A0A077Z984_TRITR Loading...

Short transient receptor potential channel 5

AlphaFold DB , UniProt , Accession A0A077Z984, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 743 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.3	Very low	45.9	Very low	222 Å²	222	135 Å²	135	100%	1.094	67%	0.674	S	S	*	*				0	-31.8	0	-88.5	164.2	139.6	0	0	113.8	S3 R4	M1-S3 PolarHBondContact O-N 3.45Å; M1-R4 PolarHBondContact O-N 3.48Å
2	S	45	Very low	46.2	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	66%	0.66	S	S	*	*	H	α-helix	trans	-59.6	-40.7	176	154.4	0	0	0	0	114.9	R4 G5 S6	S2-R4 VanDerWaalsContact C-N 3.33Å; S2-R4 PolarHBondContact O-N 3.43Å; S2-G5 PolarHBondContact O-N 3.29Å; S2-S6 PolarHBondContact O-N 3.07Å
3	S	45.7	Very low	47	Very low	90 Å²	90	130.7 Å²	130.7	63%	0.629	65%	0.647	S	S	*	*	H	α-helix	trans	-69.8	-23.3	-178.4	74.8	0	0	0	0	115.2	M1 G5 K7	M1-S3 PolarHBondContact O-N 3.45Å; S3-G5 VanDerWaalsContact C-N 3.34Å; S3-K7 PolarHBondContact O-N 3.44Å
4	R	42.1	Very low	48	Very low	212 Å²	212	126.2 Å²	126.2	80%	0.8	64%	0.635	S	S	*	*	H	α-helix	trans	-75	-25	172.6	-90.8	-175.8	176.2	175.4	-0.8	111.9	M1 S2 R8	M1-R4 PolarHBondContact O-N 3.48Å; S2-R4 VanDerWaalsContact C-N 3.33Å; S2-R4 PolarHBondContact O-N 3.43Å; R4-R8 WeakPolarHBondContact O-CB 3.46Å; R4-R8 PolarHBondContact O-N 3.49Å
5	G	42.7	Very low	48.8	Very low	42 Å²	42	120.4 Å²	120.4	43%	0.433	61%	0.611	S	S	.	*	H	α-helix	trans	-69.3	-47.2	174	0	0	0	0	0	112.1	S2 S3 R8 N9	S2-G5 PolarHBondContact O-N 3.29Å; S3-G5 VanDerWaalsContact C-N 3.34Å; G5-R8 PolarHBondContact O-N 3.11Å; G5-N9 PolarHBondContact O-N 3.19Å; G5-N9 VanDerWaalsContact O-N 3.11Å
6	S	43.9	Very low	49.7	Very low	71 Å²	71	113.2 Å²	113.2	50%	0.497	58%	0.575	S	S	.	*	H	α-helix	trans	-59.8	-50.3	179.6	-163.2	0	0	0	0	112.4	S2 R8 N9 D10	S2-S6 PolarHBondContact O-N 3.07Å; S6-R8 PolarHBondContact O-N 3.19Å; S6-N9 PolarHBondContact O-N 3.32Å; S6-D10 PolarHBondContact O-N 2.99Å
7	K	44.7	Very low	50.9	Low	155 Å²	155	109.4 Å²	109.4	67%	0.674	57%	0.565	S	S	*	*	H	α-helix	trans	-63.9	-24.3	178.9	-73.2	-171.1	177.1	-175.4	0	113.8	S3 R11	S3-K7 PolarHBondContact O-N 3.44Å; K7-R11 WeakPolarHBondContact O-CG 3.47Å; K7-R11 PolarHBondContact O-N 3.18Å
8	R	43.1	Very low	52.3	Low	181 Å²	181	107.7 Å²	107.7	68%	0.683	55%	0.554	S	S	*	*	H	α-helix	trans	-80.1	-35.9	178.5	-138.7	176.7	-170.3	-179.9	1.3	111.1	R4 G5 S6 R12	R4-R8 WeakPolarHBondContact O-CB 3.46Å; R4-R8 PolarHBondContact O-N 3.49Å; G5-R8 PolarHBondContact O-N 3.11Å; S6-R8 PolarHBondContact O-N 3.19Å; R8-R12 WeakPolarHBondContact O-CG 3.49Å; R8-R12 PolarHBondContact O-N 3.23Å
9	N	47.7	Very low	53.9	Low	103 Å²	103	102 Å²	102	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-67.6	-44.4	171.2	-98.2	12.6	0	0	0	111.7	G5 S6 R11 R12 T13	G5-N9 PolarHBondContact O-N 3.19Å; G5-N9 VanDerWaalsContact O-N 3.11Å; S6-N9 PolarHBondContact O-N 3.32Å; N9-R11 VanDerWaalsContact C-N 3.27Å; N9-R11 PolarHBondContact O-N 3.22Å; N9-R12 PolarHBondContact O-N 2.99Å; N9-R12 VanDerWaalsContact O-N 3.09Å; N9-T13 WeakPolarHBondContact O-CG2 3.45Å; N9-T13 PolarHBondContact O-N 2.99Å; N9-T13 PolarHBondContact O-OG1 3.14Å
10	D	51.7	Low	55.3	Low	96 Å²	96	97.5 Å²	97.5	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-32.2	179.1	-65.1	-29	0	0	0	113	S6 T13 S14	S6-D10 PolarHBondContact O-N 2.99Å; D10-T13 WeakPolarHBondContact CA-OG1 3.19Å; D10-T13 PolarHBondContact O-OG1 2.9Å; D10-S14 WeakPolarHBondContact O-CB 3.45Å; D10-S14 PolarHBondContact O-N 3.09Å; D10-S14 VanDerWaalsContact O-N 3.14Å
11	R	50.7	Low	56.7	Low	200 Å²	200	95.6 Å²	95.6	76%	0.755	50%	0.495	S	S	*	.	H	α-helix	trans	-73.9	-35.8	174.1	-79	-175.9	-179.6	-173	-0.8	113	K7 N9 S14 S15	K7-R11 WeakPolarHBondContact O-CG 3.47Å; K7-R11 PolarHBondContact O-N 3.18Å; N9-R11 VanDerWaalsContact C-N 3.27Å; N9-R11 PolarHBondContact O-N 3.22Å; R11-S14 PolarHBondContact O-N 3.27Å; R11-S15 PolarHBondContact O-N 3.05Å; R11-S15 PolarHBondContact O-OG 3.48Å
12	R	50.5	Low	58.4	Low	133 Å²	133	85 Å²	85	50%	0.502	44%	0.443	S	S	.	.	H	α-helix	trans	-68.3	-41.7	177.3	-79.1	-179.5	174.8	-176.6	-3.9	111.6	R8 N9 S14 S15 A16	R8-R12 WeakPolarHBondContact O-CG 3.49Å; R8-R12 PolarHBondContact O-N 3.23Å; N9-R12 PolarHBondContact O-N 2.99Å; N9-R12 VanDerWaalsContact O-N 3.09Å; R12-S14 VanDerWaalsContact C-N 3.35Å; R12-S15 PolarHBondContact O-N 3.13Å; R12-S15 PolarHBondContact O-OG 3.32Å; R12-A16 WeakPolarHBondContact O-CB 3.2Å; R12-A16 PolarHBondContact O-N 3.29Å; R12-A16 VanDerWaalsContact O-N 3.13Å
13	T	56.3	Low	60.3	Low	81 Å²	81	79.7 Å²	79.7	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-65.9	-38.8	175.2	55	0	0	0	0	111.4	N9 D10 A16 A17	N9-T13 WeakPolarHBondContact O-CG2 3.45Å; N9-T13 PolarHBondContact O-N 2.99Å; N9-T13 PolarHBondContact O-OG1 3.14Å; D10-T13 WeakPolarHBondContact CA-OG1 3.19Å; D10-T13 PolarHBondContact O-OG1 2.9Å; T13-A16 PolarHBondContact O-N 2.93Å; T13-A17 WeakPolarHBondContact O-CB 3.33Å; T13-A17 PolarHBondContact O-N 3.3Å
14	S	60.3	Low	62.1	Low	68 Å²	68	78.7 Å²	78.7	48%	0.476	39%	0.393	S	S	.	.	H	α-helix	trans	-59.7	-48.2	173	158.3	0	0	0	0	112.9	D10 R11 R12 A16 A17	D10-S14 WeakPolarHBondContact O-CB 3.45Å; D10-S14 PolarHBondContact O-N 3.09Å; D10-S14 VanDerWaalsContact O-N 3.14Å; R11-S14 PolarHBondContact O-N 3.27Å; R12-S14 VanDerWaalsContact C-N 3.35Å; S14-A16 VanDerWaalsContact C-N 3.27Å; S14-A16 PolarHBondContact O-N 3.06Å; S14-A17 PolarHBondContact O-N 3.24Å
15	S	60.4	Low	64.1	Low	39 Å²	39	74.2 Å²	74.2	27%	0.273	39%	0.386	S	S	.	.	H	α-helix	trans	-66.6	-31.3	-179.8	52.8	0	0	0	0	112.9	R11 R12 E18	R11-S15 PolarHBondContact O-N 3.05Å; R11-S15 PolarHBondContact O-OG 3.48Å; R12-S15 PolarHBondContact O-N 3.13Å; R12-S15 PolarHBondContact O-OG 3.32Å; S15-E18 WeakPolarHBondContact O-CB 3.24Å; S15-E18 PolarHBondContact O-N 3.47Å
16	A	63.5	Low	66	Low	5 Å²	5	75.9 Å²	75.9	4%	0.041	39%	0.385	C	S	.	.	H	α-helix	trans	-81.9	-25.7	-179.1	0	0	0	0	0	112	R12 T13 S14 E18 I19 A41 I44	R12-A16 WeakPolarHBondContact O-CB 3.2Å; R12-A16 PolarHBondContact O-N 3.29Å; R12-A16 VanDerWaalsContact O-N 3.13Å; T13-A16 PolarHBondContact O-N 2.93Å; S14-A16 VanDerWaalsContact C-N 3.27Å; S14-A16 PolarHBondContact O-N 3.06Å; A16-E18 PolarHBondContact O-N 2.72Å; A16-I19 WeakPolarHBondContact O-CB 3.34Å; A16-I19 VanDerWaalsContact O-CG2 3.22Å; A16-I19 WeakPolarHBondContact O-CG2 3.44Å; A16-I19 PolarHBondContact O-N 3.2Å; A16-A41 HydrophobicContact CB-CB 3.75Å; A16-I44 HydrophobicContact CB-CD1 3.13Å; A16-I44 HydrophobicContact CB-CG1 4.36Å
17	A	69.2	Low	68	Low	48 Å²	48	75.1 Å²	75.1	40%	0.397	38%	0.375	S	S	.	.	H	α-helix	trans	-68.6	-17.8	169.2	0	0	0	0	0	113.7	T13 S14 I19 P21	T13-A17 WeakPolarHBondContact O-CB 3.33Å; T13-A17 PolarHBondContact O-N 3.3Å; S14-A17 PolarHBondContact O-N 3.24Å; A17-I19 PolarHBondContact O-N 3.39Å; A17-P21 WeakPolarHBondContact O-CD 3.47Å
18	E	77.4	Confident	69.8	Low	79 Å²	79	71.9 Å²	71.9	37%	0.369	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-7.4	173.5	-63.7	-172.9	-167.9	0	0	113.6	S15 A16 P21 A22 R30	S15-E18 WeakPolarHBondContact O-CB 3.24Å; S15-E18 PolarHBondContact O-N 3.47Å; A16-E18 PolarHBondContact O-N 2.72Å; E18-P21 WeakPolarHBondContact O-CD 3.37Å; E18-A22 WeakPolarHBondContact O-CB 3.3Å; E18-A22 PolarHBondContact O-N 2.95Å; E18-R30 IonicContact OE2-CZ 3.99Å; E18-R30 IonicContact OE2-NE 3.57Å; E18-R30 IonicContact OE2-NH2 3.1Å; E18-R30 PolarHBondContact OE2-NH2 2.89Å
19	I	81.7	Confident	71.7	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-65.4	-37.4	177.7	-156.7	168.6	0	0	0	112	A16 A17 A22 I23 V31 I35 A41 A52	A16-I19 WeakPolarHBondContact O-CB 3.34Å; A16-I19 VanDerWaalsContact O-CG2 3.22Å; A16-I19 WeakPolarHBondContact O-CG2 3.44Å; A16-I19 PolarHBondContact O-N 3.2Å; A17-I19 PolarHBondContact O-N 3.39Å; I19-A22 WeakPolarHBondContact O-CB 3.29Å; I19-A22 PolarHBondContact O-N 3.13Å; I19-I23 HydrophobicContact CG1-CD1 4.28Å; I19-I23 VanDerWaalsContact O-CG1 3.3Å; I19-I23 WeakPolarHBondContact O-CG1 3.22Å; I19-I23 PolarHBondContact O-N 3.39Å; I19-V31 HydrophobicContact CG1-CG1 4.46Å; I19-I35 HydrophobicContact CD1-CG1 4.02Å; I19-A41 HydrophobicContact CD1-CB 4.24Å; I19-A52 HydrophobicContact CD1-CB 4.2Å
20	F	83	Confident	73.4	Confident	12 Å²	12	67.8 Å²	67.8	5%	0.053	35%	0.35	C	S	.	.	H	α-helix	trans	-68.7	-47.2	-177.1	-58	-75.2	0	0	0	113	A22 I23 D24 I44 N46 Y55	F20-A22 PolarHBondContact O-N 3.28Å; F20-I23 PolarHBondContact O-N 3.43Å; F20-I23 VanDerWaalsContact O-N 3.16Å; F20-D24 PolarHBondContact O-N 3.42Å; F20-I44 HydrophobicContact CE2-CG2 4.14Å; F20-I44 WeakPolarHBondContact CZ-O 3.24Å; F20-N46 HydrophobicContact CD1-CB 4Å; F20-N46 HydrophobicContact CD2-CB 4.19Å; F20-N46 HydrophobicContact CE1-CB 3.68Å; F20-N46 HydrophobicContact CE2-CB 3.89Å; F20-N46 HydrophobicContact CG-CB 4.25Å; F20-N46 HydrophobicContact CZ-CB 3.62Å; F20-Y55 HydrophobicContact CB-CE1 4.38Å; F20-Y55 AromaticContact CD1-CD1 3.78Å; F20-Y55 HydrophobicContact CD1-CD1 3.78Å; F20-Y55 HydrophobicContact CD1-CE1 4.3Å; F20-Y55 HydrophobicContact CD1-CG 4.04Å; F20-Y55 HydrophobicContact CE1-CG 4.46Å
21	P	83.7	Confident	74.7	Confident	57 Å²	57	63.2 Å²	63.2	37%	0.37	33%	0.325	S	S	.	.	H	α-helix	trans	-61.1	-30.4	170.6	-22.2	32.1	0	0	0	113.3	A17 E18 D24 N25	A17-P21 WeakPolarHBondContact O-CD 3.47Å; E18-P21 WeakPolarHBondContact O-CD 3.37Å; P21-D24 PolarHBondContact O-N 2.96Å; P21-N25 PolarHBondContact O-N 3.48Å; P21-N25 VanDerWaalsContact O-N 3.16Å; P21-N25 PolarHBondContact O-ND2 2.75Å
22	A	82.7	Confident	76.3	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-69.4	-39.4	175.8	0	0	0	0	0	111.6	E18 I19 F20 N25 D26 D27 R30 V31	E18-A22 WeakPolarHBondContact O-CB 3.3Å; E18-A22 PolarHBondContact O-N 2.95Å; I19-A22 WeakPolarHBondContact O-CB 3.29Å; I19-A22 PolarHBondContact O-N 3.13Å; F20-A22 PolarHBondContact O-N 3.28Å; A22-N25 PolarHBondContact O-N 3.17Å; A22-D26 PolarHBondContact O-N 3.48Å; A22-D27 PolarHBondContact O-N 2.93Å; A22-R30 HydrophobicContact CB-CB 4.05Å; A22-R30 HydrophobicContact CB-CG 3.85Å; A22-V31 HydrophobicContact CB-CG2 3.69Å
23	I	84.5	Confident	77.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.9	-44.1	172.1	-66.3	164.1	0	0	0	110	I19 F20 N25 D26 V31 A52 Y55 L59 K61 I68	I19-I23 HydrophobicContact CG1-CD1 4.28Å; I19-I23 VanDerWaalsContact O-CG1 3.3Å; I19-I23 WeakPolarHBondContact O-CG1 3.22Å; I19-I23 PolarHBondContact O-N 3.39Å; F20-I23 PolarHBondContact O-N 3.43Å; F20-I23 VanDerWaalsContact O-N 3.16Å; I23-N25 VanDerWaalsContact C-N 3.27Å; I23-N25 PolarHBondContact O-N 3.03Å; I23-D26 PolarHBondContact O-N 3.22Å; I23-V31 HydrophobicContact CG1-CG2 4.1Å; I23-A52 HydrophobicContact CD1-CB 3.99Å; I23-Y55 HydrophobicContact CB-CD1 4.46Å; I23-Y55 HydrophobicContact CG2-CD1 4.07Å; I23-Y55 HydrophobicContact CG2-CE1 4.38Å; I23-L59 HydrophobicContact CG2-CD1 4.08Å; I23-K61 HydrophobicContact CG2-CD 4.09Å; I23-K61 WeakPolarHBondContact O-CD 3.29Å; I23-K61 VanDerWaalsContact O-CE 3.26Å; I23-K61 WeakPolarHBondContact O-CE 3.19Å; I23-K61 PolarHBondContact O-NZ 3.33Å; I23-I68 HydrophobicContact CD1-CD1 4.34Å
24	D	85.2	Confident	78.9	Confident	69 Å²	69	56.9 Å²	56.9	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-58	-38.6	178.3	-71.6	-25.8	0	0	0	112.5	F20 P21 Y55 L59 K61	F20-D24 PolarHBondContact O-N 3.42Å; P21-D24 PolarHBondContact O-N 2.96Å; D24-Y55 WeakPolarHBondContact OD1-CE1 3.49Å; D24-Y55 PolarHBondContact OD1-OH 2.89Å; D24-Y55 PolarHBondContact OD2-OH 3.46Å; D24-L59 WeakPolarHBondContact OD1-CD1 3.08Å; D24-K61 VanDerWaalsContact C-NZ 3.33Å; D24-K61 PolarHBondContact O-NZ 3.27Å
25	N	83.6	Confident	79.8	Confident	119 Å²	119	54.1 Å²	54.1	64%	0.636	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	5.4	-178.2	-67.1	-56.3	0	0	0	114.8	P21 A22 I23 D27	P21-N25 PolarHBondContact O-N 3.48Å; P21-N25 VanDerWaalsContact O-N 3.16Å; P21-N25 PolarHBondContact O-ND2 2.75Å; A22-N25 PolarHBondContact O-N 3.17Å; I23-N25 VanDerWaalsContact C-N 3.27Å; I23-N25 PolarHBondContact O-N 3.03Å; N25-D27 PolarHBondContact O-N 3.36Å
26	D	82.5	Confident	80.6	Confident	77 Å²	77	56.3 Å²	56.3	41%	0.412	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	29.7	-175.8	-67.7	-48.6	0	0	0	114.7	A22 I23 F28 K61 M64	A22-D26 PolarHBondContact O-N 3.48Å; I23-D26 PolarHBondContact O-N 3.22Å; D26-F28 WeakPolarHBondContact O-CD2 3.44Å; D26-F28 WeakPolarHBondContact O-CE2 3.41Å; D26-F28 PolarHBondContact O-N 2.93Å; D26-K61 WeakPolarHBondContact OD1-CD 3.22Å; D26-K61 WeakPolarHBondContact OD1-CE 3.31Å; D26-K61 IonicContact OD1-NZ 3.69Å; D26-K61 PolarHBondContact OD1-NZ 2.97Å; D26-K61 IonicContact OD2-NZ 2.75Å; D26-K61 PolarHBondContact OD2-NZ 3.15Å; D26-M64 HydrophobicContact CB-CE 4.39Å
27	D	84.9	Confident	81.1	Confident	55 Å²	55	59.6 Å²	59.6	29%	0.294	32%	0.324	S	S	.	.			trans	-84.5	87.2	-178.7	-171.6	-13	0	0	0	111.5	A22 N25 T29 R30 V31	A22-D27 PolarHBondContact O-N 2.93Å; N25-D27 PolarHBondContact O-N 3.36Å; D27-T29 PolarHBondContact O-N 3.26Å; D27-T29 PolarHBondContact OD1-N 2.98Å; D27-T29 VanDerWaalsContact OD1-N 3.09Å; D27-T29 PolarHBondContact OD1-OG1 3.25Å; D27-R30 HydrophobicContact CB-CB 4.01Å; D27-R30 VanDerWaalsContact CG-CB 3.43Å; D27-R30 PolarHBondContact O-N 3.36Å; D27-R30 PolarHBondContact OD1-N 3.37Å; D27-R30 VanDerWaalsContact OD1-N 3.07Å; D27-R30 VanDerWaalsContact OD2-CB 3.3Å; D27-R30 WeakPolarHBondContact OD2-CB 3.44Å; D27-V31 WeakPolarHBondContact O-CG2 3.43Å; D27-V31 PolarHBondContact O-N 3.31Å
28	F	83.3	Confident	81.1	Confident	87 Å²	87	58.4 Å²	58.4	38%	0.382	31%	0.313	S	S	.	.	H	α-helix	trans	-52.9	-37.4	176.9	-62.3	-89.1	0	0	0	113.2	D26 K32 A63 M64 L67	D26-F28 WeakPolarHBondContact O-CD2 3.44Å; D26-F28 WeakPolarHBondContact O-CE2 3.41Å; D26-F28 PolarHBondContact O-N 2.93Å; F28-K32 WeakPolarHBondContact O-CB 3.44Å; F28-K32 VanDerWaalsContact O-CG 3.28Å; F28-K32 WeakPolarHBondContact O-CG 3.3Å; F28-K32 PolarHBondContact O-N 3.29Å; F28-A63 HydrophobicContact CE1-CB 3.53Å; F28-A63 HydrophobicContact CZ-CB 3.57Å; F28-M64 HydrophobicContact CB-CE 4.29Å; F28-M64 HydrophobicContact CD1-CE 3.26Å; F28-M64 HydrophobicContact CD1-SD 4.41Å; F28-M64 HydrophobicContact CD2-CE 3.76Å; F28-M64 HydrophobicContact CE1-CE 3.3Å; F28-M64 HydrophobicContact CE2-CE 3.78Å; F28-M64 HydrophobicContact CG-CE 3.5Å; F28-M64 HydrophobicContact CZ-CE 3.56Å; F28-L67 HydrophobicContact CD1-CD2 4.31Å
29	T	83.3	Confident	80.9	Confident	105 Å²	105	57.4 Å²	57.4	64%	0.644	32%	0.318	S	S	*	.	H	α-helix	trans	-72.1	-40.6	-174.4	67.6	0	0	0	0	110.7	D27 K33	D27-T29 PolarHBondContact O-N 3.26Å; D27-T29 PolarHBondContact OD1-N 2.98Å; D27-T29 VanDerWaalsContact OD1-N 3.09Å; D27-T29 PolarHBondContact OD1-OG1 3.25Å; T29-K33 VanDerWaalsContact O-CB 3.3Å; T29-K33 WeakPolarHBondContact O-CB 3.06Å; T29-K33 PolarHBondContact O-N 2.85Å
30	R	82.1	Confident	80.4	Confident	93 Å²	93	63.8 Å²	63.8	35%	0.351	35%	0.348	S	S	.	.	H	α-helix	trans	-69.5	-42.1	177.5	-169.7	172.2	-174.4	174.9	2.4	111.5	E18 A22 D27 K33 C34	E18-R30 IonicContact OE2-CZ 3.99Å; E18-R30 IonicContact OE2-NE 3.57Å; E18-R30 IonicContact OE2-NH2 3.1Å; E18-R30 PolarHBondContact OE2-NH2 2.89Å; A22-R30 HydrophobicContact CB-CB 4.05Å; A22-R30 HydrophobicContact CB-CG 3.85Å; D27-R30 HydrophobicContact CB-CB 4.01Å; D27-R30 VanDerWaalsContact CG-CB 3.43Å; D27-R30 PolarHBondContact O-N 3.36Å; D27-R30 PolarHBondContact OD1-N 3.37Å; D27-R30 VanDerWaalsContact OD1-N 3.07Å; D27-R30 VanDerWaalsContact OD2-CB 3.3Å; D27-R30 WeakPolarHBondContact OD2-CB 3.44Å; R30-K33 PolarHBondContact O-N 3.04Å; R30-C34 WeakPolarHBondContact O-CB 3.26Å; R30-C34 PolarHBondContact O-N 3.25Å; R30-C34 PolarHBondContact O-SG 3.38Å
31	V	80.9	Confident	79.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-48.2	174.3	175.9	0	0	0	0	110.9	I19 A22 I23 D27 K33 C34 I35 M64 L67	I19-V31 HydrophobicContact CG1-CG1 4.46Å; A22-V31 HydrophobicContact CB-CG2 3.69Å; I23-V31 HydrophobicContact CG1-CG2 4.1Å; D27-V31 WeakPolarHBondContact O-CG2 3.43Å; D27-V31 PolarHBondContact O-N 3.31Å; V31-K33 VanDerWaalsContact C-N 3.31Å; V31-K33 PolarHBondContact O-N 3.07Å; V31-C34 PolarHBondContact O-N 3.22Å; V31-I35 HydrophobicContact CG1-CD1 3.62Å; V31-I35 HydrophobicContact CG1-CG1 4.34Å; V31-I35 VanDerWaalsContact O-CG1 3.29Å; V31-I35 WeakPolarHBondContact O-CG1 3.36Å; V31-I35 PolarHBondContact O-N 3.3Å; V31-M64 HydrophobicContact CG2-SD 4.16Å; V31-L67 HydrophobicContact CB-CD2 4.12Å; V31-L67 HydrophobicContact CG1-CD2 3.81Å
32	K	82.9	Confident	79.3	Confident	108 Å²	108	61 Å²	61	47%	0.47	33%	0.331	S	S	.	.	H	α-helix	trans	-56.8	-43.9	174.6	-77.5	179.9	-179.3	-178.4	0	112.1	F28 A36 L67	F28-K32 WeakPolarHBondContact O-CB 3.44Å; F28-K32 VanDerWaalsContact O-CG 3.28Å; F28-K32 WeakPolarHBondContact O-CG 3.3Å; F28-K32 PolarHBondContact O-N 3.29Å; K32-A36 WeakPolarHBondContact O-CB 3.27Å; K32-A36 PolarHBondContact O-N 3.36Å; K32-L67 HydrophobicContact CD-CD1 4.13Å; K32-L67 HydrophobicContact CG-CD1 3.79Å; K32-L67 HydrophobicContact CG-CD2 4.08Å; K32-L67 HydrophobicContact CG-CG 4.48Å
33	K	82.3	Confident	78.9	Confident	161 Å²	161	65.9 Å²	65.9	70%	0.7	35%	0.352	S	S	*	.	H	α-helix	trans	-65.7	-42.2	179	-170.3	178.6	-178.4	-179.2	0	112	T29 R30 V31 S37	T29-K33 VanDerWaalsContact O-CB 3.3Å; T29-K33 WeakPolarHBondContact O-CB 3.06Å; T29-K33 PolarHBondContact O-N 2.85Å; R30-K33 PolarHBondContact O-N 3.04Å; V31-K33 VanDerWaalsContact C-N 3.31Å; V31-K33 PolarHBondContact O-N 3.07Å; K33-S37 VanDerWaalsContact O-CB 3.24Å; K33-S37 WeakPolarHBondContact O-CB 3.46Å; K33-S37 PolarHBondContact O-N 2.62Å; K33-S37 PolarHBondContact O-OG 3.47Å
34	C	79.5	Confident	78.6	Confident	12 Å²	12	68 Å²	68	8%	0.081	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-49.1	175.8	-74.3	0	0	0	0	111.1	R30 V31 S37 S38	R30-C34 WeakPolarHBondContact O-CB 3.26Å; R30-C34 PolarHBondContact O-N 3.25Å; R30-C34 PolarHBondContact O-SG 3.38Å; V31-C34 PolarHBondContact O-N 3.22Å; C34-S37 PolarHBondContact O-N 2.68Å; C34-S37 PolarHBondContact O-OG 3.27Å; C34-S38 PolarHBondContact O-N 2.79Å
35	I	78.4	Confident	78.3	Confident	9 Å²	9	68.4 Å²	68.4	5%	0.046	36%	0.364	C	S	.	.	H	α-helix	trans	-63.9	-45.1	179.4	-62.6	167.4	0	0	0	110.9	I19 V31 S37 S38 A39 L42 Y71	I19-I35 HydrophobicContact CD1-CG1 4.02Å; V31-I35 HydrophobicContact CG1-CD1 3.62Å; V31-I35 HydrophobicContact CG1-CG1 4.34Å; V31-I35 VanDerWaalsContact O-CG1 3.29Å; V31-I35 WeakPolarHBondContact O-CG1 3.36Å; V31-I35 PolarHBondContact O-N 3.3Å; I35-S37 PolarHBondContact O-N 3.14Å; I35-S38 CarbonylContact O-C 3.52Å; I35-S38 VanDerWaalsContact O-C 3.3Å; I35-S38 PolarHBondContact O-N 3.18Å; I35-A39 PolarHBondContact O-N 3.09Å; I35-L42 HydrophobicContact CD1-CD2 3.96Å; I35-L42 HydrophobicContact CG1-CD2 4.05Å; I35-L42 HydrophobicContact CG1-CG 4.33Å; I35-L42 HydrophobicContact CG2-CD1 4.07Å; I35-L42 HydrophobicContact CG2-CG 4.39Å; I35-Y71 HydrophobicContact CB-CE1 4.45Å; I35-Y71 HydrophobicContact CB-CE2 4.39Å; I35-Y71 HydrophobicContact CD1-CD2 4.02Å; I35-Y71 HydrophobicContact CD1-CE2 3.6Å; I35-Y71 HydrophobicContact CG2-CD1 3.74Å; I35-Y71 HydrophobicContact CG2-CD2 4.06Å; I35-Y71 HydrophobicContact CG2-CE1 3.57Å; I35-Y71 HydrophobicContact CG2-CE2 3.92Å; I35-Y71 HydrophobicContact CG2-CG 3.98Å
36	A	77.3	Confident	78	Confident	86 Å²	86	64.5 Å²	64.5	71%	0.711	34%	0.343	S	S	*	.	H	α-helix	trans	-63.1	-31.4	176.7	0	0	0	0	0	112.7	K32	K32-A36 WeakPolarHBondContact O-CB 3.27Å; K32-A36 PolarHBondContact O-N 3.36Å
37	S	74.6	Confident	77.8	Confident	73 Å²	73	70.6 Å²	70.6	51%	0.51	37%	0.366	S	S	.	.	H	α-helix	trans	-78.5	-28.1	178.9	73	0	0	0	0	113.7	K33 C34 I35	K33-S37 VanDerWaalsContact O-CB 3.24Å; K33-S37 WeakPolarHBondContact O-CB 3.46Å; K33-S37 PolarHBondContact O-N 2.62Å; K33-S37 PolarHBondContact O-OG 3.47Å; C34-S37 PolarHBondContact O-N 2.68Å; C34-S37 PolarHBondContact O-OG 3.27Å; I35-S37 PolarHBondContact O-N 3.14Å
38	S	70	Confident	77.5	Confident	23 Å²	23	72.6 Å²	72.6	16%	0.161	38%	0.375	C	S	.	.			trans	-159.3	104.2	-177.9	-68.2	0	0	0	0	109.5	C34 I35 E40 A41	C34-S38 PolarHBondContact O-N 2.79Å; I35-S38 CarbonylContact O-C 3.52Å; I35-S38 VanDerWaalsContact O-C 3.3Å; I35-S38 PolarHBondContact O-N 3.18Å; S38-E40 PolarHBondContact O-N 3.2Å; S38-E40 VanDerWaalsContact O-N 3.13Å; S38-A41 WeakPolarHBondContact O-CB 3.42Å; S38-A41 PolarHBondContact O-N 2.89Å
39	A	72	Confident	77.4	Confident	59 Å²	59	74 Å²	74	49%	0.488	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-57	-27	171.7	0	0	0	0	0	111.9	I35 A41 L42	I35-A39 PolarHBondContact O-N 3.09Å; A39-A41 PolarHBondContact O-N 2.9Å; A39-A41 VanDerWaalsContact O-N 3.17Å; A39-L42 PolarHBondContact O-N 3.22Å
40	E	72	Confident	77.3	Confident	133 Å²	133	69 Å²	69	62%	0.621	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-56.5	-25.2	172.2	-69.3	177.7	-172.8	0	0	113.5	S38 L42 F43 I44	S38-E40 PolarHBondContact O-N 3.2Å; S38-E40 VanDerWaalsContact O-N 3.13Å; E40-L42 PolarHBondContact O-N 3.09Å; E40-F43 PolarHBondContact O-N 3.06Å; E40-I44 PolarHBondContact O-N 3.16Å
41	A	70.7	Confident	77.4	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-62.1	-26.8	-179.6	0	0	0	0	0	113.4	A16 I19 S38 A39 F43	A16-A41 HydrophobicContact CB-CB 3.75Å; I19-A41 HydrophobicContact CD1-CB 4.24Å; S38-A41 WeakPolarHBondContact O-CB 3.42Å; S38-A41 PolarHBondContact O-N 2.89Å; A39-A41 PolarHBondContact O-N 2.9Å; A39-A41 VanDerWaalsContact O-N 3.17Å; A41-F43 VanDerWaalsContact C-N 3.27Å; A41-F43 PolarHBondContact O-N 3.41Å
42	L	72.8	Confident	77.6	Confident	11 Å²	11	64.9 Å²	64.9	6%	0.058	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-70	-25.4	176.2	-69.6	169	0	0	0	112.7	I35 A39 E40 I68 V74	I35-L42 HydrophobicContact CD1-CD2 3.96Å; I35-L42 HydrophobicContact CG1-CD2 4.05Å; I35-L42 HydrophobicContact CG1-CG 4.33Å; I35-L42 HydrophobicContact CG2-CD1 4.07Å; I35-L42 HydrophobicContact CG2-CG 4.39Å; A39-L42 PolarHBondContact O-N 3.22Å; E40-L42 PolarHBondContact O-N 3.09Å; L42-I68 HydrophobicContact CD2-CG2 3.9Å; L42-V74 HydrophobicContact CD1-CG2 3.98Å; L42-V74 HydrophobicContact CD2-CG2 4.37Å
43	F	74.9	Confident	77.8	Confident	104 Å²	104	59.9 Å²	59.9	46%	0.456	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-94.8	-7.3	-178.1	-57	-80.9	0	0	0	113.2	E40 A41 L45 A73 N75	E40-F43 PolarHBondContact O-N 3.06Å; A41-F43 VanDerWaalsContact C-N 3.27Å; A41-F43 PolarHBondContact O-N 3.41Å; F43-L45 PolarHBondContact O-N 3.3Å; F43-A73 WeakPolarHBondContact CZ-O 3.5Å; F43-N75 HydrophobicContact CD1-CB 4.46Å; F43-N75 HydrophobicContact CE1-CB 4.14Å
44	I	76.9	Confident	78	Confident	43 Å²	43	52.3 Å²	52.3	22%	0.221	28%	0.281	C	S	.	.			trans	-68.4	136	178.8	-63.7	-169.9	0	0	0	109.5	A16 F20 E40	A16-I44 HydrophobicContact CB-CD1 3.13Å; A16-I44 HydrophobicContact CB-CG1 4.36Å; F20-I44 HydrophobicContact CE2-CG2 4.14Å; F20-I44 WeakPolarHBondContact CZ-O 3.24Å; E40-I44 PolarHBondContact O-N 3.16Å
45	L	78.6	Confident	78.3	Confident	78 Å²	78	53 Å²	53	41%	0.408	28%	0.282	S	S	.	.			trans	-93.7	132	176.6	-62.6	173.1	0	0	0	109.6	F43 L50 T51	F43-L45 PolarHBondContact O-N 3.3Å; L45-L50 WeakPolarHBondContact CA-O 3.45Å; L45-T51 HydrophobicContact CD2-CG2 3.85Å
46	N	78	Confident	78.7	Confident	37 Å²	37	52.6 Å²	52.6	20%	0.198	28%	0.28	C	S	.	.			trans	-66.2	175.9	171.3	-161.7	-7.2	0	0	0	110.5	F20 M48 K49 L50	F20-N46 HydrophobicContact CD1-CB 4Å; F20-N46 HydrophobicContact CD2-CB 4.19Å; F20-N46 HydrophobicContact CE1-CB 3.68Å; F20-N46 HydrophobicContact CE2-CB 3.89Å; F20-N46 HydrophobicContact CG-CB 4.25Å; F20-N46 HydrophobicContact CZ-CB 3.62Å; N46-M48 PolarHBondContact O-N 3.49Å; N46-M48 VanDerWaalsContact O-N 3.09Å; N46-K49 WeakPolarHBondContact O-CA 3.28Å; N46-K49 PolarHBondContact O-N 2.8Å; N46-L50 PolarHBondContact N-O 3.06Å
47	K	79.6	Confident	79.2	Confident	206 Å²	206	48.5 Å²	48.5	90%	0.896	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-31.1	169.3	-67.6	-177.9	178.6	178.4	0	113	K49	K47-K49 VanDerWaalsContact C-N 3.27Å; K47-K49 PolarHBondContact O-N 2.92Å
48	M	77.6	Confident	79.9	Confident	96 Å²	96	47.8 Å²	47.8	47%	0.473	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	7.3	175.6	-58.2	-161.6	-63.3	0	0	113.5	N46 L50 Y55 Y111	N46-M48 PolarHBondContact O-N 3.49Å; N46-M48 VanDerWaalsContact O-N 3.09Å; M48-L50 HydrophobicContact CB-CD1 3.86Å; M48-L50 HydrophobicContact CB-CG 4.14Å; M48-L50 HydrophobicContact CE-CD1 3.66Å; M48-L50 PolarHBondContact O-N 3.16Å; M48-Y55 HydrophobicContact CE-CD2 4.28Å; M48-Y55 HydrophobicContact CE-CE2 4Å; M48-Y111 PolarHBondContact O-OH 2.94Å
49	K	80.5	Confident	80.8	Confident	116 Å²	116	49.7 Å²	49.7	50%	0.504	24%	0.244	S	C	.	.	S	Bend	trans	59.1	30.7	-174.4	-56.3	179.2	178	177.6	0	114.6	N46 K47 N110	N46-K49 WeakPolarHBondContact O-CA 3.28Å; N46-K49 PolarHBondContact O-N 2.8Å; K47-K49 VanDerWaalsContact C-N 3.27Å; K47-K49 PolarHBondContact O-N 2.92Å; K49-N110 WeakPolarHBondContact CD-ND2 3.39Å
50	L	82.2	Confident	81.5	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	25%	0.245	C	C	.	.			trans	-103.5	142.1	176.4	-63.2	164.7	0	0	0	110.4	L45 N46 M48 E54 Y55 I58 F82 Y111	L45-L50 WeakPolarHBondContact CA-O 3.45Å; N46-L50 PolarHBondContact N-O 3.06Å; M48-L50 HydrophobicContact CB-CD1 3.86Å; M48-L50 HydrophobicContact CB-CG 4.14Å; M48-L50 HydrophobicContact CE-CD1 3.66Å; M48-L50 PolarHBondContact O-N 3.16Å; L50-E54 HydrophobicContact CB-CB 4.28Å; L50-E54 HydrophobicContact CD2-CB 4.03Å; L50-Y55 HydrophobicContact CD1-CD2 4.31Å; L50-I58 HydrophobicContact CD1-CD1 3.56Å; L50-I58 HydrophobicContact CD2-CD1 3.86Å; L50-I58 HydrophobicContact CG-CD1 4.34Å; L50-F82 HydrophobicContact CD2-CE2 3.69Å; L50-F82 HydrophobicContact CD2-CZ 3.64Å; L50-Y111 HydrophobicContact CD2-CD2 4.26Å; L50-Y111 HydrophobicContact CD2-CE2 3.59Å; L50-Y111 HydrophobicContact CG-CE2 4.2Å
51	T	84.7	Confident	82.3	Confident	6 Å²	6	47.5 Å²	47.5	4%	0.037	22%	0.222	C	C	.	.			trans	-72.8	164.8	170.3	56.6	0	0	0	0	111.6	L45 L53 E54 Y55	L45-T51 HydrophobicContact CD2-CG2 3.85Å; T51-L53 PolarHBondContact O-N 3.44Å; T51-E54 PolarHBondContact N-OE2 3Å; T51-E54 PolarHBondContact O-N 3.01Å; T51-E54 WeakPolarHBondContact OG1-CG 3.44Å; T51-E54 PolarHBondContact OG1-N 2.9Å; T51-E54 PolarHBondContact OG1-OE2 2.85Å; T51-Y55 VanDerWaalsContact O-CB 3.27Å; T51-Y55 WeakPolarHBondContact O-CB 3.4Å; T51-Y55 PolarHBondContact O-N 3.21Å
52	A	84.8	Confident	83.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.8	-33.6	176.6	0	0	0	0	0	112.8	I19 I23 S56 I68	I19-A52 HydrophobicContact CD1-CB 4.2Å; I23-A52 HydrophobicContact CD1-CB 3.99Å; A52-S56 WeakPolarHBondContact O-CB 3.3Å; A52-S56 PolarHBondContact O-N 3.26Å; A52-S56 VanDerWaalsContact O-N 3.12Å; A52-S56 PolarHBondContact O-OG 3.21Å; A52-I68 HydrophobicContact CB-CD1 4.47Å
53	L	86.5	Confident	83.8	Confident	2 Å²	2	52 Å²	52	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-72.6	-50.7	176	-176.8	64.9	0	0	0	111.8	T51 Y55 S56 V57 V65 I68 V74 S79 L95	T51-L53 PolarHBondContact O-N 3.44Å; L53-Y55 PolarHBondContact O-N 3.3Å; L53-S56 PolarHBondContact O-N 3.3Å; L53-S56 VanDerWaalsContact O-N 3.15Å; L53-S56 PolarHBondContact O-OG 3.39Å; L53-V57 HydrophobicContact CD1-CG2 4.48Å; L53-V57 VanDerWaalsContact O-CG2 3.31Å; L53-V57 WeakPolarHBondContact O-CG2 3.42Å; L53-V57 PolarHBondContact O-N 3.32Å; L53-V65 HydrophobicContact CD1-CG1 4.12Å; L53-I68 HydrophobicContact CB-CG2 4.15Å; L53-I68 HydrophobicContact CD1-CB 4.33Å; L53-I68 HydrophobicContact CD1-CG2 3.97Å; L53-V74 HydrophobicContact CB-CG1 4.19Å; L53-V74 HydrophobicContact CD2-CG1 3.65Å; L53-V74 HydrophobicContact CG-CG1 4.43Å; L53-S79 VanDerWaalsContact CD2-OG 3.31Å; L53-S79 WeakPolarHBondContact CD2-OG 3.2Å; L53-S79 WeakPolarHBondContact CG-OG 3.41Å; L53-L95 HydrophobicContact CD1-CD2 4.36Å; L53-L95 HydrophobicContact CD2-CD2 4.2Å
54	E	85.9	Confident	84.3	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-39.5	178.1	-67.6	162.4	155.7	0	0	111	L50 T51 V57 I58 R77 D78 S79 F82	L50-E54 HydrophobicContact CB-CB 4.28Å; L50-E54 HydrophobicContact CD2-CB 4.03Å; T51-E54 PolarHBondContact N-OE2 3Å; T51-E54 PolarHBondContact O-N 3.01Å; T51-E54 WeakPolarHBondContact OG1-CG 3.44Å; T51-E54 PolarHBondContact OG1-N 2.9Å; T51-E54 PolarHBondContact OG1-OE2 2.85Å; E54-V57 PolarHBondContact O-N 3.12Å; E54-I58 WeakPolarHBondContact O-CB 3.31Å; E54-I58 WeakPolarHBondContact O-CD1 3.39Å; E54-I58 VanDerWaalsContact O-CG1 3.24Å; E54-I58 WeakPolarHBondContact O-CG1 3.27Å; E54-I58 PolarHBondContact O-N 3.07Å; E54-R77 WeakPolarHBondContact OE1-CB 3.22Å; E54-R77 IonicContact OE1-NE 3.65Å; E54-D78 PolarHBondContact OE1-N 2.79Å; E54-S79 VanDerWaalsContact CG-OG 3.27Å; E54-S79 WeakPolarHBondContact CG-OG 3.39Å; E54-F82 HydrophobicContact CB-CD2 3.98Å; E54-F82 HydrophobicContact CB-CE2 4.13Å; E54-F82 HydrophobicContact CG-CD2 3.88Å; E54-F82 HydrophobicContact CG-CE2 4.04Å
55	Y	86.6	Confident	84.7	Confident	27 Å²	27	45 Å²	45	11%	0.106	22%	0.218	C	C	.	.	H	α-helix	trans	-66	-41.8	177.4	-168.8	-109.2	0	0	0	112.7	F20 I23 D24 M48 L50 T51 L53 I58 L59	F20-Y55 HydrophobicContact CB-CE1 4.38Å; F20-Y55 AromaticContact CD1-CD1 3.78Å; F20-Y55 HydrophobicContact CD1-CD1 3.78Å; F20-Y55 HydrophobicContact CD1-CE1 4.3Å; F20-Y55 HydrophobicContact CD1-CG 4.04Å; F20-Y55 HydrophobicContact CE1-CG 4.46Å; I23-Y55 HydrophobicContact CB-CD1 4.46Å; I23-Y55 HydrophobicContact CG2-CD1 4.07Å; I23-Y55 HydrophobicContact CG2-CE1 4.38Å; D24-Y55 WeakPolarHBondContact OD1-CE1 3.49Å; D24-Y55 PolarHBondContact OD1-OH 2.89Å; D24-Y55 PolarHBondContact OD2-OH 3.46Å; M48-Y55 HydrophobicContact CE-CD2 4.28Å; M48-Y55 HydrophobicContact CE-CE2 4Å; L50-Y55 HydrophobicContact CD1-CD2 4.31Å; T51-Y55 VanDerWaalsContact O-CB 3.27Å; T51-Y55 WeakPolarHBondContact O-CB 3.4Å; T51-Y55 PolarHBondContact O-N 3.21Å; L53-Y55 PolarHBondContact O-N 3.3Å; Y55-I58 PolarHBondContact O-N 3.39Å; Y55-L59 HydrophobicContact CD1-CD1 3.78Å; Y55-L59 HydrophobicContact CE1-CD1 3.34Å; Y55-L59 HydrophobicContact CE1-CG 4.32Å; Y55-L59 HydrophobicContact CE2-CD1 4.43Å; Y55-L59 HydrophobicContact CG-CD1 4.49Å; Y55-L59 WeakPolarHBondContact O-CG 3.42Å; Y55-L59 PolarHBondContact O-N 2.68Å
56	S	87.4	Confident	85.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.9	-34	177	65.2	0	0	0	0	112.7	A52 L53 L59 K60 K61 V65	A52-S56 WeakPolarHBondContact O-CB 3.3Å; A52-S56 PolarHBondContact O-N 3.26Å; A52-S56 VanDerWaalsContact O-N 3.12Å; A52-S56 PolarHBondContact O-OG 3.21Å; L53-S56 PolarHBondContact O-N 3.3Å; L53-S56 VanDerWaalsContact O-N 3.15Å; L53-S56 PolarHBondContact O-OG 3.39Å; S56-L59 PolarHBondContact O-N 2.87Å; S56-K60 PolarHBondContact O-N 3.42Å; S56-K61 PolarHBondContact O-N 2.83Å; S56-V65 WeakPolarHBondContact OG-CG2 3.1Å
57	V	87.7	Confident	85.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.1	-47.9	172.4	171.3	0	0	0	0	111	L53 E54 L59 K60 V65 F82 A83 I91 L95	L53-V57 HydrophobicContact CD1-CG2 4.48Å; L53-V57 VanDerWaalsContact O-CG2 3.31Å; L53-V57 WeakPolarHBondContact O-CG2 3.42Å; L53-V57 PolarHBondContact O-N 3.32Å; E54-V57 PolarHBondContact O-N 3.12Å; V57-L59 VanDerWaalsContact C-N 3.28Å; V57-L59 PolarHBondContact O-N 3.3Å; V57-K60 PolarHBondContact O-N 2.79Å; V57-V65 HydrophobicContact CG2-CG2 3.94Å; V57-F82 HydrophobicContact CG1-CB 3.99Å; V57-A83 HydrophobicContact CG1-CB 3.84Å; V57-I91 HydrophobicContact CB-CG2 4.45Å; V57-I91 HydrophobicContact CG1-CG2 4.12Å; V57-I91 HydrophobicContact CG2-CG2 3.96Å; V57-L95 HydrophobicContact CG2-CD1 4.1Å
58	I	88.2	Confident	85.6	Confident	58 Å²	58	35.8 Å²	35.8	30%	0.297	18%	0.175	S	C	.	.	H	α-helix	trans	-60.8	-38.3	178.1	-71.3	162.5	0	0	0	111.4	L50 E54 Y55 K60 F82	L50-I58 HydrophobicContact CD1-CD1 3.56Å; L50-I58 HydrophobicContact CD2-CD1 3.86Å; L50-I58 HydrophobicContact CG-CD1 4.34Å; E54-I58 WeakPolarHBondContact O-CB 3.31Å; E54-I58 WeakPolarHBondContact O-CD1 3.39Å; E54-I58 VanDerWaalsContact O-CG1 3.24Å; E54-I58 WeakPolarHBondContact O-CG1 3.27Å; E54-I58 PolarHBondContact O-N 3.07Å; Y55-I58 PolarHBondContact O-N 3.39Å; I58-K60 PolarHBondContact O-N 3.46Å; I58-F82 HydrophobicContact CD1-CD1 3.92Å; I58-F82 HydrophobicContact CD1-CD2 4.46Å; I58-F82 HydrophobicContact CD1-CE1 4Å; I58-F82 HydrophobicContact CD1-CG 4.16Å; I58-F82 HydrophobicContact CD1-CZ 4.3Å; I58-F82 HydrophobicContact CG1-CB 4.33Å; I58-F82 HydrophobicContact CG1-CD1 4.01Å; I58-F82 HydrophobicContact CG1-CG 4.15Å
59	L	88.6	Confident	85.9	Confident	63 Å²	63	31.6 Å²	31.6	33%	0.33	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-1.5	177.3	-69.7	177	0	0	0	114.5	I23 D24 Y55 S56 V57 K61	I23-L59 HydrophobicContact CG2-CD1 4.08Å; D24-L59 WeakPolarHBondContact OD1-CD1 3.08Å; Y55-L59 HydrophobicContact CD1-CD1 3.78Å; Y55-L59 HydrophobicContact CE1-CD1 3.34Å; Y55-L59 HydrophobicContact CE1-CG 4.32Å; Y55-L59 HydrophobicContact CE2-CD1 4.43Å; Y55-L59 HydrophobicContact CG-CD1 4.49Å; Y55-L59 WeakPolarHBondContact O-CG 3.42Å; Y55-L59 PolarHBondContact O-N 2.68Å; S56-L59 PolarHBondContact O-N 2.87Å; V57-L59 VanDerWaalsContact C-N 3.28Å; V57-L59 PolarHBondContact O-N 3.3Å; L59-K61 HydrophobicContact CB-CD 3.94Å; L59-K61 HydrophobicContact CB-CG 4.11Å; L59-K61 HydrophobicContact CD1-CD 4.18Å; L59-K61 PolarHBondContact O-N 3.31Å
60	K	87.8	Confident	86	Confident	115 Å²	115	29.7 Å²	29.7	50%	0.5	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	30.5	-178.8	-59.9	177.3	176	-175.6	0	114	S56 V57 I58 E62 V86 I91	S56-K60 PolarHBondContact O-N 3.42Å; V57-K60 PolarHBondContact O-N 2.79Å; I58-K60 PolarHBondContact O-N 3.46Å; K60-E62 PolarHBondContact O-N 2.89Å; K60-V86 HydrophobicContact CD-CG1 3.99Å; K60-V86 HydrophobicContact CG-CG1 3.49Å; K60-V86 VanDerWaalsContact CG-CG1 3.49Å; K60-I91 HydrophobicContact CB-CD1 4.43Å
61	K	88.4	Confident	86	Confident	32 Å²	32	32.7 Å²	32.7	14%	0.139	17%	0.168	C	C	.	.			trans	-90	84.3	-178.2	-71.3	169.9	177.3	-110.4	0	110.8	I23 D24 D26 S56 L59 A63 M64 V65	I23-K61 HydrophobicContact CG2-CD 4.09Å; I23-K61 WeakPolarHBondContact O-CD 3.29Å; I23-K61 VanDerWaalsContact O-CE 3.26Å; I23-K61 WeakPolarHBondContact O-CE 3.19Å; I23-K61 PolarHBondContact O-NZ 3.33Å; D24-K61 VanDerWaalsContact C-NZ 3.33Å; D24-K61 PolarHBondContact O-NZ 3.27Å; D26-K61 WeakPolarHBondContact OD1-CD 3.22Å; D26-K61 WeakPolarHBondContact OD1-CE 3.31Å; D26-K61 IonicContact OD1-NZ 3.69Å; D26-K61 PolarHBondContact OD1-NZ 2.97Å; D26-K61 IonicContact OD2-NZ 2.75Å; D26-K61 PolarHBondContact OD2-NZ 3.15Å; S56-K61 PolarHBondContact O-N 2.83Å; L59-K61 HydrophobicContact CB-CD 3.94Å; L59-K61 HydrophobicContact CB-CG 4.11Å; L59-K61 HydrophobicContact CD1-CD 4.18Å; L59-K61 PolarHBondContact O-N 3.31Å; K61-A63 VanDerWaalsContact C-N 3.35Å; K61-A63 PolarHBondContact O-N 3.12Å; K61-M64 HydrophobicContact CB-CB 3.93Å; K61-M64 HydrophobicContact CB-CG 4.03Å; K61-M64 HydrophobicContact CD-CG 4.44Å; K61-M64 PolarHBondContact O-N 2.91Å; K61-M64 VanDerWaalsContact O-N 3.08Å; K61-V65 PolarHBondContact O-N 3.39Å; K61-V65 VanDerWaalsContact O-N 3.1Å
62	E	88.5	Confident	85.2	Confident	61 Å²	61	41 Å²	41	29%	0.285	21%	0.206	S	C	.	.	H	α-helix	trans	-45.8	-54.5	-177.3	-62.7	178.4	-165.4	0	0	112.4	K60 M64 V65 E66 H88 K90 I91	K60-E62 PolarHBondContact O-N 2.89Å; E62-M64 VanDerWaalsContact C-N 3.31Å; E62-M64 PolarHBondContact O-N 3.26Å; E62-V65 WeakPolarHBondContact O-CB 3.44Å; E62-V65 PolarHBondContact O-N 3.11Å; E62-V65 VanDerWaalsContact O-N 3.13Å; E62-E66 PolarHBondContact O-N 3.1Å; E62-H88 IonicContact OE1-CE1 2.81Å; E62-H88 PolarHBondContact OE1-CE1 3.23Å; E62-H88 IonicContact OE1-NE2 3.98Å; E62-H88 PolarHBondContact OE1-NE2 3.34Å; E62-K90 VanDerWaalsContact CD-CD 3.46Å; E62-K90 WeakPolarHBondContact OE1-CD 3.49Å; E62-K90 IonicContact OE1-NZ 2.82Å; E62-K90 PolarHBondContact OE1-NZ 2.93Å; E62-K90 VanDerWaalsContact OE2-CD 3.3Å; E62-K90 WeakPolarHBondContact OE2-CD 3.27Å; E62-K90 IonicContact OE2-NZ 3.86Å; E62-K90 PolarHBondContact OE2-NZ 3.29Å; E62-I91 HydrophobicContact CG-CG1 4.19Å
63	A	86.1	Confident	84.5	Confident	44 Å²	44	43.5 Å²	43.5	36%	0.364	23%	0.226	S	C	.	.	H	α-helix	trans	-68.7	-26.8	-174.7	0	0	0	0	0	113.6	F28 K61 L67	F28-A63 HydrophobicContact CE1-CB 3.53Å; F28-A63 HydrophobicContact CZ-CB 3.57Å; K61-A63 VanDerWaalsContact C-N 3.35Å; K61-A63 PolarHBondContact O-N 3.12Å; A63-L67 WeakPolarHBondContact O-CB 3.47Å; A63-L67 PolarHBondContact O-N 2.72Å; A63-L67 VanDerWaalsContact O-N 3.11Å
64	M	85	Confident	83.8	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-73.7	-38.1	173.1	-71.6	-63.4	137.2	0	0	111.3	D26 F28 V31 K61 E62 L67 I68	D26-M64 HydrophobicContact CB-CE 4.39Å; F28-M64 HydrophobicContact CB-CE 4.29Å; F28-M64 HydrophobicContact CD1-CE 3.26Å; F28-M64 HydrophobicContact CD1-SD 4.41Å; F28-M64 HydrophobicContact CD2-CE 3.76Å; F28-M64 HydrophobicContact CE1-CE 3.3Å; F28-M64 HydrophobicContact CE2-CE 3.78Å; F28-M64 HydrophobicContact CG-CE 3.5Å; F28-M64 HydrophobicContact CZ-CE 3.56Å; V31-M64 HydrophobicContact CG2-SD 4.16Å; K61-M64 HydrophobicContact CB-CB 3.93Å; K61-M64 HydrophobicContact CB-CG 4.03Å; K61-M64 HydrophobicContact CD-CG 4.44Å; K61-M64 PolarHBondContact O-N 2.91Å; K61-M64 VanDerWaalsContact O-N 3.08Å; E62-M64 VanDerWaalsContact C-N 3.31Å; E62-M64 PolarHBondContact O-N 3.26Å; M64-L67 PolarHBondContact O-N 3.33Å; M64-L67 HydrophobicContact SD-CD2 4.44Å; M64-I68 WeakPolarHBondContact O-CB 3.36Å; M64-I68 VanDerWaalsContact O-CG1 3.24Å; M64-I68 WeakPolarHBondContact O-CG1 3.36Å; M64-I68 PolarHBondContact O-N 3.08Å
65	V	86	Confident	83.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-47.1	175.5	176.1	0	0	0	0	110	L53 S56 V57 K61 E62 L67 I68 C69 I91 I94 L95	L53-V65 HydrophobicContact CD1-CG1 4.12Å; S56-V65 WeakPolarHBondContact OG-CG2 3.1Å; V57-V65 HydrophobicContact CG2-CG2 3.94Å; K61-V65 PolarHBondContact O-N 3.39Å; K61-V65 VanDerWaalsContact O-N 3.1Å; E62-V65 WeakPolarHBondContact O-CB 3.44Å; E62-V65 PolarHBondContact O-N 3.11Å; E62-V65 VanDerWaalsContact O-N 3.13Å; V65-L67 VanDerWaalsContact C-N 3.33Å; V65-L67 PolarHBondContact O-N 3.03Å; V65-I68 PolarHBondContact O-N 3.13Å; V65-C69 VanDerWaalsContact O-CB 3.29Å; V65-C69 WeakPolarHBondContact O-CB 3.46Å; V65-C69 PolarHBondContact O-N 2.81Å; V65-C69 PolarHBondContact O-SG 2.74Å; V65-I91 HydrophobicContact CG1-CG2 4.31Å; V65-I91 HydrophobicContact CG2-CG2 4.27Å; V65-I94 HydrophobicContact CG1-CG2 4.2Å; V65-L95 HydrophobicContact CG1-CD2 4.23Å; V65-L95 HydrophobicContact CG1-CG 4.44Å
66	E	87	Confident	82.9	Confident	108 Å²	108	47.4 Å²	47.4	51%	0.505	25%	0.25	S	S	.	.	H	α-helix	trans	-58.9	-44.4	175.9	-68.9	-177.7	175.5	0	0	112	E62 C69 S70 I94	E62-E66 PolarHBondContact O-N 3.1Å; E66-C69 PolarHBondContact O-N 2.78Å; E66-S70 PolarHBondContact O-N 3.2Å; E66-S70 VanDerWaalsContact O-N 3.07Å; E66-I94 HydrophobicContact CG-CD1 3.64Å; E66-I94 HydrophobicContact CG-CG1 4.14Å; E66-I94 HydrophobicContact CG-CG2 3.95Å; E66-I94 WeakPolarHBondContact OE1-CD1 3.49Å
67	L	84.5	Confident	82.5	Confident	19 Å²	19	50.5 Å²	50.5	10%	0.099	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-47.9	177.6	179.5	70.4	0	0	0	111.7	F28 V31 K32 A63 M64 V65 S70 Y71	F28-L67 HydrophobicContact CD1-CD2 4.31Å; V31-L67 HydrophobicContact CB-CD2 4.12Å; V31-L67 HydrophobicContact CG1-CD2 3.81Å; K32-L67 HydrophobicContact CD-CD1 4.13Å; K32-L67 HydrophobicContact CG-CD1 3.79Å; K32-L67 HydrophobicContact CG-CD2 4.08Å; K32-L67 HydrophobicContact CG-CG 4.48Å; A63-L67 WeakPolarHBondContact O-CB 3.47Å; A63-L67 PolarHBondContact O-N 2.72Å; A63-L67 VanDerWaalsContact O-N 3.11Å; M64-L67 PolarHBondContact O-N 3.33Å; M64-L67 HydrophobicContact SD-CD2 4.44Å; V65-L67 VanDerWaalsContact C-N 3.33Å; V65-L67 PolarHBondContact O-N 3.03Å; L67-S70 WeakPolarHBondContact O-CB 3.49Å; L67-S70 PolarHBondContact O-N 3.42Å; L67-S70 PolarHBondContact O-OG 3.06Å; L67-Y71 VanDerWaalsContact O-CD2 3.27Å; L67-Y71 WeakPolarHBondContact O-CD2 3.21Å; L67-Y71 WeakPolarHBondContact O-CE2 3.22Å
68	I	84.5	Confident	82.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.5	-44.5	-178.5	-68.6	166.5	0	0	0	109.5	I23 L42 A52 L53 M64 V65 S70 Y71 V74	I23-I68 HydrophobicContact CD1-CD1 4.34Å; L42-I68 HydrophobicContact CD2-CG2 3.9Å; A52-I68 HydrophobicContact CB-CD1 4.47Å; L53-I68 HydrophobicContact CB-CG2 4.15Å; L53-I68 HydrophobicContact CD1-CB 4.33Å; L53-I68 HydrophobicContact CD1-CG2 3.97Å; M64-I68 WeakPolarHBondContact O-CB 3.36Å; M64-I68 VanDerWaalsContact O-CG1 3.24Å; M64-I68 WeakPolarHBondContact O-CG1 3.36Å; M64-I68 PolarHBondContact O-N 3.08Å; V65-I68 PolarHBondContact O-N 3.13Å; I68-S70 PolarHBondContact O-N 2.69Å; I68-Y71 PolarHBondContact O-N 3.29Å; I68-Y71 VanDerWaalsContact O-N 3.14Å; I68-V74 HydrophobicContact CG2-CG1 4.16Å; I68-V74 HydrophobicContact CG2-CG2 3.88Å; I68-V74 VanDerWaalsContact O-CG2 3.26Å; I68-V74 WeakPolarHBondContact O-CG2 3.26Å
69	C	83.6	Confident	82.1	Confident	7 Å²	7	47.9 Å²	47.9	5%	0.047	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-19.8	178.9	-67	0	0	0	0	114	V65 E66 Y71 R98	V65-C69 VanDerWaalsContact O-CB 3.29Å; V65-C69 WeakPolarHBondContact O-CB 3.46Å; V65-C69 PolarHBondContact O-N 2.81Å; V65-C69 PolarHBondContact O-SG 2.74Å; E66-C69 PolarHBondContact O-N 2.78Å; C69-Y71 PolarHBondContact O-N 2.77Å; C69-R98 PolarHBondContact O-NE 2.83Å
70	S	82.7	Confident	82	Confident	76 Å²	76	45.2 Å²	45.2	53%	0.531	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.6	174.8	77.1	0	0	0	0	113.7	E66 L67 I68	E66-S70 PolarHBondContact O-N 3.2Å; E66-S70 VanDerWaalsContact O-N 3.07Å; L67-S70 WeakPolarHBondContact O-CB 3.49Å; L67-S70 PolarHBondContact O-N 3.42Å; L67-S70 PolarHBondContact O-OG 3.06Å; I68-S70 PolarHBondContact O-N 2.69Å
71	Y	80.9	Confident	81.9	Confident	66 Å²	66	39.9 Å²	39.9	26%	0.259	21%	0.212	S	C	.	.	S	Bend	trans	-89	134.4	176.9	-63	-86.1	0	0	0	111.5	I35 L67 I68 C69 A73	I35-Y71 HydrophobicContact CB-CE1 4.45Å; I35-Y71 HydrophobicContact CB-CE2 4.39Å; I35-Y71 HydrophobicContact CD1-CD2 4.02Å; I35-Y71 HydrophobicContact CD1-CE2 3.6Å; I35-Y71 HydrophobicContact CG2-CD1 3.74Å; I35-Y71 HydrophobicContact CG2-CD2 4.06Å; I35-Y71 HydrophobicContact CG2-CE1 3.57Å; I35-Y71 HydrophobicContact CG2-CE2 3.92Å; I35-Y71 HydrophobicContact CG2-CG 3.98Å; L67-Y71 VanDerWaalsContact O-CD2 3.27Å; L67-Y71 WeakPolarHBondContact O-CD2 3.21Å; L67-Y71 WeakPolarHBondContact O-CE2 3.22Å; I68-Y71 PolarHBondContact O-N 3.29Å; I68-Y71 VanDerWaalsContact O-N 3.14Å; C69-Y71 PolarHBondContact O-N 2.77Å; Y71-A73 VanDerWaalsContact C-N 3.29Å; Y71-A73 PolarHBondContact O-N 2.75Å
72	E	69.3	Low	81.9	Confident	181 Å²	181	38.8 Å²	38.8	85%	0.846	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-22.9	-176	-69.2	-179	166.1	0	0	114.4	V74	E72-V74 VanDerWaalsContact C-N 3.34Å; E72-V74 PolarHBondContact O-N 2.89Å
73	A	68.3	Low	81.9	Confident	51 Å²	51	36 Å²	36	42%	0.421	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	12.6	-171	0	0	0	0	0	114.9	F43 Y71	F43-A73 WeakPolarHBondContact CZ-O 3.5Å; Y71-A73 VanDerWaalsContact C-N 3.29Å; Y71-A73 PolarHBondContact O-N 2.75Å
74	V	73.1	Confident	82	Confident	16 Å²	16	33.9 Å²	33.9	10%	0.097	18%	0.177	C	C	.	.			trans	-81.8	125.4	-173.9	-177.8	0	0	0	0	111.4	L42 L53 I68 E72	L42-V74 HydrophobicContact CD1-CG2 3.98Å; L42-V74 HydrophobicContact CD2-CG2 4.37Å; L53-V74 HydrophobicContact CB-CG1 4.19Å; L53-V74 HydrophobicContact CD2-CG1 3.65Å; L53-V74 HydrophobicContact CG-CG1 4.43Å; I68-V74 HydrophobicContact CG2-CG1 4.16Å; I68-V74 HydrophobicContact CG2-CG2 3.88Å; I68-V74 VanDerWaalsContact O-CG2 3.26Å; I68-V74 WeakPolarHBondContact O-CG2 3.26Å; E72-V74 VanDerWaalsContact C-N 3.34Å; E72-V74 PolarHBondContact O-N 2.89Å
75	N	75.8	Confident	82.2	Confident	90 Å²	90	38.7 Å²	38.7	48%	0.481	20%	0.199	S	C	.	.			trans	-84.3	119	170.3	-169.5	-7.1	0	0	0	109.7	F43 R77	F43-N75 HydrophobicContact CD1-CB 4.46Å; F43-N75 HydrophobicContact CE1-CB 4.14Å; N75-R77 VanDerWaalsContact C-N 3.28Å; N75-R77 HydrophobicContact CB-CG 4.36Å; N75-R77 PolarHBondContact O-N 2.68Å; N75-R77 PolarHBondContact OD1-N 3.23Å
76	V	77.4	Confident	82.3	Confident	8 Å²	8	40 Å²	40	5%	0.048	21%	0.207	C	C	.	.			trans	-65.7	-31.9	-176.5	-178.3	0	0	0	0	111.9	D78 S79 I80 F99 I102	V76-D78 PolarHBondContact O-N 3.43Å; V76-S79 WeakPolarHBondContact O-CB 3.36Å; V76-S79 PolarHBondContact O-N 3.39Å; V76-S79 PolarHBondContact O-OG 2.89Å; V76-I80 HydrophobicContact CG1-CD1 3.8Å; V76-I80 HydrophobicContact CG1-CG1 3.67Å; V76-F99 HydrophobicContact CG2-CB 4.22Å; V76-F99 HydrophobicContact CG2-CD1 3.52Å; V76-F99 HydrophobicContact CG2-CD2 3.42Å; V76-F99 VanDerWaalsContact CG2-CD2 3.42Å; V76-F99 HydrophobicContact CG2-CE1 3.55Å; V76-F99 HydrophobicContact CG2-CE2 3.46Å; V76-F99 VanDerWaalsContact CG2-CE2 3.46Å; V76-F99 HydrophobicContact CG2-CG 3.44Å; V76-F99 VanDerWaalsContact CG2-CG 3.44Å; V76-F99 HydrophobicContact CG2-CZ 3.52Å; V76-I102 HydrophobicContact CG2-CD1 4.16Å
77	R	79	Confident	82.2	Confident	65 Å²	65	40.8 Å²	40.8	25%	0.245	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	38.5	-122.1	-174.4	-65.1	-170.8	69.5	150.8	1.6	111.8	E54 N75 T106	E54-R77 WeakPolarHBondContact OE1-CB 3.22Å; E54-R77 IonicContact OE1-NE 3.65Å; N75-R77 VanDerWaalsContact C-N 3.28Å; N75-R77 HydrophobicContact CB-CG 4.36Å; N75-R77 PolarHBondContact O-N 2.68Å; N75-R77 PolarHBondContact OD1-N 3.23Å; R77-T106 HydrophobicContact CB-CG2 3.65Å; R77-T106 HydrophobicContact CG-CG2 3.83Å
78	D	83.4	Confident	82.3	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.016	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	13.1	-177.2	-48.4	-41	0	0	0	111.7	E54 V76 I80 L81 F82 T106 S109 F112	E54-D78 PolarHBondContact OE1-N 2.79Å; V76-D78 PolarHBondContact O-N 3.43Å; D78-I80 VanDerWaalsContact C-N 3.26Å; D78-I80 PolarHBondContact O-N 3.04Å; D78-L81 HydrophobicContact CB-CB 4.48Å; D78-L81 HydrophobicContact CB-CD1 4.25Å; D78-L81 WeakPolarHBondContact O-CB 3.33Å; D78-L81 PolarHBondContact O-N 2.88Å; D78-F82 HydrophobicContact CB-CD2 4.05Å; D78-F82 HydrophobicContact CB-CE2 3.86Å; D78-F82 WeakPolarHBondContact O-CD2 3.3Å; D78-F82 PolarHBondContact O-N 3.23Å; D78-T106 VanDerWaalsContact CG-OG1 3.3Å; D78-T106 WeakPolarHBondContact OD1-CB 3.34Å; D78-T106 PolarHBondContact OD1-N 3.44Å; D78-T106 PolarHBondContact OD1-OG1 2.9Å; D78-T106 PolarHBondContact OD2-OG1 3.26Å; D78-S109 WeakPolarHBondContact OD2-CB 3.25Å; D78-F112 HydrophobicContact CB-CD2 4Å; D78-F112 HydrophobicContact CB-CE2 4.13Å
79	S	84.7	Confident	82.3	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.7	-35.9	-175.7	-56.1	0	0	0	0	112.7	L53 E54 V76 A83	L53-S79 VanDerWaalsContact CD2-OG 3.31Å; L53-S79 WeakPolarHBondContact CD2-OG 3.2Å; L53-S79 WeakPolarHBondContact CG-OG 3.41Å; E54-S79 VanDerWaalsContact CG-OG 3.27Å; E54-S79 WeakPolarHBondContact CG-OG 3.39Å; V76-S79 WeakPolarHBondContact O-CB 3.36Å; V76-S79 PolarHBondContact O-N 3.39Å; V76-S79 PolarHBondContact O-OG 2.89Å; S79-A83 WeakPolarHBondContact O-CB 2.95Å; S79-A83 PolarHBondContact O-N 3.05Å
80	I	86.1	Confident	82.5	Confident	6 Å²	6	51.2 Å²	51.2	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-67.8	-44.3	175.8	-59.8	173.3	0	0	0	110	V76 D78 F82 A83 V84 L92 I102 P118 L134	V76-I80 HydrophobicContact CG1-CD1 3.8Å; V76-I80 HydrophobicContact CG1-CG1 3.67Å; D78-I80 VanDerWaalsContact C-N 3.26Å; D78-I80 PolarHBondContact O-N 3.04Å; I80-F82 VanDerWaalsContact C-N 3.33Å; I80-F82 PolarHBondContact O-N 3.16Å; I80-A83 WeakPolarHBondContact O-CB 3.34Å; I80-A83 PolarHBondContact O-N 3Å; I80-A83 VanDerWaalsContact O-N 3.12Å; I80-V84 WeakPolarHBondContact O-CG2 3.45Å; I80-V84 PolarHBondContact O-N 2.82Å; I80-L92 HydrophobicContact CG2-CD1 4.24Å; I80-I102 HydrophobicContact CD1-CB 4.37Å; I80-P118 HydrophobicContact CB-CG 4.36Å; I80-P118 HydrophobicContact CG2-CB 3.75Å; I80-P118 HydrophobicContact CG2-CG 3.77Å; I80-L134 HydrophobicContact CG2-CD2 4.48Å
81	L	86.7	Confident	82.7	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-60	-44.2	176	-68.7	166.9	0	0	0	111	D78 A83 V84 Q85 F112 L116 P118 L121	D78-L81 HydrophobicContact CB-CB 4.48Å; D78-L81 HydrophobicContact CB-CD1 4.25Å; D78-L81 WeakPolarHBondContact O-CB 3.33Å; D78-L81 PolarHBondContact O-N 2.88Å; L81-A83 PolarHBondContact O-N 3.33Å; L81-V84 PolarHBondContact O-N 3.43Å; L81-Q85 WeakPolarHBondContact O-CB 3.24Å; L81-Q85 PolarHBondContact O-N 3.27Å; L81-F112 HydrophobicContact CB-CD2 3.87Å; L81-F112 HydrophobicContact CB-CE1 4.31Å; L81-F112 HydrophobicContact CB-CE2 3.58Å; L81-F112 HydrophobicContact CB-CG 4.34Å; L81-F112 HydrophobicContact CB-CZ 3.81Å; L81-F112 HydrophobicContact CD1-CB 4.06Å; L81-F112 HydrophobicContact CD1-CD2 3.76Å; L81-F112 HydrophobicContact CD1-CE2 4.36Å; L81-F112 HydrophobicContact CD1-CG 3.92Å; L81-F112 HydrophobicContact CG-CD2 4.43Å; L81-L116 HydrophobicContact CD2-CD2 4.35Å; L81-L116 HydrophobicContact CD2-CG 4.37Å; L81-P118 HydrophobicContact CD2-CB 4.44Å; L81-P118 HydrophobicContact CD2-CG 4.17Å; L81-P118 HydrophobicContact CG-CG 4.47Å; L81-L121 HydrophobicContact CB-CD2 3.91Å; L81-L121 HydrophobicContact CD2-CB 4.05Å; L81-L121 HydrophobicContact CD2-CD2 3.66Å; L81-L121 HydrophobicContact CG-CD2 4.42Å; L81-L121 VanDerWaalsContact O-CD2 3.26Å; L81-L121 WeakPolarHBondContact O-CD2 3.13Å
82	F	88	Confident	83	Confident	9 Å²	9	44.6 Å²	44.6	4%	0.039	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-40.6	173.4	-73.9	-60.1	0	0	0	112.4	L50 E54 V57 I58 D78 I80 V84 Q85 V86 Y111 F112	L50-F82 HydrophobicContact CD2-CE2 3.69Å; L50-F82 HydrophobicContact CD2-CZ 3.64Å; E54-F82 HydrophobicContact CB-CD2 3.98Å; E54-F82 HydrophobicContact CB-CE2 4.13Å; E54-F82 HydrophobicContact CG-CD2 3.88Å; E54-F82 HydrophobicContact CG-CE2 4.04Å; V57-F82 HydrophobicContact CG1-CB 3.99Å; I58-F82 HydrophobicContact CD1-CD1 3.92Å; I58-F82 HydrophobicContact CD1-CD2 4.46Å; I58-F82 HydrophobicContact CD1-CE1 4Å; I58-F82 HydrophobicContact CD1-CG 4.16Å; I58-F82 HydrophobicContact CD1-CZ 4.3Å; I58-F82 HydrophobicContact CG1-CB 4.33Å; I58-F82 HydrophobicContact CG1-CD1 4.01Å; I58-F82 HydrophobicContact CG1-CG 4.15Å; D78-F82 HydrophobicContact CB-CD2 4.05Å; D78-F82 HydrophobicContact CB-CE2 3.86Å; D78-F82 WeakPolarHBondContact O-CD2 3.3Å; D78-F82 PolarHBondContact O-N 3.23Å; I80-F82 VanDerWaalsContact C-N 3.33Å; I80-F82 PolarHBondContact O-N 3.16Å; F82-V84 VanDerWaalsContact C-N 3.31Å; F82-V84 PolarHBondContact O-N 3.18Å; F82-Q85 PolarHBondContact O-N 3.31Å; F82-V86 VanDerWaalsContact O-CB 3.26Å; F82-V86 WeakPolarHBondContact O-CB 3.47Å; F82-V86 WeakPolarHBondContact O-CG2 3.41Å; F82-V86 PolarHBondContact O-N 3.34Å; F82-Y111 HydrophobicContact CE1-CG 4.32Å; F82-Y111 HydrophobicContact CE2-CD2 4.48Å; F82-Y111 HydrophobicContact CZ-CD1 4.43Å; F82-Y111 AromaticContact CZ-CD2 3.67Å; F82-Y111 HydrophobicContact CZ-CD2 3.67Å; F82-Y111 HydrophobicContact CZ-CE2 4.2Å; F82-Y111 AromaticContact CZ-CG 3.79Å; F82-Y111 HydrophobicContact CZ-CG 3.79Å; F82-F112 AromaticContact CD1-CE2 3.86Å; F82-F112 HydrophobicContact CD1-CE2 3.86Å; F82-F112 AromaticContact CD1-CZ 3.87Å; F82-F112 HydrophobicContact CD1-CZ 3.87Å; F82-F112 HydrophobicContact CD2-CE2 4.21Å; F82-F112 AromaticContact CE1-CE2 3.67Å; F82-F112 HydrophobicContact CE1-CE2 3.67Å; F82-F112 AromaticContact CE1-CZ 3.9Å; F82-F112 HydrophobicContact CE1-CZ 3.9Å; F82-F112 HydrophobicContact CE2-CE2 4.04Å; F82-F112 HydrophobicContact CG-CE2 4.13Å; F82-F112 HydrophobicContact CG-CZ 4.39Å; F82-F112 AromaticContact CZ-CE2 3.77Å; F82-F112 HydrophobicContact CZ-CE2 3.77Å; F82-F112 HydrophobicContact CZ-CZ 4.45Å
83	A	88.5	Confident	83.9	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-61.8	-40.2	178.1	0	0	0	0	0	112.1	V57 S79 I80 L81 K87 I91 L92 L95	V57-A83 HydrophobicContact CG1-CB 3.84Å; S79-A83 WeakPolarHBondContact O-CB 2.95Å; S79-A83 PolarHBondContact O-N 3.05Å; I80-A83 WeakPolarHBondContact O-CB 3.34Å; I80-A83 PolarHBondContact O-N 3Å; I80-A83 VanDerWaalsContact O-N 3.12Å; L81-A83 PolarHBondContact O-N 3.33Å; A83-K87 PolarHBondContact O-N 2.96Å; A83-I91 HydrophobicContact CB-CG2 4.2Å; A83-L92 HydrophobicContact CB-CD1 4.27Å; A83-L95 HydrophobicContact CB-CD1 3.61Å
84	V	87.9	Confident	84.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.4	-47.7	173.7	174.9	0	0	0	0	110.8	I80 L81 F82 V86 K87 L92 L121 A122 L134	I80-V84 WeakPolarHBondContact O-CG2 3.45Å; I80-V84 PolarHBondContact O-N 2.82Å; L81-V84 PolarHBondContact O-N 3.43Å; F82-V84 VanDerWaalsContact C-N 3.31Å; F82-V84 PolarHBondContact O-N 3.18Å; V84-V86 VanDerWaalsContact C-N 3.33Å; V84-V86 PolarHBondContact O-N 3.29Å; V84-K87 PolarHBondContact O-N 3.05Å; V84-K87 VanDerWaalsContact O-N 3.14Å; V84-L92 HydrophobicContact CG2-CD1 4.01Å; V84-L92 HydrophobicContact CG2-CD2 4.47Å; V84-L121 HydrophobicContact CB-CD2 4.35Å; V84-L121 HydrophobicContact CG1-CB 4.36Å; V84-L121 HydrophobicContact CG1-CD2 4.34Å; V84-L121 HydrophobicContact CG1-CG 4Å; V84-A122 VanDerWaalsContact CG1-CA 3.45Å; V84-A122 HydrophobicContact CG1-CB 3.7Å; V84-L134 HydrophobicContact CG2-CD1 4Å
85	Q	88.7	Confident	85.4	Confident	101 Å²	101	38.4 Å²	38.4	47%	0.472	18%	0.178	S	C	.	.	H	α-helix	trans	-62.7	-37.7	179.7	-171.2	179.2	7.3	0	0	112.9	L81 F82 K87 L121	L81-Q85 WeakPolarHBondContact O-CB 3.24Å; L81-Q85 PolarHBondContact O-N 3.27Å; F82-Q85 PolarHBondContact O-N 3.31Å; Q85-K87 PolarHBondContact O-N 3.29Å; Q85-L121 HydrophobicContact CB-CD2 4.45Å
86	V	87.4	Confident	85.9	Confident	29 Å²	29	34.8 Å²	34.8	18%	0.176	16%	0.158	C	C	.	.	H	α-helix	trans	-73.6	-13.2	179.9	173.6	0	0	0	0	112.1	K60 F82 V84 H88	K60-V86 HydrophobicContact CD-CG1 3.99Å; K60-V86 HydrophobicContact CG-CG1 3.49Å; K60-V86 VanDerWaalsContact CG-CG1 3.49Å; F82-V86 VanDerWaalsContact O-CB 3.26Å; F82-V86 WeakPolarHBondContact O-CB 3.47Å; F82-V86 WeakPolarHBondContact O-CG2 3.41Å; F82-V86 PolarHBondContact O-N 3.34Å; V84-V86 VanDerWaalsContact C-N 3.33Å; V84-V86 PolarHBondContact O-N 3.29Å; V86-H88 VanDerWaalsContact C-N 3.32Å; V86-H88 HydrophobicContact CG1-CB 4.17Å; V86-H88 PolarHBondContact O-N 3.36Å
87	K	85.2	Confident	86.2	Confident	123 Å²	123	42 Å²	42	54%	0.535	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	39.5	-179.2	-57.9	-170.7	174.7	-164.2	0	113.3	A83 V84 Q85 T125	A83-K87 PolarHBondContact O-N 2.96Å; V84-K87 PolarHBondContact O-N 3.05Å; V84-K87 VanDerWaalsContact O-N 3.14Å; Q85-K87 PolarHBondContact O-N 3.29Å; K87-T125 WeakPolarHBondContact CE-O 3.13Å; K87-T125 PolarHBondContact NZ-O 3.29Å
88	H	86.5	Confident	86.2	Confident	38 Å²	38	44.6 Å²	44.6	18%	0.176	20%	0.201	C	C	.	.			trans	-108.4	97.8	-179.7	-162.7	-53	0	0	0	112.3	E62 V86 K90 I91 L92	E62-H88 IonicContact OE1-CE1 2.81Å; E62-H88 PolarHBondContact OE1-CE1 3.23Å; E62-H88 IonicContact OE1-NE2 3.98Å; E62-H88 PolarHBondContact OE1-NE2 3.34Å; V86-H88 VanDerWaalsContact C-N 3.32Å; V86-H88 HydrophobicContact CG1-CB 4.17Å; V86-H88 PolarHBondContact O-N 3.36Å; H88-K90 PolarHBondContact O-N 3.48Å; H88-I91 HydrophobicContact CB-CB 4.35Å; H88-I91 HydrophobicContact CB-CD1 4.11Å; H88-I91 HydrophobicContact CB-CG1 4.44Å; H88-I91 PolarHBondContact O-N 3.2Å; H88-L92 PolarHBondContact O-N 3.32Å; H88-L92 VanDerWaalsContact O-N 3.14Å
89	Q	85.2	Confident	86	Confident	92 Å²	92	46.3 Å²	46.3	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-55.9	-47.7	-172.2	-168.7	-176.2	2.2	0	0	114.1	I91 L92 K93 V129 E133	Q89-I91 PolarHBondContact O-N 3.43Å; Q89-L92 WeakPolarHBondContact O-CB 3.45Å; Q89-L92 PolarHBondContact O-N 2.97Å; Q89-K93 WeakPolarHBondContact O-CG 3.32Å; Q89-K93 PolarHBondContact O-N 3.16Å; Q89-V129 HydrophobicContact CG-CG1 4Å; Q89-E133 VanDerWaalsContact CD-OE1 3.27Å; Q89-E133 WeakPolarHBondContact CG-OE1 3.42Å; Q89-E133 PolarHBondContact NE2-OE1 3.36Å
90	K	86.8	Confident	85.4	Confident	116 Å²	116	50.5 Å²	50.5	50%	0.504	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-41.6	-178	-64.1	172.7	179.7	173.7	0	113.3	E62 H88 L92 K93 I94	E62-K90 VanDerWaalsContact CD-CD 3.46Å; E62-K90 WeakPolarHBondContact OE1-CD 3.49Å; E62-K90 IonicContact OE1-NZ 2.82Å; E62-K90 PolarHBondContact OE1-NZ 2.93Å; E62-K90 VanDerWaalsContact OE2-CD 3.3Å; E62-K90 WeakPolarHBondContact OE2-CD 3.27Å; E62-K90 IonicContact OE2-NZ 3.86Å; E62-K90 PolarHBondContact OE2-NZ 3.29Å; H88-K90 PolarHBondContact O-N 3.48Å; K90-L92 VanDerWaalsContact C-N 3.31Å; K90-K93 PolarHBondContact O-N 2.65Å; K90-I94 WeakPolarHBondContact O-CD1 3.5Å; K90-I94 VanDerWaalsContact O-CG1 3.23Å; K90-I94 WeakPolarHBondContact O-CG1 3.28Å; K90-I94 PolarHBondContact O-N 2.99Å
91	I	88	Confident	84.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-43.1	177.9	-67.5	175.1	0	0	0	109.5	V57 K60 E62 V65 A83 H88 Q89 I94 L95	V57-I91 HydrophobicContact CB-CG2 4.45Å; V57-I91 HydrophobicContact CG1-CG2 4.12Å; V57-I91 HydrophobicContact CG2-CG2 3.96Å; K60-I91 HydrophobicContact CB-CD1 4.43Å; E62-I91 HydrophobicContact CG-CG1 4.19Å; V65-I91 HydrophobicContact CG1-CG2 4.31Å; V65-I91 HydrophobicContact CG2-CG2 4.27Å; A83-I91 HydrophobicContact CB-CG2 4.2Å; H88-I91 HydrophobicContact CB-CB 4.35Å; H88-I91 HydrophobicContact CB-CD1 4.11Å; H88-I91 HydrophobicContact CB-CG1 4.44Å; H88-I91 PolarHBondContact O-N 3.2Å; Q89-I91 PolarHBondContact O-N 3.43Å; I91-I94 PolarHBondContact O-N 3.19Å; I91-L95 HydrophobicContact CG2-CD1 4.07Å; I91-L95 WeakPolarHBondContact O-CG 3.46Å; I91-L95 PolarHBondContact O-N 3.31Å
92	L	87.6	Confident	83.9	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-58.4	-48.5	173.9	-176.1	63.3	0	0	0	111.1	I80 A83 V84 H88 Q89 K90 I94 L95 L96 A130	I80-L92 HydrophobicContact CG2-CD1 4.24Å; A83-L92 HydrophobicContact CB-CD1 4.27Å; V84-L92 HydrophobicContact CG2-CD1 4.01Å; V84-L92 HydrophobicContact CG2-CD2 4.47Å; H88-L92 PolarHBondContact O-N 3.32Å; H88-L92 VanDerWaalsContact O-N 3.14Å; Q89-L92 WeakPolarHBondContact O-CB 3.45Å; Q89-L92 PolarHBondContact O-N 2.97Å; K90-L92 VanDerWaalsContact C-N 3.31Å; L92-I94 PolarHBondContact O-N 3.14Å; L92-L95 PolarHBondContact O-N 3.21Å; L92-L95 VanDerWaalsContact O-N 3.16Å; L92-L96 HydrophobicContact CD1-CD1 4Å; L92-L96 HydrophobicContact CD1-CD2 4.45Å; L92-L96 HydrophobicContact CD1-CG 4.04Å; L92-L96 HydrophobicContact CD2-CD1 4.37Å; L92-L96 HydrophobicContact CG-CD1 3.75Å; L92-L96 HydrophobicContact CG-CG 4.18Å; L92-L96 WeakPolarHBondContact O-CB 3.47Å; L92-L96 VanDerWaalsContact O-CG 3.29Å; L92-L96 WeakPolarHBondContact O-CG 3.11Å; L92-L96 PolarHBondContact O-N 3.3Å; L92-A130 HydrophobicContact CD2-CB 3.53Å
93	K	88	Confident	82.8	Confident	91 Å²	91	56.4 Å²	56.4	40%	0.396	28%	0.277	S	S	.	.	H	α-helix	trans	-57.2	-44.3	175.7	-71.4	-174.2	-176.7	-179.1	0	113.2	Q89 K90 L95 L96 Q97 E133	Q89-K93 WeakPolarHBondContact O-CG 3.32Å; Q89-K93 PolarHBondContact O-N 3.16Å; K90-K93 PolarHBondContact O-N 2.65Å; K93-L95 VanDerWaalsContact C-N 3.31Å; K93-L95 PolarHBondContact O-N 3.23Å; K93-L96 PolarHBondContact O-N 2.84Å; K93-Q97 WeakPolarHBondContact O-CB 3.44Å; K93-Q97 WeakPolarHBondContact O-CG 3.29Å; K93-Q97 PolarHBondContact O-N 3.4Å; K93-E133 VanDerWaalsContact CE-CD 3.42Å; K93-E133 WeakPolarHBondContact CE-OE1 3.36Å; K93-E133 IonicContact NZ-OE1 3.06Å; K93-E133 PolarHBondContact NZ-OE1 3.07Å
94	I	86.6	Confident	81.5	Confident	26 Å²	26	63.2 Å²	63.2	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-42.7	178.5	-67.1	156.5	0	0	0	110.3	V65 E66 K90 I91 L92 R98	V65-I94 HydrophobicContact CG1-CG2 4.2Å; E66-I94 HydrophobicContact CG-CD1 3.64Å; E66-I94 HydrophobicContact CG-CG1 4.14Å; E66-I94 HydrophobicContact CG-CG2 3.95Å; E66-I94 WeakPolarHBondContact OE1-CD1 3.49Å; K90-I94 WeakPolarHBondContact O-CD1 3.5Å; K90-I94 VanDerWaalsContact O-CG1 3.23Å; K90-I94 WeakPolarHBondContact O-CG1 3.28Å; K90-I94 PolarHBondContact O-N 2.99Å; I91-I94 PolarHBondContact O-N 3.19Å; L92-I94 PolarHBondContact O-N 3.14Å; I94-R98 PolarHBondContact O-N 2.91Å
95	L	86.2	Confident	80.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-68	-45.3	177.7	-69.6	171.2	0	0	0	112.1	L53 V57 V65 A83 I91 L92 K93 R98 F99	L53-L95 HydrophobicContact CD1-CD2 4.36Å; L53-L95 HydrophobicContact CD2-CD2 4.2Å; V57-L95 HydrophobicContact CG2-CD1 4.1Å; V65-L95 HydrophobicContact CG1-CD2 4.23Å; V65-L95 HydrophobicContact CG1-CG 4.44Å; A83-L95 HydrophobicContact CB-CD1 3.61Å; I91-L95 HydrophobicContact CG2-CD1 4.07Å; I91-L95 WeakPolarHBondContact O-CG 3.46Å; I91-L95 PolarHBondContact O-N 3.31Å; L92-L95 PolarHBondContact O-N 3.21Å; L92-L95 VanDerWaalsContact O-N 3.16Å; K93-L95 VanDerWaalsContact C-N 3.31Å; K93-L95 PolarHBondContact O-N 3.23Å; L95-R98 PolarHBondContact O-N 3.13Å; L95-F99 PolarHBondContact O-N 2.91Å
96	L	85.3	Confident	78.8	Confident	14 Å²	14	60.8 Å²	60.8	7%	0.073	30%	0.303	C	S	.	.	H	α-helix	trans	-67.1	-36.1	-179.4	-67.7	177.4	0	0	0	112.6	L92 K93 R98 E133 L134 A137 H139	L92-L96 HydrophobicContact CD1-CD1 4Å; L92-L96 HydrophobicContact CD1-CD2 4.45Å; L92-L96 HydrophobicContact CD1-CG 4.04Å; L92-L96 HydrophobicContact CD2-CD1 4.37Å; L92-L96 HydrophobicContact CG-CD1 3.75Å; L92-L96 HydrophobicContact CG-CG 4.18Å; L92-L96 WeakPolarHBondContact O-CB 3.47Å; L92-L96 VanDerWaalsContact O-CG 3.29Å; L92-L96 WeakPolarHBondContact O-CG 3.11Å; L92-L96 PolarHBondContact O-N 3.3Å; K93-L96 PolarHBondContact O-N 2.84Å; L96-R98 VanDerWaalsContact C-N 3.26Å; L96-R98 PolarHBondContact O-N 3.46Å; L96-E133 HydrophobicContact CD1-CB 4.09Å; L96-L134 HydrophobicContact CD1-CD2 4.16Å; L96-L134 HydrophobicContact CD2-CD2 3.69Å; L96-A137 HydrophobicContact CB-CB 4.41Å; L96-A137 HydrophobicContact CD1-CB 4.31Å; L96-A137 HydrophobicContact CD2-CB 4.19Å; L96-H139 WeakPolarHBondContact CD2-NE2 3.22Å
97	Q	84.2	Confident	77.5	Confident	159 Å²	159	67.2 Å²	67.2	74%	0.743	33%	0.328	S	S	*	.	H	α-helix	trans	-62.5	-34.6	174.4	-78.5	175.9	2.5	0	0	112.4	K93	K93-Q97 WeakPolarHBondContact O-CB 3.44Å; K93-Q97 WeakPolarHBondContact O-CG 3.29Å; K93-Q97 PolarHBondContact O-N 3.4Å
98	R	79.7	Confident	76.4	Confident	120 Å²	120	68.1 Å²	68.1	45%	0.453	34%	0.339	S	S	.	.	H	α-helix	trans	-87.3	-35.5	-177.9	-172.2	58.5	167.4	159	2.4	112.7	C69 I94 L95 L96	C69-R98 PolarHBondContact O-NE 2.83Å; I94-R98 PolarHBondContact O-N 2.91Å; L95-R98 PolarHBondContact O-N 3.13Å; L96-R98 VanDerWaalsContact C-N 3.26Å; L96-R98 PolarHBondContact O-N 3.46Å
99	F	78.6	Confident	75.6	Confident	39 Å²	39	67.3 Å²	67.3	17%	0.171	34%	0.338	C	S	.	.	S	Bend	trans	-129.2	68.1	-173.9	-59.3	-76.6	0	0	0	111.7	V76 L95 I102	V76-F99 HydrophobicContact CG2-CB 4.22Å; V76-F99 HydrophobicContact CG2-CD1 3.52Å; V76-F99 HydrophobicContact CG2-CD2 3.42Å; V76-F99 VanDerWaalsContact CG2-CD2 3.42Å; V76-F99 HydrophobicContact CG2-CE1 3.55Å; V76-F99 HydrophobicContact CG2-CE2 3.46Å; V76-F99 VanDerWaalsContact CG2-CE2 3.46Å; V76-F99 HydrophobicContact CG2-CG 3.44Å; V76-F99 VanDerWaalsContact CG2-CG 3.44Å; V76-F99 HydrophobicContact CG2-CZ 3.52Å; L95-F99 PolarHBondContact O-N 2.91Å; F99-I102 HydrophobicContact CB-CD1 3.84Å; F99-I102 HydrophobicContact CB-CG1 4.37Å; F99-I102 HydrophobicContact CD1-CD1 3.99Å; F99-I102 HydrophobicContact CG-CD1 4.24Å
100	P	72.6	Confident	75	Confident	89 Å²	89	67.9 Å²	67.9	58%	0.578	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	134.4	176.4	28.5	-34	0	0	0	110.8
101	G	69	Low	74.8	Confident	39 Å²	39	67.4 Å²	67.4	40%	0.402	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	16	168.3	0	0	0	0	0	117	D103	G101-D103 PolarHBondContact O-N 2.99Å
102	I	71.4	Confident	74.5	Confident	68 Å²	68	68.3 Å²	68.3	35%	0.349	34%	0.343	S	S	.	.			trans	-82.3	94.6	169.7	-56.2	-175.8	0	0	0	109.4	V76 I80 F99 H139	V76-I102 HydrophobicContact CG2-CD1 4.16Å; I80-I102 HydrophobicContact CD1-CB 4.37Å; F99-I102 HydrophobicContact CB-CD1 3.84Å; F99-I102 HydrophobicContact CB-CG1 4.37Å; F99-I102 HydrophobicContact CD1-CD1 3.99Å; F99-I102 HydrophobicContact CG-CD1 4.24Å; I102-H139 PolarHBondContact O-CE1 3.22Å; I102-H139 VanDerWaalsContact O-CE1 3.3Å
103	D	64.5	Low	74.1	Confident	35 Å²	35	70.7 Å²	70.7	19%	0.187	36%	0.359	C	S	.	.			trans	-80.7	-20.9	-176.2	-68.5	-30.8	0	0	0	114.5	G101 T117 P118 H139	G101-D103 PolarHBondContact O-N 2.99Å; D103-T117 WeakPolarHBondContact O-CB 3.34Å; D103-T117 WeakPolarHBondContact O-CG2 3.43Å; D103-P118 WeakPolarHBondContact O-CD 3.26Å; D103-H139 WeakPolarHBondContact OD1-CA 3.46Å; D103-H139 WeakPolarHBondContact OD1-CB 3.21Å; D103-H139 IonicContact OD1-CE1 2.72Å; D103-H139 IonicContact OD1-CG 3.78Å; D103-H139 IonicContact OD1-ND1 3.78Å; D103-H139 PolarHBondContact OD1-ND1 3.12Å
104	Q	61.1	Low	73.5	Confident	146 Å²	146	69.5 Å²	69.5	68%	0.682	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-103.5	124	-167.4	-64.9	-177.2	8.1	0	0	112.1
105	G	59.9	Low	73	Confident	13 Å²	13	70.8 Å²	70.8	13%	0.134	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-64	165.5	160.9	0	0	0	0	0	111.5	K107	G105-K107 PolarHBondContact O-N 3.38Å
106	T	60.4	Low	72.8	Confident	36 Å²	36	71.3 Å²	71.3	22%	0.221	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-68.3	124.8	177	58.7	0	0	0	0	110.4	R77 D78 N108 S109	R77-T106 HydrophobicContact CB-CG2 3.65Å; R77-T106 HydrophobicContact CG-CG2 3.83Å; D78-T106 VanDerWaalsContact CG-OG1 3.3Å; D78-T106 WeakPolarHBondContact OD1-CB 3.34Å; D78-T106 PolarHBondContact OD1-N 3.44Å; D78-T106 PolarHBondContact OD1-OG1 2.9Å; D78-T106 PolarHBondContact OD2-OG1 3.26Å; T106-N108 PolarHBondContact O-N 3.14Å; T106-S109 PolarHBondContact O-N 3.23Å; T106-S109 WeakPolarHBondContact OG1-CB 3.47Å
107	K	61.4	Low	72.7	Confident	164 Å²	164	71.7 Å²	71.7	71%	0.713	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-24.9	-179.9	-67.7	-172.6	177	-172.1	0	114.3	G105	G105-K107 PolarHBondContact O-N 3.38Å
108	N	61.7	Low	72.8	Confident	143 Å²	143	64.2 Å²	64.2	77%	0.765	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	38.9	-179.1	-66.6	-6.2	0	0	0	112.4	T106	T106-N108 PolarHBondContact O-N 3.14Å
109	S	68.7	Low	73.2	Confident	21 Å²	21	58.6 Å²	58.6	15%	0.147	31%	0.314	C	S	.	.			trans	-70.5	145.4	171	94.5	0	0	0	0	110.7	D78 T106 Y111 F112	D78-S109 WeakPolarHBondContact OD2-CB 3.25Å; T106-S109 PolarHBondContact O-N 3.23Å; T106-S109 WeakPolarHBondContact OG1-CB 3.47Å; S109-Y111 PolarHBondContact OG-N 3.31Å; S109-F112 WeakPolarHBondContact OG-CA 3.42Å; S109-F112 PolarHBondContact OG-N 2.93Å; S109-F112 PolarHBondContact OG-O 3.35Å
110	N	74	Confident	73.6	Confident	103 Å²	103	56.8 Å²	56.8	55%	0.551	31%	0.306	S	S	*	.	S	Bend	trans	-83.8	-0.7	172.1	-55.6	-79.2	0	0	0	112	K49	K49-N110 WeakPolarHBondContact CD-ND2 3.39Å
111	Y	81.5	Confident	74.4	Confident	106 Å²	106	53.2 Å²	53.2	42%	0.416	28%	0.282	S	S	.	.	S	Bend	trans	-118.4	-36.2	-164.2	-68.6	-71.1	0	0	0	113.3	M48 L50 F82 S109	M48-Y111 PolarHBondContact O-OH 2.94Å; L50-Y111 HydrophobicContact CD2-CD2 4.26Å; L50-Y111 HydrophobicContact CD2-CE2 3.59Å; L50-Y111 HydrophobicContact CG-CE2 4.2Å; F82-Y111 HydrophobicContact CE1-CG 4.32Å; F82-Y111 HydrophobicContact CE2-CD2 4.48Å; F82-Y111 HydrophobicContact CZ-CD1 4.43Å; F82-Y111 AromaticContact CZ-CD2 3.67Å; F82-Y111 HydrophobicContact CZ-CD2 3.67Å; F82-Y111 HydrophobicContact CZ-CE2 4.2Å; F82-Y111 AromaticContact CZ-CG 3.79Å; F82-Y111 HydrophobicContact CZ-CG 3.79Å; S109-Y111 PolarHBondContact OG-N 3.31Å
112	F	82.7	Confident	75.3	Confident	19 Å²	19	51.3 Å²	51.3	8%	0.083	26%	0.263	C	S	.	.	S	Bend	trans	-126.6	138.3	-176.5	-58.2	-71.7	0	0	0	110.7	D78 L81 F82 S109 L116 L121	D78-F112 HydrophobicContact CB-CD2 4Å; D78-F112 HydrophobicContact CB-CE2 4.13Å; L81-F112 HydrophobicContact CB-CD2 3.87Å; L81-F112 HydrophobicContact CB-CE1 4.31Å; L81-F112 HydrophobicContact CB-CE2 3.58Å; L81-F112 HydrophobicContact CB-CG 4.34Å; L81-F112 HydrophobicContact CB-CZ 3.81Å; L81-F112 HydrophobicContact CD1-CB 4.06Å; L81-F112 HydrophobicContact CD1-CD2 3.76Å; L81-F112 HydrophobicContact CD1-CE2 4.36Å; L81-F112 HydrophobicContact CD1-CG 3.92Å; L81-F112 HydrophobicContact CG-CD2 4.43Å; F82-F112 AromaticContact CD1-CE2 3.86Å; F82-F112 HydrophobicContact CD1-CE2 3.86Å; F82-F112 AromaticContact CD1-CZ 3.87Å; F82-F112 HydrophobicContact CD1-CZ 3.87Å; F82-F112 HydrophobicContact CD2-CE2 4.21Å; F82-F112 AromaticContact CE1-CE2 3.67Å; F82-F112 HydrophobicContact CE1-CE2 3.67Å; F82-F112 AromaticContact CE1-CZ 3.9Å; F82-F112 HydrophobicContact CE1-CZ 3.9Å; F82-F112 HydrophobicContact CE2-CE2 4.04Å; F82-F112 HydrophobicContact CG-CE2 4.13Å; F82-F112 HydrophobicContact CG-CZ 4.39Å; F82-F112 AromaticContact CZ-CE2 3.77Å; F82-F112 HydrophobicContact CZ-CE2 3.77Å; F82-F112 HydrophobicContact CZ-CZ 4.45Å; S109-F112 WeakPolarHBondContact OG-CA 3.42Å; S109-F112 PolarHBondContact OG-N 2.93Å; S109-F112 PolarHBondContact OG-O 3.35Å; F112-L116 HydrophobicContact CB-CD2 4.09Å; F112-L116 HydrophobicContact CD1-CD2 3.62Å; F112-L116 HydrophobicContact CE1-CD2 4.48Å; F112-L116 HydrophobicContact CG-CD2 4.21Å; F112-L121 HydrophobicContact CD1-CD2 4.33Å; F112-L121 HydrophobicContact CE1-CD2 3.78Å; F112-L121 HydrophobicContact CZ-CD2 4.28Å
113	P	79.3	Confident	76.1	Confident	53 Å²	53	48.2 Å²	48.2	34%	0.344	25%	0.247	S	C	.	.			trans	-58.7	150.7	171.1	-22.7	33.6	0	0	0	112.1	Y115 L116	P113-Y115 HydrophobicContact CB-CD1 3.52Å; P113-Y115 HydrophobicContact CB-CE1 3.15Å; P113-Y115 HydrophobicContact CB-CE2 4.39Å; P113-Y115 HydrophobicContact CB-CG 4.3Å; P113-Y115 HydrophobicContact CG-CE1 3.89Å; P113-Y115 PolarHBondContact O-N 3.49Å; P113-L116 WeakPolarHBondContact O-CB 3.47Å; P113-L116 PolarHBondContact O-N 3.34Å; P113-L116 VanDerWaalsContact O-N 3.13Å
114	P	74.2	Confident	77.3	Confident	67 Å²	67	48.6 Å²	48.6	44%	0.435	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-23.8	-174.2	27.5	-35.3	0	0	0	113.4	L116 E167	P114-L116 VanDerWaalsContact C-N 3.33Å; P114-E167 VanDerWaalsContact CG-OE1 3.3Å; P114-E167 WeakPolarHBondContact CG-OE1 3.44Å
115	Y	76.2	Confident	78.6	Confident	52 Å²	52	43.1 Å²	43.1	20%	0.204	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-12.3	178.6	65.4	-97.5	0	0	0	113.8	P113 T117 E167 T171 D174	P113-Y115 HydrophobicContact CB-CD1 3.52Å; P113-Y115 HydrophobicContact CB-CE1 3.15Å; P113-Y115 HydrophobicContact CB-CE2 4.39Å; P113-Y115 HydrophobicContact CB-CG 4.3Å; P113-Y115 HydrophobicContact CG-CE1 3.89Å; P113-Y115 PolarHBondContact O-N 3.49Å; Y115-T117 PolarHBondContact O-N 3.41Å; Y115-E167 HydrophobicContact CD1-CG 4.5Å; Y115-E167 HydrophobicContact CE1-CG 4.37Å; Y115-T171 HydrophobicContact CD1-CG2 3.29Å; Y115-T171 HydrophobicContact CD2-CG2 4.09Å; Y115-T171 HydrophobicContact CE1-CG2 3.36Å; Y115-T171 HydrophobicContact CE2-CG2 4.19Å; Y115-T171 HydrophobicContact CG-CG2 3.67Å; Y115-D174 HydrophobicContact CE2-CB 4.03Å; Y115-D174 PolarHBondContact OH-OD2 3.27Å
116	L	81.8	Confident	79.8	Confident	11 Å²	11	47.9 Å²	47.9	6%	0.058	24%	0.244	C	C	.	.			trans	-80	112.4	-171.5	-171	72.7	0	0	0	111.2	L81 F112 P113 P114 V120 L121 I124	L81-L116 HydrophobicContact CD2-CD2 4.35Å; L81-L116 HydrophobicContact CD2-CG 4.37Å; F112-L116 HydrophobicContact CB-CD2 4.09Å; F112-L116 HydrophobicContact CD1-CD2 3.62Å; F112-L116 HydrophobicContact CE1-CD2 4.48Å; F112-L116 HydrophobicContact CG-CD2 4.21Å; P113-L116 WeakPolarHBondContact O-CB 3.47Å; P113-L116 PolarHBondContact O-N 3.34Å; P113-L116 VanDerWaalsContact O-N 3.13Å; P114-L116 VanDerWaalsContact C-N 3.33Å; L116-V120 HydrophobicContact CD1-CB 4.25Å; L116-V120 HydrophobicContact CD1-CG1 3.74Å; L116-L121 HydrophobicContact CD1-CB 4.22Å; L116-L121 HydrophobicContact CD2-CB 4.04Å; L116-L121 HydrophobicContact CD2-CD1 4.06Å; L116-L121 HydrophobicContact CD2-CD2 4.26Å; L116-L121 HydrophobicContact CD2-CG 4.33Å; L116-L121 HydrophobicContact CG-CB 4.11Å; L116-I124 HydrophobicContact CD1-CD1 3.97Å
117	T	84.1	Confident	81	Confident	22 Å²	22	47.5 Å²	47.5	14%	0.135	24%	0.241	C	C	.	.			trans	-89.3	156.1	172.4	63.7	0	0	0	0	111.1	D103 Y115 I119 V120 L121	D103-T117 WeakPolarHBondContact O-CB 3.34Å; D103-T117 WeakPolarHBondContact O-CG2 3.43Å; Y115-T117 PolarHBondContact O-N 3.41Å; T117-I119 PolarHBondContact O-N 3.28Å; T117-I119 WeakPolarHBondContact OG1-CG2 3.23Å; T117-V120 PolarHBondContact O-N 3.15Å; T117-V120 VanDerWaalsContact O-N 3.09Å; T117-V120 WeakPolarHBondContact OG1-CB 3.09Å; T117-V120 WeakPolarHBondContact OG1-CG2 3.3Å; T117-V120 PolarHBondContact OG1-N 2.84Å; T117-L121 PolarHBondContact O-N 3.24Å
118	P	86.6	Confident	82	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.019	22%	0.222	C	C	.	.	H	α-helix	trans	-53.7	-39.5	177.1	-29.5	36.6	0	0	0	114.2	I80 L81 D103 L121 A122 L134	I80-P118 HydrophobicContact CB-CG 4.36Å; I80-P118 HydrophobicContact CG2-CB 3.75Å; I80-P118 HydrophobicContact CG2-CG 3.77Å; L81-P118 HydrophobicContact CD2-CB 4.44Å; L81-P118 HydrophobicContact CD2-CG 4.17Å; L81-P118 HydrophobicContact CG-CG 4.47Å; D103-P118 WeakPolarHBondContact O-CD 3.26Å; P118-L121 PolarHBondContact O-N 3.03Å; P118-A122 WeakPolarHBondContact O-CB 3.14Å; P118-A122 PolarHBondContact O-N 3.4Å; P118-L134 HydrophobicContact CB-CD1 4.14Å; P118-L134 HydrophobicContact CB-CD2 3.98Å; P118-L134 WeakPolarHBondContact O-CD1 3.31Å
119	I	86.8	Confident	83.1	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-68.3	-38.5	178.6	-168.5	163.8	0	0	0	111.7	T117 A122 A123 Y131 L135 V141 F178	T117-I119 PolarHBondContact O-N 3.28Å; T117-I119 WeakPolarHBondContact OG1-CG2 3.23Å; I119-A122 PolarHBondContact O-N 2.95Å; I119-A123 WeakPolarHBondContact O-CB 3.46Å; I119-A123 PolarHBondContact O-N 3.42Å; I119-Y131 HydrophobicContact CD1-CE2 4.04Å; I119-Y131 HydrophobicContact CG1-CD2 3.79Å; I119-Y131 HydrophobicContact CG1-CE2 3.55Å; I119-L135 HydrophobicContact CD1-CD2 3.53Å; I119-L135 HydrophobicContact CD1-CG 3.94Å; I119-V141 HydrophobicContact CD1-CG2 4.14Å; I119-V141 HydrophobicContact CG1-CG2 4.38Å; I119-V141 HydrophobicContact CG2-CG2 3.69Å; I119-F178 HydrophobicContact CG1-CE2 4.49Å
120	V	87.5	Confident	83.9	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-66.8	-42.6	175.1	173.6	0	0	0	0	110.7	L116 T117 A122 A123 I124 V141 L144 F178	L116-V120 HydrophobicContact CD1-CB 4.25Å; L116-V120 HydrophobicContact CD1-CG1 3.74Å; T117-V120 PolarHBondContact O-N 3.15Å; T117-V120 VanDerWaalsContact O-N 3.09Å; T117-V120 WeakPolarHBondContact OG1-CB 3.09Å; T117-V120 WeakPolarHBondContact OG1-CG2 3.3Å; T117-V120 PolarHBondContact OG1-N 2.84Å; V120-A122 PolarHBondContact O-N 3.04Å; V120-A123 WeakPolarHBondContact O-CB 3.26Å; V120-A123 PolarHBondContact O-N 2.92Å; V120-I124 HydrophobicContact CG1-CD1 3.64Å; V120-I124 HydrophobicContact CG1-CG1 4.33Å; V120-I124 WeakPolarHBondContact O-CB 3.34Å; V120-I124 VanDerWaalsContact O-CG1 3.22Å; V120-I124 WeakPolarHBondContact O-CG1 3.47Å; V120-I124 PolarHBondContact O-N 3.41Å; V120-V141 HydrophobicContact CG2-CG1 4.45Å; V120-L144 HydrophobicContact CG1-CD2 4.41Å; V120-L144 HydrophobicContact CG2-CD1 3.94Å; V120-L144 HydrophobicContact CG2-CD2 4.1Å; V120-L144 HydrophobicContact CG2-CG 4.3Å; V120-F178 HydrophobicContact CB-CD2 4.29Å; V120-F178 HydrophobicContact CG1-CB 4.34Å; V120-F178 HydrophobicContact CG2-CD2 3.84Å; V120-F178 HydrophobicContact CG2-CE2 4.29Å; V120-F178 HydrophobicContact CG2-CG 4.29Å
121	L	89	Confident	84.6	Confident	14 Å²	14	31 Å²	31	7%	0.073	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-39.1	174.7	-179.3	58.8	0	0	0	112.2	L81 V84 Q85 F112 L116 T117 P118 A123 I124 T125	L81-L121 HydrophobicContact CB-CD2 3.91Å; L81-L121 HydrophobicContact CD2-CB 4.05Å; L81-L121 HydrophobicContact CD2-CD2 3.66Å; L81-L121 HydrophobicContact CG-CD2 4.42Å; L81-L121 VanDerWaalsContact O-CD2 3.26Å; L81-L121 WeakPolarHBondContact O-CD2 3.13Å; V84-L121 HydrophobicContact CB-CD2 4.35Å; V84-L121 HydrophobicContact CG1-CB 4.36Å; V84-L121 HydrophobicContact CG1-CD2 4.34Å; V84-L121 HydrophobicContact CG1-CG 4Å; Q85-L121 HydrophobicContact CB-CD2 4.45Å; F112-L121 HydrophobicContact CD1-CD2 4.33Å; F112-L121 HydrophobicContact CE1-CD2 3.78Å; F112-L121 HydrophobicContact CZ-CD2 4.28Å; L116-L121 HydrophobicContact CD1-CB 4.22Å; L116-L121 HydrophobicContact CD2-CB 4.04Å; L116-L121 HydrophobicContact CD2-CD1 4.06Å; L116-L121 HydrophobicContact CD2-CD2 4.26Å; L116-L121 HydrophobicContact CD2-CG 4.33Å; L116-L121 HydrophobicContact CG-CB 4.11Å; T117-L121 PolarHBondContact O-N 3.24Å; P118-L121 PolarHBondContact O-N 3.03Å; L121-A123 VanDerWaalsContact C-N 3.33Å; L121-A123 PolarHBondContact O-N 2.84Å; L121-I124 PolarHBondContact O-N 3.4Å; L121-T125 HydrophobicContact CD1-CG2 3.71Å; L121-T125 HydrophobicContact CG-CG2 4.29Å; L121-T125 WeakPolarHBondContact O-CB 3.36Å; L121-T125 VanDerWaalsContact O-CG2 3.31Å; L121-T125 WeakPolarHBondContact O-CG2 3.36Å; L121-T125 PolarHBondContact O-N 3.21Å; L121-T125 PolarHBondContact O-OG1 2.99Å
122	A	89	Confident	84.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.6	-41.9	177	0	0	0	0	0	111.6	V84 P118 I119 V120 T125 E126 N127 A130 L134	V84-A122 VanDerWaalsContact CG1-CA 3.45Å; V84-A122 HydrophobicContact CG1-CB 3.7Å; P118-A122 WeakPolarHBondContact O-CB 3.14Å; P118-A122 PolarHBondContact O-N 3.4Å; I119-A122 PolarHBondContact O-N 2.95Å; V120-A122 PolarHBondContact O-N 3.04Å; A122-T125 PolarHBondContact O-OG1 3.22Å; A122-E126 PolarHBondContact O-N 3.04Å; A122-N127 PolarHBondContact O-N 3.11Å; A122-A130 HydrophobicContact CB-CB 4.26Å; A122-L134 HydrophobicContact CB-CD1 3.69Å
123	A	88.6	Confident	84.9	Confident	2 Å²	2	29.8 Å²	29.8	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-63.7	-48.4	173.8	0	0	0	0	0	112.3	I119 V120 L121 T125 E126 Y131 F178 S181	I119-A123 WeakPolarHBondContact O-CB 3.46Å; I119-A123 PolarHBondContact O-N 3.42Å; V120-A123 WeakPolarHBondContact O-CB 3.26Å; V120-A123 PolarHBondContact O-N 2.92Å; L121-A123 VanDerWaalsContact C-N 3.33Å; L121-A123 PolarHBondContact O-N 2.84Å; A123-T125 VanDerWaalsContact C-N 3.31Å; A123-T125 PolarHBondContact O-N 2.95Å; A123-E126 PolarHBondContact O-N 3.38Å; A123-E126 VanDerWaalsContact O-N 3.11Å; A123-Y131 HydrophobicContact CB-CD2 4.14Å; A123-Y131 HydrophobicContact CB-CE2 4.15Å; A123-F178 HydrophobicContact CB-CD2 3.44Å; A123-F178 VanDerWaalsContact CB-CD2 3.44Å; A123-F178 HydrophobicContact CB-CE2 3.93Å; A123-F178 HydrophobicContact CB-CG 4.38Å; A123-S181 WeakPolarHBondContact CB-OG 3.44Å; A123-S181 WeakPolarHBondContact O-CB 3.35Å
124	I	89.6	Confident	85.3	Confident	44 Å²	44	27.2 Å²	27.2	23%	0.226	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-37	-179.9	-68.8	168.3	0	0	0	111.6	L116 V120 L121 E126 D174 R177	L116-I124 HydrophobicContact CD1-CD1 3.97Å; V120-I124 HydrophobicContact CG1-CD1 3.64Å; V120-I124 HydrophobicContact CG1-CG1 4.33Å; V120-I124 WeakPolarHBondContact O-CB 3.34Å; V120-I124 VanDerWaalsContact O-CG1 3.22Å; V120-I124 WeakPolarHBondContact O-CG1 3.47Å; V120-I124 PolarHBondContact O-N 3.41Å; L121-I124 PolarHBondContact O-N 3.4Å; I124-E126 PolarHBondContact O-N 3.3Å; I124-D174 HydrophobicContact CD1-CB 3.88Å; I124-R177 HydrophobicContact CG1-CB 3.93Å
125	T	86.9	Confident	85.8	Confident	30 Å²	30	26.9 Å²	26.9	18%	0.184	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	2.2	178.4	56.9	0	0	0	0	113.8	K87 L121 A122 A123 N127	K87-T125 WeakPolarHBondContact CE-O 3.13Å; K87-T125 PolarHBondContact NZ-O 3.29Å; L121-T125 HydrophobicContact CD1-CG2 3.71Å; L121-T125 HydrophobicContact CG-CG2 4.29Å; L121-T125 WeakPolarHBondContact O-CB 3.36Å; L121-T125 VanDerWaalsContact O-CG2 3.31Å; L121-T125 WeakPolarHBondContact O-CG2 3.36Å; L121-T125 PolarHBondContact O-N 3.21Å; L121-T125 PolarHBondContact O-OG1 2.99Å; A122-T125 PolarHBondContact O-OG1 3.22Å; A123-T125 VanDerWaalsContact C-N 3.31Å; A123-T125 PolarHBondContact O-N 2.95Å; T125-N127 PolarHBondContact O-N 3.34Å
126	E	85.6	Confident	86.2	Confident	113 Å²	113	31.4 Å²	31.4	53%	0.528	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	39.5	-178.3	-62.1	178.1	-175.6	0	0	112.4	A122 A123 I124 K223	A122-E126 PolarHBondContact O-N 3.04Å; A123-E126 PolarHBondContact O-N 3.38Å; A123-E126 VanDerWaalsContact O-N 3.11Å; I124-E126 PolarHBondContact O-N 3.3Å; E126-K223 WeakPolarHBondContact OE1-CE 3.36Å; E126-K223 IonicContact OE1-NZ 2.95Å; E126-K223 PolarHBondContact OE1-NZ 3.5Å; E126-K223 IonicContact OE2-NZ 3.42Å
127	N	85.5	Confident	86.4	Confident	28 Å²	28	32.2 Å²	32.2	15%	0.15	18%	0.18	C	C	.	.			trans	-100.1	85.4	176.7	-170.7	-6.7	0	0	0	110.3	A122 T125 V129 A130 Y131	A122-N127 PolarHBondContact O-N 3.11Å; T125-N127 PolarHBondContact O-N 3.34Å; N127-V129 VanDerWaalsContact C-N 3.29Å; N127-V129 PolarHBondContact O-N 3.09Å; N127-A130 HydrophobicContact CB-CB 4.08Å; N127-A130 WeakPolarHBondContact ND2-CB 3.37Å; N127-A130 PolarHBondContact O-N 2.89Å; N127-A130 PolarHBondContact OD1-N 2.79Å; N127-Y131 PolarHBondContact O-N 3.39Å
128	G	83.3	Confident	86.2	Confident	30 Å²	30	33.5 Å²	33.5	31%	0.309	20%	0.198	S	C	.	.	H	α-helix	trans	-58.8	-36.3	-178	0	0	0	0	0	114	Y131 E132	G128-Y131 WeakPolarHBondContact O-CB 3.22Å; G128-Y131 PolarHBondContact O-N 3.09Å; G128-E132 PolarHBondContact O-N 2.92Å
129	V	84.3	Confident	85.8	Confident	48 Å²	48	33.5 Å²	33.5	29%	0.291	20%	0.197	S	C	.	.	H	α-helix	trans	-67.3	-44.1	179.5	-178.2	0	0	0	0	111.2	Q89 N127 Y131 E132 E133	Q89-V129 HydrophobicContact CG-CG1 4Å; N127-V129 VanDerWaalsContact C-N 3.29Å; N127-V129 PolarHBondContact O-N 3.09Å; V129-Y131 VanDerWaalsContact C-N 3.29Å; V129-Y131 PolarHBondContact O-N 3.25Å; V129-E132 PolarHBondContact O-N 3.29Å; V129-E133 WeakPolarHBondContact O-CG 3.46Å; V129-E133 PolarHBondContact O-N 2.97Å
130	A	86	Confident	85.2	Confident	4 Å²	4	37.6 Å²	37.6	3%	0.033	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-36.2	175.2	0	0	0	0	0	111.6	L92 A122 N127 E133 L134	L92-A130 HydrophobicContact CD2-CB 3.53Å; A122-A130 HydrophobicContact CB-CB 4.26Å; N127-A130 HydrophobicContact CB-CB 4.08Å; N127-A130 WeakPolarHBondContact ND2-CB 3.37Å; N127-A130 PolarHBondContact O-N 2.89Å; N127-A130 PolarHBondContact OD1-N 2.79Å; A130-E133 PolarHBondContact O-N 3.38Å; A130-L134 WeakPolarHBondContact O-CB 3.38Å; A130-L134 WeakPolarHBondContact O-CD1 3.42Å; A130-L134 WeakPolarHBondContact O-CG 3.38Å; A130-L134 PolarHBondContact O-N 3.38Å
131	Y	87.5	Confident	84.4	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-48.4	176.5	-174.1	-94.1	0	0	0	111.9	I119 A123 N127 G128 V129 L134 L135 F178 A183 A184 E187	I119-Y131 HydrophobicContact CD1-CE2 4.04Å; I119-Y131 HydrophobicContact CG1-CD2 3.79Å; I119-Y131 HydrophobicContact CG1-CE2 3.55Å; A123-Y131 HydrophobicContact CB-CD2 4.14Å; A123-Y131 HydrophobicContact CB-CE2 4.15Å; N127-Y131 PolarHBondContact O-N 3.39Å; G128-Y131 WeakPolarHBondContact O-CB 3.22Å; G128-Y131 PolarHBondContact O-N 3.09Å; V129-Y131 VanDerWaalsContact C-N 3.29Å; V129-Y131 PolarHBondContact O-N 3.25Å; Y131-L134 PolarHBondContact O-N 3.43Å; Y131-L135 HydrophobicContact CD1-CD1 3.66Å; Y131-L135 HydrophobicContact CD1-CG 4.28Å; Y131-L135 HydrophobicContact CE1-CD1 3.27Å; Y131-L135 HydrophobicContact CE1-CG 4.04Å; Y131-L135 WeakPolarHBondContact O-CG 2.73Å; Y131-L135 PolarHBondContact O-N 2.8Å; Y131-F178 AromaticContact CE2-CE2 3.85Å; Y131-F178 HydrophobicContact CE2-CE2 3.85Å; Y131-F178 HydrophobicContact CE2-CZ 4.36Å; Y131-A183 HydrophobicContact CD1-CB 3.47Å; Y131-A183 VanDerWaalsContact CD1-CB 3.47Å; Y131-A183 HydrophobicContact CD2-CB 4.31Å; Y131-A183 HydrophobicContact CE1-CB 4.02Å; Y131-A183 HydrophobicContact CG-CB 3.63Å; Y131-A184 HydrophobicContact CE2-CB 4.47Å; Y131-E187 PolarHBondContact OH-OE2 3.44Å
132	E	85.3	Confident	83.1	Confident	76 Å²	76	44.2 Å²	44.2	36%	0.355	26%	0.259	S	S	.	.	H	α-helix	trans	-62.7	-42.8	176.8	-70.8	-176.1	160.4	0	0	111.6	G128 V129 L134 L135 D136 R701	G128-E132 PolarHBondContact O-N 2.92Å; V129-E132 PolarHBondContact O-N 3.29Å; E132-L134 VanDerWaalsContact C-N 3.31Å; E132-L134 PolarHBondContact O-N 3.43Å; E132-L135 PolarHBondContact O-N 2.72Å; E132-D136 WeakPolarHBondContact O-CB 3.04Å; E132-D136 PolarHBondContact O-N 2.86Å; E132-R701 IonicContact OE1-CZ 2.73Å; E132-R701 IonicContact OE1-NE 3.03Å; E132-R701 IonicContact OE1-NH1 2.65Å; E132-R701 PolarHBondContact OE1-NH1 2.9Å
133	E	85.2	Confident	81.5	Confident	22 Å²	22	53.1 Å²	53.1	10%	0.103	30%	0.3	C	S	.	.	H	α-helix	trans	-63.8	-34.9	176.7	-74.2	176.8	-174.9	0	0	113.3	Q89 K93 L96 V129 A130 A137	Q89-E133 VanDerWaalsContact CD-OE1 3.27Å; Q89-E133 WeakPolarHBondContact CG-OE1 3.42Å; Q89-E133 PolarHBondContact NE2-OE1 3.36Å; K93-E133 VanDerWaalsContact CE-CD 3.42Å; K93-E133 WeakPolarHBondContact CE-OE1 3.36Å; K93-E133 IonicContact NZ-OE1 3.06Å; K93-E133 PolarHBondContact NZ-OE1 3.07Å; L96-E133 HydrophobicContact CD1-CB 4.09Å; V129-E133 WeakPolarHBondContact O-CG 3.46Å; V129-E133 PolarHBondContact O-N 2.97Å; A130-E133 PolarHBondContact O-N 3.38Å; E133-A137 WeakPolarHBondContact O-CB 3.5Å; E133-A137 PolarHBondContact O-N 3.06Å; E133-A137 VanDerWaalsContact O-N 3.09Å
134	L	87.6	Confident	80.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-71.5	-39.3	175.6	-73	165.7	0	0	0	111.6	I80 V84 L96 P118 A122 A130 Y131 E132 A137 G138 H139	I80-L134 HydrophobicContact CG2-CD2 4.48Å; V84-L134 HydrophobicContact CG2-CD1 4Å; L96-L134 HydrophobicContact CD1-CD2 4.16Å; L96-L134 HydrophobicContact CD2-CD2 3.69Å; P118-L134 HydrophobicContact CB-CD1 4.14Å; P118-L134 HydrophobicContact CB-CD2 3.98Å; P118-L134 WeakPolarHBondContact O-CD1 3.31Å; A122-L134 HydrophobicContact CB-CD1 3.69Å; A130-L134 WeakPolarHBondContact O-CB 3.38Å; A130-L134 WeakPolarHBondContact O-CD1 3.42Å; A130-L134 WeakPolarHBondContact O-CG 3.38Å; A130-L134 PolarHBondContact O-N 3.38Å; Y131-L134 PolarHBondContact O-N 3.43Å; E132-L134 VanDerWaalsContact C-N 3.31Å; E132-L134 PolarHBondContact O-N 3.43Å; L134-A137 PolarHBondContact O-N 3.03Å; L134-G138 PolarHBondContact O-N 2.63Å; L134-H139 HydrophobicContact CB-CB 4.45Å; L134-H139 WeakPolarHBondContact O-CB 3.21Å; L134-H139 PolarHBondContact O-CD2 2.95Å; L134-H139 VanDerWaalsContact O-CD2 3.29Å; L134-H139 PolarHBondContact O-N 2.77Å; L134-H139 VanDerWaalsContact O-N 3.11Å
135	L	85.6	Confident	78.7	Confident	60 Å²	60	56.3 Å²	56.3	31%	0.314	32%	0.321	S	S	.	.	H	α-helix	trans	-62.8	-45.7	172.9	-77.7	176.7	0	0	0	111.5	I119 Y131 E132 A137 G138	I119-L135 HydrophobicContact CD1-CD2 3.53Å; I119-L135 HydrophobicContact CD1-CG 3.94Å; Y131-L135 HydrophobicContact CD1-CD1 3.66Å; Y131-L135 HydrophobicContact CD1-CG 4.28Å; Y131-L135 HydrophobicContact CE1-CD1 3.27Å; Y131-L135 HydrophobicContact CE1-CG 4.04Å; Y131-L135 WeakPolarHBondContact O-CG 2.73Å; Y131-L135 PolarHBondContact O-N 2.8Å; E132-L135 PolarHBondContact O-N 2.72Å; L135-A137 PolarHBondContact O-N 3.3Å; L135-G138 PolarHBondContact O-N 2.87Å
136	D	85.6	Confident	77.2	Confident	147 Å²	147	60.6 Å²	60.6	79%	0.786	35%	0.346	S	S	*	.	H	α-helix	trans	-61.7	-31.6	177.2	-75.4	-15.1	0	0	0	112.2	E132 G138	E132-D136 WeakPolarHBondContact O-CB 3.04Å; E132-D136 PolarHBondContact O-N 2.86Å; D136-G138 PolarHBondContact O-N 3.48Å
137	A	84.2	Confident	75.9	Confident	28 Å²	28	56.7 Å²	56.7	23%	0.231	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-1	174.9	0	0	0	0	0	114	L96 E133 L134 L135	L96-A137 HydrophobicContact CB-CB 4.41Å; L96-A137 HydrophobicContact CD1-CB 4.31Å; L96-A137 HydrophobicContact CD2-CB 4.19Å; E133-A137 WeakPolarHBondContact O-CB 3.5Å; E133-A137 PolarHBondContact O-N 3.06Å; E133-A137 VanDerWaalsContact O-N 3.09Å; L134-A137 PolarHBondContact O-N 3.03Å; L135-A137 PolarHBondContact O-N 3.3Å
138	G	80.8	Confident	74.6	Confident	49 Å²	49	62.5 Å²	62.5	51%	0.505	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	17.5	175.5	0	0	0	0	0	115.1	L134 L135 D136 V140	L134-G138 PolarHBondContact O-N 2.63Å; L135-G138 PolarHBondContact O-N 2.87Å; D136-G138 PolarHBondContact O-N 3.48Å; G138-V140 PolarHBondContact O-N 3.48Å
139	H	78.6	Confident	73.7	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.009	36%	0.355	C	S	.	.			trans	-70.3	122.2	174	-70	-81.3	0	0	0	110.2	L96 I102 D103 L134	L96-H139 WeakPolarHBondContact CD2-NE2 3.22Å; I102-H139 PolarHBondContact O-CE1 3.22Å; I102-H139 VanDerWaalsContact O-CE1 3.3Å; D103-H139 WeakPolarHBondContact OD1-CA 3.46Å; D103-H139 WeakPolarHBondContact OD1-CB 3.21Å; D103-H139 IonicContact OD1-CE1 2.72Å; D103-H139 IonicContact OD1-CG 3.78Å; D103-H139 IonicContact OD1-ND1 3.78Å; D103-H139 PolarHBondContact OD1-ND1 3.12Å; L134-H139 HydrophobicContact CB-CB 4.45Å; L134-H139 WeakPolarHBondContact O-CB 3.21Å; L134-H139 PolarHBondContact O-CD2 2.95Å; L134-H139 VanDerWaalsContact O-CD2 3.29Å; L134-H139 PolarHBondContact O-N 2.77Å; L134-H139 VanDerWaalsContact O-N 3.11Å
140	V	73	Confident	72.6	Confident	88 Å²	88	67.3 Å²	67.3	53%	0.533	38%	0.378	S	S	.	.			trans	-110.7	139.9	179.9	-176.6	0	0	0	0	110	G138 N142	G138-V140 PolarHBondContact O-N 3.48Å; V140-N142 PolarHBondContact O-N 2.9Å
141	V	71.8	Confident	71.8	Confident	44 Å²	44	69.1 Å²	69.1	27%	0.267	39%	0.39	S	S	.	.			trans	-75.2	95.6	175	-176	0	0	0	0	109	I119 V120 L144 F178	I119-V141 HydrophobicContact CD1-CG2 4.14Å; I119-V141 HydrophobicContact CG1-CG2 4.38Å; I119-V141 HydrophobicContact CG2-CG2 3.69Å; V120-V141 HydrophobicContact CG2-CG1 4.45Å; V141-L144 HydrophobicContact CG1-CD1 3.6Å; V141-L144 HydrophobicContact CG1-CG 3.95Å; V141-F178 HydrophobicContact CB-CZ 4.39Å; V141-F178 HydrophobicContact CG1-CE1 4.25Å; V141-F178 HydrophobicContact CG1-CZ 4.33Å; V141-F178 HydrophobicContact CG2-CE1 4.1Å; V141-F178 HydrophobicContact CG2-CE2 3.77Å; V141-F178 HydrophobicContact CG2-CZ 3.41Å; V141-F178 VanDerWaalsContact CG2-CZ 3.41Å
142	N	60.8	Low	70.8	Confident	110 Å²	110	75.6 Å²	75.6	59%	0.588	43%	0.425	S	S	*	.			trans	-89.1	112.9	173.4	-71.3	-35	0	0	0	110.2	V140	V140-N142 PolarHBondContact O-N 2.9Å
143	H	55.3	Low	69.8	Low	186 Å²	186	79.3 Å²	79.3	86%	0.861	44%	0.442	S	S	*	.			trans	51	73.7	169.1	-62.7	-63.6	0	0	0	116.5
144	L	60.5	Low	68.9	Low	29 Å²	29	80.3 Å²	80.3	15%	0.152	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-73.5	127	149.4	-71.9	162.3	0	0	0	107.7	V120 V141 V146 F178	V120-L144 HydrophobicContact CG1-CD2 4.41Å; V120-L144 HydrophobicContact CG2-CD1 3.94Å; V120-L144 HydrophobicContact CG2-CD2 4.1Å; V120-L144 HydrophobicContact CG2-CG 4.3Å; V141-L144 HydrophobicContact CG1-CD1 3.6Å; V141-L144 HydrophobicContact CG1-CG 3.95Å; L144-V146 PolarHBondContact O-N 3.36Å; L144-F178 HydrophobicContact CD1-CB 3.88Å; L144-F178 HydrophobicContact CD1-CD1 3.35Å; L144-F178 HydrophobicContact CD1-CD2 4.39Å; L144-F178 HydrophobicContact CD1-CE1 4.06Å; L144-F178 HydrophobicContact CD1-CG 3.59Å
145	T	59.3	Low	67.9	Low	85 Å²	85	84 Å²	84	52%	0.521	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-60.7	124.2	-178	30.1	0	0	0	0	110.2
146	V	56.3	Low	66.8	Low	119 Å²	119	83.6 Å²	83.6	72%	0.721	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-72.2	140.4	171.2	-178.6	0	0	0	0	107.3	L144 R148	L144-V146 PolarHBondContact O-N 3.36Å; V146-R148 PolarHBondContact O-N 3.41Å
147	P	56.6	Low	65.6	Low	31 Å²	31	83.3 Å²	83.3	20%	0.201	46%	0.464	C	S	.	.	S	Bend	trans	-45	133.7	177	15.1	-31.7	0	0	0	111.9	C149 F176	P147-C149 PolarHBondContact O-N 2.68Å; P147-F176 HydrophobicContact CG-CZ 4.13Å
148	R	58.2	Low	64.4	Low	151 Å²	151	83.9 Å²	83.9	57%	0.57	47%	0.473	S	S	*	.			trans	-34.4	109.4	-172.9	-68.5	-176.6	178.5	-175.3	-2.9	111.7	V146 D168	V146-R148 PolarHBondContact O-N 3.41Å; R148-D168 IonicContact CZ-OD2 2.78Å; R148-D168 IonicContact NH2-OD2 3.41Å; R148-D168 PolarHBondContact NH2-OD2 3.46Å
149	C	64.8	Low	63.3	Low	58 Å²	58	88.9 Å²	88.9	39%	0.392	48%	0.483	S	S	.	.			trans	-70	148	168.1	52.1	0	0	0	0	109.4	P147 C151 C154	P147-C149 PolarHBondContact O-N 2.68Å; C149-C151 HydrophobicContact CB-CB 4Å; C149-C151 WeakPolarHBondContact CB-SG 3.28Å; C149-C151 PolarHBondContact O-N 3.39Å; C149-C151 WeakPolarHBondContact SG-CB 3.44Å; C149-C151 CovalentContact SG-SG 2.06Å; C149-C151 PolarHBondContact SG-SG 3.14Å; C149-C154 WeakPolarHBondContact O-CB 3.49Å; C149-C154 PolarHBondContact SG-SG 3.34Å
150	P	62	Low	62.2	Low	121 Å²	121	95.1 Å²	95.1	79%	0.786	52%	0.517	S	S	*	.	S	Bend	trans	-71.1	21.2	170.5	33	-37.1	0	0	0	112.4
151	C	69.6	Low	61.4	Low	42 Å²	42	94.5 Å²	94.5	28%	0.284	51%	0.51	S	S	.	.	S	Bend	trans	-78.7	140.4	178.4	58	0	0	0	0	108.8	C149 Q153 C154 I155	C149-C151 HydrophobicContact CB-CB 4Å; C149-C151 WeakPolarHBondContact CB-SG 3.28Å; C149-C151 PolarHBondContact O-N 3.39Å; C149-C151 WeakPolarHBondContact SG-CB 3.44Å; C149-C151 CovalentContact SG-SG 2.06Å; C149-C151 PolarHBondContact SG-SG 3.14Å; C151-Q153 PolarHBondContact O-N 3.35Å; C151-C154 PolarHBondContact O-N 3.4Å; C151-C154 WeakPolarHBondContact SG-CB 3.48Å; C151-C154 PolarHBondContact SG-SG 3.44Å; C151-I155 PolarHBondContact O-N 2.9Å
152	D	65.2	Low	60.5	Low	139 Å²	139	101.1 Å²	101.1	74%	0.743	54%	0.544	S	S	*	.	H	α-helix	trans	-55.4	-30.4	-177.8	-66.1	-22.6	0	0	0	112.8	I155 S156	D152-I155 PolarHBondContact O-N 3.4Å; D152-S156 WeakPolarHBondContact O-CB 3.46Å; D152-S156 PolarHBondContact O-N 3.49Å; D152-S156 PolarHBondContact O-OG 3.27Å
153	Q	65.6	Low	60.4	Low	154 Å²	154	101.3 Å²	101.3	72%	0.72	54%	0.541	S	S	*	.	H	α-helix	trans	-67	-33.3	177.8	-65.5	-179.2	-0.5	0	0	114.3	C151 S156 K157	C151-Q153 PolarHBondContact O-N 3.35Å; Q153-S156 PolarHBondContact O-OG 2.86Å; Q153-K157 VanDerWaalsContact O-CG 3.28Å; Q153-K157 WeakPolarHBondContact O-CG 3.38Å; Q153-K157 PolarHBondContact O-N 2.97Å
154	C	66.1	Low	61	Low	44 Å²	44	97.9 Å²	97.9	30%	0.297	53%	0.529	S	S	.	.	H	α-helix	trans	-83.5	-29.5	176.1	-76.9	0	0	0	0	111.7	C149 C151 G158	C149-C154 WeakPolarHBondContact O-CB 3.49Å; C149-C154 PolarHBondContact SG-SG 3.34Å; C151-C154 PolarHBondContact O-N 3.4Å; C151-C154 WeakPolarHBondContact SG-CB 3.48Å; C151-C154 PolarHBondContact SG-SG 3.44Å; C154-G158 PolarHBondContact O-N 3.5Å
155	I	65.9	Low	61.7	Low	78 Å²	78	102.3 Å²	102.3	40%	0.4	55%	0.552	S	S	.	*	H	α-helix	trans	-69.4	-46.7	174.8	-61.7	170.6	0	0	0	109.3	C151 D152 K157 G158 E159	C151-I155 PolarHBondContact O-N 2.9Å; D152-I155 PolarHBondContact O-N 3.4Å; I155-K157 PolarHBondContact O-N 3.07Å; I155-G158 PolarHBondContact O-N 3.42Å; I155-E159 PolarHBondContact O-N 2.88Å; I155-E159 VanDerWaalsContact O-N 3.16Å
156	S	62.2	Low	62.7	Low	50 Å²	50	104 Å²	104	35%	0.35	56%	0.557	S	S	.	*	H	α-helix	trans	-62.2	-41.6	178.4	69.1	0	0	0	0	112.3	D152 Q153 G158 E159 D160	D152-S156 WeakPolarHBondContact O-CB 3.46Å; D152-S156 PolarHBondContact O-N 3.49Å; D152-S156 PolarHBondContact O-OG 3.27Å; Q153-S156 PolarHBondContact O-OG 2.86Å; S156-G158 PolarHBondContact O-N 2.06Å; S156-E159 PolarHBondContact O-N 3.02Å; S156-E159 VanDerWaalsContact O-N 3.14Å; S156-D160 WeakPolarHBondContact O-CB 3.28Å; S156-D160 PolarHBondContact O-N 3.35Å
157	K	61.1	Low	63.6	Low	141 Å²	141	102 Å²	102	61%	0.613	54%	0.539	S	S	*	.	H	α-helix	trans	-60.3	-33.7	173.1	-78.5	-178.6	176.4	-169.5	0	113	Q153 I155 E159	Q153-K157 VanDerWaalsContact O-CG 3.28Å; Q153-K157 WeakPolarHBondContact O-CG 3.38Å; Q153-K157 PolarHBondContact O-N 2.97Å; I155-K157 PolarHBondContact O-N 3.07Å; K157-E159 VanDerWaalsContact C-N 3.34Å
158	G	59	Low	64.6	Low	40 Å²	40	103 Å²	103	41%	0.412	54%	0.543	S	S	.	.	H	α-helix	trans	-79.5	-12.8	177.7	0	0	0	0	0	114.8	C154 I155 S156	C154-G158 PolarHBondContact O-N 3.5Å; I155-G158 PolarHBondContact O-N 3.42Å; S156-G158 PolarHBondContact O-N 2.06Å
159	E	57.9	Low	65.6	Low	155 Å²	155	97.7 Å²	97.7	72%	0.724	53%	0.526	S	S	*	.	H	α-helix	trans	-103.8	-32.1	179.8	-72.6	-176.6	167.2	0	0	112.8	I155 S156 K157	I155-E159 PolarHBondContact O-N 2.88Å; I155-E159 VanDerWaalsContact O-N 3.16Å; S156-E159 PolarHBondContact O-N 3.02Å; S156-E159 VanDerWaalsContact O-N 3.14Å; K157-E159 VanDerWaalsContact C-N 3.34Å
160	D	56	Low	66.5	Low	133 Å²	133	96.8 Å²	96.8	71%	0.711	52%	0.519	S	S	*	.	H	α-helix	trans	-88.3	-19.9	-174.7	-71.6	-36.6	0	0	0	113.9	S156	S156-D160 WeakPolarHBondContact O-CB 3.28Å; S156-D160 PolarHBondContact O-N 3.35Å
161	D	55.3	Low	67.5	Low	75 Å²	75	91.9 Å²	91.9	40%	0.401	49%	0.486	S	S	.	.			trans	-102.9	118.3	-179.4	-66.6	-44.5	0	0	0	109.8	E163	D161-E163 HydrophobicContact CB-CB 3.86Å; D161-E163 HydrophobicContact CB-CG 3.66Å; D161-E163 PolarHBondContact O-N 3.26Å
162	D	52.3	Low	68.2	Low	182 Å²	182	90.9 Å²	90.9	97%	0.973	48%	0.478	S	S	*	.			trans	-63	37.1	159.1	-78.2	-42.3	0	0	0	110.4
163	E	58.4	Low	69.2	Low	115 Å²	115	84.8 Å²	84.8	54%	0.537	45%	0.445	S	S	.	.			trans	-72.7	135.2	-179.4	-92.2	175.1	-172.3	0	0	109.6	D161 I165	D161-E163 HydrophobicContact CB-CB 3.86Å; D161-E163 HydrophobicContact CB-CG 3.66Å; D161-E163 PolarHBondContact O-N 3.26Å; E163-I165 PolarHBondContact O-N 3.09Å
164	D	68.8	Low	70.3	Confident	114 Å²	114	78.3 Å²	78.3	61%	0.61	42%	0.415	S	S	*	.			trans	-59.7	110.1	-176.5	-83	-42	0	0	0	110	I166 E167 D168	D164-I166 PolarHBondContact O-N 3.44Å; D164-E167 HydrophobicContact CB-CB 4.18Å; D164-E167 WeakPolarHBondContact O-CB 3.39Å; D164-E167 PolarHBondContact O-N 3.39Å; D164-D168 PolarHBondContact O-N 3.13Å
165	I	75	Confident	71.3	Confident	121 Å²	121	76.5 Å²	76.5	62%	0.621	40%	0.403	S	S	*	.	H	α-helix	trans	-48.2	-31.8	176.1	-60.8	170	0	0	0	111.5	E163 L169	E163-I165 PolarHBondContact O-N 3.09Å; I165-L169 HydrophobicContact CG2-CD1 3.91Å; I165-L169 HydrophobicContact CG2-CG 4.39Å; I165-L169 WeakPolarHBondContact O-CB 3.47Å; I165-L169 VanDerWaalsContact O-CG 3.22Å; I165-L169 WeakPolarHBondContact O-CG 3.47Å; I165-L169 PolarHBondContact O-N 2.95Å
166	I	79.5	Confident	72.5	Confident	121 Å²	121	73 Å²	73	62%	0.621	39%	0.385	S	S	*	.	H	α-helix	trans	-67	-44.9	178.6	-60.2	177	0	0	0	111.2	D164 L169 T170	D164-I166 PolarHBondContact O-N 3.44Å; I166-L169 PolarHBondContact O-N 3.24Å; I166-T170 WeakPolarHBondContact O-CG2 3.44Å; I166-T170 PolarHBondContact O-N 3.08Å; I166-T170 PolarHBondContact O-OG1 3.27Å
167	E	76.9	Confident	73.8	Confident	77 Å²	77	75.2 Å²	75.2	36%	0.36	39%	0.386	S	S	.	.	H	α-helix	trans	-63	-47.7	179.8	-174.4	166.8	-172	0	0	110	P114 Y115 D164 L169 T170 T171	P114-E167 VanDerWaalsContact CG-OE1 3.3Å; P114-E167 WeakPolarHBondContact CG-OE1 3.44Å; Y115-E167 HydrophobicContact CD1-CG 4.5Å; Y115-E167 HydrophobicContact CE1-CG 4.37Å; D164-E167 HydrophobicContact CB-CB 4.18Å; D164-E167 WeakPolarHBondContact O-CB 3.39Å; D164-E167 PolarHBondContact O-N 3.39Å; E167-L169 PolarHBondContact O-N 2.96Å; E167-T170 VanDerWaalsContact CA-OG1 3.25Å; E167-T170 WeakPolarHBondContact CA-OG1 3.45Å; E167-T170 CarbonylContact O-C 3.6Å; E167-T170 PolarHBondContact O-N 3.06Å; E167-T170 PolarHBondContact O-OG1 3.13Å; E167-T171 HydrophobicContact CG-CG2 4.18Å; E167-T171 WeakPolarHBondContact O-CG2 3.22Å; E167-T171 PolarHBondContact O-N 2.83Å
168	D	75.9	Confident	75.2	Confident	52 Å²	52	68.9 Å²	68.9	28%	0.278	36%	0.358	S	S	.	.	H	α-helix	trans	-51.8	-50.1	172.9	-106.3	14.1	0	0	0	112.9	R148 D164 T170 T171 E172	R148-D168 IonicContact CZ-OD2 2.78Å; R148-D168 IonicContact NH2-OD2 3.41Å; R148-D168 PolarHBondContact NH2-OD2 3.46Å; D164-D168 PolarHBondContact O-N 3.13Å; D168-T170 VanDerWaalsContact C-N 3.3Å; D168-T170 PolarHBondContact O-N 3Å; D168-T171 PolarHBondContact O-N 3.34Å; D168-T171 PolarHBondContact O-OG1 2.91Å; D168-E172 PolarHBondContact O-N 2.91Å; D168-E172 VanDerWaalsContact O-N 3.07Å
169	L	79.9	Confident	76.6	Confident	39 Å²	39	70 Å²	70	20%	0.204	35%	0.352	C	S	.	.	H	α-helix	trans	-68.3	-33.3	179.6	-71.1	170.1	0	0	0	111.5	I165 I166 E167 L173 N210 R213	I165-L169 HydrophobicContact CG2-CD1 3.91Å; I165-L169 HydrophobicContact CG2-CG 4.39Å; I165-L169 WeakPolarHBondContact O-CB 3.47Å; I165-L169 VanDerWaalsContact O-CG 3.22Å; I165-L169 WeakPolarHBondContact O-CG 3.47Å; I165-L169 PolarHBondContact O-N 2.95Å; I166-L169 PolarHBondContact O-N 3.24Å; E167-L169 PolarHBondContact O-N 2.96Å; L169-L173 WeakPolarHBondContact O-CB 3.48Å; L169-L173 PolarHBondContact O-N 3.11Å; L169-L173 VanDerWaalsContact O-N 3.13Å; L169-N210 WeakPolarHBondContact CD2-ND2 3.45Å; L169-R213 PolarHBondContact O-NH1 3.47Å
170	T	83.8	Confident	78.1	Confident	40 Å²	40	62.6 Å²	62.6	25%	0.245	32%	0.318	C	S	.	.	H	α-helix	trans	-72.5	-38.2	177	45.9	0	0	0	0	112.2	I166 E167 D168 L173 D174	I166-T170 WeakPolarHBondContact O-CG2 3.44Å; I166-T170 PolarHBondContact O-N 3.08Å; I166-T170 PolarHBondContact O-OG1 3.27Å; E167-T170 VanDerWaalsContact CA-OG1 3.25Å; E167-T170 WeakPolarHBondContact CA-OG1 3.45Å; E167-T170 CarbonylContact O-C 3.6Å; E167-T170 PolarHBondContact O-N 3.06Å; E167-T170 PolarHBondContact O-OG1 3.13Å; D168-T170 VanDerWaalsContact C-N 3.3Å; D168-T170 PolarHBondContact O-N 3Å; T170-L173 PolarHBondContact O-N 3.48Å; T170-D174 WeakPolarHBondContact O-CB 3.38Å; T170-D174 PolarHBondContact O-N 3.27Å
171	T	82.4	Confident	79.7	Confident	18 Å²	18	56.3 Å²	56.3	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-44.4	175.5	65.6	0	0	0	0	110.1	Y115 E167 D168 L173 D174 S175	Y115-T171 HydrophobicContact CD1-CG2 3.29Å; Y115-T171 HydrophobicContact CD2-CG2 4.09Å; Y115-T171 HydrophobicContact CE1-CG2 3.36Å; Y115-T171 HydrophobicContact CE2-CG2 4.19Å; Y115-T171 HydrophobicContact CG-CG2 3.67Å; E167-T171 HydrophobicContact CG-CG2 4.18Å; E167-T171 WeakPolarHBondContact O-CG2 3.22Å; E167-T171 PolarHBondContact O-N 2.83Å; D168-T171 PolarHBondContact O-N 3.34Å; D168-T171 PolarHBondContact O-OG1 2.91Å; T171-L173 PolarHBondContact O-N 2.86Å; T171-D174 PolarHBondContact O-N 3.27Å; T171-S175 VanDerWaalsContact O-CB 3.28Å; T171-S175 WeakPolarHBondContact O-CB 3.39Å; T171-S175 PolarHBondContact O-N 2.86Å
172	E	84.5	Confident	81.4	Confident	21 Å²	21	55.3 Å²	55.3	10%	0.098	28%	0.277	C	S	.	.	H	α-helix	trans	-59.4	-48.6	174.8	-178	179.4	-166.1	0	0	111.1	D168 S175 F176 R209 N210	D168-E172 PolarHBondContact O-N 2.91Å; D168-E172 VanDerWaalsContact O-N 3.07Å; E172-S175 WeakPolarHBondContact O-CB 3.21Å; E172-S175 PolarHBondContact O-N 3Å; E172-F176 HydrophobicContact CG-CD2 4Å; E172-F176 HydrophobicContact CG-CE2 3.69Å; E172-F176 WeakPolarHBondContact O-CD2 3.44Å; E172-F176 PolarHBondContact O-N 3.37Å; E172-F176 VanDerWaalsContact O-N 3.09Å; E172-R209 IonicContact OE1-NH1 3.72Å; E172-R209 PolarHBondContact OE1-NH1 2.84Å; E172-N210 PolarHBondContact OE2-ND2 3.35Å
173	L	87.7	Confident	82.9	Confident	11 Å²	11	47.6 Å²	47.6	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-41.6	-179.5	-178.5	63.1	0	0	0	112.5	L169 T170 T171 S175 F176 R177 A216 Y217 L220	L169-L173 WeakPolarHBondContact O-CB 3.48Å; L169-L173 PolarHBondContact O-N 3.11Å; L169-L173 VanDerWaalsContact O-N 3.13Å; T170-L173 PolarHBondContact O-N 3.48Å; T171-L173 PolarHBondContact O-N 2.86Å; L173-S175 VanDerWaalsContact C-N 3.34Å; L173-F176 PolarHBondContact O-N 2.88Å; L173-R177 WeakPolarHBondContact O-CG 3.49Å; L173-R177 PolarHBondContact O-N 3.4Å; L173-A216 HydrophobicContact CD1-CB 4.07Å; L173-A216 HydrophobicContact CD2-CB 4.13Å; L173-Y217 HydrophobicContact CD1-CD1 3.95Å; L173-Y217 HydrophobicContact CD1-CE1 3.66Å; L173-L220 HydrophobicContact CD1-CD1 3.92Å
174	D	88.1	Confident	84.2	Confident	18 Å²	18	42.1 Å²	42.1	10%	0.096	21%	0.213	C	C	.	.	H	α-helix	trans	-70.8	-31.6	179.1	-73.8	-20.6	0	0	0	112	Y115 I124 T170 T171 R177 F178	Y115-D174 HydrophobicContact CE2-CB 4.03Å; Y115-D174 PolarHBondContact OH-OD2 3.27Å; I124-D174 HydrophobicContact CD1-CB 3.88Å; T170-D174 WeakPolarHBondContact O-CB 3.38Å; T170-D174 PolarHBondContact O-N 3.27Å; T171-D174 PolarHBondContact O-N 3.27Å; D174-R177 PolarHBondContact O-N 3.3Å; D174-R177 WeakPolarHBondContact OD1-CD 3.49Å; D174-R177 IonicContact OD1-CZ 2.69Å; D174-R177 IonicContact OD1-NH1 3.59Å; D174-R177 PolarHBondContact OD1-NH1 3.02Å; D174-F178 WeakPolarHBondContact O-CB 3.14Å; D174-F178 PolarHBondContact O-N 3.22Å
175	S	87.4	Confident	85.1	Confident	6 Å²	6	36.8 Å²	36.8	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-47.9	167.3	175.3	0	0	0	0	111.3	T171 E172 L173 R177 F178 H179	T171-S175 VanDerWaalsContact O-CB 3.28Å; T171-S175 WeakPolarHBondContact O-CB 3.39Å; T171-S175 PolarHBondContact O-N 2.86Å; E172-S175 WeakPolarHBondContact O-CB 3.21Å; E172-S175 PolarHBondContact O-N 3Å; L173-S175 VanDerWaalsContact C-N 3.34Å; S175-R177 PolarHBondContact O-N 3.47Å; S175-F178 WeakPolarHBondContact O-CB 3.35Å; S175-F178 PolarHBondContact O-N 3.28Å; S175-H179 PolarHBondContact O-CD2 3.31Å; S175-H179 PolarHBondContact O-N 3.31Å; S175-H179 VanDerWaalsContact O-N 3.08Å
176	F	89.5	Confident	85.7	Confident	5 Å²	5	31.1 Å²	31.1	2%	0.022	16%	0.156	C	C	.	.	H	α-helix	trans	-64.6	-37.3	174.9	-78.7	-62.6	0	0	0	113.1	P147 E172 L173 F178 H179 A180 L199 E202 L203 A206 Y217 L220	P147-F176 HydrophobicContact CG-CZ 4.13Å; E172-F176 HydrophobicContact CG-CD2 4Å; E172-F176 HydrophobicContact CG-CE2 3.69Å; E172-F176 WeakPolarHBondContact O-CD2 3.44Å; E172-F176 PolarHBondContact O-N 3.37Å; E172-F176 VanDerWaalsContact O-N 3.09Å; L173-F176 PolarHBondContact O-N 2.88Å; F176-F178 VanDerWaalsContact C-N 3.34Å; F176-H179 PolarHBondContact O-N 3.44Å; F176-A180 WeakPolarHBondContact O-CB 3.41Å; F176-A180 PolarHBondContact O-N 3.3Å; F176-L199 HydrophobicContact CD1-CD1 4.19Å; F176-E202 HydrophobicContact CE1-CB 4.18Å; F176-L203 HydrophobicContact CB-CD2 3.79Å; F176-L203 HydrophobicContact CD1-CD2 3.49Å; F176-L203 VanDerWaalsContact CD1-CD2 3.49Å; F176-L203 HydrophobicContact CD1-CG 4.05Å; F176-L203 HydrophobicContact CD2-CD2 4.44Å; F176-L203 HydrophobicContact CE1-CD2 4.17Å; F176-L203 HydrophobicContact CE1-CG 4.43Å; F176-L203 HydrophobicContact CG-CD2 3.66Å; F176-A206 HydrophobicContact CE2-CB 3.68Å; F176-A206 HydrophobicContact CZ-CB 3.86Å; F176-Y217 HydrophobicContact CD2-CD1 4.32Å; F176-Y217 AromaticContact CD2-CE1 3.65Å; F176-Y217 HydrophobicContact CD2-CE1 3.65Å; F176-Y217 HydrophobicContact CE2-CE1 4.12Å; F176-Y217 HydrophobicContact CG-CE1 4.39Å; F176-L220 HydrophobicContact CB-CD1 4.39Å
177	R	90.9	Very high	85.9	Confident	96 Å²	96	29.1 Å²	29.1	36%	0.362	14%	0.144	S	C	.	.	H	α-helix	trans	-63.8	-39.8	174.6	-73.8	171.2	167.5	167.6	-5.8	112.4	I124 L173 D174 S175 A180 S181 L220	I124-R177 HydrophobicContact CG1-CB 3.93Å; L173-R177 WeakPolarHBondContact O-CG 3.49Å; L173-R177 PolarHBondContact O-N 3.4Å; D174-R177 PolarHBondContact O-N 3.3Å; D174-R177 WeakPolarHBondContact OD1-CD 3.49Å; D174-R177 IonicContact OD1-CZ 2.69Å; D174-R177 IonicContact OD1-NH1 3.59Å; D174-R177 PolarHBondContact OD1-NH1 3.02Å; S175-R177 PolarHBondContact O-N 3.47Å; R177-A180 CarbonylContact O-C 3.46Å; R177-A180 PolarHBondContact O-N 3.09Å; R177-S181 PolarHBondContact O-N 2.75Å; R177-L220 HydrophobicContact CG-CD1 3.71Å; R177-L220 HydrophobicContact CG-CD2 3.88Å; R177-L220 HydrophobicContact CG-CG 4.4Å
178	F	90	Very high	85.8	Confident	8 Å²	8	32.3 Å²	32.3	4%	0.035	16%	0.163	C	C	.	.	H	α-helix	trans	-58.2	-54.7	174.4	169.8	-97.5	0	0	0	110.7	I119 V120 A123 Y131 V141 L144 D174 S175 F176 A180 S181 A184	I119-F178 HydrophobicContact CG1-CE2 4.49Å; V120-F178 HydrophobicContact CB-CD2 4.29Å; V120-F178 HydrophobicContact CG1-CB 4.34Å; V120-F178 HydrophobicContact CG2-CD2 3.84Å; V120-F178 HydrophobicContact CG2-CE2 4.29Å; V120-F178 HydrophobicContact CG2-CG 4.29Å; A123-F178 HydrophobicContact CB-CD2 3.44Å; A123-F178 VanDerWaalsContact CB-CD2 3.44Å; A123-F178 HydrophobicContact CB-CE2 3.93Å; A123-F178 HydrophobicContact CB-CG 4.38Å; Y131-F178 AromaticContact CE2-CE2 3.85Å; Y131-F178 HydrophobicContact CE2-CE2 3.85Å; Y131-F178 HydrophobicContact CE2-CZ 4.36Å; V141-F178 HydrophobicContact CB-CZ 4.39Å; V141-F178 HydrophobicContact CG1-CE1 4.25Å; V141-F178 HydrophobicContact CG1-CZ 4.33Å; V141-F178 HydrophobicContact CG2-CE1 4.1Å; V141-F178 HydrophobicContact CG2-CE2 3.77Å; V141-F178 HydrophobicContact CG2-CZ 3.41Å; V141-F178 VanDerWaalsContact CG2-CZ 3.41Å; L144-F178 HydrophobicContact CD1-CB 3.88Å; L144-F178 HydrophobicContact CD1-CD1 3.35Å; L144-F178 HydrophobicContact CD1-CD2 4.39Å; L144-F178 HydrophobicContact CD1-CE1 4.06Å; L144-F178 HydrophobicContact CD1-CG 3.59Å; D174-F178 WeakPolarHBondContact O-CB 3.14Å; D174-F178 PolarHBondContact O-N 3.22Å; S175-F178 WeakPolarHBondContact O-CB 3.35Å; S175-F178 PolarHBondContact O-N 3.28Å; F176-F178 VanDerWaalsContact C-N 3.34Å; F178-A180 VanDerWaalsContact C-N 3.28Å; F178-A180 PolarHBondContact O-N 3.06Å; F178-S181 VanDerWaalsContact O-CB 3.26Å; F178-S181 WeakPolarHBondContact O-CB 3.22Å; F178-S181 PolarHBondContact O-N 2.87Å; F178-S181 VanDerWaalsContact O-N 3.09Å; F178-S181 PolarHBondContact O-OG 2.9Å; F178-A184 HydrophobicContact CZ-CB 4.32Å; F178-A184 WeakPolarHBondContact O-CB 3.26Å
179	H	88	Confident	85.9	Confident	62 Å²	62	33.6 Å²	33.6	29%	0.287	16%	0.164	S	C	.	.	H	α-helix	trans	-66.8	-27.6	-179.4	-69	-59.8	0	0	0	113.5	S175 F176 S181 L185 L199	S175-H179 PolarHBondContact O-CD2 3.31Å; S175-H179 PolarHBondContact O-N 3.31Å; S175-H179 VanDerWaalsContact O-N 3.08Å; F176-H179 PolarHBondContact O-N 3.44Å; H179-S181 VanDerWaalsContact C-N 3.34Å; H179-L185 WeakPolarHBondContact O-CD2 3.38Å; H179-L199 HydrophobicContact CB-CD1 4.05Å; H179-L199 HydrophobicContact CB-CD2 4.22Å
180	A	90.7	Very high	85.5	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.008	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	4.2	175	0	0	0	0	0	113.9	F176 R177 F178 L220 K223 V224	F176-A180 WeakPolarHBondContact O-CB 3.41Å; F176-A180 PolarHBondContact O-N 3.3Å; R177-A180 CarbonylContact O-C 3.46Å; R177-A180 PolarHBondContact O-N 3.09Å; F178-A180 VanDerWaalsContact C-N 3.28Å; F178-A180 PolarHBondContact O-N 3.06Å; A180-L220 HydrophobicContact CB-CD2 4.22Å; A180-K223 PolarHBondContact O-NZ 3.34Å; A180-V224 HydrophobicContact CB-CG2 3.57Å
181	S	89.8	Confident	85.2	Confident	1 Å²	1	34 Å²	34	1%	0.007	17%	0.173	C	C	.	.	S	Bend	trans	-73.6	142.4	176.5	73.7	0	0	0	0	111	A123 R177 F178 H179 A183 A184 L185	A123-S181 WeakPolarHBondContact CB-OG 3.44Å; A123-S181 WeakPolarHBondContact O-CB 3.35Å; R177-S181 PolarHBondContact O-N 2.75Å; F178-S181 VanDerWaalsContact O-CB 3.26Å; F178-S181 WeakPolarHBondContact O-CB 3.22Å; F178-S181 PolarHBondContact O-N 2.87Å; F178-S181 VanDerWaalsContact O-N 3.09Å; F178-S181 PolarHBondContact O-OG 2.9Å; H179-S181 VanDerWaalsContact C-N 3.34Å; S181-A183 PolarHBondContact O-N 3.29Å; S181-A184 PolarHBondContact O-N 3.25Å; S181-A184 WeakPolarHBondContact OG-CB 3.32Å; S181-A184 PolarHBondContact OG-N 2.77Å; S181-L185 WeakPolarHBondContact O-CB 3.15Å; S181-L185 VanDerWaalsContact O-CG 3.23Å; S181-L185 WeakPolarHBondContact O-CG 3.34Å; S181-L185 PolarHBondContact O-N 2.89Å
182	E	89	Confident	85.4	Confident	53 Å²	53	33.3 Å²	33.3	25%	0.248	17%	0.169	C	C	.	.	H	α-helix	trans	-63.1	-31.6	-175.2	-56.3	-166.6	163.8	0	0	112.3	L186 F227 Q704	E182-L186 WeakPolarHBondContact O-CD1 3.14Å; E182-L186 VanDerWaalsContact O-CG 3.25Å; E182-L186 WeakPolarHBondContact O-CG 3.18Å; E182-L186 PolarHBondContact O-N 3.25Å; E182-F227 HydrophobicContact CB-CD2 4.33Å; E182-F227 HydrophobicContact CB-CE2 3.84Å; E182-F227 HydrophobicContact CB-CZ 4.36Å; E182-F227 HydrophobicContact CG-CD2 3.92Å; E182-F227 HydrophobicContact CG-CE2 3.92Å; E182-Q704 PolarHBondContact OE2-NE2 3.31Å
183	A	85.2	Confident	85.7	Confident	20 Å²	20	32.6 Å²	32.6	17%	0.165	17%	0.166	C	C	.	.	H	α-helix	trans	-70.8	-45.6	177.7	0	0	0	0	0	112.1	Y131 S181 L185 L186 E187	Y131-A183 HydrophobicContact CD1-CB 3.47Å; Y131-A183 VanDerWaalsContact CD1-CB 3.47Å; Y131-A183 HydrophobicContact CD2-CB 4.31Å; Y131-A183 HydrophobicContact CE1-CB 4.02Å; Y131-A183 HydrophobicContact CG-CB 3.63Å; S181-A183 PolarHBondContact O-N 3.29Å; A183-L185 VanDerWaalsContact C-N 3.26Å; A183-L185 PolarHBondContact O-N 3.26Å; A183-L186 PolarHBondContact O-N 3.16Å; A183-L186 VanDerWaalsContact O-N 3.16Å; A183-E187 PolarHBondContact O-N 3.38Å
184	A	85.7	Confident	85.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69	-25.4	177.6	0	0	0	0	0	113	Y131 F178 S181 E187 R189	Y131-A184 HydrophobicContact CE2-CB 4.47Å; F178-A184 HydrophobicContact CZ-CB 4.32Å; F178-A184 WeakPolarHBondContact O-CB 3.26Å; S181-A184 PolarHBondContact O-N 3.25Å; S181-A184 WeakPolarHBondContact OG-CB 3.32Å; S181-A184 PolarHBondContact OG-N 2.77Å; A184-E187 WeakPolarHBondContact O-CB 3.36Å; A184-R189 PolarHBondContact O-NH2 3.06Å
185	L	87.6	Confident	85.5	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-74.1	-26.3	173.5	-74	-176.2	0	0	0	113	H179 S181 A183 M196 L199 V224 F227	H179-L185 WeakPolarHBondContact O-CD2 3.38Å; S181-L185 WeakPolarHBondContact O-CB 3.15Å; S181-L185 VanDerWaalsContact O-CG 3.23Å; S181-L185 WeakPolarHBondContact O-CG 3.34Å; S181-L185 PolarHBondContact O-N 2.89Å; A183-L185 VanDerWaalsContact C-N 3.26Å; A183-L185 PolarHBondContact O-N 3.26Å; L185-M196 HydrophobicContact CB-CE 3.74Å; L185-M196 HydrophobicContact CD1-SD 4.33Å; L185-M196 HydrophobicContact CD2-CE 4.06Å; L185-M196 HydrophobicContact CD2-CG 3.63Å; L185-M196 HydrophobicContact CD2-SD 4.27Å; L185-M196 HydrophobicContact CG-CE 4.31Å; L185-M196 VanDerWaalsContact O-CE 3.24Å; L185-M196 WeakPolarHBondContact O-CE 3.33Å; L185-L199 HydrophobicContact CD2-CD2 4.23Å; L185-V224 HydrophobicContact CD1-CG2 4.41Å; L185-F227 HydrophobicContact CB-CD1 4.26Å; L185-F227 HydrophobicContact CB-CE1 3.82Å; L185-F227 HydrophobicContact CB-CZ 4.48Å; L185-F227 HydrophobicContact CD1-CD1 3.63Å; L185-F227 HydrophobicContact CD1-CE1 4.05Å; L185-F227 HydrophobicContact CD1-CG 4.16Å
186	L	87	Confident	85.7	Confident	2 Å²	2	34 Å²	34	1%	0.01	17%	0.174	C	C	.	.	S	Bend	trans	-96	2.8	178.5	-68.3	170.7	0	0	0	113.4	E182 A183 F227 V697 I700 R701	E182-L186 WeakPolarHBondContact O-CD1 3.14Å; E182-L186 VanDerWaalsContact O-CG 3.25Å; E182-L186 WeakPolarHBondContact O-CG 3.18Å; E182-L186 PolarHBondContact O-N 3.25Å; A183-L186 PolarHBondContact O-N 3.16Å; A183-L186 VanDerWaalsContact O-N 3.16Å; L186-F227 HydrophobicContact CD1-CZ 3.95Å; L186-F227 HydrophobicContact CD2-CE1 4.24Å; L186-F227 HydrophobicContact CD2-CZ 3.82Å; L186-F227 HydrophobicContact CG-CE1 4.32Å; L186-F227 HydrophobicContact CG-CZ 3.71Å; L186-V697 HydrophobicContact CB-CG1 4.28Å; L186-V697 HydrophobicContact CD2-CB 4.44Å; L186-V697 HydrophobicContact CD2-CG1 4.11Å; L186-V697 HydrophobicContact CD2-CG2 4.2Å; L186-I700 HydrophobicContact CD1-CG2 4.05Å; L186-I700 HydrophobicContact CD2-CB 4.25Å; L186-I700 HydrophobicContact CD2-CD1 4.4Å; L186-I700 HydrophobicContact CD2-CG2 4.01Å; L186-R701 HydrophobicContact CD1-CG 3.8Å; L186-R701 PolarHBondContact O-NH2 3.17Å
187	E	83.7	Confident	85.7	Confident	78 Å²	78	33.8 Å²	33.8	36%	0.364	17%	0.173	S	C	.	.	S	Bend	trans	-59.7	154.1	173.1	-164.9	170.1	160.1	0	0	110.7	Y131 A183 A184 R189	Y131-E187 PolarHBondContact OH-OE2 3.44Å; A183-E187 PolarHBondContact O-N 3.38Å; A184-E187 WeakPolarHBondContact O-CB 3.36Å; E187-R189 PolarHBondContact O-N 2.89Å
188	D	75.6	Confident	85.6	Confident	145 Å²	145	32.3 Å²	32.3	78%	0.775	17%	0.171	S	C	*	.	S	Bend	trans	-67.8	81.4	-176.4	-77.6	-18.4	0	0	0	111
189	R	76.3	Confident	85.6	Confident	79 Å²	79	32.6 Å²	32.6	30%	0.298	17%	0.173	S	C	.	.			trans	-101	147.5	171.9	-56.8	-171.5	-168.4	-160	4.8	109.5	A184 E187 E191 D195	A184-R189 PolarHBondContact O-NH2 3.06Å; E187-R189 PolarHBondContact O-N 2.89Å; R189-E191 VanDerWaalsContact C-N 3.28Å; R189-E191 PolarHBondContact O-N 3.43Å; R189-D195 VanDerWaalsContact CD-OD2 3.28Å; R189-D195 WeakPolarHBondContact CD-OD2 3.41Å; R189-D195 IonicContact NH1-OD2 3.05Å
190	A	71.9	Confident	85.7	Confident	62 Å²	62	29.8 Å²	29.8	51%	0.512	16%	0.161	S	C	.	.	S	Bend	trans	-59.9	-41.2	174.7	0	0	0	0	0	111.3
191	E	78.5	Confident	85.7	Confident	24 Å²	24	34.3 Å²	34.3	11%	0.112	18%	0.182	C	C	.	.			trans	-136.9	73.4	-172.9	-60.4	-160.6	157.7	0	0	113.4	R189 V193 S194 D195 R247 Q249	R189-E191 VanDerWaalsContact C-N 3.28Å; R189-E191 PolarHBondContact O-N 3.43Å; E191-V193 VanDerWaalsContact C-N 3.29Å; E191-V193 PolarHBondContact O-N 3.22Å; E191-S194 PolarHBondContact O-N 3.37Å; E191-D195 PolarHBondContact O-N 3.37Å; E191-D195 VanDerWaalsContact O-N 3.12Å; E191-R247 WeakPolarHBondContact OE1-CD 3.28Å; E191-R247 IonicContact OE1-CZ 3.82Å; E191-R247 IonicContact OE1-NE 3.66Å; E191-R247 PolarHBondContact OE1-NE 3.18Å; E191-R247 IonicContact OE1-NH2 2.86Å; E191-Q249 WeakPolarHBondContact OE1-CB 3.11Å
192	P	87.2	Confident	85.6	Confident	4 Å²	4	38.3 Å²	38.3	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-36.1	-173.3	23.2	-33.3	0	0	0	113.1	M196 F231 I693	P192-M196 HydrophobicContact CB-CE 3.89Å; P192-M196 WeakPolarHBondContact O-CB 3.38Å; P192-M196 WeakPolarHBondContact O-CE 3.38Å; P192-M196 WeakPolarHBondContact O-CG 3.48Å; P192-M196 PolarHBondContact O-N 3.32Å; P192-F231 HydrophobicContact CB-CE1 4.4Å; P192-F231 HydrophobicContact CB-CZ 4.08Å; P192-F231 HydrophobicContact CG-CE1 4.05Å; P192-F231 HydrophobicContact CG-CZ 4.23Å; P192-I693 HydrophobicContact CG-CD1 4.25Å; P192-I693 HydrophobicContact CG-CG2 3.55Å
193	V	89.3	Confident	85.7	Confident	6 Å²	6	35.8 Å²	35.8	4%	0.036	19%	0.188	C	C	.	.	H	α-helix	trans	-72.8	-41.8	-176.8	-179.1	0	0	0	0	112.2	E191 M196 F197 V228 F231 L244 L261 F273	E191-V193 VanDerWaalsContact C-N 3.29Å; E191-V193 PolarHBondContact O-N 3.22Å; V193-M196 PolarHBondContact O-N 3.33Å; V193-F197 HydrophobicContact CG1-CD2 4.43Å; V193-F197 HydrophobicContact CG1-CE1 4.09Å; V193-F197 HydrophobicContact CG1-CE2 3.78Å; V193-F197 HydrophobicContact CG1-CZ 3.59Å; V193-F197 VanDerWaalsContact O-CG 3.3Å; V193-F197 WeakPolarHBondContact O-CG 3.49Å; V193-F197 PolarHBondContact O-N 3.39Å; V193-V228 HydrophobicContact CG1-CG1 3.76Å; V193-F231 HydrophobicContact CG2-CB 4.27Å; V193-F231 HydrophobicContact CG2-CD1 3.92Å; V193-F231 HydrophobicContact CG2-CD2 4.06Å; V193-F231 HydrophobicContact CG2-CE1 4.24Å; V193-F231 HydrophobicContact CG2-CE2 4.37Å; V193-F231 HydrophobicContact CG2-CG 3.82Å; V193-F231 HydrophobicContact CG2-CZ 4.46Å; V193-L244 HydrophobicContact CG2-CD1 4.14Å; V193-L261 HydrophobicContact CG1-CD1 4.18Å; V193-L261 HydrophobicContact CG1-CD2 3.99Å; V193-F273 HydrophobicContact CG1-CE2 4.08Å; V193-F273 HydrophobicContact CG1-CZ 4.36Å
194	S	85.6	Confident	86	Confident	8 Å²	8	36.9 Å²	36.9	6%	0.056	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-46	177.8	-166.5	0	0	0	0	110.5	E191 M196 F197 I198 L264	E191-S194 PolarHBondContact O-N 3.37Å; S194-M196 VanDerWaalsContact C-N 3.33Å; S194-M196 PolarHBondContact O-N 3.34Å; S194-F197 WeakPolarHBondContact O-CB 3.23Å; S194-F197 PolarHBondContact O-N 3.12Å; S194-I198 WeakPolarHBondContact O-CG1 3.25Å; S194-I198 PolarHBondContact O-N 2.58Å; S194-L264 WeakPolarHBondContact OG-CD2 3.34Å
195	D	86	Confident	86.1	Confident	55 Å²	55	42 Å²	42	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-58.7	-42.2	176.1	-72.5	-7.9	0	0	0	112.3	R189 E191 F197 I198 L199	R189-D195 VanDerWaalsContact CD-OD2 3.28Å; R189-D195 WeakPolarHBondContact CD-OD2 3.41Å; R189-D195 IonicContact NH1-OD2 3.05Å; E191-D195 PolarHBondContact O-N 3.37Å; E191-D195 VanDerWaalsContact O-N 3.12Å; D195-F197 VanDerWaalsContact C-N 3.28Å; D195-F197 PolarHBondContact O-N 2.96Å; D195-I198 PolarHBondContact O-N 2.73Å; D195-L199 WeakPolarHBondContact O-CB 3.24Å; D195-L199 PolarHBondContact O-N 3.19Å
196	M	91.1	Very high	86.1	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-34.8	175.9	-75.7	175.2	-145.7	0	0	112.5	L185 P192 V193 S194 C200 V224 F227 V228 F231	L185-M196 HydrophobicContact CB-CE 3.74Å; L185-M196 HydrophobicContact CD1-SD 4.33Å; L185-M196 HydrophobicContact CD2-CE 4.06Å; L185-M196 HydrophobicContact CD2-CG 3.63Å; L185-M196 HydrophobicContact CD2-SD 4.27Å; L185-M196 HydrophobicContact CG-CE 4.31Å; L185-M196 VanDerWaalsContact O-CE 3.24Å; L185-M196 WeakPolarHBondContact O-CE 3.33Å; P192-M196 HydrophobicContact CB-CE 3.89Å; P192-M196 WeakPolarHBondContact O-CB 3.38Å; P192-M196 WeakPolarHBondContact O-CE 3.38Å; P192-M196 WeakPolarHBondContact O-CG 3.48Å; P192-M196 PolarHBondContact O-N 3.32Å; V193-M196 PolarHBondContact O-N 3.33Å; S194-M196 VanDerWaalsContact C-N 3.33Å; S194-M196 PolarHBondContact O-N 3.34Å; M196-C200 PolarHBondContact O-N 3.36Å; M196-C200 PolarHBondContact O-SG 3.1Å; M196-V224 HydrophobicContact CB-CG1 4.14Å; M196-V224 HydrophobicContact CG-CG1 4.34Å; M196-F227 HydrophobicContact CE-CD1 4.25Å; M196-F227 HydrophobicContact CE-CE1 4.01Å; M196-F227 HydrophobicContact SD-CD1 3.92Å; M196-F227 HydrophobicContact SD-CE1 4.29Å; M196-V228 HydrophobicContact CB-CG2 3.59Å; M196-V228 HydrophobicContact CG-CG2 4.13Å; M196-V228 HydrophobicContact SD-CB 4.35Å; M196-V228 HydrophobicContact SD-CG1 4.36Å; M196-V228 HydrophobicContact SD-CG2 3.67Å; M196-F231 HydrophobicContact CE-CE2 3.62Å; M196-F231 HydrophobicContact CE-CZ 3.74Å; M196-F231 HydrophobicContact SD-CE2 3.87Å
197	F	91	Very high	86.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.1	-40.4	176	-64.9	-16.4	0	0	0	111.9	V193 S194 D195 C200 Q201 V228 L261 L264 A265 T268 Q270 F273	V193-F197 HydrophobicContact CG1-CD2 4.43Å; V193-F197 HydrophobicContact CG1-CE1 4.09Å; V193-F197 HydrophobicContact CG1-CE2 3.78Å; V193-F197 HydrophobicContact CG1-CZ 3.59Å; V193-F197 VanDerWaalsContact O-CG 3.3Å; V193-F197 WeakPolarHBondContact O-CG 3.49Å; V193-F197 PolarHBondContact O-N 3.39Å; S194-F197 WeakPolarHBondContact O-CB 3.23Å; S194-F197 PolarHBondContact O-N 3.12Å; D195-F197 VanDerWaalsContact C-N 3.28Å; D195-F197 PolarHBondContact O-N 2.96Å; F197-C200 WeakPolarHBondContact O-CB 3.48Å; F197-C200 PolarHBondContact O-N 3.06Å; F197-Q201 PolarHBondContact O-N 3.2Å; F197-Q201 VanDerWaalsContact O-N 3.17Å; F197-V228 HydrophobicContact CD1-CG1 4.35Å; F197-V228 HydrophobicContact CE1-CB 4.29Å; F197-V228 HydrophobicContact CE1-CG1 3.6Å; F197-V228 HydrophobicContact CE1-CG2 4.4Å; F197-V228 HydrophobicContact CZ-CG1 4.2Å; F197-L261 HydrophobicContact CD2-CD1 4.01Å; F197-L261 HydrophobicContact CE2-CD1 3.64Å; F197-L261 HydrophobicContact CE2-CG 4.15Å; F197-L264 HydrophobicContact CB-CD2 4.46Å; F197-L264 HydrophobicContact CB-CG 4.47Å; F197-L264 HydrophobicContact CD2-CD2 3.98Å; F197-L264 HydrophobicContact CD2-CG 3.96Å; F197-A265 HydrophobicContact CE2-CB 3.75Å; F197-A265 HydrophobicContact CZ-CB 3.91Å; F197-T268 HydrophobicContact CB-CG2 4.19Å; F197-Q270 HydrophobicContact CD1-CB 4.34Å; F197-Q270 VanDerWaalsContact CD1-CD 3.41Å; F197-Q270 HydrophobicContact CD1-CG 3.41Å; F197-Q270 VanDerWaalsContact CD1-CG 3.41Å; F197-Q270 HydrophobicContact CE1-CB 3.85Å; F197-Q270 HydrophobicContact CE1-CG 3.42Å; F197-Q270 VanDerWaalsContact CE1-CG 3.42Å; F197-Q270 HydrophobicContact CG-CG 4Å; F197-Q270 HydrophobicContact CZ-CB 4.23Å; F197-Q270 HydrophobicContact CZ-CG 4.05Å; F197-F273 HydrophobicContact CE1-CG 4.42Å; F197-F273 AromaticContact CZ-CD1 3.89Å; F197-F273 HydrophobicContact CZ-CD1 3.89Å; F197-F273 HydrophobicContact CZ-CD2 4.25Å; F197-F273 HydrophobicContact CZ-CE1 4.11Å; F197-F273 HydrophobicContact CZ-CE2 4.43Å; F197-F273 AromaticContact CZ-CG 3.97Å; F197-F273 HydrophobicContact CZ-CG 3.97Å; F197-F273 HydrophobicContact CZ-CZ 4.38Å
198	I	87.4	Confident	86.5	Confident	65 Å²	65	48.1 Å²	48.1	33%	0.333	24%	0.237	S	C	.	.	H	α-helix	trans	-63.9	-45.2	174.4	-64.4	168.2	0	0	0	110	S194 D195 C200 Q201 E202	S194-I198 WeakPolarHBondContact O-CG1 3.25Å; S194-I198 PolarHBondContact O-N 2.58Å; D195-I198 PolarHBondContact O-N 2.73Å; I198-C200 VanDerWaalsContact C-N 3.3Å; I198-C200 PolarHBondContact O-N 3.3Å; I198-Q201 CarbonylContact O-C 3.59Å; I198-Q201 WeakPolarHBondContact O-CA 3.34Å; I198-Q201 VanDerWaalsContact O-CB 3.31Å; I198-Q201 WeakPolarHBondContact O-CB 3.44Å; I198-Q201 PolarHBondContact O-N 2.89Å; I198-E202 PolarHBondContact O-N 2.93Å
199	L	89.9	Confident	87	Confident	15 Å²	15	47 Å²	47	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-57.2	-42	175.5	179.5	63.9	0	0	0	111.8	F176 H179 L185 D195 Q201 E202 L203 V224	F176-L199 HydrophobicContact CD1-CD1 4.19Å; H179-L199 HydrophobicContact CB-CD1 4.05Å; H179-L199 HydrophobicContact CB-CD2 4.22Å; L185-L199 HydrophobicContact CD2-CD2 4.23Å; D195-L199 WeakPolarHBondContact O-CB 3.24Å; D195-L199 PolarHBondContact O-N 3.19Å; L199-Q201 VanDerWaalsContact C-N 3.28Å; L199-Q201 PolarHBondContact O-N 2.87Å; L199-E202 PolarHBondContact O-N 3.21Å; L199-L203 HydrophobicContact CG-CD1 4.29Å; L199-L203 WeakPolarHBondContact O-CB 3.43Å; L199-L203 WeakPolarHBondContact O-CG 3.38Å; L199-L203 PolarHBondContact O-N 3.24Å; L199-V224 HydrophobicContact CD2-CG2 4.25Å
200	C	91.9	Very high	87.4	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.02	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-39.1	173.7	-70.4	0	0	0	0	112.2	M196 F197 I198 E204 M221 Q270	M196-C200 PolarHBondContact O-N 3.36Å; M196-C200 PolarHBondContact O-SG 3.1Å; F197-C200 WeakPolarHBondContact O-CB 3.48Å; F197-C200 PolarHBondContact O-N 3.06Å; I198-C200 VanDerWaalsContact C-N 3.3Å; I198-C200 PolarHBondContact O-N 3.3Å; C200-E204 WeakPolarHBondContact O-CB 3.37Å; C200-E204 PolarHBondContact O-N 3.11Å; C200-M221 HydrophobicContact CB-CG 4.47Å; C200-Q270 VanDerWaalsContact CB-NE2 3.34Å; C200-Q270 PolarHBondContact SG-NE2 3.01Å; C200-Q270 VanDerWaalsContact SG-NE2 3.41Å
201	Q	88.9	Confident	88	Confident	96 Å²	96	46.2 Å²	46.2	45%	0.449	22%	0.224	S	C	.	.	H	α-helix	trans	-68.7	-35.8	177.2	-166.6	-176.3	16.6	0	0	112	F197 I198 L199 E204 K205	F197-Q201 PolarHBondContact O-N 3.2Å; F197-Q201 VanDerWaalsContact O-N 3.17Å; I198-Q201 CarbonylContact O-C 3.59Å; I198-Q201 WeakPolarHBondContact O-CA 3.34Å; I198-Q201 VanDerWaalsContact O-CB 3.31Å; I198-Q201 WeakPolarHBondContact O-CB 3.44Å; I198-Q201 PolarHBondContact O-N 2.89Å; L199-Q201 VanDerWaalsContact C-N 3.28Å; L199-Q201 PolarHBondContact O-N 2.87Å; Q201-E204 PolarHBondContact O-N 3.41Å; Q201-K205 WeakPolarHBondContact O-CG 3.46Å; Q201-K205 PolarHBondContact O-N 2.84Å; Q201-K205 VanDerWaalsContact O-N 3.11Å
202	E	88.6	Confident	88.4	Confident	84 Å²	84	50 Å²	50	39%	0.393	25%	0.253	S	S	.	.	H	α-helix	trans	-69.5	-42.3	175.6	-68	-175.4	162.2	0	0	112.2	F176 I198 L199 E204 K205 A206	F176-E202 HydrophobicContact CE1-CB 4.18Å; I198-E202 PolarHBondContact O-N 2.93Å; L199-E202 PolarHBondContact O-N 3.21Å; E202-E204 VanDerWaalsContact C-N 3.28Å; E202-E204 PolarHBondContact O-N 3.38Å; E202-K205 PolarHBondContact O-N 3.27Å; E202-A206 WeakPolarHBondContact O-CB 3.39Å; E202-A206 PolarHBondContact O-N 3.29Å
203	L	91.5	Very high	88.3	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-58.7	-40.6	172.1	-76.2	169.6	0	0	0	111.8	F176 L199 A206 R207 Y217 L220 M221	F176-L203 HydrophobicContact CB-CD2 3.79Å; F176-L203 HydrophobicContact CD1-CD2 3.49Å; F176-L203 VanDerWaalsContact CD1-CD2 3.49Å; F176-L203 HydrophobicContact CD1-CG 4.05Å; F176-L203 HydrophobicContact CD2-CD2 4.44Å; F176-L203 HydrophobicContact CE1-CD2 4.17Å; F176-L203 HydrophobicContact CE1-CG 4.43Å; F176-L203 HydrophobicContact CG-CD2 3.66Å; L199-L203 HydrophobicContact CG-CD1 4.29Å; L199-L203 WeakPolarHBondContact O-CB 3.43Å; L199-L203 WeakPolarHBondContact O-CG 3.38Å; L199-L203 PolarHBondContact O-N 3.24Å; L203-A206 PolarHBondContact O-N 3.35Å; L203-R207 WeakPolarHBondContact O-CB 3.36Å; L203-R207 PolarHBondContact O-N 3.41Å; L203-Y217 HydrophobicContact CD2-CD1 4.01Å; L203-L220 HydrophobicContact CD1-CB 4.42Å; L203-L220 HydrophobicContact CD2-CB 4.41Å; L203-M221 HydrophobicContact CB-CB 4.39Å; L203-M221 HydrophobicContact CD1-CB 4.15Å
204	E	90.3	Very high	88.3	Confident	42 Å²	42	53.4 Å²	53.4	20%	0.196	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-41.4	176.5	-179.4	54.5	-143.1	0	0	111.8	C200 Q201 E202 R207 Q208	C200-E204 WeakPolarHBondContact O-CB 3.37Å; C200-E204 PolarHBondContact O-N 3.11Å; Q201-E204 PolarHBondContact O-N 3.41Å; E202-E204 VanDerWaalsContact C-N 3.28Å; E202-E204 PolarHBondContact O-N 3.38Å; E204-R207 WeakPolarHBondContact O-CB 3.37Å; E204-R207 PolarHBondContact O-N 3.08Å; E204-R207 IonicContact OE1-CZ 3.71Å; E204-R207 IonicContact OE1-NE 3.38Å; E204-R207 PolarHBondContact OE1-NE 3.01Å; E204-R207 IonicContact OE1-NH2 3.66Å; E204-R207 PolarHBondContact OE1-NH2 2.77Å; E204-R207 IonicContact OE2-CZ 4Å; E204-R207 IonicContact OE2-NE 3.24Å; E204-R207 PolarHBondContact OE2-NE 3.12Å; E204-R207 VanDerWaalsContact OE2-NE 3.09Å; E204-R207 IonicContact OE2-NH1 2.78Å; E204-R207 IonicContact OE2-NH2 3.31Å; E204-R207 PolarHBondContact OE2-NH2 3.42Å; E204-Q208 WeakPolarHBondContact O-CG 3.46Å; E204-Q208 PolarHBondContact O-N 3.25Å; E204-Q208 VanDerWaalsContact O-N 3.12Å; E204-Q208 PolarHBondContact OE1-NE2 2.91Å
205	K	89.1	Confident	88.7	Confident	108 Å²	108	61.3 Å²	61.3	47%	0.47	30%	0.303	S	S	.	.	H	α-helix	trans	-64.9	-40.6	173.4	-69.5	169.1	-174.7	168	0	111.8	Q201 E202 Q208 R209	Q201-K205 WeakPolarHBondContact O-CG 3.46Å; Q201-K205 PolarHBondContact O-N 2.84Å; Q201-K205 VanDerWaalsContact O-N 3.11Å; E202-K205 PolarHBondContact O-N 3.27Å; K205-Q208 PolarHBondContact O-N 3.49Å; K205-R209 PolarHBondContact O-N 2.95Å
206	A	87.2	Confident	89	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65	-40.4	176.9	0	0	0	0	0	111.7	F176 E202 L203 Q208 R209 N210 Y217	F176-A206 HydrophobicContact CE2-CB 3.68Å; F176-A206 HydrophobicContact CZ-CB 3.86Å; E202-A206 WeakPolarHBondContact O-CB 3.39Å; E202-A206 PolarHBondContact O-N 3.29Å; L203-A206 PolarHBondContact O-N 3.35Å; A206-Q208 VanDerWaalsContact C-N 3.35Å; A206-Q208 PolarHBondContact O-N 2.7Å; A206-R209 PolarHBondContact O-N 2.98Å; A206-N210 PolarHBondContact O-N 3.31Å; A206-Y217 HydrophobicContact CB-CD1 4.17Å; A206-Y217 HydrophobicContact CB-CE1 3.98Å
207	R	91	Very high	89.1	Confident	72 Å²	72	60 Å²	60	27%	0.272	30%	0.3	S	S	.	.	H	α-helix	trans	-58	-45	173.5	-175.5	-175.3	76.1	151.5	0.6	112.1	L203 E204 R209 N210 A214 E218	L203-R207 WeakPolarHBondContact O-CB 3.36Å; L203-R207 PolarHBondContact O-N 3.41Å; E204-R207 WeakPolarHBondContact O-CB 3.37Å; E204-R207 PolarHBondContact O-N 3.08Å; E204-R207 IonicContact OE1-CZ 3.71Å; E204-R207 IonicContact OE1-NE 3.38Å; E204-R207 PolarHBondContact OE1-NE 3.01Å; E204-R207 IonicContact OE1-NH2 3.66Å; E204-R207 PolarHBondContact OE1-NH2 2.77Å; E204-R207 IonicContact OE2-CZ 4Å; E204-R207 IonicContact OE2-NE 3.24Å; E204-R207 PolarHBondContact OE2-NE 3.12Å; E204-R207 VanDerWaalsContact OE2-NE 3.09Å; E204-R207 IonicContact OE2-NH1 2.78Å; E204-R207 IonicContact OE2-NH2 3.31Å; E204-R207 PolarHBondContact OE2-NH2 3.42Å; R207-R209 VanDerWaalsContact C-N 3.34Å; R207-N210 CarbonylContact O-C 3.3Å; R207-A214 HydrophobicContact CG-CB 3.83Å; R207-E218 IonicContact NH1-OE1 3.95Å
208	Q	88.5	Confident	89.1	Confident	139 Å²	139	64.2 Å²	64.2	65%	0.65	32%	0.32	S	S	*	.	H	α-helix	trans	-68	-34.9	179.2	-70.1	175.3	14.6	0	0	112.3	E204 K205 A206	E204-Q208 WeakPolarHBondContact O-CG 3.46Å; E204-Q208 PolarHBondContact O-N 3.25Å; E204-Q208 VanDerWaalsContact O-N 3.12Å; E204-Q208 PolarHBondContact OE1-NE2 2.91Å; K205-Q208 PolarHBondContact O-N 3.49Å; A206-Q208 VanDerWaalsContact C-N 3.35Å; A206-Q208 PolarHBondContact O-N 2.7Å
209	R	85.7	Confident	89.5	Confident	121 Å²	121	63.4 Å²	63.4	46%	0.457	32%	0.323	S	S	.	.	H	α-helix	trans	-68.9	-46.6	175.4	-169.2	-171.2	-58.5	125.1	0.7	111.9	E172 K205 A206 R207	E172-R209 IonicContact OE1-NH1 3.72Å; E172-R209 PolarHBondContact OE1-NH1 2.84Å; K205-R209 PolarHBondContact O-N 2.95Å; A206-R209 PolarHBondContact O-N 2.98Å; R207-R209 VanDerWaalsContact C-N 3.34Å
210	N	84.2	Confident	89.6	Confident	24 Å²	24	63.8 Å²	63.8	13%	0.128	33%	0.325	C	S	.	.			trans	-112.6	74	-170.8	-66.4	-18.6	0	0	0	111.2	L169 E172 A206 R207 S212 R213 A214 Y217	L169-N210 WeakPolarHBondContact CD2-ND2 3.45Å; E172-N210 PolarHBondContact OE2-ND2 3.35Å; A206-N210 PolarHBondContact O-N 3.31Å; R207-N210 CarbonylContact O-C 3.3Å; N210-S212 PolarHBondContact O-N 3.4Å; N210-R213 PolarHBondContact O-N 2.99Å; N210-A214 PolarHBondContact O-N 3.37Å; N210-Y217 HydrophobicContact CB-CE2 3.86Å; N210-Y217 PolarHBondContact ND2-OH 3.48Å
211	S	85.1	Confident	89.7	Confident	102 Å²	102	64.3 Å²	64.3	71%	0.713	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-60.6	-28	-177.2	63.9	0	0	0	0	114	R213 A214	S211-R213 VanDerWaalsContact C-N 3.3Å; S211-R213 PolarHBondContact O-N 3.48Å; S211-A214 WeakPolarHBondContact O-CB 3.37Å; S211-A214 PolarHBondContact O-N 2.88Å
212	S	86.7	Confident	89.9	Confident	103 Å²	103	63.4 Å²	63.4	72%	0.72	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-64.8	-30.1	179	60.5	0	0	0	0	113.8	N210	N210-S212 PolarHBondContact O-N 3.4Å
213	R	85.3	Confident	90.2	Very high	57 Å²	57	61.6 Å²	61.6	22%	0.215	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-111.8	17.9	178.4	-64	-174.6	-176.8	175.8	3.9	112.5	L169 N210 S211 F215 A216 Y217	L169-R213 PolarHBondContact O-NH1 3.47Å; N210-R213 PolarHBondContact O-N 2.99Å; S211-R213 VanDerWaalsContact C-N 3.3Å; S211-R213 PolarHBondContact O-N 3.48Å; R213-F215 PolarHBondContact O-N 3.46Å; R213-F215 VanDerWaalsContact O-N 3.12Å; R213-A216 PolarHBondContact O-N 3.25Å; R213-Y217 HydrophobicContact CB-CD2 4.36Å; R213-Y217 HydrophobicContact CB-CE2 3.97Å; R213-Y217 VanDerWaalsContact O-CD2 3.32Å; R213-Y217 WeakPolarHBondContact O-CD2 3.32Å; R213-Y217 PolarHBondContact O-N 3.2Å
214	A	89.8	Confident	90.3	Very high	25 Å²	25	61.6 Å²	61.6	21%	0.207	31%	0.314	C	S	.	.	H	α-helix	trans	-52.7	-39.3	-175.7	0	0	0	0	0	113.1	R207 N210 S211 A216 Y217 E218	R207-A214 HydrophobicContact CG-CB 3.83Å; N210-A214 PolarHBondContact O-N 3.37Å; S211-A214 WeakPolarHBondContact O-CB 3.37Å; S211-A214 PolarHBondContact O-N 2.88Å; A214-A216 VanDerWaalsContact C-N 3.33Å; A214-A216 PolarHBondContact O-N 2.98Å; A214-Y217 PolarHBondContact O-N 3.33Å; A214-E218 WeakPolarHBondContact O-CB 3.43Å; A214-E218 PolarHBondContact O-N 2.79Å
215	F	93.1	Very high	90.5	Very high	174 Å²	174	61.3 Å²	61.3	76%	0.763	31%	0.312	S	S	*	.	H	α-helix	trans	-60.3	-38.6	177.8	-176	-98.9	0	0	0	113.1	R213 E218 A219	R213-F215 PolarHBondContact O-N 3.46Å; R213-F215 VanDerWaalsContact O-N 3.12Å; F215-E218 PolarHBondContact O-N 3.28Å; F215-A219 WeakPolarHBondContact O-CB 3.4Å; F215-A219 PolarHBondContact O-N 3.45Å
216	A	92.3	Very high	90.6	Very high	27 Å²	27	61 Å²	61	22%	0.223	31%	0.31	C	S	.	.	H	α-helix	trans	-69.8	-42.2	179.4	0	0	0	0	0	111.6	L173 R213 A214 L220	L173-A216 HydrophobicContact CD1-CB 4.07Å; L173-A216 HydrophobicContact CD2-CB 4.13Å; R213-A216 PolarHBondContact O-N 3.25Å; A214-A216 VanDerWaalsContact C-N 3.33Å; A214-A216 PolarHBondContact O-N 2.98Å; A216-L220 WeakPolarHBondContact O-CG 3.4Å; A216-L220 PolarHBondContact O-N 3.02Å; A216-L220 VanDerWaalsContact O-N 3.1Å
217	Y	93	Very high	90.9	Very high	1 Å²	1	61.2 Å²	61.2	0%	0.004	31%	0.311	C	S	.	.	H	α-helix	trans	-65.9	-38.6	174.8	-64.6	-66.3	0	0	0	112.1	L173 F176 L203 A206 N210 R213 A214 L220 M221	L173-Y217 HydrophobicContact CD1-CD1 3.95Å; L173-Y217 HydrophobicContact CD1-CE1 3.66Å; F176-Y217 HydrophobicContact CD2-CD1 4.32Å; F176-Y217 AromaticContact CD2-CE1 3.65Å; F176-Y217 HydrophobicContact CD2-CE1 3.65Å; F176-Y217 HydrophobicContact CE2-CE1 4.12Å; F176-Y217 HydrophobicContact CG-CE1 4.39Å; L203-Y217 HydrophobicContact CD2-CD1 4.01Å; A206-Y217 HydrophobicContact CB-CD1 4.17Å; A206-Y217 HydrophobicContact CB-CE1 3.98Å; N210-Y217 HydrophobicContact CB-CE2 3.86Å; N210-Y217 PolarHBondContact ND2-OH 3.48Å; R213-Y217 HydrophobicContact CB-CD2 4.36Å; R213-Y217 HydrophobicContact CB-CE2 3.97Å; R213-Y217 VanDerWaalsContact O-CD2 3.32Å; R213-Y217 WeakPolarHBondContact O-CD2 3.32Å; R213-Y217 PolarHBondContact O-N 3.2Å; A214-Y217 PolarHBondContact O-N 3.33Å; Y217-L220 PolarHBondContact O-N 3.43Å; Y217-M221 WeakPolarHBondContact O-CB 3.14Å; Y217-M221 PolarHBondContact O-N 3.29Å
218	E	92.6	Very high	91	Very high	90 Å²	90	57.8 Å²	57.8	42%	0.421	30%	0.298	S	S	.	.	H	α-helix	trans	-65.3	-43.2	177.1	-175.5	163.3	-152.3	0	0	111.9	R207 A214 F215 L220 M221 E222	R207-E218 IonicContact NH1-OE1 3.95Å; A214-E218 WeakPolarHBondContact O-CB 3.43Å; A214-E218 PolarHBondContact O-N 2.79Å; F215-E218 PolarHBondContact O-N 3.28Å; E218-L220 PolarHBondContact O-N 3.44Å; E218-M221 PolarHBondContact O-N 3.4Å; E218-E222 WeakPolarHBondContact O-CB 3.36Å; E218-E222 PolarHBondContact O-N 3.22Å
219	A	94.4	Very high	91.2	Very high	48 Å²	48	51.6 Å²	51.6	40%	0.397	27%	0.271	S	S	.	.	H	α-helix	trans	-61.5	-42.2	174.7	0	0	0	0	0	112.3	F215 E222 K223	F215-A219 WeakPolarHBondContact O-CB 3.4Å; F215-A219 PolarHBondContact O-N 3.45Å; A219-E222 PolarHBondContact O-N 3.15Å; A219-K223 WeakPolarHBondContact O-CB 3.45Å; A219-K223 PolarHBondContact O-N 3.05Å
220	L	93.2	Very high	91.4	Very high	22 Å²	22	48.2 Å²	48.2	12%	0.115	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-44.2	175.3	-70.7	170.4	0	0	0	111.8	L173 F176 R177 A180 L203 A216 Y217 E218 E222 K223 V224	L173-L220 HydrophobicContact CD1-CD1 3.92Å; F176-L220 HydrophobicContact CB-CD1 4.39Å; R177-L220 HydrophobicContact CG-CD1 3.71Å; R177-L220 HydrophobicContact CG-CD2 3.88Å; R177-L220 HydrophobicContact CG-CG 4.4Å; A180-L220 HydrophobicContact CB-CD2 4.22Å; L203-L220 HydrophobicContact CD1-CB 4.42Å; L203-L220 HydrophobicContact CD2-CB 4.41Å; A216-L220 WeakPolarHBondContact O-CG 3.4Å; A216-L220 PolarHBondContact O-N 3.02Å; A216-L220 VanDerWaalsContact O-N 3.1Å; Y217-L220 PolarHBondContact O-N 3.43Å; E218-L220 PolarHBondContact O-N 3.44Å; L220-E222 PolarHBondContact O-N 2.93Å; L220-K223 WeakPolarHBondContact O-CB 3.38Å; L220-K223 PolarHBondContact O-N 3.37Å; L220-V224 WeakPolarHBondContact O-CG2 3.4Å; L220-V224 PolarHBondContact O-N 3.15Å
221	M	93.9	Very high	91.8	Very high	15 Å²	15	47.1 Å²	47.1	7%	0.074	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-45.8	176.4	179.4	178.3	51.1	0	0	110.8	C200 L203 Y217 E218 K223 V224 K225	C200-M221 HydrophobicContact CB-CG 4.47Å; L203-M221 HydrophobicContact CB-CB 4.39Å; L203-M221 HydrophobicContact CD1-CB 4.15Å; Y217-M221 WeakPolarHBondContact O-CB 3.14Å; Y217-M221 PolarHBondContact O-N 3.29Å; E218-M221 PolarHBondContact O-N 3.4Å; M221-K223 VanDerWaalsContact C-N 3.31Å; M221-K223 PolarHBondContact O-N 3.02Å; M221-V224 PolarHBondContact O-N 3.46Å; M221-K225 HydrophobicContact CG-CD 4.03Å; M221-K225 HydrophobicContact CG-CG 4.26Å; M221-K225 WeakPolarHBondContact O-CB 3.48Å; M221-K225 WeakPolarHBondContact O-CG 3.29Å; M221-K225 PolarHBondContact O-N 2.93Å
222	E	93.3	Very high	92.1	Very high	77 Å²	77	42.2 Å²	42.2	36%	0.36	22%	0.22	S	C	.	.	H	α-helix	trans	-61	-40.9	177.3	-168.9	-177.7	167.5	0	0	111.7	E218 A219 L220 K225 K226	E218-E222 WeakPolarHBondContact O-CB 3.36Å; E218-E222 PolarHBondContact O-N 3.22Å; A219-E222 PolarHBondContact O-N 3.15Å; L220-E222 PolarHBondContact O-N 2.93Å; E222-K225 PolarHBondContact O-N 3.47Å; E222-K226 HydrophobicContact CG-CD 4.37Å; E222-K226 WeakPolarHBondContact O-CG 3.49Å; E222-K226 PolarHBondContact O-N 3.46Å; E222-K226 WeakPolarHBondContact OE1-CE 3.43Å; E222-K226 IonicContact OE1-NZ 3.3Å; E222-K226 PolarHBondContact OE1-NZ 3.35Å
223	K	93.5	Very high	92.3	Very high	46 Å²	46	39.1 Å²	39.1	20%	0.2	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-51.3	174	-174.4	-169.4	172.3	-159.8	0	111.5	E126 A180 A219 L220 M221 K225 K226 F227	E126-K223 WeakPolarHBondContact OE1-CE 3.36Å; E126-K223 IonicContact OE1-NZ 2.95Å; E126-K223 PolarHBondContact OE1-NZ 3.5Å; E126-K223 IonicContact OE2-NZ 3.42Å; A180-K223 PolarHBondContact O-NZ 3.34Å; A219-K223 WeakPolarHBondContact O-CB 3.45Å; A219-K223 PolarHBondContact O-N 3.05Å; L220-K223 WeakPolarHBondContact O-CB 3.38Å; L220-K223 PolarHBondContact O-N 3.37Å; M221-K223 VanDerWaalsContact C-N 3.31Å; M221-K223 PolarHBondContact O-N 3.02Å; K223-K225 PolarHBondContact O-N 2.91Å; K223-K226 PolarHBondContact O-N 3.28Å; K223-F227 WeakPolarHBondContact O-CB 3.31Å; K223-F227 PolarHBondContact O-N 3Å
224	V	94.2	Very high	92.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-47.3	177.9	177.5	0	0	0	0	110.2	A180 L185 M196 L199 L220 M221 K226 F227 V228	A180-V224 HydrophobicContact CB-CG2 3.57Å; L185-V224 HydrophobicContact CD1-CG2 4.41Å; M196-V224 HydrophobicContact CB-CG1 4.14Å; M196-V224 HydrophobicContact CG-CG1 4.34Å; L199-V224 HydrophobicContact CD2-CG2 4.25Å; L220-V224 WeakPolarHBondContact O-CG2 3.4Å; L220-V224 PolarHBondContact O-N 3.15Å; M221-V224 PolarHBondContact O-N 3.46Å; V224-K226 VanDerWaalsContact C-N 3.33Å; V224-K226 PolarHBondContact O-N 3.41Å; V224-F227 WeakPolarHBondContact O-CA 3.45Å; V224-F227 WeakPolarHBondContact O-CB 3.31Å; V224-F227 PolarHBondContact O-N 3.26Å; V224-V228 HydrophobicContact CG1-CG2 4.12Å; V224-V228 WeakPolarHBondContact O-CG2 3.44Å; V224-V228 PolarHBondContact O-N 3.04Å
225	K	93.5	Very high	92.5	Very high	35 Å²	35	38.3 Å²	38.3	15%	0.152	19%	0.193	C	C	.	.	H	α-helix	trans	-59	-40.5	179.9	-69.5	-176.5	171.7	178.5	0	113.1	M221 E222 K223 Y272	M221-K225 HydrophobicContact CG-CD 4.03Å; M221-K225 HydrophobicContact CG-CG 4.26Å; M221-K225 WeakPolarHBondContact O-CB 3.48Å; M221-K225 WeakPolarHBondContact O-CG 3.29Å; M221-K225 PolarHBondContact O-N 2.93Å; E222-K225 PolarHBondContact O-N 3.47Å; K223-K225 PolarHBondContact O-N 2.91Å; K225-Y272 HydrophobicContact CB-CD2 3.86Å; K225-Y272 HydrophobicContact CB-CE2 4.37Å
226	K	92.6	Very high	92.3	Very high	102 Å²	102	36.9 Å²	36.9	44%	0.443	19%	0.189	S	C	.	.	H	α-helix	trans	-68.2	-39.2	173.8	-73.8	176.1	-176.7	167.7	0	111.6	E222 K223 V224 A229 Y272	E222-K226 HydrophobicContact CG-CD 4.37Å; E222-K226 WeakPolarHBondContact O-CG 3.49Å; E222-K226 PolarHBondContact O-N 3.46Å; E222-K226 WeakPolarHBondContact OE1-CE 3.43Å; E222-K226 IonicContact OE1-NZ 3.3Å; E222-K226 PolarHBondContact OE1-NZ 3.35Å; K223-K226 PolarHBondContact O-N 3.28Å; V224-K226 VanDerWaalsContact C-N 3.33Å; V224-K226 PolarHBondContact O-N 3.41Å; K226-A229 WeakPolarHBondContact O-CB 3.3Å; K226-A229 PolarHBondContact O-N 3.36Å; K226-Y272 HydrophobicContact CG-CD2 4.32Å; K226-Y272 HydrophobicContact CG-CE1 4.49Å; K226-Y272 HydrophobicContact CG-CE2 4.27Å; K226-Y272 HydrophobicContact CG-CG 4.43Å
227	F	92.8	Very high	92.2	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-63.4	-44.5	177.3	-172.2	-95.7	0	0	0	112.1	E182 L185 L186 M196 K223 V224 A229 K230 F231 I700	E182-F227 HydrophobicContact CB-CD2 4.33Å; E182-F227 HydrophobicContact CB-CE2 3.84Å; E182-F227 HydrophobicContact CB-CZ 4.36Å; E182-F227 HydrophobicContact CG-CD2 3.92Å; E182-F227 HydrophobicContact CG-CE2 3.92Å; L185-F227 HydrophobicContact CB-CD1 4.26Å; L185-F227 HydrophobicContact CB-CE1 3.82Å; L185-F227 HydrophobicContact CB-CZ 4.48Å; L185-F227 HydrophobicContact CD1-CD1 3.63Å; L185-F227 HydrophobicContact CD1-CE1 4.05Å; L185-F227 HydrophobicContact CD1-CG 4.16Å; L186-F227 HydrophobicContact CD1-CZ 3.95Å; L186-F227 HydrophobicContact CD2-CE1 4.24Å; L186-F227 HydrophobicContact CD2-CZ 3.82Å; L186-F227 HydrophobicContact CG-CE1 4.32Å; L186-F227 HydrophobicContact CG-CZ 3.71Å; M196-F227 HydrophobicContact CE-CD1 4.25Å; M196-F227 HydrophobicContact CE-CE1 4.01Å; M196-F227 HydrophobicContact SD-CD1 3.92Å; M196-F227 HydrophobicContact SD-CE1 4.29Å; K223-F227 WeakPolarHBondContact O-CB 3.31Å; K223-F227 PolarHBondContact O-N 3Å; V224-F227 WeakPolarHBondContact O-CA 3.45Å; V224-F227 WeakPolarHBondContact O-CB 3.31Å; V224-F227 PolarHBondContact O-N 3.26Å; F227-A229 PolarHBondContact O-N 3.39Å; F227-K230 HydrophobicContact CD2-CD 4.3Å; F227-K230 HydrophobicContact CE2-CD 4.46Å; F227-K230 VanDerWaalsContact O-CB 3.27Å; F227-K230 WeakPolarHBondContact O-CB 3.42Å; F227-K230 WeakPolarHBondContact O-CG 3.43Å; F227-K230 PolarHBondContact O-N 2.84Å; F227-F231 HydrophobicContact CD1-CE2 4.49Å; F227-F231 HydrophobicContact CE1-CE2 4.16Å; F227-I700 HydrophobicContact CE2-CG2 4.29Å; F227-I700 HydrophobicContact CZ-CG2 4.15Å
228	V	93.1	Very high	92	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-31.9	178.9	-162.4	0	0	0	0	112	V193 M196 F197 V224 K230 F231 P232 F273	V193-V228 HydrophobicContact CG1-CG1 3.76Å; M196-V228 HydrophobicContact CB-CG2 3.59Å; M196-V228 HydrophobicContact CG-CG2 4.13Å; M196-V228 HydrophobicContact SD-CB 4.35Å; M196-V228 HydrophobicContact SD-CG1 4.36Å; M196-V228 HydrophobicContact SD-CG2 3.67Å; F197-V228 HydrophobicContact CD1-CG1 4.35Å; F197-V228 HydrophobicContact CE1-CB 4.29Å; F197-V228 HydrophobicContact CE1-CG1 3.6Å; F197-V228 HydrophobicContact CE1-CG2 4.4Å; F197-V228 HydrophobicContact CZ-CG1 4.2Å; V224-V228 HydrophobicContact CG1-CG2 4.12Å; V224-V228 WeakPolarHBondContact O-CG2 3.44Å; V224-V228 PolarHBondContact O-N 3.04Å; V228-K230 PolarHBondContact O-N 3.34Å; V228-K230 VanDerWaalsContact O-N 3.16Å; V228-F231 HydrophobicContact CG1-CD2 4.4Å; V228-F231 PolarHBondContact O-N 2.82Å; V228-P232 WeakPolarHBondContact O-CD 3.21Å; V228-F273 HydrophobicContact CG1-CD2 3.91Å; V228-F273 HydrophobicContact CG1-CE2 4.42Å
229	A	92.4	Very high	91.8	Very high	10 Å²	10	40.6 Å²	40.6	8%	0.083	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.1	177.4	0	0	0	0	0	113.5	K226 F227 P232 A233	K226-A229 WeakPolarHBondContact O-CB 3.3Å; K226-A229 PolarHBondContact O-N 3.36Å; F227-A229 PolarHBondContact O-N 3.39Å; A229-P232 VanDerWaalsContact O-CD 3.3Å; A229-P232 WeakPolarHBondContact O-CD 3.44Å; A229-P232 WeakPolarHBondContact O-CG 3.44Å; A229-A233 PolarHBondContact O-N 3.12Å
230	K	91.2	Very high	91.6	Very high	50 Å²	50	39.8 Å²	39.8	22%	0.217	20%	0.202	C	C	.	.	H	α-helix	trans	-66.3	-35.4	174.7	-64.7	-171.8	174	-165.1	0	112.7	F227 V228 A233 Y234 I700 E703	F227-K230 HydrophobicContact CD2-CD 4.3Å; F227-K230 HydrophobicContact CE2-CD 4.46Å; F227-K230 VanDerWaalsContact O-CB 3.27Å; F227-K230 WeakPolarHBondContact O-CB 3.42Å; F227-K230 WeakPolarHBondContact O-CG 3.43Å; F227-K230 PolarHBondContact O-N 2.84Å; V228-K230 PolarHBondContact O-N 3.34Å; V228-K230 VanDerWaalsContact O-N 3.16Å; K230-A233 WeakPolarHBondContact O-CB 3.49Å; K230-A233 PolarHBondContact O-N 3.06Å; K230-A233 VanDerWaalsContact O-N 3.1Å; K230-Y234 HydrophobicContact CB-CD2 4.17Å; K230-Y234 HydrophobicContact CB-CE2 4.09Å; K230-Y234 WeakPolarHBondContact O-CD2 3.11Å; K230-Y234 PolarHBondContact O-N 3.2Å; K230-I700 HydrophobicContact CB-CD1 4.39Å; K230-I700 HydrophobicContact CB-CG1 4.44Å; K230-I700 HydrophobicContact CD-CG2 4.47Å; K230-E703 IonicContact NZ-OE2 2.81Å
231	F	92	Very high	91.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-53.9	-55.8	-179.9	-74.6	-94	0	0	0	112.9	P192 V193 M196 F227 V228 A233 Y234 C235 L244 L696 V697 I700	P192-F231 HydrophobicContact CB-CE1 4.4Å; P192-F231 HydrophobicContact CB-CZ 4.08Å; P192-F231 HydrophobicContact CG-CE1 4.05Å; P192-F231 HydrophobicContact CG-CZ 4.23Å; V193-F231 HydrophobicContact CG2-CB 4.27Å; V193-F231 HydrophobicContact CG2-CD1 3.92Å; V193-F231 HydrophobicContact CG2-CD2 4.06Å; V193-F231 HydrophobicContact CG2-CE1 4.24Å; V193-F231 HydrophobicContact CG2-CE2 4.37Å; V193-F231 HydrophobicContact CG2-CG 3.82Å; V193-F231 HydrophobicContact CG2-CZ 4.46Å; M196-F231 HydrophobicContact CE-CE2 3.62Å; M196-F231 HydrophobicContact CE-CZ 3.74Å; M196-F231 HydrophobicContact SD-CE2 3.87Å; F227-F231 HydrophobicContact CD1-CE2 4.49Å; F227-F231 HydrophobicContact CE1-CE2 4.16Å; V228-F231 HydrophobicContact CG1-CD2 4.4Å; V228-F231 PolarHBondContact O-N 2.82Å; F231-A233 VanDerWaalsContact C-N 3.3Å; F231-A233 PolarHBondContact O-N 3.14Å; F231-Y234 PolarHBondContact O-N 3.33Å; F231-C235 PolarHBondContact O-N 3.22Å; F231-C235 PolarHBondContact O-SG 3Å; F231-C235 VanDerWaalsContact O-SG 3.42Å; F231-L244 HydrophobicContact CB-CD2 4.29Å; F231-L696 HydrophobicContact CD1-CB 4.33Å; F231-L696 HydrophobicContact CD1-CD1 4.36Å; F231-V697 HydrophobicContact CE1-CG2 4.43Å; F231-I700 HydrophobicContact CD1-CD1 4.09Å; F231-I700 HydrophobicContact CD2-CD1 4.24Å; F231-I700 HydrophobicContact CE1-CD1 4.11Å; F231-I700 HydrophobicContact CE2-CD1 4.25Å; F231-I700 HydrophobicContact CG-CD1 4.16Å; F231-I700 HydrophobicContact CZ-CD1 4.19Å
232	P	91.1	Very high	91	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.9	-26.3	176.4	24.7	-32.1	0	0	0	113.4	V228 A229 Y234 C235 F273 E276 N278 C279	V228-P232 WeakPolarHBondContact O-CD 3.21Å; A229-P232 VanDerWaalsContact O-CD 3.3Å; A229-P232 WeakPolarHBondContact O-CD 3.44Å; A229-P232 WeakPolarHBondContact O-CG 3.44Å; P232-Y234 VanDerWaalsContact C-N 3.3Å; P232-Y234 PolarHBondContact O-N 3.07Å; P232-C235 PolarHBondContact O-N 3.49Å; P232-F273 HydrophobicContact CG-CD2 3.7Å; P232-F273 HydrophobicContact CG-CE2 3.75Å; P232-E276 HydrophobicContact CB-CG 4.29Å; P232-E276 HydrophobicContact CG-CB 4.07Å; P232-E276 HydrophobicContact CG-CG 4Å; P232-N278 VanDerWaalsContact O-CB 3.28Å; P232-N278 WeakPolarHBondContact O-CB 3.29Å; P232-N278 PolarHBondContact O-ND2 3.43Å; P232-C279 HydrophobicContact CB-CB 3.86Å; P232-C279 HydrophobicContact CG-CB 4.34Å
233	A	90.9	Very high	90.6	Very high	38 Å²	38	40.1 Å²	40.1	31%	0.314	20%	0.201	S	C	.	.	H	α-helix	trans	-63.5	-36	175.1	0	0	0	0	0	111.9	A229 K230 F231 E276 N278	A229-A233 PolarHBondContact O-N 3.12Å; K230-A233 WeakPolarHBondContact O-CB 3.49Å; K230-A233 PolarHBondContact O-N 3.06Å; K230-A233 VanDerWaalsContact O-N 3.1Å; F231-A233 VanDerWaalsContact C-N 3.3Å; F231-A233 PolarHBondContact O-N 3.14Å; A233-E276 HydrophobicContact CB-CG 4.08Å; A233-N278 PolarHBondContact O-ND2 3.41Å
234	Y	90.1	Very high	90.2	Very high	61 Å²	61	38 Å²	38	24%	0.239	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-2.5	178.8	-75.6	-63.9	0	0	0	115.8	K230 F231 P232 E236 R699 I700 E703	K230-Y234 HydrophobicContact CB-CD2 4.17Å; K230-Y234 HydrophobicContact CB-CE2 4.09Å; K230-Y234 WeakPolarHBondContact O-CD2 3.11Å; K230-Y234 PolarHBondContact O-N 3.2Å; F231-Y234 PolarHBondContact O-N 3.33Å; P232-Y234 VanDerWaalsContact C-N 3.3Å; P232-Y234 PolarHBondContact O-N 3.07Å; Y234-E236 PolarHBondContact O-N 3.41Å; Y234-R699 HydrophobicContact CD1-CB 4.17Å; Y234-R699 HydrophobicContact CG-CB 4.29Å; Y234-R699 PolarHBondContact O-NH1 3.49Å; Y234-I700 HydrophobicContact CD2-CD1 4.32Å; Y234-I700 HydrophobicContact CD2-CG1 3.42Å; Y234-I700 VanDerWaalsContact CD2-CG1 3.42Å; Y234-I700 HydrophobicContact CE2-CG1 3.87Å; Y234-I700 HydrophobicContact CG-CG1 4.25Å; Y234-E703 WeakPolarHBondContact CE2-OE2 3.38Å; Y234-E703 WeakPolarHBondContact OH-CG 3.35Å; Y234-E703 PolarHBondContact OH-OE1 2.99Å; Y234-E703 PolarHBondContact OH-OE2 2.9Å
235	C	90	Very high	89.8	Confident	4 Å²	4	38 Å²	38	3%	0.027	19%	0.192	C	C	.	.			trans	-73.8	121.5	169.7	-67.8	0	0	0	0	109.9	F231 P232 Q240 V241 N278	F231-C235 PolarHBondContact O-N 3.22Å; F231-C235 PolarHBondContact O-SG 3Å; F231-C235 VanDerWaalsContact O-SG 3.42Å; P232-C235 PolarHBondContact O-N 3.49Å; C235-Q240 HydrophobicContact CB-CB 4.06Å; C235-V241 HydrophobicContact CB-CG2 3.37Å; C235-N278 PolarHBondContact O-ND2 2.97Å
236	E	88.1	Confident	88.9	Confident	144 Å²	144	41.1 Å²	41.1	67%	0.673	21%	0.205	S	C	*	.			trans	-86.9	-28.6	-178.5	-72.1	164.8	175.5	0	0	112.2	Y234 R699	Y234-E236 PolarHBondContact O-N 3.41Å; E236-R699 VanDerWaalsContact CD-CZ 3.42Å; E236-R699 VanDerWaalsContact CD-NH1 3.33Å; E236-R699 IonicContact OE1-CZ 2.77Å; E236-R699 IonicContact OE1-NE 3.48Å; E236-R699 IonicContact OE1-NH1 3.76Å; E236-R699 IonicContact OE1-NH2 3.72Å; E236-R699 PolarHBondContact OE1-NH2 3.23Å; E236-R699 VanDerWaalsContact OE1-NH2 3.16Å; E236-R699 IonicContact OE2-CZ 2.9Å; E236-R699 IonicContact OE2-NH1 2.58Å; E236-R699 PolarHBondContact OE2-NH1 2.78Å; E236-R699 IonicContact OE2-NH2 4Å; E236-R699 PolarHBondContact OE2-NH2 2.93Å
237	T	90.5	Very high	87.7	Confident	73 Å²	73	37.8 Å²	37.8	45%	0.448	19%	0.19	S	C	.	.	S	Bend	trans	-115.5	147	-175.6	-7.5	0	0	0	0	111	D239 Q240 V241	T237-D239 PolarHBondContact O-N 3.48Å; T237-Q240 WeakPolarHBondContact O-CB 3.48Å; T237-Q240 PolarHBondContact O-N 3.17Å; T237-Q240 VanDerWaalsContact O-N 3.12Å; T237-V241 PolarHBondContact O-N 3.35Å
238	S	88.6	Confident	86	Confident	52 Å²	52	39 Å²	39	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-60.8	-29.8	174.5	60.1	0	0	0	0	112.7	V241 L242	S238-V241 PolarHBondContact O-N 3.05Å; S238-L242 WeakPolarHBondContact O-CG 3.27Å; S238-L242 PolarHBondContact O-N 3.17Å
239	D	87.9	Confident	84.1	Confident	70 Å²	70	42.7 Å²	42.7	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-66.2	-40.6	176.1	-172.6	54.9	0	0	0	111.8	T237 V241 L242 R243	T237-D239 PolarHBondContact O-N 3.48Å; D239-V241 VanDerWaalsContact C-N 3.35Å; D239-V241 PolarHBondContact O-N 2.95Å; D239-L242 PolarHBondContact O-N 3.18Å; D239-R243 WeakPolarHBondContact O-CG 3.49Å; D239-R243 PolarHBondContact O-N 3.42Å; D239-R243 IonicContact OD1-NE 3.07Å; D239-R243 IonicContact OD2-CZ 3.09Å; D239-R243 IonicContact OD2-NE 3.98Å; D239-R243 PolarHBondContact OD2-NE 3.43Å; D239-R243 IonicContact OD2-NH2 3.33Å; D239-R243 PolarHBondContact OD2-NH2 3.18Å
240	Q	90	Very high	82	Confident	31 Å²	31	44.6 Å²	44.6	15%	0.145	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-45.4	175.3	-66.4	-179	-15.5	0	0	111.1	C235 T237 L242 R243 L244 L692	C235-Q240 HydrophobicContact CB-CB 4.06Å; T237-Q240 WeakPolarHBondContact O-CB 3.48Å; T237-Q240 PolarHBondContact O-N 3.17Å; T237-Q240 VanDerWaalsContact O-N 3.12Å; Q240-L242 PolarHBondContact O-N 3.04Å; Q240-R243 PolarHBondContact O-N 3.33Å; Q240-L244 PolarHBondContact O-N 2.98Å; Q240-L692 HydrophobicContact CB-CD1 3.79Å; Q240-L692 HydrophobicContact CB-CD2 4.25Å; Q240-L692 HydrophobicContact CG-CD1 3.71Å; Q240-L692 VanDerWaalsContact O-CD2 3.27Å; Q240-L692 WeakPolarHBondContact O-CD2 3.28Å
241	V	89.2	Confident	80	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-42.2	175.9	-179.6	0	0	0	0	111.5	C235 T237 S238 D239 L244 L245 N278 V282	C235-V241 HydrophobicContact CB-CG2 3.37Å; T237-V241 PolarHBondContact O-N 3.35Å; S238-V241 PolarHBondContact O-N 3.05Å; D239-V241 VanDerWaalsContact C-N 3.35Å; D239-V241 PolarHBondContact O-N 2.95Å; V241-L244 WeakPolarHBondContact O-CB 3.42Å; V241-L244 PolarHBondContact O-N 2.98Å; V241-L245 HydrophobicContact CG1-CD1 4.11Å; V241-L245 WeakPolarHBondContact O-CG 3.49Å; V241-L245 PolarHBondContact O-N 3.36Å; V241-L245 VanDerWaalsContact O-N 3.07Å; V241-N278 HydrophobicContact CG2-CB 4.49Å; V241-V282 HydrophobicContact CB-CB 4.24Å; V241-V282 HydrophobicContact CB-CG1 4.12Å; V241-V282 HydrophobicContact CB-CG2 3.96Å; V241-V282 HydrophobicContact CG1-CB 3.83Å; V241-V282 HydrophobicContact CG1-CG1 3.87Å; V241-V282 HydrophobicContact CG1-CG2 4.03Å; V241-V282 HydrophobicContact CG2-CG2 4.16Å
242	L	85.9	Confident	78	Confident	37 Å²	37	52.7 Å²	52.7	19%	0.194	27%	0.272	C	S	.	.	H	α-helix	trans	-65.1	-41.6	177.6	-74.7	171.2	0	0	0	112	S238 D239 Q240 L244 L245 K246 V282	S238-L242 WeakPolarHBondContact O-CG 3.27Å; S238-L242 PolarHBondContact O-N 3.17Å; D239-L242 PolarHBondContact O-N 3.18Å; Q240-L242 PolarHBondContact O-N 3.04Å; L242-L244 VanDerWaalsContact C-N 3.3Å; L242-L244 PolarHBondContact O-N 3.45Å; L242-L245 PolarHBondContact O-N 2.91Å; L242-K246 WeakPolarHBondContact O-CB 3.4Å; L242-K246 VanDerWaalsContact O-CG 3.27Å; L242-K246 WeakPolarHBondContact O-CG 3.44Å; L242-K246 PolarHBondContact O-N 3.32Å; L242-V282 HydrophobicContact CD1-CG1 4.46Å; L242-V282 HydrophobicContact CD2-CG1 3.69Å; L242-V282 HydrophobicContact CG-CG1 3.66Å
243	R	84.5	Confident	76	Confident	83 Å²	83	55.1 Å²	55.1	31%	0.313	28%	0.284	S	S	.	.	H	α-helix	trans	-63.4	-36.3	175.1	-71.7	-178.3	-162	-170.1	4.3	112.3	D239 Q240 L245 H689 L692	D239-R243 WeakPolarHBondContact O-CG 3.49Å; D239-R243 PolarHBondContact O-N 3.42Å; D239-R243 IonicContact OD1-NE 3.07Å; D239-R243 IonicContact OD2-CZ 3.09Å; D239-R243 IonicContact OD2-NE 3.98Å; D239-R243 PolarHBondContact OD2-NE 3.43Å; D239-R243 IonicContact OD2-NH2 3.33Å; D239-R243 PolarHBondContact OD2-NH2 3.18Å; Q240-R243 PolarHBondContact O-N 3.33Å; R243-L245 VanDerWaalsContact C-N 3.35Å; R243-H689 PolarHBondContact O-ND1 2.89Å; R243-H689 VanDerWaalsContact O-ND1 3.12Å; R243-L692 HydrophobicContact CB-CD2 3.98Å
244	L	86.5	Confident	73.8	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-46.2	172.3	-173.3	68.2	0	0	0	110.5	V193 F231 Q240 V241 L242 L261 F273 I693	V193-L244 HydrophobicContact CG2-CD1 4.14Å; F231-L244 HydrophobicContact CB-CD2 4.29Å; Q240-L244 PolarHBondContact O-N 2.98Å; V241-L244 WeakPolarHBondContact O-CB 3.42Å; V241-L244 PolarHBondContact O-N 2.98Å; L242-L244 VanDerWaalsContact C-N 3.3Å; L242-L244 PolarHBondContact O-N 3.45Å; L244-L261 HydrophobicContact CG-CD2 4.23Å; L244-L261 WeakPolarHBondContact O-CD2 3.32Å; L244-F273 HydrophobicContact CD2-CE2 4.13Å; L244-F273 HydrophobicContact CD2-CZ 4.19Å; L244-I693 HydrophobicContact CD1-CD1 3.78Å
245	L	84.1	Confident	71.8	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-76.9	-20	-175.7	-66.8	171.9	0	0	0	115.4	V241 L242 R243 L259 L261 F262 F273 L283	V241-L245 HydrophobicContact CG1-CD1 4.11Å; V241-L245 WeakPolarHBondContact O-CG 3.49Å; V241-L245 PolarHBondContact O-N 3.36Å; V241-L245 VanDerWaalsContact O-N 3.07Å; L242-L245 PolarHBondContact O-N 2.91Å; R243-L245 VanDerWaalsContact C-N 3.35Å; L245-L259 HydrophobicContact CB-CD2 3.93Å; L245-L261 WeakPolarHBondContact O-CB 3.49Å; L245-L261 PolarHBondContact O-N 2.88Å; L245-F262 HydrophobicContact CD2-CB 4.36Å; L245-F273 HydrophobicContact CD2-CE1 3.87Å; L245-F273 HydrophobicContact CD2-CZ 4.06Å; L245-L283 HydrophobicContact CD1-CD2 3.81Å; L245-L283 HydrophobicContact CD1-CG 4.12Å
246	K	75.6	Confident	69.9	Low	99 Å²	99	60.1 Å²	60.1	43%	0.43	30%	0.304	S	S	.	.	H	α-helix	trans	-81.6	-19.7	-173.4	-86.5	-179.9	173	-168.2	0	115.1	L242 L259 P260	L242-K246 WeakPolarHBondContact O-CB 3.4Å; L242-K246 VanDerWaalsContact O-CG 3.27Å; L242-K246 WeakPolarHBondContact O-CG 3.44Å; L242-K246 PolarHBondContact O-N 3.32Å; K246-L259 HydrophobicContact CG-CD2 4Å; K246-P260 WeakPolarHBondContact O-CD 3.38Å; K246-P260 VanDerWaalsContact O-CG 3.25Å; K246-P260 WeakPolarHBondContact O-CG 3.5Å
247	R	66.4	Low	68.4	Low	32 Å²	32	54 Å²	54	12%	0.121	28%	0.276	C	S	.	.			trans	-73.8	136.5	-169	-169.8	160.9	175.5	143	-6.3	113.4	E191 P260 T686 H689 E690	E191-R247 WeakPolarHBondContact OE1-CD 3.28Å; E191-R247 IonicContact OE1-CZ 3.82Å; E191-R247 IonicContact OE1-NE 3.66Å; E191-R247 PolarHBondContact OE1-NE 3.18Å; E191-R247 IonicContact OE1-NH2 2.86Å; R247-P260 WeakPolarHBondContact O-CG 3.46Å; R247-T686 PolarHBondContact NH1-O 3.08Å; R247-H689 WeakPolarHBondContact CD-CD2 3.26Å; R247-H689 VanDerWaalsContact CD-CG 3.49Å; R247-H689 WeakPolarHBondContact CD-NE2 3.46Å; R247-H689 PolarHBondContact NH1-CD2 3Å; R247-E690 IonicContact NH1-OE1 3.62Å; R247-E690 IonicContact NH2-OE1 3.73Å; R247-E690 PolarHBondContact NH2-OE1 2.78Å
248	T	57.4	Low	67	Low	29 Å²	29	53.3 Å²	53.3	18%	0.178	27%	0.274	C	S	.	.			trans	-93.5	-19.1	-158	33.6	0	0	0	0	116.7	G250 E254 P260 E681	T248-G250 PolarHBondContact O-N 2.9Å; T248-E254 VanDerWaalsContact O-CG 3.26Å; T248-E254 WeakPolarHBondContact O-CG 3.49Å; T248-P260 HydrophobicContact CG2-CG 3.88Å; T248-E681 PolarHBondContact OG1-OE1 3.29Å
249	Q	53.8	Low	66.3	Low	79 Å²	79	50.9 Å²	50.9	37%	0.369	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	130.8	-168.8	-56.7	-173.2	-11.7	0	0	112.1	E191 E681	E191-Q249 WeakPolarHBondContact OE1-CB 3.11Å; Q249-E681 PolarHBondContact NE2-OE1 2.98Å
250	G	48.7	Very low	65.8	Low	49 Å²	49	48 Å²	48	51%	0.505	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.9	-7.7	173.2	0	0	0	0	0	116.3	T248	T248-G250 PolarHBondContact O-N 2.9Å
251	S	49	Very low	65.4	Low	9 Å²	9	47.2 Å²	47.2	6%	0.063	24%	0.239	C	C	.	.			trans	-89	124.7	172.3	85.8	0	0	0	0	110.2	M253 E254	S251-M253 PolarHBondContact O-N 2.92Å; S251-E254 WeakPolarHBondContact O-CB 3.13Å; S251-E254 WeakPolarHBondContact O-CG 3.38Å; S251-E254 PolarHBondContact O-N 3.07Å; S251-E254 WeakPolarHBondContact OG-CA 3.15Å; S251-E254 PolarHBondContact OG-N 2.65Å
252	K	48.9	Very low	65.3	Low	211 Å²	211	47.2 Å²	47.2	92%	0.917	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-7.7	173	-65	-176.6	-179.5	-178.4	0	113.6
253	M	50	Low	65.2	Low	51 Å²	51	45.8 Å²	45.8	25%	0.251	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	34.3	-179.9	-61.9	-74.4	158.3	0	0	110.7	S251 H255 R395	S251-M253 PolarHBondContact O-N 2.92Å; M253-H255 PolarHBondContact O-N 3.09Å; M253-R395 WeakPolarHBondContact CE-O 3.2Å; M253-R395 HydrophobicContact SD-CG 4.49Å
254	E	44.2	Very low	65.2	Low	81 Å²	81	42.7 Å²	42.7	38%	0.379	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-9.9	-175.5	-102.9	155.8	-151.5	0	0	116.3	T248 S251	T248-E254 VanDerWaalsContact O-CG 3.26Å; T248-E254 WeakPolarHBondContact O-CG 3.49Å; S251-E254 WeakPolarHBondContact O-CB 3.13Å; S251-E254 WeakPolarHBondContact O-CG 3.38Å; S251-E254 PolarHBondContact O-N 3.07Å; S251-E254 WeakPolarHBondContact OG-CA 3.15Å; S251-E254 PolarHBondContact OG-N 2.65Å
255	H	48.2	Very low	65.4	Low	95 Å²	95	42.6 Å²	42.6	44%	0.44	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.1	12.1	-157.8	-61.8	-34.4	0	0	0	115.4	M253 Y676 L678	M253-H255 PolarHBondContact O-N 3.09Å; H255-Y676 WeakPolarHBondContact O-CD1 3.42Å; H255-Y676 WeakPolarHBondContact O-CE1 3.48Å; H255-L678 HydrophobicContact CB-CD2 3.39Å; H255-L678 WeakPolarHBondContact ND1-CD2 3.4Å
256	V	50.5	Low	65.5	Low	32 Å²	32	43.4 Å²	43.4	19%	0.194	23%	0.225	C	C	.	.	S	Bend	trans	-132.1	-6.6	-174.4	-166.1	0	0	0	0	114.1	Y676	V256-Y676 VanDerWaalsContact CA-CZ 3.5Å; V256-Y676 WeakPolarHBondContact CA-OH 3.46Å; V256-Y676 PolarHBondContact O-OH 3.39Å
257	I	56	Low	65.9	Low	17 Å²	17	42.8 Å²	42.8	9%	0.087	22%	0.224	C	C	.	.			trans	-131.5	134.9	-164.8	-54.4	178.8	0	0	0	111.7	L259 E263 N633 Y676	I257-L259 PolarHBondContact O-N 3.29Å; I257-E263 HydrophobicContact CD1-CG 4.39Å; I257-E263 WeakPolarHBondContact CD1-OE1 3.27Å; I257-E263 WeakPolarHBondContact CD1-OE2 3.12Å; I257-N633 WeakPolarHBondContact CD1-OD1 3.43Å; I257-N633 WeakPolarHBondContact CG1-OD1 3.5Å; I257-Y676 PolarHBondContact N-OH 3.44Å
258	S	61.2	Low	66.8	Low	58 Å²	58	42.3 Å²	42.3	41%	0.406	22%	0.224	S	C	.	.	S	Bend	trans	-65.4	-17.1	-177.8	60	0	0	0	0	114.9
259	L	75.4	Confident	68.2	Low	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.234	C	C	.	.			trans	-145.6	77.2	-173.8	-64.3	170.4	0	0	0	109.5	L245 K246 I257 F262 E263 L283	L245-L259 HydrophobicContact CB-CD2 3.93Å; K246-L259 HydrophobicContact CG-CD2 4Å; I257-L259 PolarHBondContact O-N 3.29Å; L259-F262 HydrophobicContact CB-CB 3.75Å; L259-F262 WeakPolarHBondContact O-CB 3.35Å; L259-F262 PolarHBondContact O-N 3.47Å; L259-E263 PolarHBondContact O-N 3.4Å; L259-L283 HydrophobicContact CD1-CD2 4.2Å
260	P	75.6	Confident	70	Confident	9 Å²	9	41.1 Å²	41.1	6%	0.058	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-43.3	-177.3	20.9	-34.6	0	0	0	113.9	K246 R247 T248 F262 E263 L264	K246-P260 WeakPolarHBondContact O-CD 3.38Å; K246-P260 VanDerWaalsContact O-CG 3.25Å; K246-P260 WeakPolarHBondContact O-CG 3.5Å; R247-P260 WeakPolarHBondContact O-CG 3.46Å; T248-P260 HydrophobicContact CG2-CG 3.88Å; P260-F262 VanDerWaalsContact C-N 3.27Å; P260-F262 PolarHBondContact O-N 3.42Å; P260-E263 WeakPolarHBondContact O-CB 3.43Å; P260-E263 PolarHBondContact O-N 3.04Å; P260-E263 VanDerWaalsContact O-N 3.1Å; P260-L264 PolarHBondContact O-N 3.24Å
261	L	83.2	Confident	72.1	Confident	15 Å²	15	41.9 Å²	41.9	8%	0.079	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-33	178.6	-173.4	68	0	0	0	112	V193 F197 L244 L245 E263 L264 A265 F273	V193-L261 HydrophobicContact CG1-CD1 4.18Å; V193-L261 HydrophobicContact CG1-CD2 3.99Å; F197-L261 HydrophobicContact CD2-CD1 4.01Å; F197-L261 HydrophobicContact CE2-CD1 3.64Å; F197-L261 HydrophobicContact CE2-CG 4.15Å; L244-L261 HydrophobicContact CG-CD2 4.23Å; L244-L261 WeakPolarHBondContact O-CD2 3.32Å; L245-L261 WeakPolarHBondContact O-CB 3.49Å; L245-L261 PolarHBondContact O-N 2.88Å; L261-E263 VanDerWaalsContact C-N 3.31Å; L261-E263 PolarHBondContact O-N 3.33Å; L261-L264 HydrophobicContact CD1-CD2 4.34Å; L261-L264 PolarHBondContact O-N 3.23Å; L261-A265 WeakPolarHBondContact O-CB 3.25Å; L261-A265 PolarHBondContact O-N 2.88Å; L261-F273 HydrophobicContact CD2-CZ 4.27Å
262	F	87.4	Confident	74.2	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-40.3	173.9	174.7	-119.4	0	0	0	111.3	L245 L259 P260 A265 V266 L274 L283 C625 I629 F632	L245-F262 HydrophobicContact CD2-CB 4.36Å; L259-F262 HydrophobicContact CB-CB 3.75Å; L259-F262 WeakPolarHBondContact O-CB 3.35Å; L259-F262 PolarHBondContact O-N 3.47Å; P260-F262 VanDerWaalsContact C-N 3.27Å; P260-F262 PolarHBondContact O-N 3.42Å; F262-A265 PolarHBondContact O-N 2.68Å; F262-V266 HydrophobicContact CD2-CG2 4.49Å; F262-V266 HydrophobicContact CE2-CG2 4.09Å; F262-V266 HydrophobicContact CZ-CG2 4.22Å; F262-V266 WeakPolarHBondContact O-CG2 3.46Å; F262-V266 PolarHBondContact O-N 3.35Å; F262-V266 VanDerWaalsContact O-N 3.11Å; F262-L274 HydrophobicContact CD2-CD2 3.54Å; F262-L274 HydrophobicContact CE2-CD1 4.28Å; F262-L274 HydrophobicContact CE2-CD2 3.75Å; F262-L283 HydrophobicContact CD1-CD2 4.49Å; F262-L283 HydrophobicContact CD2-CD1 3.8Å; F262-L283 HydrophobicContact CD2-CD2 3.79Å; F262-L283 HydrophobicContact CD2-CG 4.48Å; F262-L283 HydrophobicContact CE2-CD1 3.62Å; F262-L283 HydrophobicContact CE2-CD2 4Å; F262-L283 HydrophobicContact CE2-CG 4.46Å; F262-L283 HydrophobicContact CG-CD2 4.07Å; F262-L283 HydrophobicContact CZ-CD2 4.42Å; F262-C625 HydrophobicContact CE2-CB 3.75Å; F262-C625 HydrophobicContact CZ-CB 3.82Å; F262-I629 HydrophobicContact CD1-CB 4.45Å; F262-I629 HydrophobicContact CD1-CD1 4.17Å; F262-I629 HydrophobicContact CD1-CG1 4.31Å; F262-I629 HydrophobicContact CE1-CB 3.7Å; F262-I629 HydrophobicContact CE1-CD1 4.19Å; F262-I629 HydrophobicContact CE1-CG1 4.05Å; F262-I629 HydrophobicContact CZ-CB 4.34Å; F262-F632 HydrophobicContact CD1-CD2 4.4Å; F262-F632 AromaticContact CE1-CD2 3.86Å; F262-F632 HydrophobicContact CE1-CD2 3.86Å; F262-F632 HydrophobicContact CE1-CE2 4.02Å
263	E	83.2	Confident	76.4	Confident	7 Å²	7	34.8 Å²	34.8	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-47.5	173.5	-175.9	178.2	-150.5	0	0	112.1	I257 L259 P260 L261 A265 V266 Q267 I629	I257-E263 HydrophobicContact CD1-CG 4.39Å; I257-E263 WeakPolarHBondContact CD1-OE1 3.27Å; I257-E263 WeakPolarHBondContact CD1-OE2 3.12Å; L259-E263 PolarHBondContact O-N 3.4Å; P260-E263 WeakPolarHBondContact O-CB 3.43Å; P260-E263 PolarHBondContact O-N 3.04Å; P260-E263 VanDerWaalsContact O-N 3.1Å; L261-E263 VanDerWaalsContact C-N 3.31Å; L261-E263 PolarHBondContact O-N 3.33Å; E263-A265 VanDerWaalsContact C-N 3.26Å; E263-A265 PolarHBondContact O-N 2.99Å; E263-V266 PolarHBondContact O-N 3.2Å; E263-Q267 VanDerWaalsContact CD-NE2 3.28Å; E263-Q267 HydrophobicContact CG-CG 4.12Å; E263-Q267 WeakPolarHBondContact O-CG 3.3Å; E263-Q267 PolarHBondContact O-N 3.39Å; E263-Q267 PolarHBondContact OE1-NE2 2.97Å; E263-Q267 VanDerWaalsContact OE1-NE2 3.08Å; E263-I629 VanDerWaalsContact CA-CD1 3.41Å; E263-I629 HydrophobicContact CB-CD1 3.64Å; E263-I629 HydrophobicContact CG-CD1 3.73Å
264	L	84.3	Confident	78.4	Confident	19 Å²	19	32.4 Å²	32.4	10%	0.099	16%	0.161	C	C	.	.	H	α-helix	trans	-58.3	-41.6	178.5	-175.4	62.3	0	0	0	111.2	S194 F197 P260 L261 V266 Q267 T268	S194-L264 WeakPolarHBondContact OG-CD2 3.34Å; F197-L264 HydrophobicContact CB-CD2 4.46Å; F197-L264 HydrophobicContact CB-CG 4.47Å; F197-L264 HydrophobicContact CD2-CD2 3.98Å; F197-L264 HydrophobicContact CD2-CG 3.96Å; P260-L264 PolarHBondContact O-N 3.24Å; L261-L264 HydrophobicContact CD1-CD2 4.34Å; L261-L264 PolarHBondContact O-N 3.23Å; L264-V266 VanDerWaalsContact C-N 3.34Å; L264-V266 PolarHBondContact O-N 3.13Å; L264-Q267 PolarHBondContact O-N 3.11Å; L264-T268 HydrophobicContact CD1-CG2 4.04Å; L264-T268 HydrophobicContact CG-CG2 4.47Å; L264-T268 WeakPolarHBondContact O-CB 3.39Å; L264-T268 WeakPolarHBondContact O-CG2 3.38Å; L264-T268 PolarHBondContact O-N 2.65Å; L264-T268 PolarHBondContact O-OG1 2.64Å
265	A	89.6	Confident	80.7	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63	-37.2	175.9	0	0	0	0	0	112.7	F197 L261 F262 E263 E269 Q270 F273 L274	F197-A265 HydrophobicContact CE2-CB 3.75Å; F197-A265 HydrophobicContact CZ-CB 3.91Å; L261-A265 WeakPolarHBondContact O-CB 3.25Å; L261-A265 PolarHBondContact O-N 2.88Å; F262-A265 PolarHBondContact O-N 2.68Å; E263-A265 VanDerWaalsContact C-N 3.26Å; E263-A265 PolarHBondContact O-N 2.99Å; A265-E269 PolarHBondContact O-N 3.14Å; A265-Q270 HydrophobicContact CB-CB 4.2Å; A265-Q270 WeakPolarHBondContact O-CB 3.44Å; A265-Q270 PolarHBondContact O-N 2.93Å; A265-F273 HydrophobicContact CB-CD1 4.02Å; A265-F273 HydrophobicContact CB-CE1 4.25Å; A265-L274 HydrophobicContact CB-CD1 4.09Å; A265-L274 HydrophobicContact CB-CD2 3.94Å; A265-L274 HydrophobicContact CB-CG 4.06Å
266	V	87.7	Confident	82.9	Confident	17 Å²	17	27 Å²	27	10%	0.103	14%	0.137	C	C	.	.	H	α-helix	trans	-70.8	-42.6	174.9	173	0	0	0	0	111.1	F262 E263 L264 E269 L274 K626 I629	F262-V266 HydrophobicContact CD2-CG2 4.49Å; F262-V266 HydrophobicContact CE2-CG2 4.09Å; F262-V266 HydrophobicContact CZ-CG2 4.22Å; F262-V266 WeakPolarHBondContact O-CG2 3.46Å; F262-V266 PolarHBondContact O-N 3.35Å; F262-V266 VanDerWaalsContact O-N 3.11Å; E263-V266 PolarHBondContact O-N 3.2Å; L264-V266 VanDerWaalsContact C-N 3.34Å; L264-V266 PolarHBondContact O-N 3.13Å; V266-E269 PolarHBondContact O-N 3.22Å; V266-L274 HydrophobicContact CG2-CD1 3.66Å; V266-K626 HydrophobicContact CG1-CG 3.78Å; V266-I629 HydrophobicContact CB-CD1 4.24Å; V266-I629 HydrophobicContact CG1-CG2 4.46Å; V266-I629 HydrophobicContact CG2-CD1 4.24Å
267	Q	84	Confident	84.9	Confident	87 Å²	87	33.7 Å²	33.7	41%	0.407	16%	0.159	S	C	.	.	H	α-helix	trans	-66.4	-36.9	179.5	-70.5	-178.7	6.1	0	0	112.6	E263 L264 E269	E263-Q267 VanDerWaalsContact CD-NE2 3.28Å; E263-Q267 HydrophobicContact CG-CG 4.12Å; E263-Q267 WeakPolarHBondContact O-CG 3.3Å; E263-Q267 PolarHBondContact O-N 3.39Å; E263-Q267 PolarHBondContact OE1-NE2 2.97Å; E263-Q267 VanDerWaalsContact OE1-NE2 3.08Å; L264-Q267 PolarHBondContact O-N 3.11Å; Q267-E269 VanDerWaalsContact C-N 3.29Å
268	T	84.1	Confident	86.6	Confident	21 Å²	21	35.5 Å²	35.5	13%	0.129	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	8.2	177.3	57.2	0	0	0	0	113.5	F197 L264 Q270	F197-T268 HydrophobicContact CB-CG2 4.19Å; L264-T268 HydrophobicContact CD1-CG2 4.04Å; L264-T268 HydrophobicContact CG-CG2 4.47Å; L264-T268 WeakPolarHBondContact O-CB 3.39Å; L264-T268 WeakPolarHBondContact O-CG2 3.38Å; L264-T268 PolarHBondContact O-N 2.65Å; L264-T268 PolarHBondContact O-OG1 2.64Å; T268-Q270 PolarHBondContact O-N 2.83Å; T268-Q270 WeakPolarHBondContact OG1-CG 3.47Å
269	E	88.3	Confident	88.1	Confident	84 Å²	84	32.7 Å²	32.7	39%	0.393	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	47.9	177.9	-54.3	-154.9	130.4	0	0	115.2	A265 V266 Q267 K271 F622 K626	A265-E269 PolarHBondContact O-N 3.14Å; V266-E269 PolarHBondContact O-N 3.22Å; Q267-E269 VanDerWaalsContact C-N 3.29Å; E269-K271 VanDerWaalsContact C-N 3.31Å; E269-K271 PolarHBondContact O-N 2.84Å; E269-F622 HydrophobicContact CB-CZ 4.06Å; E269-F622 HydrophobicContact CG-CZ 4.29Å; E269-K626 IonicContact OE1-NZ 3.28Å; E269-K626 PolarHBondContact OE1-NZ 3.32Å
270	Q	91.2	Very high	88.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.153	C	C	.	.			trans	-84.6	71.5	-176.3	-60.5	-69.4	-13.9	0	0	111.4	F197 C200 A265 T268 Y272 F273 L274	F197-Q270 HydrophobicContact CD1-CB 4.34Å; F197-Q270 VanDerWaalsContact CD1-CD 3.41Å; F197-Q270 HydrophobicContact CD1-CG 3.41Å; F197-Q270 VanDerWaalsContact CD1-CG 3.41Å; F197-Q270 HydrophobicContact CE1-CB 3.85Å; F197-Q270 HydrophobicContact CE1-CG 3.42Å; F197-Q270 VanDerWaalsContact CE1-CG 3.42Å; F197-Q270 HydrophobicContact CG-CG 4Å; F197-Q270 HydrophobicContact CZ-CB 4.23Å; F197-Q270 HydrophobicContact CZ-CG 4.05Å; C200-Q270 VanDerWaalsContact CB-NE2 3.34Å; C200-Q270 PolarHBondContact SG-NE2 3.01Å; C200-Q270 VanDerWaalsContact SG-NE2 3.41Å; A265-Q270 HydrophobicContact CB-CB 4.2Å; A265-Q270 WeakPolarHBondContact O-CB 3.44Å; A265-Q270 PolarHBondContact O-N 2.93Å; T268-Q270 PolarHBondContact O-N 2.83Å; T268-Q270 WeakPolarHBondContact OG1-CG 3.47Å; Q270-Y272 PolarHBondContact O-N 3.44Å; Q270-F273 HydrophobicContact CB-CB 4.24Å; Q270-F273 PolarHBondContact O-N 3.4Å; Q270-L274 PolarHBondContact O-N 3.42Å
271	K	92.5	Very high	89.7	Confident	64 Å²	64	37.2 Å²	37.2	28%	0.278	17%	0.171	S	C	.	.	H	α-helix	trans	-58.7	-48.1	-172.9	-60.2	-177	174.5	-170.6	0	113.5	E269 L274 A275 T618 D619 F622	E269-K271 VanDerWaalsContact C-N 3.31Å; E269-K271 PolarHBondContact O-N 2.84Å; K271-L274 PolarHBondContact O-N 2.96Å; K271-A275 WeakPolarHBondContact O-CB 3.13Å; K271-A275 PolarHBondContact O-N 3.06Å; K271-T618 HydrophobicContact CB-CG2 3.96Å; K271-D619 WeakPolarHBondContact CD-OD1 3.5Å; K271-D619 WeakPolarHBondContact CE-OD1 3.41Å; K271-D619 IonicContact NZ-OD1 2.64Å; K271-D619 PolarHBondContact NZ-OD1 3.47Å; K271-D619 IonicContact NZ-OD2 3.46Å; K271-F622 HydrophobicContact CB-CB 4.48Å; K271-F622 HydrophobicContact CB-CD2 4.43Å; K271-F622 HydrophobicContact CB-CG 4.36Å; K271-F622 HydrophobicContact CD-CD1 4.46Å; K271-F622 HydrophobicContact CG-CB 4.36Å; K271-F622 HydrophobicContact CG-CD1 3.89Å; K271-F622 HydrophobicContact CG-CD2 4.08Å; K271-F622 HydrophobicContact CG-CE1 4.1Å; K271-F622 HydrophobicContact CG-CE2 4.31Å; K271-F622 HydrophobicContact CG-CG 3.86Å; K271-F622 HydrophobicContact CG-CZ 4.32Å
272	Y	93.4	Very high	90	Very high	71 Å²	71	37.1 Å²	37.1	28%	0.278	17%	0.171	S	C	.	.	H	α-helix	trans	-65.4	-42.8	-176.7	-61.7	-77	0	0	0	112.3	K225 K226 Q270 L274 A275 E276 T618	K225-Y272 HydrophobicContact CB-CD2 3.86Å; K225-Y272 HydrophobicContact CB-CE2 4.37Å; K226-Y272 HydrophobicContact CG-CD2 4.32Å; K226-Y272 HydrophobicContact CG-CE1 4.49Å; K226-Y272 HydrophobicContact CG-CE2 4.27Å; K226-Y272 HydrophobicContact CG-CG 4.43Å; Q270-Y272 PolarHBondContact O-N 3.44Å; Y272-L274 PolarHBondContact O-N 3.18Å; Y272-A275 PolarHBondContact O-N 3.32Å; Y272-E276 PolarHBondContact O-N 3Å; Y272-T618 HydrophobicContact CD1-CG2 4.29Å
273	F	93.9	Very high	90.2	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-59	-46.1	177.8	176.6	-96.1	0	0	0	112.4	V193 F197 V228 P232 L244 L245 L261 A265 Q270 E276 C279	V193-F273 HydrophobicContact CG1-CE2 4.08Å; V193-F273 HydrophobicContact CG1-CZ 4.36Å; F197-F273 HydrophobicContact CE1-CG 4.42Å; F197-F273 AromaticContact CZ-CD1 3.89Å; F197-F273 HydrophobicContact CZ-CD1 3.89Å; F197-F273 HydrophobicContact CZ-CD2 4.25Å; F197-F273 HydrophobicContact CZ-CE1 4.11Å; F197-F273 HydrophobicContact CZ-CE2 4.43Å; F197-F273 AromaticContact CZ-CG 3.97Å; F197-F273 HydrophobicContact CZ-CG 3.97Å; F197-F273 HydrophobicContact CZ-CZ 4.38Å; V228-F273 HydrophobicContact CG1-CD2 3.91Å; V228-F273 HydrophobicContact CG1-CE2 4.42Å; P232-F273 HydrophobicContact CG-CD2 3.7Å; P232-F273 HydrophobicContact CG-CE2 3.75Å; L244-F273 HydrophobicContact CD2-CE2 4.13Å; L244-F273 HydrophobicContact CD2-CZ 4.19Å; L245-F273 HydrophobicContact CD2-CE1 3.87Å; L245-F273 HydrophobicContact CD2-CZ 4.06Å; L261-F273 HydrophobicContact CD2-CZ 4.27Å; A265-F273 HydrophobicContact CB-CD1 4.02Å; A265-F273 HydrophobicContact CB-CE1 4.25Å; Q270-F273 HydrophobicContact CB-CB 4.24Å; Q270-F273 PolarHBondContact O-N 3.4Å; F273-E276 WeakPolarHBondContact O-CB 3.38Å; F273-C279 WeakPolarHBondContact O-CB 3.47Å
274	L	92.9	Very high	90.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-77.3	-28.6	-179.5	-65.4	179.2	0	0	0	113.3	F262 A265 V266 Q270 K271 Y272 E276 L283 F622 C625	F262-L274 HydrophobicContact CD2-CD2 3.54Å; F262-L274 HydrophobicContact CE2-CD1 4.28Å; F262-L274 HydrophobicContact CE2-CD2 3.75Å; A265-L274 HydrophobicContact CB-CD1 4.09Å; A265-L274 HydrophobicContact CB-CD2 3.94Å; A265-L274 HydrophobicContact CB-CG 4.06Å; V266-L274 HydrophobicContact CG2-CD1 3.66Å; Q270-L274 PolarHBondContact O-N 3.42Å; K271-L274 PolarHBondContact O-N 2.96Å; Y272-L274 PolarHBondContact O-N 3.18Å; L274-E276 VanDerWaalsContact C-N 3.32Å; L274-L283 HydrophobicContact CD2-CD1 4.1Å; L274-F622 HydrophobicContact CD1-CD2 3.87Å; L274-F622 HydrophobicContact CD1-CE2 3.96Å; L274-C625 HydrophobicContact CD1-CB 4.17Å
275	A	92.2	Very high	90.8	Very high	6 Å²	6	44.3 Å²	44.3	5%	0.05	20%	0.202	C	C	.	.	H	α-helix	trans	-79.3	-15.5	176.6	0	0	0	0	0	113.3	K271 Y272 T618 R621	K271-A275 WeakPolarHBondContact O-CB 3.13Å; K271-A275 PolarHBondContact O-N 3.06Å; Y272-A275 PolarHBondContact O-N 3.32Å; A275-T618 HydrophobicContact CB-CG2 3.7Å; A275-R621 HydrophobicContact CB-CB 4.14Å; A275-R621 WeakPolarHBondContact O-CD 3.25Å; A275-R621 PolarHBondContact O-NH1 3.03Å
276	E	93.7	Very high	90.6	Very high	57 Å²	57	47.7 Å²	47.7	27%	0.266	22%	0.217	S	C	.	.	S	Bend	trans	-53.6	138.6	178	-175.4	46.1	-120.5	0	0	110.9	P232 A233 Y272 F273 L274 N278 C279 F280	P232-E276 HydrophobicContact CB-CG 4.29Å; P232-E276 HydrophobicContact CG-CB 4.07Å; P232-E276 HydrophobicContact CG-CG 4Å; A233-E276 HydrophobicContact CB-CG 4.08Å; Y272-E276 PolarHBondContact O-N 3Å; F273-E276 WeakPolarHBondContact O-CB 3.38Å; L274-E276 VanDerWaalsContact C-N 3.32Å; E276-N278 PolarHBondContact O-N 3.05Å; E276-C279 HydrophobicContact CB-CB 4.31Å; E276-C279 PolarHBondContact O-N 3.2Å; E276-F280 VanDerWaalsContact O-CB 3.3Å; E276-F280 WeakPolarHBondContact O-CB 3.42Å; E276-F280 PolarHBondContact O-N 2.81Å
277	R	92.5	Very high	90.6	Very high	173 Å²	173	47.2 Å²	47.2	65%	0.653	21%	0.214	S	C	*	.	H	α-helix	trans	-58.8	-47	-167.9	-178.5	178.4	-177.8	172.1	-0	111.8	I281	R277-I281 HydrophobicContact CG-CD1 3.74Å; R277-I281 WeakPolarHBondContact O-CB 3.28Å; R277-I281 WeakPolarHBondContact O-CD1 3.44Å; R277-I281 WeakPolarHBondContact O-CG1 3.39Å; R277-I281 PolarHBondContact O-N 2.63Å
278	N	92.7	Very high	90.7	Very high	54 Å²	54	44.9 Å²	44.9	29%	0.289	20%	0.203	S	C	.	.	H	α-helix	trans	-67.5	-44.6	-177.7	-67.6	-12.8	0	0	0	111.3	P232 A233 C235 V241 E276 V282	P232-N278 VanDerWaalsContact O-CB 3.28Å; P232-N278 WeakPolarHBondContact O-CB 3.29Å; P232-N278 PolarHBondContact O-ND2 3.43Å; A233-N278 PolarHBondContact O-ND2 3.41Å; C235-N278 PolarHBondContact O-ND2 2.97Å; V241-N278 HydrophobicContact CG2-CB 4.49Å; E276-N278 PolarHBondContact O-N 3.05Å; N278-V282 WeakPolarHBondContact O-CB 3.36Å; N278-V282 VanDerWaalsContact O-CG2 3.25Å; N278-V282 WeakPolarHBondContact O-CG2 3.44Å; N278-V282 PolarHBondContact O-N 2.87Å
279	C	92	Very high	90.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-50.9	176.2	-169.6	0	0	0	0	111	P232 F273 E276 I281 V282 L283	P232-C279 HydrophobicContact CB-CB 3.86Å; P232-C279 HydrophobicContact CG-CB 4.34Å; F273-C279 WeakPolarHBondContact O-CB 3.47Å; E276-C279 HydrophobicContact CB-CB 4.31Å; E276-C279 PolarHBondContact O-N 3.2Å; C279-I281 PolarHBondContact O-N 2.97Å; C279-V282 PolarHBondContact O-N 3.27Å; C279-L283 WeakPolarHBondContact O-CB 3.3Å; C279-L283 WeakPolarHBondContact O-CG 3.49Å; C279-L283 PolarHBondContact O-N 3.43Å
280	F	92.7	Very high	90.2	Very high	22 Å²	22	46.2 Å²	46.2	10%	0.096	22%	0.223	C	C	.	.	H	α-helix	trans	-63.7	-42.3	-176.1	-170.8	-96.9	0	0	0	112.7	E276 V282 L283 Q284 R621 C624 W628	E276-F280 VanDerWaalsContact O-CB 3.3Å; E276-F280 WeakPolarHBondContact O-CB 3.42Å; E276-F280 PolarHBondContact O-N 2.81Å; F280-V282 VanDerWaalsContact C-N 3.34Å; F280-V282 PolarHBondContact O-N 3.5Å; F280-L283 PolarHBondContact O-N 3.23Å; F280-Q284 VanDerWaalsContact O-CB 3.23Å; F280-Q284 WeakPolarHBondContact O-CB 3.46Å; F280-Q284 PolarHBondContact O-N 3.28Å; F280-R621 HydrophobicContact CD1-CG 4.32Å; F280-R621 HydrophobicContact CD2-CB 3.71Å; F280-R621 HydrophobicContact CD2-CG 3.77Å; F280-R621 HydrophobicContact CE1-CG 4.15Å; F280-R621 HydrophobicContact CE2-CB 3.57Å; F280-R621 HydrophobicContact CE2-CG 3.58Å; F280-R621 HydrophobicContact CG-CB 4.49Å; F280-R621 HydrophobicContact CG-CG 4.13Å; F280-R621 HydrophobicContact CZ-CB 4.25Å; F280-R621 HydrophobicContact CZ-CG 3.78Å; F280-C624 HydrophobicContact CE2-CB 4.23Å; F280-C624 HydrophobicContact CZ-CB 4.44Å; F280-W628 HydrophobicContact CD2-CH2 4.35Å; F280-W628 HydrophobicContact CD2-CZ3 4.25Å; F280-W628 HydrophobicContact CE1-CH2 4.13Å; F280-W628 AromaticContact CE2-CH2 3.58Å; F280-W628 HydrophobicContact CE2-CH2 3.58Å; F280-W628 AromaticContact CE2-CZ3 3.81Å; F280-W628 HydrophobicContact CE2-CZ3 3.81Å; F280-W628 AromaticContact CZ-CH2 3.46Å; F280-W628 HydrophobicContact CZ-CH2 3.46Å; F280-W628 VanDerWaalsContact CZ-CH2 3.46Å; F280-W628 HydrophobicContact CZ-CZ2 4.21Å; F280-W628 HydrophobicContact CZ-CZ3 4.16Å
281	I	91.4	Very high	89.7	Confident	83 Å²	83	47.1 Å²	47.1	43%	0.426	23%	0.226	S	C	.	.	H	α-helix	trans	-63.2	-42.2	177.2	-70.4	168.3	0	0	0	110.8	R277 C279 Q284 K285	R277-I281 HydrophobicContact CG-CD1 3.74Å; R277-I281 WeakPolarHBondContact O-CB 3.28Å; R277-I281 WeakPolarHBondContact O-CD1 3.44Å; R277-I281 WeakPolarHBondContact O-CG1 3.39Å; R277-I281 PolarHBondContact O-N 2.63Å; C279-I281 PolarHBondContact O-N 2.97Å; I281-Q284 PolarHBondContact O-N 3.25Å; I281-K285 WeakPolarHBondContact O-CB 3.44Å; I281-K285 PolarHBondContact O-N 3.41Å
282	V	91.1	Very high	88.9	Confident	12 Å²	12	47.9 Å²	47.9	7%	0.073	24%	0.239	C	C	.	.	H	α-helix	trans	-67.6	-44.2	179.2	172.2	0	0	0	0	110.9	V241 L242 N278 C279 F280 Q284 K285 H286	V241-V282 HydrophobicContact CB-CB 4.24Å; V241-V282 HydrophobicContact CB-CG1 4.12Å; V241-V282 HydrophobicContact CB-CG2 3.96Å; V241-V282 HydrophobicContact CG1-CB 3.83Å; V241-V282 HydrophobicContact CG1-CG1 3.87Å; V241-V282 HydrophobicContact CG1-CG2 4.03Å; V241-V282 HydrophobicContact CG2-CG2 4.16Å; L242-V282 HydrophobicContact CD1-CG1 4.46Å; L242-V282 HydrophobicContact CD2-CG1 3.69Å; L242-V282 HydrophobicContact CG-CG1 3.66Å; N278-V282 WeakPolarHBondContact O-CB 3.36Å; N278-V282 VanDerWaalsContact O-CG2 3.25Å; N278-V282 WeakPolarHBondContact O-CG2 3.44Å; N278-V282 PolarHBondContact O-N 2.87Å; C279-V282 PolarHBondContact O-N 3.27Å; F280-V282 VanDerWaalsContact C-N 3.34Å; F280-V282 PolarHBondContact O-N 3.5Å; V282-Q284 VanDerWaalsContact C-N 3.34Å; V282-Q284 PolarHBondContact O-N 3.16Å; V282-K285 PolarHBondContact O-N 2.87Å; V282-H286 WeakPolarHBondContact O-CB 3.41Å; V282-H286 PolarHBondContact O-N 3.11Å
283	L	91.1	Very high	88.4	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-42.4	173.5	-74.9	171.6	0	0	0	111.6	L245 L259 F262 L274 C279 F280 H286 W287 W628	L245-L283 HydrophobicContact CD1-CD2 3.81Å; L245-L283 HydrophobicContact CD1-CG 4.12Å; L259-L283 HydrophobicContact CD1-CD2 4.2Å; F262-L283 HydrophobicContact CD1-CD2 4.49Å; F262-L283 HydrophobicContact CD2-CD1 3.8Å; F262-L283 HydrophobicContact CD2-CD2 3.79Å; F262-L283 HydrophobicContact CD2-CG 4.48Å; F262-L283 HydrophobicContact CE2-CD1 3.62Å; F262-L283 HydrophobicContact CE2-CD2 4Å; F262-L283 HydrophobicContact CE2-CG 4.46Å; F262-L283 HydrophobicContact CG-CD2 4.07Å; F262-L283 HydrophobicContact CZ-CD2 4.42Å; L274-L283 HydrophobicContact CD2-CD1 4.1Å; C279-L283 WeakPolarHBondContact O-CB 3.3Å; C279-L283 WeakPolarHBondContact O-CG 3.49Å; C279-L283 PolarHBondContact O-N 3.43Å; F280-L283 PolarHBondContact O-N 3.23Å; L283-H286 PolarHBondContact O-N 2.92Å; L283-W287 VanDerWaalsContact O-CB 3.28Å; L283-W287 WeakPolarHBondContact O-CB 3.16Å; L283-W287 PolarHBondContact O-N 2.9Å; L283-W628 HydrophobicContact CB-CE3 4.32Å; L283-W628 HydrophobicContact CB-CZ3 4.01Å
284	Q	90.5	Very high	87.8	Confident	58 Å²	58	50.1 Å²	50.1	27%	0.271	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-41.3	176.4	-173.1	179.7	22.8	0	0	111.7	F280 I281 V282 H286 W287 M288 W628	F280-Q284 VanDerWaalsContact O-CB 3.23Å; F280-Q284 WeakPolarHBondContact O-CB 3.46Å; F280-Q284 PolarHBondContact O-N 3.28Å; I281-Q284 PolarHBondContact O-N 3.25Å; V282-Q284 VanDerWaalsContact C-N 3.34Å; V282-Q284 PolarHBondContact O-N 3.16Å; Q284-H286 VanDerWaalsContact C-N 3.35Å; Q284-W287 WeakPolarHBondContact O-CB 3.37Å; Q284-W287 PolarHBondContact O-N 3.41Å; Q284-M288 WeakPolarHBondContact O-CB 3.46Å; Q284-M288 VanDerWaalsContact O-CG 3.31Å; Q284-M288 WeakPolarHBondContact O-CG 3.26Å; Q284-M288 PolarHBondContact O-N 3.45Å; Q284-W628 HydrophobicContact CB-CH2 3.82Å; Q284-W628 HydrophobicContact CB-CZ3 4.3Å; Q284-W628 HydrophobicContact CG-CH2 4.13Å
285	K	89.2	Confident	87.1	Confident	120 Å²	120	57.1 Å²	57.1	52%	0.522	29%	0.285	S	S	.	.	H	α-helix	trans	-62.9	-43.7	174.9	-175.4	179.5	178.3	-178	0	110.6	I281 V282 M288 G289	I281-K285 WeakPolarHBondContact O-CB 3.44Å; I281-K285 PolarHBondContact O-N 3.41Å; V282-K285 PolarHBondContact O-N 2.87Å; K285-M288 PolarHBondContact O-N 3.31Å; K285-G289 PolarHBondContact O-N 3.49Å
286	H	86.4	Confident	86.8	Confident	70 Å²	70	63.1 Å²	63.1	32%	0.324	32%	0.32	S	S	.	.	H	α-helix	trans	-67	-36.7	177.4	-162.2	-100.3	0	0	0	112.1	V282 L283 Q284 G289 F632	V282-H286 WeakPolarHBondContact O-CB 3.41Å; V282-H286 PolarHBondContact O-N 3.11Å; L283-H286 PolarHBondContact O-N 2.92Å; Q284-H286 VanDerWaalsContact C-N 3.35Å; H286-G289 PolarHBondContact O-N 2.88Å; H286-F632 AromaticContact CE1-CE1 3.84Å; H286-F632 AromaticContact ND1-CE1 3.14Å; H286-F632 WeakPolarHBondContact ND1-CE1 3.36Å; H286-F632 AromaticContact ND1-CZ 3.72Å
287	W	87.8	Confident	86.3	Confident	8 Å²	8	60.8 Å²	60.8	3%	0.03	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-47	173	172.8	-98.7	0	0	0	112.6	L283 Q284 G289 P333 C334 Y337 W628 Y631 F632	L283-W287 VanDerWaalsContact O-CB 3.28Å; L283-W287 WeakPolarHBondContact O-CB 3.16Å; L283-W287 PolarHBondContact O-N 2.9Å; Q284-W287 WeakPolarHBondContact O-CB 3.37Å; Q284-W287 PolarHBondContact O-N 3.41Å; W287-G289 VanDerWaalsContact C-N 3.31Å; W287-P333 HydrophobicContact CD2-CB 4Å; W287-P333 HydrophobicContact CE3-CB 3.32Å; W287-P333 HydrophobicContact CE3-CG 4.37Å; W287-P333 HydrophobicContact CH2-CB 4.2Å; W287-P333 HydrophobicContact CZ3-CB 3.41Å; W287-P333 VanDerWaalsContact CZ3-CB 3.41Å; W287-C334 VanDerWaalsContact O-CB 3.29Å; W287-C334 WeakPolarHBondContact O-CB 3.25Å; W287-C334 PolarHBondContact O-N 2.7Å; W287-C334 VanDerWaalsContact O-N 3.09Å; W287-Y337 HydrophobicContact CZ2-CG 4.04Å; W287-W628 HydrophobicContact CB-CD2 4.36Å; W287-W628 HydrophobicContact CD2-CB 4.18Å; W287-W628 AromaticContact CD2-CD1 3.42Å; W287-W628 VanDerWaalsContact CD2-CD1 3.42Å; W287-W628 HydrophobicContact CD2-CD2 4.14Å; W287-W628 AromaticContact CD2-CG 3.67Å; W287-W628 HydrophobicContact CD2-CG 3.67Å; W287-W628 AromaticContact CD2-NE1 3.76Å; W287-W628 AromaticContact CE2-CD1 3.46Å; W287-W628 VanDerWaalsContact CE2-CD1 3.46Å; W287-W628 AromaticContact CE2-NE1 3.65Å; W287-W628 HydrophobicContact CE3-CB 3.47Å; W287-W628 VanDerWaalsContact CE3-CB 3.47Å; W287-W628 AromaticContact CE3-CD1 3.54Å; W287-W628 HydrophobicContact CE3-CD2 4.3Å; W287-W628 AromaticContact CE3-CG 3.49Å; W287-W628 HydrophobicContact CE3-CG 3.49Å; W287-W628 VanDerWaalsContact CE3-CG 3.49Å; W287-W628 HydrophobicContact CG-CD2 4.16Å; W287-W628 HydrophobicContact CG-CG 4.19Å; W287-W628 AromaticContact CG-NE1 4Å; W287-W628 HydrophobicContact CH2-CB 4.42Å; W287-W628 AromaticContact CH2-CD1 3.74Å; W287-W628 HydrophobicContact CH2-CG 4.36Å; W287-W628 AromaticContact CZ2-CD1 3.63Å; W287-W628 HydrophobicContact CZ3-CB 3.64Å; W287-W628 AromaticContact CZ3-CD1 3.71Å; W287-W628 AromaticContact CZ3-CG 3.88Å; W287-W628 HydrophobicContact CZ3-CG 3.88Å; W287-W628 VanDerWaalsContact CZ3-O 3.29Å; W287-W628 WeakPolarHBondContact CZ3-O 3.3Å; W287-W628 AromaticContact NE1-NE1 3.8Å; W287-Y631 AromaticContact CH2-CD2 3.63Å; W287-Y631 HydrophobicContact CH2-CD2 3.63Å; W287-Y631 AromaticContact CH2-CG 3.83Å; W287-Y631 HydrophobicContact CH2-CG 3.83Å; W287-Y631 HydrophobicContact CZ3-CD2 4.28Å; W287-Y631 HydrophobicContact CZ3-CG 4.35Å; W287-F632 HydrophobicContact CB-CZ 4.28Å; W287-F632 HydrophobicContact CE3-CE2 4.06Å; W287-F632 HydrophobicContact CE3-CZ 4.18Å
288	M	85.3	Confident	86.2	Confident	37 Å²	37	56.1 Å²	56.1	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-70.8	-28.8	177.7	-68.2	-64.5	-175.7	0	0	112.1	Q284 K285 T290 W291 N332 C334	Q284-M288 WeakPolarHBondContact O-CB 3.46Å; Q284-M288 VanDerWaalsContact O-CG 3.31Å; Q284-M288 WeakPolarHBondContact O-CG 3.26Å; Q284-M288 PolarHBondContact O-N 3.45Å; K285-M288 PolarHBondContact O-N 3.31Å; M288-T290 PolarHBondContact O-N 3.33Å; M288-W291 WeakPolarHBondContact O-CB 3.2Å; M288-W291 PolarHBondContact O-N 3.42Å; M288-N332 PolarHBondContact O-ND2 3.3Å; M288-C334 HydrophobicContact SD-CB 4.25Å
289	G	82.7	Confident	85.9	Confident	26 Å²	26	59.4 Å²	59.4	27%	0.268	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	56.2	-124.7	-179.2	0	0	0	0	0	111.4	K285 H286 W287 W291 S292	K285-G289 PolarHBondContact O-N 3.49Å; H286-G289 PolarHBondContact O-N 2.88Å; W287-G289 VanDerWaalsContact C-N 3.31Å; G289-W291 PolarHBondContact O-N 3.42Å; G289-W291 VanDerWaalsContact O-N 3.13Å; G289-S292 PolarHBondContact O-N 3.2Å
290	T	79	Confident	85.9	Confident	108 Å²	108	63.8 Å²	63.8	66%	0.663	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-66.8	-7.1	176.9	63	0	0	0	0	114.5	M288 N332	M288-T290 PolarHBondContact O-N 3.33Å; T290-N332 PolarHBondContact N-ND2 3.49Å; T290-N332 PolarHBondContact N-OD1 2.91Å; T290-N332 PolarHBondContact OG1-ND2 3.36Å
291	W	79.8	Confident	85.6	Confident	18 Å²	18	66.4 Å²	66.4	7%	0.068	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-98.5	29.8	178.3	-61.1	-2.9	0	0	0	113.2	M288 G289 D293 W294 R305 F309 A335 L338	M288-W291 WeakPolarHBondContact O-CB 3.2Å; M288-W291 PolarHBondContact O-N 3.42Å; G289-W291 PolarHBondContact O-N 3.42Å; G289-W291 VanDerWaalsContact O-N 3.13Å; W291-D293 PolarHBondContact O-N 3.45Å; W291-D293 VanDerWaalsContact O-N 3.1Å; W291-W294 AromaticContact CE3-CE3 3.98Å; W291-W294 HydrophobicContact CE3-CE3 3.98Å; W291-W294 AromaticContact CE3-CZ3 3.92Å; W291-W294 HydrophobicContact CE3-CZ3 3.92Å; W291-W294 HydrophobicContact CZ3-CZ3 4.08Å; W291-W294 VanDerWaalsContact O-CB 3.26Å; W291-W294 WeakPolarHBondContact O-CB 3.45Å; W291-W294 PolarHBondContact O-N 3Å; W291-R305 HydrophobicContact CH2-CB 4.48Å; W291-R305 HydrophobicContact CZ2-CB 4.41Å; W291-F309 AromaticContact CH2-CD2 3.91Å; W291-F309 HydrophobicContact CH2-CD2 3.91Å; W291-F309 HydrophobicContact CH2-CE2 4.11Å; W291-F309 HydrophobicContact CH2-CG 4.47Å; W291-F309 AromaticContact CZ2-CD2 3.7Å; W291-F309 HydrophobicContact CZ2-CD2 3.7Å; W291-F309 AromaticContact CZ2-CE2 3.44Å; W291-F309 HydrophobicContact CZ2-CE2 3.44Å; W291-F309 VanDerWaalsContact CZ2-CE2 3.44Å; W291-F309 HydrophobicContact CZ2-CZ 4.05Å; W291-A335 HydrophobicContact CH2-CB 3.8Å; W291-A335 HydrophobicContact CZ2-CB 4.06Å; W291-A335 HydrophobicContact CZ3-CB 4.3Å; W291-L338 HydrophobicContact CH2-CD2 4.03Å; W291-L338 HydrophobicContact CZ3-CD2 3.86Å
292	S	76.3	Confident	85.3	Confident	80 Å²	80	65.9 Å²	65.9	56%	0.559	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-59.2	-21	175.3	58.2	0	0	0	0	113.2	G289 W294	G289-S292 PolarHBondContact O-N 3.2Å; S292-W294 PolarHBondContact O-N 3.16Å
293	D	82.4	Confident	85	Confident	62 Å²	62	69.7 Å²	69.7	33%	0.332	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-75.7	-1.6	174.2	70.2	-26.4	0	0	0	113.9	W291 Q295 V296 A297 R305	W291-D293 PolarHBondContact O-N 3.45Å; W291-D293 VanDerWaalsContact O-N 3.1Å; D293-Q295 PolarHBondContact O-N 3.33Å; D293-Q295 VanDerWaalsContact O-N 3.1Å; D293-V296 CarbonylContact O-C 3.5Å; D293-V296 PolarHBondContact O-N 3.02Å; D293-A297 PolarHBondContact O-N 3.1Å; D293-R305 IonicContact OD1-CZ 3.47Å; D293-R305 IonicContact OD1-NH1 2.77Å; D293-R305 PolarHBondContact OD1-NH1 3.19Å; D293-R305 IonicContact OD1-NH2 3.16Å; D293-R305 PolarHBondContact OD1-NH2 2.73Å; D293-R305 IonicContact OD2-CZ 3.58Å; D293-R305 IonicContact OD2-NH1 2.86Å; D293-R305 PolarHBondContact OD2-NH1 2.82Å; D293-R305 IonicContact OD2-NH2 2.76Å; D293-R305 PolarHBondContact OD2-NH2 3.23Å
294	W	81.6	Confident	84.7	Confident	57 Å²	57	76 Å²	76	22%	0.216	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-51.3	-41.5	-175.1	-172.7	-94.1	0	0	0	112.8	W291 S292 V296 A297 R302 R305 I306	W291-W294 AromaticContact CE3-CE3 3.98Å; W291-W294 HydrophobicContact CE3-CE3 3.98Å; W291-W294 AromaticContact CE3-CZ3 3.92Å; W291-W294 HydrophobicContact CE3-CZ3 3.92Å; W291-W294 HydrophobicContact CZ3-CZ3 4.08Å; W291-W294 VanDerWaalsContact O-CB 3.26Å; W291-W294 WeakPolarHBondContact O-CB 3.45Å; W291-W294 PolarHBondContact O-N 3Å; S292-W294 PolarHBondContact O-N 3.16Å; W294-V296 VanDerWaalsContact C-N 3.28Å; W294-V296 PolarHBondContact O-N 2.78Å; W294-A297 PolarHBondContact O-N 3.47Å; W294-R302 HydrophobicContact CD2-CG 4.27Å; W294-R302 HydrophobicContact CE3-CG 4.33Å; W294-R302 HydrophobicContact CH2-CB 3.83Å; W294-R302 HydrophobicContact CH2-CG 4.09Å; W294-R302 HydrophobicContact CZ2-CB 4.01Å; W294-R302 HydrophobicContact CZ2-CG 4.01Å; W294-R302 HydrophobicContact CZ3-CB 4.27Å; W294-R302 HydrophobicContact CZ3-CG 4.25Å; W294-R302 PolarHBondContact O-NE 3.44Å; W294-R302 PolarHBondContact O-NH2 3.08Å; W294-R305 HydrophobicContact CZ3-CB 4.43Å; W294-I306 HydrophobicContact CH2-CD1 4.21Å; W294-I306 HydrophobicContact CH2-CG1 4.13Å
295	Q	79.7	Confident	84.3	Confident	148 Å²	148	75.8 Å²	75.8	69%	0.692	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-63.2	-32.6	179.7	-66.9	-175.9	-7.9	0	0	112.9	D293 R302	D293-Q295 PolarHBondContact O-N 3.33Å; D293-Q295 VanDerWaalsContact O-N 3.1Å; Q295-R302 PolarHBondContact O-NH2 3.22Å
296	V	84.8	Confident	83.9	Confident	131 Å²	131	72.9 Å²	72.9	79%	0.794	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-23.5	-178.4	-173.3	0	0	0	0	111.8	D293 W294	D293-V296 CarbonylContact O-C 3.5Å; D293-V296 PolarHBondContact O-N 3.02Å; W294-V296 VanDerWaalsContact C-N 3.28Å; W294-V296 PolarHBondContact O-N 2.78Å
297	A	84.2	Confident	83.6	Confident	8 Å²	8	71.4 Å²	71.4	7%	0.066	39%	0.39	C	S	.	.	S	Bend	trans	-62.2	131.9	-175.7	0	0	0	0	0	111.9	D293 W294 I301 R302	D293-A297 PolarHBondContact O-N 3.1Å; W294-A297 PolarHBondContact O-N 3.47Å; A297-I301 HydrophobicContact CB-CG2 4.41Å; A297-R302 HydrophobicContact CB-CG 4.18Å; A297-R302 PolarHBondContact O-NE 3.38Å; A297-R302 PolarHBondContact O-NH2 3.33Å
298	P	90	Very high	83.1	Confident	75 Å²	75	73.3 Å²	73.3	49%	0.487	41%	0.405	S	S	.	.			trans	-61.9	152.5	174.7	26.7	-35.1	0	0	0	111	V300 I301 R302	P298-V300 PolarHBondContact O-N 3.42Å; P298-V300 VanDerWaalsContact O-N 3.1Å; P298-I301 HydrophobicContact CG-CB 4.16Å; P298-I301 HydrophobicContact CG-CD1 3.66Å; P298-I301 HydrophobicContact CG-CG1 3.82Å; P298-I301 PolarHBondContact O-N 3.07Å; P298-R302 PolarHBondContact O-N 3.09Å; P298-R302 VanDerWaalsContact O-N 3.16Å
299	L	86.8	Confident	82.5	Confident	123 Å²	123	73.8 Å²	73.8	64%	0.644	41%	0.406	S	S	*	.	H	α-helix	trans	-50.5	-40.2	-177.8	-171.5	101.3	0	0	0	112.5	I301 R302 I303	L299-I301 PolarHBondContact O-N 3.29Å; L299-R302 WeakPolarHBondContact O-CB 2.98Å; L299-R302 PolarHBondContact O-N 3.35Å; L299-I303 HydrophobicContact CD2-CD1 3.64Å; L299-I303 HydrophobicContact CG-CD1 3.88Å; L299-I303 HydrophobicContact CG-CG1 4.43Å; L299-I303 WeakPolarHBondContact O-CG1 3.17Å; L299-I303 PolarHBondContact O-N 3.06Å
300	V	90.8	Very high	82.1	Confident	93 Å²	93	74.5 Å²	74.5	56%	0.564	41%	0.407	S	S	*	.	H	α-helix	trans	-60.6	-44.3	179.8	-178.5	0	0	0	0	111.8	P298 R302 I303 M304	P298-V300 PolarHBondContact O-N 3.42Å; P298-V300 VanDerWaalsContact O-N 3.1Å; V300-R302 VanDerWaalsContact C-N 3.35Å; V300-I303 PolarHBondContact O-N 3.39Å; V300-M304 HydrophobicContact CG1-CG 4.47Å; V300-M304 WeakPolarHBondContact O-CB 3.25Å; V300-M304 VanDerWaalsContact O-CG 3.29Å; V300-M304 WeakPolarHBondContact O-CG 3.47Å; V300-M304 PolarHBondContact O-N 2.86Å
301	I	86.6	Confident	81.8	Confident	77 Å²	77	74.6 Å²	74.6	40%	0.395	40%	0.402	S	S	.	.	H	α-helix	trans	-67	-39.5	177.7	-68.1	179.6	0	0	0	110.3	A297 P298 L299 M304 R305	A297-I301 HydrophobicContact CB-CG2 4.41Å; P298-I301 HydrophobicContact CG-CB 4.16Å; P298-I301 HydrophobicContact CG-CD1 3.66Å; P298-I301 HydrophobicContact CG-CG1 3.82Å; P298-I301 PolarHBondContact O-N 3.07Å; L299-I301 PolarHBondContact O-N 3.29Å; I301-M304 PolarHBondContact O-N 3.13Å; I301-R305 HydrophobicContact CG2-CG 4.4Å; I301-R305 WeakPolarHBondContact O-CB 3.45Å; I301-R305 WeakPolarHBondContact O-CG 3.45Å; I301-R305 PolarHBondContact O-N 3.28Å
302	R	84.8	Confident	81.5	Confident	71 Å²	71	79 Å²	79	27%	0.268	42%	0.422	S	S	.	.	H	α-helix	trans	-59.9	-47.7	174.8	-63.3	-178.4	-174.9	164.7	6.1	111	W294 Q295 A297 P298 L299 V300 M304 R305 I306	W294-R302 HydrophobicContact CD2-CG 4.27Å; W294-R302 HydrophobicContact CE3-CG 4.33Å; W294-R302 HydrophobicContact CH2-CB 3.83Å; W294-R302 HydrophobicContact CH2-CG 4.09Å; W294-R302 HydrophobicContact CZ2-CB 4.01Å; W294-R302 HydrophobicContact CZ2-CG 4.01Å; W294-R302 HydrophobicContact CZ3-CB 4.27Å; W294-R302 HydrophobicContact CZ3-CG 4.25Å; W294-R302 PolarHBondContact O-NE 3.44Å; W294-R302 PolarHBondContact O-NH2 3.08Å; Q295-R302 PolarHBondContact O-NH2 3.22Å; A297-R302 HydrophobicContact CB-CG 4.18Å; A297-R302 PolarHBondContact O-NE 3.38Å; A297-R302 PolarHBondContact O-NH2 3.33Å; P298-R302 PolarHBondContact O-N 3.09Å; P298-R302 VanDerWaalsContact O-N 3.16Å; L299-R302 WeakPolarHBondContact O-CB 2.98Å; L299-R302 PolarHBondContact O-N 3.35Å; V300-R302 VanDerWaalsContact C-N 3.35Å; R302-M304 PolarHBondContact O-N 3.49Å; R302-R305 PolarHBondContact O-N 3.38Å; R302-I306 WeakPolarHBondContact O-CD1 3.45Å; R302-I306 WeakPolarHBondContact O-CG1 3.38Å; R302-I306 PolarHBondContact O-N 3.49Å
303	I	84.9	Confident	81.2	Confident	93 Å²	93	75.5 Å²	75.5	48%	0.477	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-45	176.3	-68.1	168	0	0	0	110.7	L299 V300 R305 I306 A307	L299-I303 HydrophobicContact CD2-CD1 3.64Å; L299-I303 HydrophobicContact CG-CD1 3.88Å; L299-I303 HydrophobicContact CG-CG1 4.43Å; L299-I303 WeakPolarHBondContact O-CG1 3.17Å; L299-I303 PolarHBondContact O-N 3.06Å; V300-I303 PolarHBondContact O-N 3.39Å; I303-R305 VanDerWaalsContact C-N 3.34Å; I303-R305 PolarHBondContact O-N 3.1Å; I303-I306 PolarHBondContact O-N 3.05Å; I303-A307 VanDerWaalsContact O-CB 3.28Å; I303-A307 WeakPolarHBondContact O-CB 3.34Å; I303-A307 PolarHBondContact O-N 2.94Å
304	M	84.5	Confident	80.6	Confident	134 Å²	134	74.3 Å²	74.3	66%	0.66	39%	0.392	S	S	*	.	H	α-helix	trans	-62.3	-39.6	177.4	-73.7	-132.4	179.6	0	0	112.4	V300 I301 R302 S308	V300-M304 HydrophobicContact CG1-CG 4.47Å; V300-M304 WeakPolarHBondContact O-CB 3.25Å; V300-M304 VanDerWaalsContact O-CG 3.29Å; V300-M304 WeakPolarHBondContact O-CG 3.47Å; V300-M304 PolarHBondContact O-N 2.86Å; I301-M304 PolarHBondContact O-N 3.13Å; R302-M304 PolarHBondContact O-N 3.49Å; M304-S308 WeakPolarHBondContact O-CB 3.07Å; M304-S308 PolarHBondContact O-N 3.46Å
305	R	82.7	Confident	80.1	Confident	53 Å²	53	78 Å²	78	20%	0.2	41%	0.41	C	S	.	.	H	α-helix	trans	-62.3	-48.3	173	-72.7	176.5	-175.3	178.5	4.2	110.6	W291 D293 W294 I301 R302 I303 A307 S308 F309	W291-R305 HydrophobicContact CH2-CB 4.48Å; W291-R305 HydrophobicContact CZ2-CB 4.41Å; D293-R305 IonicContact OD1-CZ 3.47Å; D293-R305 IonicContact OD1-NH1 2.77Å; D293-R305 PolarHBondContact OD1-NH1 3.19Å; D293-R305 IonicContact OD1-NH2 3.16Å; D293-R305 PolarHBondContact OD1-NH2 2.73Å; D293-R305 IonicContact OD2-CZ 3.58Å; D293-R305 IonicContact OD2-NH1 2.86Å; D293-R305 PolarHBondContact OD2-NH1 2.82Å; D293-R305 IonicContact OD2-NH2 2.76Å; D293-R305 PolarHBondContact OD2-NH2 3.23Å; W294-R305 HydrophobicContact CZ3-CB 4.43Å; I301-R305 HydrophobicContact CG2-CG 4.4Å; I301-R305 WeakPolarHBondContact O-CB 3.45Å; I301-R305 WeakPolarHBondContact O-CG 3.45Å; I301-R305 PolarHBondContact O-N 3.28Å; R302-R305 PolarHBondContact O-N 3.38Å; I303-R305 VanDerWaalsContact C-N 3.34Å; I303-R305 PolarHBondContact O-N 3.1Å; R305-A307 PolarHBondContact O-N 3.15Å; R305-S308 PolarHBondContact O-N 3.13Å; R305-F309 WeakPolarHBondContact O-CD2 3.48Å; R305-F309 PolarHBondContact O-N 3.31Å
306	I	81.6	Confident	79.6	Confident	59 Å²	59	71.9 Å²	71.9	30%	0.303	38%	0.383	S	S	.	.	H	α-helix	trans	-59	-50.1	177.3	-61.7	158.2	0	0	0	111	W294 R302 I303 S308 F309 S310 L338	W294-I306 HydrophobicContact CH2-CD1 4.21Å; W294-I306 HydrophobicContact CH2-CG1 4.13Å; R302-I306 WeakPolarHBondContact O-CD1 3.45Å; R302-I306 WeakPolarHBondContact O-CG1 3.38Å; R302-I306 PolarHBondContact O-N 3.49Å; I303-I306 PolarHBondContact O-N 3.05Å; I306-S308 VanDerWaalsContact C-N 3.33Å; I306-S308 PolarHBondContact O-N 3.12Å; I306-F309 PolarHBondContact O-N 3.26Å; I306-S310 VanDerWaalsContact O-CB 3.25Å; I306-S310 WeakPolarHBondContact O-CB 3.38Å; I306-S310 PolarHBondContact O-N 3.16Å; I306-L338 HydrophobicContact CB-CD2 4.16Å; I306-L338 HydrophobicContact CG1-CD1 4.03Å; I306-L338 HydrophobicContact CG1-CD2 3.55Å; I306-L338 HydrophobicContact CG1-CG 4.25Å; I306-L338 HydrophobicContact CG2-CD1 4.16Å; I306-L338 HydrophobicContact CG2-CD2 4.41Å; I306-L338 HydrophobicContact CG2-CG 4.39Å
307	A	80.2	Confident	78.8	Confident	39 Å²	39	66.2 Å²	66.2	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-40.6	179.8	0	0	0	0	0	111.6	I303 R305 S310 I311	I303-A307 VanDerWaalsContact O-CB 3.28Å; I303-A307 WeakPolarHBondContact O-CB 3.34Å; I303-A307 PolarHBondContact O-N 2.94Å; R305-A307 PolarHBondContact O-N 3.15Å; A307-S310 PolarHBondContact O-N 3.15Å; A307-I311 WeakPolarHBondContact O-CB 3.42Å; A307-I311 WeakPolarHBondContact O-CG1 3.49Å; A307-I311 PolarHBondContact O-N 3.08Å
308	S	77.2	Confident	78	Confident	48 Å²	48	70.9 Å²	70.9	34%	0.336	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-47.8	177.6	-178.9	0	0	0	0	111.1	M304 R305 I306 S310 F312	M304-S308 WeakPolarHBondContact O-CB 3.07Å; M304-S308 PolarHBondContact O-N 3.46Å; R305-S308 PolarHBondContact O-N 3.13Å; I306-S308 VanDerWaalsContact C-N 3.33Å; I306-S308 PolarHBondContact O-N 3.12Å; S308-S310 PolarHBondContact O-N 3.21Å; S308-F312 WeakPolarHBondContact O-CA 3.48Å; S308-F312 WeakPolarHBondContact O-CB 3.42Å; S308-F312 WeakPolarHBondContact O-CD2 3.27Å; S308-F312 PolarHBondContact O-N 2.88Å
309	F	72.4	Confident	76.9	Confident	47 Å²	47	68.2 Å²	68.2	21%	0.206	36%	0.357	C	S	.	.	H	α-helix	trans	-75.2	-22.7	179.1	-80.8	-88	0	0	0	114.1	W291 R305 I306 H313 F331 A335	W291-F309 AromaticContact CH2-CD2 3.91Å; W291-F309 HydrophobicContact CH2-CD2 3.91Å; W291-F309 HydrophobicContact CH2-CE2 4.11Å; W291-F309 HydrophobicContact CH2-CG 4.47Å; W291-F309 AromaticContact CZ2-CD2 3.7Å; W291-F309 HydrophobicContact CZ2-CD2 3.7Å; W291-F309 AromaticContact CZ2-CE2 3.44Å; W291-F309 HydrophobicContact CZ2-CE2 3.44Å; W291-F309 VanDerWaalsContact CZ2-CE2 3.44Å; W291-F309 HydrophobicContact CZ2-CZ 4.05Å; R305-F309 WeakPolarHBondContact O-CD2 3.48Å; R305-F309 PolarHBondContact O-N 3.31Å; I306-F309 PolarHBondContact O-N 3.26Å; F309-H313 WeakPolarHBondContact O-CB 3.28Å; F309-F331 HydrophobicContact CD1-CD1 4.31Å; F309-F331 HydrophobicContact CD1-CE1 4.28Å; F309-F331 AromaticContact CE1-CD1 3.77Å; F309-F331 HydrophobicContact CE1-CD1 3.77Å; F309-F331 AromaticContact CE1-CE1 3.84Å; F309-F331 HydrophobicContact CE1-CE1 3.84Å; F309-A335 HydrophobicContact CD1-CB 4.26Å; F309-A335 HydrophobicContact CE1-CB 4.14Å
310	S	73.9	Confident	75.8	Confident	41 Å²	41	63.5 Å²	63.5	29%	0.287	33%	0.332	S	S	.	.	H	α-helix	trans	-75.1	-50.2	174	-179.7	0	0	0	0	111.7	I306 A307 S308 S342	I306-S310 VanDerWaalsContact O-CB 3.25Å; I306-S310 WeakPolarHBondContact O-CB 3.38Å; I306-S310 PolarHBondContact O-N 3.16Å; A307-S310 PolarHBondContact O-N 3.15Å; S308-S310 PolarHBondContact O-N 3.21Å; S310-S342 VanDerWaalsContact CB-OG 3.28Å; S310-S342 WeakPolarHBondContact CB-OG 3.21Å; S310-S342 PolarHBondContact OG-OG 3.21Å
311	I	73.4	Confident	74.6	Confident	109 Å²	109	61.2 Å²	61.2	56%	0.559	32%	0.318	S	S	*	.	H	α-helix	trans	-84.6	-40.2	-172.6	-60.7	169.7	0	0	0	111.3	A307 H313 P314	A307-I311 WeakPolarHBondContact O-CB 3.42Å; A307-I311 WeakPolarHBondContact O-CG1 3.49Å; A307-I311 PolarHBondContact O-N 3.08Å; I311-H313 VanDerWaalsContact C-N 3.35Å; I311-P314 WeakPolarHBondContact O-CD 3.35Å
312	F	72.5	Confident	73.5	Confident	112 Å²	112	67.7 Å²	67.7	49%	0.491	34%	0.338	S	S	.	.	S	Bend	trans	-87	-1.4	-175.7	-61.3	-70.6	0	0	0	114.3	S308 F315 T316	S308-F312 WeakPolarHBondContact O-CA 3.48Å; S308-F312 WeakPolarHBondContact O-CB 3.42Å; S308-F312 WeakPolarHBondContact O-CD2 3.27Å; S308-F312 PolarHBondContact O-N 2.88Å; F312-F315 AromaticContact CD1-CD2 3.96Å; F312-F315 HydrophobicContact CD1-CD2 3.96Å; F312-F315 HydrophobicContact CD1-CE2 4.33Å; F312-F315 WeakPolarHBondContact O-CB 3.43Å; F312-F315 PolarHBondContact O-N 3.07Å; F312-T316 PolarHBondContact O-N 3.35Å; F312-T316 VanDerWaalsContact O-N 3.12Å
313	H	70.9	Confident	72.4	Confident	5 Å²	5	68.5 Å²	68.5	2%	0.023	35%	0.346	C	S	.	.	H	α-helix	trans	-51.1	-45.3	178.2	-150.6	-63.8	0	0	0	115.7	F309 I311 F315 T316 I317 S339 P639	F309-H313 WeakPolarHBondContact O-CB 3.28Å; I311-H313 VanDerWaalsContact C-N 3.35Å; H313-F315 VanDerWaalsContact C-N 3.25Å; H313-F315 PolarHBondContact O-N 3.33Å; H313-T316 PolarHBondContact O-N 2.97Å; H313-T316 PolarHBondContact O-OG1 2.86Å; H313-I317 WeakPolarHBondContact ND1-CD1 3.42Å; H313-I317 WeakPolarHBondContact O-CD1 3.38Å; H313-I317 WeakPolarHBondContact O-CG1 3.13Å; H313-I317 PolarHBondContact O-N 3.5Å; H313-S339 WeakPolarHBondContact CD2-CB 3.4Å; H313-P639 WeakPolarHBondContact CE1-CD 3.44Å; H313-P639 WeakPolarHBondContact NE2-CD 3.36Å
314	P	69.6	Low	71	Confident	38 Å²	38	73.8 Å²	73.8	25%	0.247	37%	0.366	C	S	.	.	H	α-helix	trans	-61.6	-34.9	176.3	20.6	-32.6	0	0	0	112.5	I311 I317 I318 F642	I311-P314 WeakPolarHBondContact O-CD 3.35Å; P314-I317 PolarHBondContact O-N 3.1Å; P314-I318 WeakPolarHBondContact O-CG1 3.47Å; P314-I318 PolarHBondContact O-N 2.89Å; P314-F642 HydrophobicContact CB-CD1 4.4Å; P314-F642 HydrophobicContact CB-CE1 3.82Å; P314-F642 HydrophobicContact CB-CZ 3.97Å; P314-F642 HydrophobicContact CG-CE1 4.49Å; P314-F642 HydrophobicContact CG-CZ 4.17Å
315	F	71.2	Confident	69.5	Low	135 Å²	135	68.1 Å²	68.1	59%	0.592	34%	0.342	S	S	*	.	H	α-helix	trans	-71.1	-38.3	-179.5	-62.4	-82	0	0	0	112.2	F312 H313 I317 I318 G319	F312-F315 AromaticContact CD1-CD2 3.96Å; F312-F315 HydrophobicContact CD1-CD2 3.96Å; F312-F315 HydrophobicContact CD1-CE2 4.33Å; F312-F315 WeakPolarHBondContact O-CB 3.43Å; F312-F315 PolarHBondContact O-N 3.07Å; H313-F315 VanDerWaalsContact C-N 3.25Å; H313-F315 PolarHBondContact O-N 3.33Å; F315-I317 VanDerWaalsContact C-N 3.27Å; F315-I317 PolarHBondContact O-N 3.26Å; F315-I318 PolarHBondContact O-N 3.34Å; F315-G319 PolarHBondContact O-N 3.28Å
316	T	68.7	Low	67.8	Low	19 Å²	19	73 Å²	73	12%	0.117	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-32.7	176.9	61.6	0	0	0	0	111.9	F312 H313 N320 F329 F331	F312-T316 PolarHBondContact O-N 3.35Å; F312-T316 VanDerWaalsContact O-N 3.12Å; H313-T316 PolarHBondContact O-N 2.97Å; H313-T316 PolarHBondContact O-OG1 2.86Å; T316-N320 WeakPolarHBondContact O-CB 3.47Å; T316-N320 PolarHBondContact O-N 2.98Å; T316-N320 PolarHBondContact O-ND2 3.07Å; T316-F329 HydrophobicContact CG2-CD2 4.25Å; T316-F329 HydrophobicContact CG2-CE2 4.19Å; T316-F329 HydrophobicContact CG2-CZ 4.43Å; T316-F331 HydrophobicContact CG2-CZ 4.49Å
317	I	67.7	Low	66.2	Low	11 Å²	11	73.5 Å²	73.5	6%	0.056	38%	0.377	C	S	.	.	H	α-helix	trans	-67.1	-47.9	174.9	-65	161.6	0	0	0	111	H313 P314 F315 G319 N320 V321 Y638 F642 V646	H313-I317 WeakPolarHBondContact ND1-CD1 3.42Å; H313-I317 WeakPolarHBondContact O-CD1 3.38Å; H313-I317 WeakPolarHBondContact O-CG1 3.13Å; H313-I317 PolarHBondContact O-N 3.5Å; P314-I317 PolarHBondContact O-N 3.1Å; F315-I317 VanDerWaalsContact C-N 3.27Å; F315-I317 PolarHBondContact O-N 3.26Å; I317-G319 VanDerWaalsContact C-N 3.26Å; I317-G319 PolarHBondContact O-N 3.36Å; I317-N320 PolarHBondContact O-N 3.18Å; I317-V321 HydrophobicContact CG2-CG2 4.23Å; I317-V321 WeakPolarHBondContact O-CG2 3.44Å; I317-V321 PolarHBondContact O-N 3.33Å; I317-Y638 HydrophobicContact CD1-CD1 4.09Å; I317-Y638 HydrophobicContact CG1-CD1 3.55Å; I317-Y638 HydrophobicContact CG1-CE1 3.81Å; I317-F642 HydrophobicContact CD1-CB 3.35Å; I317-F642 HydrophobicContact CD1-CD2 4.35Å; I317-F642 HydrophobicContact CD1-CG 3.87Å; I317-V646 HydrophobicContact CG2-CG2 3.89Å
318	I	68.5	Low	64.9	Low	106 Å²	106	75 Å²	75	54%	0.544	38%	0.38	S	S	.	.	H	α-helix	trans	-59.8	-41.5	179.2	-65.3	165.7	0	0	0	110.3	P314 F315 V321 R322	P314-I318 WeakPolarHBondContact O-CG1 3.47Å; P314-I318 PolarHBondContact O-N 2.89Å; F315-I318 PolarHBondContact O-N 3.34Å; I318-V321 PolarHBondContact O-N 2.96Å; I318-R322 VanDerWaalsContact O-CB 3.29Å; I318-R322 WeakPolarHBondContact O-CB 3.33Å; I318-R322 PolarHBondContact O-N 3.47Å
319	G	65.5	Low	63.8	Low	20 Å²	20	77.3 Å²	77.3	21%	0.206	38%	0.384	C	S	.	.	H	α-helix	trans	-58.9	-50.8	174.7	0	0	0	0	0	112.7	F315 I317 V321 R322 I323	F315-G319 PolarHBondContact O-N 3.28Å; I317-G319 VanDerWaalsContact C-N 3.26Å; I317-G319 PolarHBondContact O-N 3.36Å; G319-V321 PolarHBondContact O-N 3.35Å; G319-R322 PolarHBondContact O-N 3.34Å; G319-I323 WeakPolarHBondContact O-CB 3.4Å; G319-I323 WeakPolarHBondContact O-CG1 3.3Å; G319-I323 PolarHBondContact O-N 3.29Å
320	N	64.4	Low	63	Low	23 Å²	23	81.6 Å²	81.6	12%	0.123	41%	0.409	C	S	.	.	H	α-helix	trans	-61.3	-42.1	179.4	-80.7	-33.8	0	0	0	112.8	T316 I317 V327	T316-N320 WeakPolarHBondContact O-CB 3.47Å; T316-N320 PolarHBondContact O-N 2.98Å; T316-N320 PolarHBondContact O-ND2 3.07Å; I317-N320 PolarHBondContact O-N 3.18Å; N320-V327 PolarHBondContact OD1-O 3.47Å
321	V	66.5	Low	62.5	Low	45 Å²	45	80.4 Å²	80.4	27%	0.273	40%	0.399	S	S	.	.	H	α-helix	trans	-71	-42.1	-178.2	172.6	0	0	0	0	111.8	I317 I318 G319 Y649	I317-V321 HydrophobicContact CG2-CG2 4.23Å; I317-V321 WeakPolarHBondContact O-CG2 3.44Å; I317-V321 PolarHBondContact O-N 3.33Å; I318-V321 PolarHBondContact O-N 2.96Å; G319-V321 PolarHBondContact O-N 3.35Å; V321-Y649 HydrophobicContact CG1-CD1 3.89Å; V321-Y649 HydrophobicContact CG1-CD2 4.25Å; V321-Y649 HydrophobicContact CG1-CE1 3.75Å; V321-Y649 HydrophobicContact CG1-CE2 4.15Å; V321-Y649 HydrophobicContact CG1-CG 4.12Å
322	R	63.5	Low	62.6	Low	213 Å²	213	76.3 Å²	76.3	80%	0.804	38%	0.378	S	S	*	.	H	α-helix	trans	-85	-30.4	-171.5	-163	159.1	-177.9	88.6	-2.5	113.6	I318 G319 K324	I318-R322 VanDerWaalsContact O-CB 3.29Å; I318-R322 WeakPolarHBondContact O-CB 3.33Å; I318-R322 PolarHBondContact O-N 3.47Å; G319-R322 PolarHBondContact O-N 3.34Å; R322-K324 PolarHBondContact O-N 3.5Å
323	I	60.4	Low	63.2	Low	88 Å²	88	71.7 Å²	71.7	45%	0.451	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	31.3	-171.7	-50.5	168.2	0	0	0	111.5	G319 G325 L326	G319-I323 WeakPolarHBondContact O-CB 3.4Å; G319-I323 WeakPolarHBondContact O-CG1 3.3Å; G319-I323 PolarHBondContact O-N 3.29Å; I323-G325 PolarHBondContact O-N 3.11Å; I323-L326 HydrophobicContact CG2-CB 3.74Å; I323-L326 PolarHBondContact O-N 2.89Å
324	K	55.9	Low	63.8	Low	204 Å²	204	72.2 Å²	72.2	89%	0.887	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.8	39.7	174.2	-72.4	-174.6	175.2	177.5	0	114.3	R322 L326	R322-K324 PolarHBondContact O-N 3.5Å; K324-L326 PolarHBondContact O-N 2.88Å
325	G	53.6	Low	64.4	Low	16 Å²	16	70.4 Å²	70.4	17%	0.165	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	25.6	-179.7	0	0	0	0	0	116.5	I323 V327 K675	I323-G325 PolarHBondContact O-N 3.11Å; G325-V327 VanDerWaalsContact C-N 3.28Å; G325-K675 PolarHBondContact O-NZ 3.04Å
326	L	46.3	Very low	65.1	Low	154 Å²	154	64.9 Å²	64.9	81%	0.806	33%	0.328	S	S	*	.	S	Bend	trans	-72.1	-26.8	173.8	-140.9	90.9	0	0	0	112.3	I323 K324	I323-L326 HydrophobicContact CG2-CB 3.74Å; I323-L326 PolarHBondContact O-N 2.89Å; K324-L326 PolarHBondContact O-N 2.88Å
327	V	48.7	Very low	66.1	Low	70 Å²	70	65.3 Å²	65.3	42%	0.424	33%	0.327	S	S	.	.	S	Bend	trans	-120	80.9	176.2	-174.1	0	0	0	0	106.9	N320 G325 F329	N320-V327 PolarHBondContact OD1-O 3.47Å; G325-V327 VanDerWaalsContact C-N 3.28Å; V327-F329 HydrophobicContact CG1-CD2 4.3Å; V327-F329 HydrophobicContact CG1-CE1 4.38Å; V327-F329 HydrophobicContact CG1-CE2 3.93Å; V327-F329 HydrophobicContact CG1-CZ 3.98Å; V327-F329 PolarHBondContact O-N 3.45Å
328	D	51.4	Low	67	Low	72 Å²	72	65.9 Å²	65.9	39%	0.385	33%	0.33	S	S	.	.			trans	-70.9	103.7	167.1	-71	-12.4	0	0	0	106.6	N330 K675	D328-N330 PolarHBondContact O-N 3.47Å; D328-K675 IonicContact OD1-NZ 3.96Å; D328-K675 PolarHBondContact OD1-NZ 3.32Å; D328-K675 VanDerWaalsContact OD1-NZ 3.07Å; D328-K675 WeakPolarHBondContact OD2-CD 3.34Å; D328-K675 IonicContact OD2-NZ 3.34Å; D328-K675 PolarHBondContact OD2-NZ 3.2Å
329	F	55.2	Low	67.8	Low	95 Å²	95	61.1 Å²	61.1	42%	0.417	31%	0.306	S	S	.	.			trans	-65.2	86	154.6	-65.5	-76.7	0	0	0	105.6	T316 V327 F331	T316-F329 HydrophobicContact CG2-CD2 4.25Å; T316-F329 HydrophobicContact CG2-CE2 4.19Å; T316-F329 HydrophobicContact CG2-CZ 4.43Å; V327-F329 HydrophobicContact CG1-CD2 4.3Å; V327-F329 HydrophobicContact CG1-CE1 4.38Å; V327-F329 HydrophobicContact CG1-CE2 3.93Å; V327-F329 HydrophobicContact CG1-CZ 3.98Å; V327-F329 PolarHBondContact O-N 3.45Å; F329-F331 HydrophobicContact CB-CD1 4.37Å; F329-F331 HydrophobicContact CB-CD2 4.36Å; F329-F331 HydrophobicContact CB-CE1 3.9Å; F329-F331 HydrophobicContact CB-CE2 3.91Å; F329-F331 HydrophobicContact CB-CZ 3.65Å; F329-F331 HydrophobicContact CG-CZ 4.42Å; F329-F331 WeakPolarHBondContact O-CD2 3.36Å; F329-F331 WeakPolarHBondContact O-CE2 3.4Å; F329-F331 WeakPolarHBondContact O-CG 3.35Å; F329-F331 PolarHBondContact O-N 2.76Å
330	N	54.6	Low	68.9	Low	137 Å²	137	61 Å²	61	73%	0.733	30%	0.302	S	S	*	.			trans	-61.7	88.1	167.7	-91.2	-12.9	0	0	0	106.2	D328 N332	D328-N330 PolarHBondContact O-N 3.47Å; N330-N332 PolarHBondContact O-N 3.16Å
331	F	63.9	Low	70.1	Confident	17 Å²	17	61.5 Å²	61.5	8%	0.075	30%	0.304	C	S	.	.			trans	-65.4	112.9	-179.3	-66.1	-74.6	0	0	0	106.5	F309 T316 F329 K336 T637 Y638	F309-F331 HydrophobicContact CD1-CD1 4.31Å; F309-F331 HydrophobicContact CD1-CE1 4.28Å; F309-F331 AromaticContact CE1-CD1 3.77Å; F309-F331 HydrophobicContact CE1-CD1 3.77Å; F309-F331 AromaticContact CE1-CE1 3.84Å; F309-F331 HydrophobicContact CE1-CE1 3.84Å; T316-F331 HydrophobicContact CG2-CZ 4.49Å; F329-F331 HydrophobicContact CB-CD1 4.37Å; F329-F331 HydrophobicContact CB-CD2 4.36Å; F329-F331 HydrophobicContact CB-CE1 3.9Å; F329-F331 HydrophobicContact CB-CE2 3.91Å; F329-F331 HydrophobicContact CB-CZ 3.65Å; F329-F331 HydrophobicContact CG-CZ 4.42Å; F329-F331 WeakPolarHBondContact O-CD2 3.36Å; F329-F331 WeakPolarHBondContact O-CE2 3.4Å; F329-F331 WeakPolarHBondContact O-CG 3.35Å; F329-F331 PolarHBondContact O-N 2.76Å; F331-K336 HydrophobicContact CB-CD 4.41Å; F331-K336 HydrophobicContact CB-CG 3.63Å; F331-K336 VanDerWaalsContact O-CE 3.29Å; F331-K336 WeakPolarHBondContact O-CE 3.14Å; F331-T637 HydrophobicContact CD2-CG2 3.77Å; F331-T637 HydrophobicContact CE2-CG2 4.37Å; F331-Y638 HydrophobicContact CE2-CE1 4.21Å
332	N	76.1	Confident	71.1	Confident	22 Å²	22	60.2 Å²	60.2	12%	0.118	30%	0.297	C	S	.	.			trans	-49.4	142	167.2	-64.4	-26	0	0	0	108.3	M288 T290 N330 C334 A335 K336	M288-N332 PolarHBondContact O-ND2 3.3Å; T290-N332 PolarHBondContact N-ND2 3.49Å; T290-N332 PolarHBondContact N-OD1 2.91Å; T290-N332 PolarHBondContact OG1-ND2 3.36Å; N330-N332 PolarHBondContact O-N 3.16Å; N332-C334 PolarHBondContact O-N 2.86Å; N332-C334 VanDerWaalsContact O-N 3.15Å; N332-A335 HydrophobicContact CB-CB 4.32Å; N332-A335 WeakPolarHBondContact O-CA 3.08Å; N332-A335 WeakPolarHBondContact O-CB 3.46Å; N332-A335 PolarHBondContact O-N 3.46Å; N332-K336 PolarHBondContact O-N 3.02Å
333	P	83.6	Confident	72.4	Confident	16 Å²	16	50.6 Å²	50.6	10%	0.104	26%	0.262	C	S	.	.	H	α-helix	trans	-50.8	-40.4	177	-27.1	33	0	0	0	112.9	W287 A335 K336 Y337 F632	W287-P333 HydrophobicContact CD2-CB 4Å; W287-P333 HydrophobicContact CE3-CB 3.32Å; W287-P333 HydrophobicContact CE3-CG 4.37Å; W287-P333 HydrophobicContact CH2-CB 4.2Å; W287-P333 HydrophobicContact CZ3-CB 3.41Å; W287-P333 VanDerWaalsContact CZ3-CB 3.41Å; P333-A335 VanDerWaalsContact C-N 3.33Å; P333-A335 PolarHBondContact O-N 3.45Å; P333-K336 WeakPolarHBondContact O-CB 3.07Å; P333-K336 PolarHBondContact O-N 3.24Å; P333-Y337 PolarHBondContact O-N 2.77Å; P333-F632 HydrophobicContact CB-CD1 4.26Å; P333-F632 HydrophobicContact CB-CE1 4.17Å; P333-F632 HydrophobicContact CG-CD1 3.57Å; P333-F632 HydrophobicContact CG-CE1 3.42Å; P333-F632 VanDerWaalsContact CG-CE1 3.42Å; P333-F632 HydrophobicContact CG-CG 4.45Å; P333-F632 HydrophobicContact CG-CZ 4.24Å
334	C	85.3	Confident	73.9	Confident	15 Å²	15	46.8 Å²	46.8	10%	0.101	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-38	174.2	-171.9	0	0	0	0	113.3	W287 M288 N332 Y337 L338	W287-C334 VanDerWaalsContact O-CB 3.29Å; W287-C334 WeakPolarHBondContact O-CB 3.25Å; W287-C334 PolarHBondContact O-N 2.7Å; W287-C334 VanDerWaalsContact O-N 3.09Å; M288-C334 HydrophobicContact SD-CB 4.25Å; N332-C334 PolarHBondContact O-N 2.86Å; N332-C334 VanDerWaalsContact O-N 3.15Å; C334-Y337 PolarHBondContact O-N 3Å; C334-L338 VanDerWaalsContact O-CB 3.32Å; C334-L338 WeakPolarHBondContact O-CB 3.42Å; C334-L338 PolarHBondContact O-N 3.26Å
335	A	82.1	Confident	75.6	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-68.9	-39.4	176	0	0	0	0	0	111.6	W291 F309 N332 P333 Y337 L338 S339	W291-A335 HydrophobicContact CH2-CB 3.8Å; W291-A335 HydrophobicContact CZ2-CB 4.06Å; W291-A335 HydrophobicContact CZ3-CB 4.3Å; F309-A335 HydrophobicContact CD1-CB 4.26Å; F309-A335 HydrophobicContact CE1-CB 4.14Å; N332-A335 HydrophobicContact CB-CB 4.32Å; N332-A335 WeakPolarHBondContact O-CA 3.08Å; N332-A335 WeakPolarHBondContact O-CB 3.46Å; N332-A335 PolarHBondContact O-N 3.46Å; P333-A335 VanDerWaalsContact C-N 3.33Å; P333-A335 PolarHBondContact O-N 3.45Å; A335-Y337 VanDerWaalsContact C-N 3.35Å; A335-L338 PolarHBondContact O-N 3.47Å; A335-S339 WeakPolarHBondContact O-CB 3.23Å; A335-S339 PolarHBondContact O-N 3.31Å; A335-S339 PolarHBondContact O-OG 3.43Å
336	K	85.4	Confident	77.4	Confident	19 Å²	19	43.3 Å²	43.3	8%	0.083	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-42.6	172.8	-60.3	179.5	-177.5	-171.6	0	111.8	F331 N332 P333 S339 T340 Y631 T637	F331-K336 HydrophobicContact CB-CD 4.41Å; F331-K336 HydrophobicContact CB-CG 3.63Å; F331-K336 VanDerWaalsContact O-CE 3.29Å; F331-K336 WeakPolarHBondContact O-CE 3.14Å; N332-K336 PolarHBondContact O-N 3.02Å; P333-K336 WeakPolarHBondContact O-CB 3.07Å; P333-K336 PolarHBondContact O-N 3.24Å; K336-S339 PolarHBondContact O-OG 3.38Å; K336-T340 WeakPolarHBondContact O-CB 3.33Å; K336-T340 PolarHBondContact O-N 3.47Å; K336-T340 VanDerWaalsContact O-N 3.1Å; K336-T340 PolarHBondContact O-OG1 3.21Å; K336-Y631 HydrophobicContact CB-CD1 4.17Å; K336-Y631 WeakPolarHBondContact CD-O 3.49Å; K336-T637 PolarHBondContact NZ-OG1 2.54Å; K336-T637 VanDerWaalsContact NZ-OG1 3.1Å
337	Y	88.9	Confident	79.6	Confident	27 Å²	27	36 Å²	36	11%	0.106	20%	0.195	C	C	.	.	H	α-helix	trans	-60.4	-50	174.9	168.2	-96.6	0	0	0	111.6	W287 P333 C334 A335 S339 T340 L341 F471 L474 Y631	W287-Y337 HydrophobicContact CZ2-CG 4.04Å; P333-Y337 PolarHBondContact O-N 2.77Å; C334-Y337 PolarHBondContact O-N 3Å; A335-Y337 VanDerWaalsContact C-N 3.35Å; Y337-S339 PolarHBondContact O-N 3.45Å; Y337-T340 WeakPolarHBondContact O-CB 2.98Å; Y337-T340 PolarHBondContact O-N 2.85Å; Y337-L341 HydrophobicContact CE1-CD2 4.16Å; Y337-L341 WeakPolarHBondContact O-CB 3.45Å; Y337-L341 PolarHBondContact O-N 3.47Å; Y337-F471 AromaticContact CE2-CD1 3.58Å; Y337-F471 HydrophobicContact CE2-CD1 3.58Å; Y337-F471 HydrophobicContact CE2-CE1 4.13Å; Y337-F471 AromaticContact CZ-CD1 3.85Å; Y337-F471 PolarHBondContact OH-O 3.29Å; Y337-L474 HydrophobicContact CD2-CD1 4.17Å; Y337-L474 HydrophobicContact CE2-CD1 3.34Å; Y337-Y631 HydrophobicContact CD2-CD2 4.25Å; Y337-Y631 HydrophobicContact CD2-CE1 4.29Å; Y337-Y631 AromaticContact CD2-CE2 3.57Å; Y337-Y631 HydrophobicContact CD2-CE2 3.57Å; Y337-Y631 AromaticContact CD2-CZ 3.58Å; Y337-Y631 HydrophobicContact CE2-CE2 4.43Å; Y337-Y631 HydrophobicContact CG-CE2 4.44Å
338	L	87.1	Confident	81.8	Confident	24 Å²	24	33.2 Å²	33.2	13%	0.126	18%	0.178	C	C	.	.	H	α-helix	trans	-67.5	-36.8	-175.8	-176.6	61.9	0	0	0	112.5	W291 I306 C334 A335 L341 S342	W291-L338 HydrophobicContact CH2-CD2 4.03Å; W291-L338 HydrophobicContact CZ3-CD2 3.86Å; I306-L338 HydrophobicContact CB-CD2 4.16Å; I306-L338 HydrophobicContact CG1-CD1 4.03Å; I306-L338 HydrophobicContact CG1-CD2 3.55Å; I306-L338 HydrophobicContact CG1-CG 4.25Å; I306-L338 HydrophobicContact CG2-CD1 4.16Å; I306-L338 HydrophobicContact CG2-CD2 4.41Å; I306-L338 HydrophobicContact CG2-CG 4.39Å; C334-L338 VanDerWaalsContact O-CB 3.32Å; C334-L338 WeakPolarHBondContact O-CB 3.42Å; C334-L338 PolarHBondContact O-N 3.26Å; A335-L338 PolarHBondContact O-N 3.47Å; L338-L341 PolarHBondContact O-N 2.9Å; L338-S342 WeakPolarHBondContact O-CB 3.2Å; L338-S342 PolarHBondContact O-N 3.35Å
339	S	84.7	Confident	83.8	Confident	5 Å²	5	36.3 Å²	36.3	4%	0.035	19%	0.188	C	C	.	.	H	α-helix	trans	-66.6	-39.8	173.8	66.3	0	0	0	0	111.8	H313 A335 K336 Y337 S342 S343	H313-S339 WeakPolarHBondContact CD2-CB 3.4Å; A335-S339 WeakPolarHBondContact O-CB 3.23Å; A335-S339 PolarHBondContact O-N 3.31Å; A335-S339 PolarHBondContact O-OG 3.43Å; K336-S339 PolarHBondContact O-OG 3.38Å; Y337-S339 PolarHBondContact O-N 3.45Å; S339-S342 PolarHBondContact O-N 3.13Å; S339-S343 WeakPolarHBondContact O-CB 3.3Å; S339-S343 PolarHBondContact O-N 3.1Å
340	T	88.2	Confident	85.5	Confident	18 Å²	18	32 Å²	32	11%	0.11	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-45.5	174	-57.4	0	0	0	0	111.4	K336 Y337 S343 Y344 F471 Y631	K336-T340 WeakPolarHBondContact O-CB 3.33Å; K336-T340 PolarHBondContact O-N 3.47Å; K336-T340 VanDerWaalsContact O-N 3.1Å; K336-T340 PolarHBondContact O-OG1 3.21Å; Y337-T340 WeakPolarHBondContact O-CB 2.98Å; Y337-T340 PolarHBondContact O-N 2.85Å; T340-S343 PolarHBondContact O-N 3.34Å; T340-Y344 WeakPolarHBondContact O-CB 3.48Å; T340-Y344 PolarHBondContact O-N 3.36Å; T340-F471 HydrophobicContact CG2-CE1 4.49Å; T340-F471 HydrophobicContact CG2-CZ 4.42Å; T340-Y631 HydrophobicContact CG2-CE1 4.3Å
341	L	90.5	Very high	87.3	Confident	33 Å²	33	25.5 Å²	25.5	17%	0.173	14%	0.135	C	C	.	.	H	α-helix	trans	-60.6	-47.8	175.9	172.2	59.3	0	0	0	111.2	Y337 L338 S343 Y344 L345 F471	Y337-L341 HydrophobicContact CE1-CD2 4.16Å; Y337-L341 WeakPolarHBondContact O-CB 3.45Å; Y337-L341 PolarHBondContact O-N 3.47Å; L338-L341 PolarHBondContact O-N 2.9Å; L341-S343 VanDerWaalsContact C-N 3.32Å; L341-S343 PolarHBondContact O-N 3.21Å; L341-Y344 WeakPolarHBondContact O-CB 3.42Å; L341-Y344 PolarHBondContact O-N 2.82Å; L341-L345 HydrophobicContact CD1-CD1 4.21Å; L341-L345 HydrophobicContact CD1-CG 4.16Å; L341-L345 HydrophobicContact CG-CD1 4.33Å; L341-L345 WeakPolarHBondContact O-CG 3.41Å; L341-L345 PolarHBondContact O-N 3.24Å; L341-F471 HydrophobicContact CB-CD1 4.03Å; L341-F471 HydrophobicContact CB-CE1 4.06Å; L341-F471 HydrophobicContact CD1-CB 3.8Å; L341-F471 HydrophobicContact CD1-CD1 3.76Å; L341-F471 HydrophobicContact CD1-CD2 3.96Å; L341-F471 HydrophobicContact CD1-CE1 4.29Å; L341-F471 HydrophobicContact CD1-CE2 4.46Å; L341-F471 HydrophobicContact CD1-CG 3.57Å; L341-F471 HydrophobicContact CG-CD1 4.38Å
342	S	88	Confident	88.7	Confident	19 Å²	19	27.6 Å²	27.6	13%	0.133	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-43.5	178.4	-176.4	0	0	0	0	111.5	S310 L338 S339 Y344 L345 C346	S310-S342 VanDerWaalsContact CB-OG 3.28Å; S310-S342 WeakPolarHBondContact CB-OG 3.21Å; S310-S342 PolarHBondContact OG-OG 3.21Å; L338-S342 WeakPolarHBondContact O-CB 3.2Å; L338-S342 PolarHBondContact O-N 3.35Å; S339-S342 PolarHBondContact O-N 3.13Å; S342-Y344 VanDerWaalsContact C-N 3.31Å; S342-Y344 PolarHBondContact O-N 3.06Å; S342-L345 PolarHBondContact O-N 3.43Å; S342-C346 PolarHBondContact O-N 2.91Å; S342-C346 PolarHBondContact O-SG 3.29Å; S342-C346 VanDerWaalsContact O-SG 3.38Å
343	S	89.5	Confident	89.4	Confident	10 Å²	10	28.4 Å²	28.4	7%	0.07	15%	0.151	C	C	.	.	H	α-helix	trans	-64.8	-38.4	177.7	-167.1	0	0	0	0	111.7	S339 T340 L341 L345 C346 F347 P640	S339-S343 WeakPolarHBondContact O-CB 3.3Å; S339-S343 PolarHBondContact O-N 3.1Å; T340-S343 PolarHBondContact O-N 3.34Å; L341-S343 VanDerWaalsContact C-N 3.32Å; L341-S343 PolarHBondContact O-N 3.21Å; S343-L345 PolarHBondContact O-N 3.1Å; S343-C346 PolarHBondContact O-N 2.72Å; S343-F347 WeakPolarHBondContact O-CB 3.44Å; S343-F347 PolarHBondContact O-N 3.24Å; S343-P640 WeakPolarHBondContact CB-O 3.03Å; S343-P640 PolarHBondContact OG-O 3.36Å
344	Y	92.3	Very high	89.7	Confident	9 Å²	9	27.8 Å²	27.8	4%	0.035	15%	0.147	C	C	.	.	H	α-helix	trans	-61.2	-42.9	174.6	-164.3	-103.2	0	0	0	112.3	T340 L341 S342 F347 L348 Y381 S464 R467 L468 F471	T340-Y344 WeakPolarHBondContact O-CB 3.48Å; T340-Y344 PolarHBondContact O-N 3.36Å; L341-Y344 WeakPolarHBondContact O-CB 3.42Å; L341-Y344 PolarHBondContact O-N 2.82Å; S342-Y344 VanDerWaalsContact C-N 3.31Å; S342-Y344 PolarHBondContact O-N 3.06Å; Y344-F347 HydrophobicContact CD2-CD1 4.21Å; Y344-F347 AromaticContact CE2-CD1 3.91Å; Y344-F347 HydrophobicContact CE2-CD1 3.91Å; Y344-F347 HydrophobicContact CE2-CE1 4.05Å; Y344-F347 WeakPolarHBondContact O-CB 3.37Å; Y344-F347 PolarHBondContact O-N 3.48Å; Y344-L348 HydrophobicContact CD1-CD1 3.82Å; Y344-L348 HydrophobicContact CD1-CG 4.1Å; Y344-L348 HydrophobicContact CE1-CD1 3.49Å; Y344-L348 VanDerWaalsContact CE1-CD1 3.49Å; Y344-L348 HydrophobicContact CE1-CD2 4.08Å; Y344-L348 HydrophobicContact CE1-CG 3.74Å; Y344-L348 WeakPolarHBondContact O-CG 3.49Å; Y344-L348 PolarHBondContact O-N 3.38Å; Y344-Y381 HydrophobicContact CD2-CE1 4.47Å; Y344-Y381 VanDerWaalsContact CD2-OH 3.28Å; Y344-Y381 WeakPolarHBondContact CD2-OH 3.34Å; Y344-S464 VanDerWaalsContact OH-C 3.31Å; Y344-S464 WeakPolarHBondContact OH-CA 3.22Å; Y344-S464 PolarHBondContact OH-O 3.48Å; Y344-R467 HydrophobicContact CE1-CB 4.12Å; Y344-R467 HydrophobicContact CE1-CG 4.16Å; Y344-R467 HydrophobicContact CE2-CB 4.48Å; Y344-R467 HydrophobicContact CE2-CG 4.01Å; Y344-R467 WeakPolarHBondContact OH-CB 3.41Å; Y344-L468 HydrophobicContact CD1-CD2 3.94Å; Y344-L468 HydrophobicContact CE1-CD2 4.01Å; Y344-L468 HydrophobicContact CE1-CG 4.23Å; Y344-F471 HydrophobicContact CD1-CD2 4.14Å; Y344-F471 AromaticContact CD1-CE2 3.54Å; Y344-F471 HydrophobicContact CD1-CE2 3.54Å; Y344-F471 HydrophobicContact CD1-CZ 4.46Å; Y344-F471 HydrophobicContact CD2-CE2 4.27Å; Y344-F471 HydrophobicContact CE1-CE2 4.2Å; Y344-F471 AromaticContact CG-CE2 3.63Å; Y344-F471 HydrophobicContact CG-CE2 3.63Å; Y344-F471 HydrophobicContact CG-CZ 4.13Å
345	L	92.5	Very high	89.9	Confident	87 Å²	87	28 Å²	28	46%	0.455	15%	0.15	S	C	.	.	H	α-helix	trans	-65.6	-41.1	176.5	-68	175.1	0	0	0	112.1	L341 S342 S343 F347 L348 F349 L468	L341-L345 HydrophobicContact CD1-CD1 4.21Å; L341-L345 HydrophobicContact CD1-CG 4.16Å; L341-L345 HydrophobicContact CG-CD1 4.33Å; L341-L345 WeakPolarHBondContact O-CG 3.41Å; L341-L345 PolarHBondContact O-N 3.24Å; S342-L345 PolarHBondContact O-N 3.43Å; S343-L345 PolarHBondContact O-N 3.1Å; L345-F347 VanDerWaalsContact C-N 3.34Å; L345-L348 PolarHBondContact O-N 3.48Å; L345-F349 WeakPolarHBondContact O-CB 3.31Å; L345-F349 PolarHBondContact O-N 3.42Å; L345-L468 HydrophobicContact CD2-CD2 3.88Å
346	C	91	Very high	90.2	Very high	60 Å²	60	33.1 Å²	33.1	41%	0.405	19%	0.185	S	C	.	.	H	α-helix	trans	-62.1	-41.9	173	-70.1	0	0	0	0	111.7	S342 S343 F349 A350	S342-C346 PolarHBondContact O-N 2.91Å; S342-C346 PolarHBondContact O-SG 3.29Å; S342-C346 VanDerWaalsContact O-SG 3.38Å; S343-C346 PolarHBondContact O-N 2.72Å; C346-F349 PolarHBondContact O-N 2.92Å; C346-A350 WeakPolarHBondContact O-CB 3.43Å; C346-A350 PolarHBondContact O-N 2.96Å
347	F	93.2	Very high	90.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-48	173.7	161.9	-101.7	0	0	0	112.5	S343 Y344 L345 F349 A350 L351 V378 Y381 F417	S343-F347 WeakPolarHBondContact O-CB 3.44Å; S343-F347 PolarHBondContact O-N 3.24Å; Y344-F347 HydrophobicContact CD2-CD1 4.21Å; Y344-F347 AromaticContact CE2-CD1 3.91Å; Y344-F347 HydrophobicContact CE2-CD1 3.91Å; Y344-F347 HydrophobicContact CE2-CE1 4.05Å; Y344-F347 WeakPolarHBondContact O-CB 3.37Å; Y344-F347 PolarHBondContact O-N 3.48Å; L345-F347 VanDerWaalsContact C-N 3.34Å; F347-F349 VanDerWaalsContact C-N 3.32Å; F347-F349 PolarHBondContact O-N 2.97Å; F347-A350 PolarHBondContact O-N 3.31Å; F347-L351 HydrophobicContact CE1-CD2 4.48Å; F347-L351 HydrophobicContact CZ-CD2 4.21Å; F347-L351 WeakPolarHBondContact O-CB 3.18Å; F347-L351 PolarHBondContact O-N 2.83Å; F347-V378 HydrophobicContact CE2-CG1 4.12Å; F347-V378 HydrophobicContact CE2-CG2 4.5Å; F347-Y381 HydrophobicContact CB-CD1 4.14Å; F347-Y381 HydrophobicContact CB-CD2 3.7Å; F347-Y381 HydrophobicContact CB-CE1 4.14Å; F347-Y381 HydrophobicContact CB-CE2 3.69Å; F347-Y381 HydrophobicContact CB-CG 3.96Å; F347-Y381 HydrophobicContact CD1-CD1 4.07Å; F347-Y381 AromaticContact CD1-CE1 3.81Å; F347-Y381 HydrophobicContact CD1-CE1 3.81Å; F347-Y381 AromaticContact CD2-CD1 3.25Å; F347-Y381 HydrophobicContact CD2-CD1 3.25Å; F347-Y381 HydrophobicContact CD2-CD2 4.06Å; F347-Y381 AromaticContact CD2-CE1 3.87Å; F347-Y381 HydrophobicContact CD2-CE1 3.87Å; F347-Y381 AromaticContact CD2-CG 3.4Å; F347-Y381 HydrophobicContact CD2-CG 3.4Å; F347-Y381 HydrophobicContact CE1-CD1 4.28Å; F347-Y381 HydrophobicContact CE1-CE1 4.12Å; F347-Y381 AromaticContact CE2-CD1 3.48Å; F347-Y381 HydrophobicContact CE2-CD1 3.48Å; F347-Y381 VanDerWaalsContact CE2-CD1 3.48Å; F347-Y381 HydrophobicContact CE2-CE1 4.15Å; F347-Y381 HydrophobicContact CE2-CG 4.02Å; F347-Y381 AromaticContact CG-CD1 3.54Å; F347-Y381 HydrophobicContact CG-CD1 3.54Å; F347-Y381 HydrophobicContact CG-CD2 4.04Å; F347-Y381 AromaticContact CG-CE1 3.66Å; F347-Y381 HydrophobicContact CG-CE1 3.66Å; F347-Y381 HydrophobicContact CG-CE2 4.13Å; F347-Y381 AromaticContact CG-CG 3.78Å; F347-Y381 HydrophobicContact CG-CG 3.78Å; F347-Y381 AromaticContact CG-CZ 3.98Å; F347-Y381 AromaticContact CZ-CD1 3.99Å; F347-Y381 HydrophobicContact CZ-CD1 3.99Å; F347-Y381 HydrophobicContact CZ-CE1 4.25Å; F347-F417 HydrophobicContact CE2-CZ 4.12Å; F347-F417 HydrophobicContact CZ-CE1 4.31Å; F347-F417 AromaticContact CZ-CE2 3.89Å; F347-F417 HydrophobicContact CZ-CE2 3.89Å; F347-F417 AromaticContact CZ-CZ 3.49Å; F347-F417 HydrophobicContact CZ-CZ 3.49Å; F347-F417 VanDerWaalsContact CZ-CZ 3.49Å
348	L	93.7	Very high	89.3	Confident	11 Å²	11	38.4 Å²	38.4	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-41.9	176.6	-73.9	179.8	0	0	0	112.1	Y344 L345 L351 N352 S464 L468	Y344-L348 HydrophobicContact CD1-CD1 3.82Å; Y344-L348 HydrophobicContact CD1-CG 4.1Å; Y344-L348 HydrophobicContact CE1-CD1 3.49Å; Y344-L348 VanDerWaalsContact CE1-CD1 3.49Å; Y344-L348 HydrophobicContact CE1-CD2 4.08Å; Y344-L348 HydrophobicContact CE1-CG 3.74Å; Y344-L348 WeakPolarHBondContact O-CG 3.49Å; Y344-L348 PolarHBondContact O-N 3.38Å; L345-L348 PolarHBondContact O-N 3.48Å; L348-L351 PolarHBondContact O-N 3.23Å; L348-N352 WeakPolarHBondContact O-CB 3.18Å; L348-N352 PolarHBondContact O-N 3.31Å; L348-N352 PolarHBondContact O-ND2 2.9Å; L348-S464 WeakPolarHBondContact CD2-O 3.02Å; L348-L468 HydrophobicContact CD1-CD1 3.7Å; L348-L468 HydrophobicContact CD1-CD2 3.59Å; L348-L468 HydrophobicContact CD1-CG 3.61Å
349	F	92.9	Very high	88.6	Confident	137 Å²	137	45.2 Å²	45.2	60%	0.601	25%	0.248	S	C	*	.	H	α-helix	trans	-62.6	-46.2	176.2	-177.2	-107.3	0	0	0	111.1	L345 C346 F347 L351 N352 L353	L345-F349 WeakPolarHBondContact O-CB 3.31Å; L345-F349 PolarHBondContact O-N 3.42Å; C346-F349 PolarHBondContact O-N 2.92Å; F347-F349 VanDerWaalsContact C-N 3.32Å; F347-F349 PolarHBondContact O-N 2.97Å; F349-L351 PolarHBondContact O-N 3.11Å; F349-N352 PolarHBondContact O-N 3.02Å; F349-L353 HydrophobicContact CD1-CD1 3.83Å; F349-L353 HydrophobicContact CD1-CG 4.27Å; F349-L353 HydrophobicContact CE1-CD1 3.31Å; F349-L353 HydrophobicContact CE1-CG 3.97Å; F349-L353 HydrophobicContact CE2-CD1 4.49Å; F349-L353 HydrophobicContact CE2-CD2 4.39Å; F349-L353 HydrophobicContact CE2-CG 4.32Å; F349-L353 HydrophobicContact CZ-CD1 3.7Å; F349-L353 HydrophobicContact CZ-CD2 4.13Å; F349-L353 HydrophobicContact CZ-CG 3.99Å; F349-L353 WeakPolarHBondContact O-CB 3.24Å; F349-L353 VanDerWaalsContact O-CG 3.32Å; F349-L353 WeakPolarHBondContact O-CG 3.45Å; F349-L353 PolarHBondContact O-N 2.97Å
350	A	92.5	Very high	88.2	Confident	5 Å²	5	48.2 Å²	48.2	4%	0.041	26%	0.262	C	S	.	.	H	α-helix	trans	-59.3	-45.2	175.2	0	0	0	0	0	112	C346 F347 L353 V354 L374 Y377	C346-A350 WeakPolarHBondContact O-CB 3.43Å; C346-A350 PolarHBondContact O-N 2.96Å; F347-A350 PolarHBondContact O-N 3.31Å; A350-L353 PolarHBondContact O-N 2.96Å; A350-V354 WeakPolarHBondContact O-CG2 3.43Å; A350-V354 PolarHBondContact O-N 3.22Å; A350-L374 HydrophobicContact CB-CD2 3.93Å; A350-Y377 HydrophobicContact CB-CD1 3.77Å; A350-Y377 HydrophobicContact CB-CE1 3.87Å
351	L	92.8	Very high	87.5	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-44.1	179.2	-171.6	67.7	0	0	0	111.7	F347 L348 F349 V354 A355 V378 F417 F457 L461 S464	F347-L351 HydrophobicContact CE1-CD2 4.48Å; F347-L351 HydrophobicContact CZ-CD2 4.21Å; F347-L351 WeakPolarHBondContact O-CB 3.18Å; F347-L351 PolarHBondContact O-N 2.83Å; L348-L351 PolarHBondContact O-N 3.23Å; F349-L351 PolarHBondContact O-N 3.11Å; L351-V354 PolarHBondContact O-N 2.98Å; L351-A355 PolarHBondContact O-N 3.2Å; L351-V378 HydrophobicContact CD1-CG1 4.07Å; L351-V378 HydrophobicContact CD1-CG2 4.32Å; L351-F417 HydrophobicContact CD1-CE1 4.39Å; L351-F417 HydrophobicContact CD2-CZ 4.38Å; L351-F457 HydrophobicContact CD1-CE2 3.85Å; L351-F457 HydrophobicContact CD1-CZ 3.94Å; L351-L461 HydrophobicContact CD2-CD1 3.97Å; L351-L461 HydrophobicContact CG-CD1 4Å; L351-S464 WeakPolarHBondContact CD2-OG 3.42Å
352	N	91.6	Very high	86.8	Confident	60 Å²	60	49.3 Å²	49.3	32%	0.321	27%	0.267	S	S	.	.	H	α-helix	trans	-66.4	-37.5	175.1	-80.9	-85.6	0	0	0	111.9	L348 F349 V354 A355 C356	L348-N352 WeakPolarHBondContact O-CB 3.18Å; L348-N352 PolarHBondContact O-N 3.31Å; L348-N352 PolarHBondContact O-ND2 2.9Å; F349-N352 PolarHBondContact O-N 3.02Å; N352-V354 VanDerWaalsContact C-N 3.33Å; N352-V354 PolarHBondContact O-N 3.43Å; N352-A355 WeakPolarHBondContact O-CB 3.45Å; N352-A355 PolarHBondContact O-N 3.45Å; N352-C356 PolarHBondContact O-N 3.34Å; N352-C356 PolarHBondContact O-SG 3.13Å; N352-C356 VanDerWaalsContact O-SG 3.4Å
353	L	91.5	Very high	85.9	Confident	40 Å²	40	49.3 Å²	49.3	21%	0.209	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-37.7	174.3	-76.8	-173.2	0	0	0	112.3	F349 A350 A355 C356 R357 L374	F349-L353 HydrophobicContact CD1-CD1 3.83Å; F349-L353 HydrophobicContact CD1-CG 4.27Å; F349-L353 HydrophobicContact CE1-CD1 3.31Å; F349-L353 HydrophobicContact CE1-CG 3.97Å; F349-L353 HydrophobicContact CE2-CD1 4.49Å; F349-L353 HydrophobicContact CE2-CD2 4.39Å; F349-L353 HydrophobicContact CE2-CG 4.32Å; F349-L353 HydrophobicContact CZ-CD1 3.7Å; F349-L353 HydrophobicContact CZ-CD2 4.13Å; F349-L353 HydrophobicContact CZ-CG 3.99Å; F349-L353 WeakPolarHBondContact O-CB 3.24Å; F349-L353 VanDerWaalsContact O-CG 3.32Å; F349-L353 WeakPolarHBondContact O-CG 3.45Å; F349-L353 PolarHBondContact O-N 2.97Å; A350-L353 PolarHBondContact O-N 2.96Å; L353-A355 VanDerWaalsContact C-N 3.32Å; L353-C356 PolarHBondContact O-N 3.3Å; L353-R357 VanDerWaalsContact O-CB 3.24Å; L353-R357 WeakPolarHBondContact O-CB 3.43Å; L353-R357 WeakPolarHBondContact O-CG 3.4Å; L353-R357 PolarHBondContact O-N 2.88Å; L353-R357 VanDerWaalsContact O-N 3.11Å; L353-L374 HydrophobicContact CB-CD1 3.86Å; L353-L374 HydrophobicContact CD1-CD1 4.36Å
354	V	90	Very high	84.9	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-39.6	172.5	172.2	0	0	0	0	110.6	A350 L351 N352 W362 L374 F457	A350-V354 WeakPolarHBondContact O-CG2 3.43Å; A350-V354 PolarHBondContact O-N 3.22Å; L351-V354 PolarHBondContact O-N 2.98Å; N352-V354 VanDerWaalsContact C-N 3.33Å; N352-V354 PolarHBondContact O-N 3.43Å; V354-W362 HydrophobicContact CG1-CH2 4.14Å; V354-L374 HydrophobicContact CG2-CB 3.48Å; V354-L374 VanDerWaalsContact CG2-CB 3.48Å; V354-L374 HydrophobicContact CG2-CD1 4.1Å; V354-L374 HydrophobicContact CG2-CG 4.45Å; V354-F457 HydrophobicContact CB-CZ 4.5Å; V354-F457 HydrophobicContact CG1-CZ 3.94Å
355	A	89.1	Confident	84.1	Confident	20 Å²	20	54 Å²	54	17%	0.165	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-34.2	177.4	0	0	0	0	0	113.3	L351 N352 L353 H360 F457 L461	L351-A355 PolarHBondContact O-N 3.2Å; N352-A355 WeakPolarHBondContact O-CB 3.45Å; N352-A355 PolarHBondContact O-N 3.45Å; L353-A355 VanDerWaalsContact C-N 3.32Å; A355-H360 PolarHBondContact O-CE1 3.34Å; A355-H360 PolarHBondContact O-NE2 2.81Å; A355-F457 HydrophobicContact CB-CE1 3.94Å; A355-L461 HydrophobicContact CB-CD2 4.21Å
356	C	87.7	Confident	83.3	Confident	109 Å²	109	50.8 Å²	50.8	74%	0.736	28%	0.276	S	S	*	.	H	α-helix	trans	-89.4	-12.4	-179	-66.4	0	0	0	0	114	N352 L353	N352-C356 PolarHBondContact O-N 3.34Å; N352-C356 PolarHBondContact O-SG 3.13Å; N352-C356 VanDerWaalsContact O-SG 3.4Å; L353-C356 PolarHBondContact O-N 3.3Å
357	R	84	Confident	82.4	Confident	106 Å²	106	55 Å²	55	40%	0.4	30%	0.295	S	S	.	.	S	Bend	trans	-102.1	124.1	-173.6	-79.1	-166.3	156.9	99.4	1.8	113.8	L353 K371	L353-R357 VanDerWaalsContact O-CB 3.24Å; L353-R357 WeakPolarHBondContact O-CB 3.43Å; L353-R357 WeakPolarHBondContact O-CG 3.4Å; L353-R357 PolarHBondContact O-N 2.88Å; L353-R357 VanDerWaalsContact O-N 3.11Å; R357-K371 PolarHBondContact O-NZ 3.35Å
358	G	72.1	Confident	81.9	Confident	51 Å²	51	59.3 Å²	59.3	53%	0.526	32%	0.317	S	S	.	.	S	Bend	trans	73.2	-174.4	168.6	0	0	0	0	0	113.7
359	K	72.8	Confident	81.5	Confident	167 Å²	167	66.7 Å²	66.7	73%	0.726	35%	0.351	S	S	*	.			trans	-75.5	143.9	170.2	-66.6	-179.9	-179.5	177.4	0	109.7	D361 K371	K359-D361 WeakPolarHBondContact CB-OD2 2.98Å; K359-D361 PolarHBondContact O-N 3.36Å; K359-K371 PolarHBondContact O-NZ 2.84Å
360	H	75.7	Confident	81.2	Confident	67 Å²	67	64.2 Å²	64.2	31%	0.31	34%	0.344	S	S	.	.			trans	-83.2	71.8	176.2	-61.4	-62.1	0	0	0	109.5	A355 W362 E450	A355-H360 PolarHBondContact O-CE1 3.34Å; A355-H360 PolarHBondContact O-NE2 2.81Å; H360-W362 HydrophobicContact CB-CZ2 4.49Å; H360-W362 AromaticContact ND1-CZ2 3.91Å; H360-E450 VanDerWaalsContact O-OE1 3.09Å
361	D	73.5	Confident	81	Confident	73 Å²	73	64.4 Å²	64.4	39%	0.39	34%	0.344	S	S	.	.			trans	-101.3	101.5	173.8	-57.2	-36.1	0	0	0	107.5	K359 R363	K359-D361 WeakPolarHBondContact CB-OD2 2.98Å; K359-D361 PolarHBondContact O-N 3.36Å; D361-R363 VanDerWaalsContact C-N 3.32Å
362	W	76.4	Confident	80.7	Confident	1 Å²	1	68 Å²	68	0%	0.004	36%	0.36	C	S	.	.			trans	-93.4	12.4	179.8	-51.3	112.8	0	0	0	112.8	V354 H360 L375 F420 F424 E450 L453 F457	V354-W362 HydrophobicContact CG1-CH2 4.14Å; H360-W362 HydrophobicContact CB-CZ2 4.49Å; H360-W362 AromaticContact ND1-CZ2 3.91Å; W362-L375 HydrophobicContact CZ3-CD1 4.34Å; W362-F420 HydrophobicContact CD2-CE2 4.46Å; W362-F420 HydrophobicContact CD2-CZ 4.07Å; W362-F420 AromaticContact CE3-CZ 3.88Å; W362-F420 HydrophobicContact CE3-CZ 3.88Å; W362-F420 AromaticContact CH2-CZ 4Å; W362-F420 HydrophobicContact CH2-CZ 4Å; W362-F420 HydrophobicContact CZ2-CZ 4.2Å; W362-F420 AromaticContact CZ3-CZ 3.84Å; W362-F420 HydrophobicContact CZ3-CZ 3.84Å; W362-F424 HydrophobicContact CB-CD2 4.03Å; W362-F424 HydrophobicContact CB-CE2 4.4Å; W362-F424 HydrophobicContact CE3-CD2 4.22Å; W362-F424 HydrophobicContact CE3-CE2 4.24Å; W362-F424 WeakPolarHBondContact O-CD2 3.21Å; W362-E450 WeakPolarHBondContact CA-OE1 3.34Å; W362-E450 VanDerWaalsContact CB-OE1 3.26Å; W362-E450 WeakPolarHBondContact CB-OE1 3.49Å; W362-E450 WeakPolarHBondContact CB-OE2 2.94Å; W362-E450 PolarHBondContact N-OE1 2.84Å; W362-L453 HydrophobicContact CB-CD1 4.12Å; W362-F457 HydrophobicContact CH2-CD2 4.27Å; W362-F457 HydrophobicContact CH2-CE1 4.46Å; W362-F457 HydrophobicContact CH2-CE2 4.16Å; W362-F457 HydrophobicContact CH2-CG 4.48Å; W362-F457 HydrophobicContact CH2-CZ 4.26Å; W362-F457 HydrophobicContact CZ2-CD1 4.07Å; W362-F457 HydrophobicContact CZ2-CD2 4.27Å; W362-F457 HydrophobicContact CZ2-CE1 4.31Å; W362-F457 HydrophobicContact CZ2-CG 4.05Å
363	R	69.1	Low	80.6	Confident	20 Å²	20	68.7 Å²	68.7	8%	0.075	37%	0.369	C	S	.	.	S	Bend	trans	-90	-38.7	176.8	-59.2	179.2	-176.6	163	-0.7	112.7	D361 Q436 W444	D361-R363 VanDerWaalsContact C-N 3.32Å; R363-Q436 PolarHBondContact NH1-O 3.26Å; R363-Q436 VanDerWaalsContact NH1-O 3.1Å; R363-W444 VanDerWaalsContact CZ-CZ2 3.45Å
364	S	69.2	Low	80.6	Confident	42 Å²	42	68.2 Å²	68.2	29%	0.294	37%	0.367	S	S	.	.	S	Bend	trans	-110.4	159.2	178.9	59.4	0	0	0	0	110.3
365	L	75.4	Confident	80.6	Confident	76 Å²	76	68.7 Å²	68.7	40%	0.398	37%	0.369	S	S	.	.			trans	-58	133.7	164.2	-76.7	147.8	0	0	0	108.2	D367 F372 F428	L365-D367 PolarHBondContact O-N 3.4Å; L365-F372 HydrophobicContact CD2-CD2 3.7Å; L365-F372 HydrophobicContact CD2-CE2 3.19Å; L365-F372 HydrophobicContact CD2-CZ 3.99Å; L365-F428 HydrophobicContact CD1-CD2 4.38Å; L365-F428 HydrophobicContact CD1-CE2 3.41Å; L365-F428 VanDerWaalsContact CD1-CE2 3.41Å; L365-F428 HydrophobicContact CD1-CZ 3.66Å; L365-F428 HydrophobicContact CG-CD2 4.3Å; L365-F428 HydrophobicContact CG-CE2 3.77Å; L365-F428 HydrophobicContact CG-CZ 4.38Å
366	P	74.9	Confident	80.7	Confident	18 Å²	18	71.1 Å²	71.1	12%	0.117	38%	0.379	C	S	.	.			trans	-58.3	124	175.6	-23.1	32	0	0	0	110.6	D368 K371	P366-D368 PolarHBondContact O-N 2.8Å; P366-K371 HydrophobicContact CB-CB 4.05Å; P366-K371 HydrophobicContact CB-CD 3.93Å; P366-K371 HydrophobicContact CB-CG 3.91Å; P366-K371 HydrophobicContact CG-CD 4.22Å; P366-K371 HydrophobicContact CG-CG 4.06Å
367	D	72.3	Confident	80.9	Confident	150 Å²	150	68.9 Å²	68.9	80%	0.802	36%	0.355	S	S	*	.	S	Bend	trans	-60.5	-30	175.1	-64.9	-35.8	0	0	0	111.3	L365 H369	L365-D367 PolarHBondContact O-N 3.4Å; D367-H369 PolarHBondContact O-N 2.93Å
368	D	82.3	Confident	81.3	Confident	89 Å²	89	64 Å²	64	48%	0.476	34%	0.337	S	S	.	.			trans	-67.2	102.3	173.7	-75.3	-25.7	0	0	0	111	P366 L370 K371 F372	P366-D368 PolarHBondContact O-N 2.8Å; D368-L370 PolarHBondContact O-N 3.19Å; D368-K371 HydrophobicContact CB-CB 3.81Å; D368-K371 PolarHBondContact O-N 3.21Å; D368-F372 PolarHBondContact O-N 3.49Å
369	H	85.3	Confident	82.3	Confident	166 Å²	166	64.3 Å²	64.3	77%	0.769	33%	0.327	S	S	*	.	H	α-helix	trans	-49.9	-35.1	176.1	-63.8	-48.4	0	0	0	113.5	D367 S373	D367-H369 PolarHBondContact O-N 2.93Å; H369-S373 VanDerWaalsContact O-CB 3.29Å; H369-S373 WeakPolarHBondContact O-CB 3.41Å; H369-S373 PolarHBondContact O-N 2.8Å
370	L	88	Confident	83.3	Confident	86 Å²	86	59.6 Å²	59.6	45%	0.45	31%	0.309	S	S	.	.	H	α-helix	trans	-69.1	-43.6	177.4	-175	144.6	0	0	0	111.7	D368 F372 S373 L374	D368-L370 PolarHBondContact O-N 3.19Å; L370-F372 VanDerWaalsContact C-N 3.34Å; L370-S373 PolarHBondContact O-N 2.89Å; L370-L374 HydrophobicContact CD2-CD1 3.54Å; L370-L374 HydrophobicContact CD2-CG 4.24Å; L370-L374 HydrophobicContact CG-CD1 4.43Å; L370-L374 WeakPolarHBondContact O-CB 3.36Å; L370-L374 VanDerWaalsContact O-CG 3.27Å; L370-L374 WeakPolarHBondContact O-CG 3.45Å; L370-L374 PolarHBondContact O-N 3.47Å
371	K	86.6	Confident	84.1	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.035	30%	0.296	C	S	.	.	H	α-helix	trans	-64.9	-41.9	177.1	-178	170.4	173	172	0	110.7	R357 K359 P366 D368 L374 L375	R357-K371 PolarHBondContact O-NZ 3.35Å; K359-K371 PolarHBondContact O-NZ 2.84Å; P366-K371 HydrophobicContact CB-CB 4.05Å; P366-K371 HydrophobicContact CB-CD 3.93Å; P366-K371 HydrophobicContact CB-CG 3.91Å; P366-K371 HydrophobicContact CG-CD 4.22Å; P366-K371 HydrophobicContact CG-CG 4.06Å; D368-K371 HydrophobicContact CB-CB 3.81Å; D368-K371 PolarHBondContact O-N 3.21Å; K371-L374 PolarHBondContact O-N 3.06Å; K371-L375 WeakPolarHBondContact O-CB 3.5Å; K371-L375 PolarHBondContact O-N 3.39Å
372	F	87	Confident	85	Confident	77 Å²	77	53.7 Å²	53.7	34%	0.338	28%	0.28	S	S	.	.	H	α-helix	trans	-61.1	-47.2	174.9	-179.3	-114	0	0	0	112.3	L365 D368 L370 L374 L375 I376	L365-F372 HydrophobicContact CD2-CD2 3.7Å; L365-F372 HydrophobicContact CD2-CE2 3.19Å; L365-F372 HydrophobicContact CD2-CZ 3.99Å; D368-F372 PolarHBondContact O-N 3.49Å; L370-F372 VanDerWaalsContact C-N 3.34Å; F372-L374 PolarHBondContact O-N 2.95Å; F372-L375 PolarHBondContact O-N 3.42Å; F372-I376 HydrophobicContact CD1-CD1 3.84Å; F372-I376 HydrophobicContact CD2-CD1 4.46Å; F372-I376 HydrophobicContact CE1-CD1 3.37Å; F372-I376 HydrophobicContact CE1-CG1 4.47Å; F372-I376 HydrophobicContact CE2-CD1 4.02Å; F372-I376 HydrophobicContact CE2-CG1 4.33Å; F372-I376 HydrophobicContact CG-CD1 4.38Å; F372-I376 HydrophobicContact CZ-CD1 3.49Å; F372-I376 VanDerWaalsContact CZ-CD1 3.49Å; F372-I376 HydrophobicContact CZ-CG1 4.25Å; F372-I376 WeakPolarHBondContact O-CG1 3.44Å; F372-I376 PolarHBondContact O-N 3.34Å
373	S	90	Very high	85.8	Confident	75 Å²	75	56.8 Å²	56.8	52%	0.524	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-43.2	176.9	-177.8	0	0	0	0	112.4	H369 L370 I376 Y377	H369-S373 VanDerWaalsContact O-CB 3.29Å; H369-S373 WeakPolarHBondContact O-CB 3.41Å; H369-S373 PolarHBondContact O-N 2.8Å; L370-S373 PolarHBondContact O-N 2.89Å; S373-I376 PolarHBondContact O-N 3.29Å; S373-Y377 PolarHBondContact O-N 3.48Å
374	L	90.9	Very high	86.9	Confident	30 Å²	30	55.8 Å²	55.8	16%	0.157	29%	0.292	C	S	.	.	H	α-helix	trans	-64.9	-39	175.4	-70	176.1	0	0	0	112.2	A350 L353 V354 L370 K371 F372 Y377 V378	A350-L374 HydrophobicContact CB-CD2 3.93Å; L353-L374 HydrophobicContact CB-CD1 3.86Å; L353-L374 HydrophobicContact CD1-CD1 4.36Å; V354-L374 HydrophobicContact CG2-CB 3.48Å; V354-L374 VanDerWaalsContact CG2-CB 3.48Å; V354-L374 HydrophobicContact CG2-CD1 4.1Å; V354-L374 HydrophobicContact CG2-CG 4.45Å; L370-L374 HydrophobicContact CD2-CD1 3.54Å; L370-L374 HydrophobicContact CD2-CG 4.24Å; L370-L374 HydrophobicContact CG-CD1 4.43Å; L370-L374 WeakPolarHBondContact O-CB 3.36Å; L370-L374 VanDerWaalsContact O-CG 3.27Å; L370-L374 WeakPolarHBondContact O-CG 3.45Å; L370-L374 PolarHBondContact O-N 3.47Å; K371-L374 PolarHBondContact O-N 3.06Å; F372-L374 PolarHBondContact O-N 2.95Å; L374-Y377 WeakPolarHBondContact O-CB 3.34Å; L374-Y377 PolarHBondContact O-N 3.22Å; L374-V378 WeakPolarHBondContact O-CG2 3.46Å; L374-V378 PolarHBondContact O-N 3.02Å
375	L	90.5	Very high	87.9	Confident	11 Å²	11	55.2 Å²	55.2	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-41.9	177	-173.1	68.4	0	0	0	111.5	W362 K371 F372 Y377 V378 L379 F420 F421 F424	W362-L375 HydrophobicContact CZ3-CD1 4.34Å; K371-L375 WeakPolarHBondContact O-CB 3.5Å; K371-L375 PolarHBondContact O-N 3.39Å; F372-L375 PolarHBondContact O-N 3.42Å; L375-Y377 VanDerWaalsContact C-N 3.34Å; L375-V378 PolarHBondContact O-N 2.93Å; L375-L379 PolarHBondContact O-N 3.47Å; L375-F420 HydrophobicContact CD1-CE1 4.48Å; L375-F421 HydrophobicContact CD1-CE1 3.76Å; L375-F421 HydrophobicContact CD1-CZ 4.15Å; L375-F421 HydrophobicContact CG-CE1 4.04Å; L375-F424 HydrophobicContact CD2-CE1 4.07Å; L375-F424 HydrophobicContact CD2-CZ 3.99Å
376	I	91.5	Very high	88.7	Confident	72 Å²	72	52.8 Å²	52.8	37%	0.369	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-44.4	172.9	-68.7	165.4	0	0	0	110.6	F372 S373 V378 L379 L380	F372-I376 HydrophobicContact CD1-CD1 3.84Å; F372-I376 HydrophobicContact CD2-CD1 4.46Å; F372-I376 HydrophobicContact CE1-CD1 3.37Å; F372-I376 HydrophobicContact CE1-CG1 4.47Å; F372-I376 HydrophobicContact CE2-CD1 4.02Å; F372-I376 HydrophobicContact CE2-CG1 4.33Å; F372-I376 HydrophobicContact CG-CD1 4.38Å; F372-I376 HydrophobicContact CZ-CD1 3.49Å; F372-I376 VanDerWaalsContact CZ-CD1 3.49Å; F372-I376 HydrophobicContact CZ-CG1 4.25Å; F372-I376 WeakPolarHBondContact O-CG1 3.44Å; F372-I376 PolarHBondContact O-N 3.34Å; S373-I376 PolarHBondContact O-N 3.29Å; I376-V378 PolarHBondContact O-N 3.44Å; I376-L379 WeakPolarHBondContact O-CB 3.25Å; I376-L379 PolarHBondContact O-N 2.84Å; I376-L380 HydrophobicContact CG2-CD1 3.92Å; I376-L380 HydrophobicContact CG2-CG 4.3Å; I376-L380 WeakPolarHBondContact O-CG 3.47Å; I376-L380 PolarHBondContact O-N 3.32Å
377	Y	92.3	Very high	89.5	Confident	61 Å²	61	53.2 Å²	53.2	24%	0.239	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-43.6	177.1	173.2	-102.2	0	0	0	112.1	A350 S373 L374 L375 L379 L380 Y381 P641	A350-Y377 HydrophobicContact CB-CD1 3.77Å; A350-Y377 HydrophobicContact CB-CE1 3.87Å; S373-Y377 PolarHBondContact O-N 3.48Å; L374-Y377 WeakPolarHBondContact O-CB 3.34Å; L374-Y377 PolarHBondContact O-N 3.22Å; L375-Y377 VanDerWaalsContact C-N 3.34Å; Y377-L379 VanDerWaalsContact C-N 3.34Å; Y377-L379 PolarHBondContact O-N 3.18Å; Y377-L380 PolarHBondContact O-N 3.45Å; Y377-Y381 WeakPolarHBondContact O-CB 3.4Å; Y377-Y381 PolarHBondContact O-N 3.04Å; Y377-P641 HydrophobicContact CD2-CG 4.26Å; Y377-P641 HydrophobicContact CE2-CG 3.85Å
378	V	92.6	Very high	90.3	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-42.3	175.2	169.4	0	0	0	0	111	F347 L351 L374 L375 I376 Y381 A382 F417 F421	F347-V378 HydrophobicContact CE2-CG1 4.12Å; F347-V378 HydrophobicContact CE2-CG2 4.5Å; L351-V378 HydrophobicContact CD1-CG1 4.07Å; L351-V378 HydrophobicContact CD1-CG2 4.32Å; L374-V378 WeakPolarHBondContact O-CG2 3.46Å; L374-V378 PolarHBondContact O-N 3.02Å; L375-V378 PolarHBondContact O-N 2.93Å; I376-V378 PolarHBondContact O-N 3.44Å; V378-Y381 PolarHBondContact O-N 3.48Å; V378-A382 WeakPolarHBondContact O-CB 3.39Å; V378-A382 PolarHBondContact O-N 3.14Å; V378-F417 HydrophobicContact CG1-CD1 4.43Å; V378-F417 HydrophobicContact CG1-CE1 3.94Å; V378-F421 HydrophobicContact CB-CZ 4.47Å; V378-F421 HydrophobicContact CG1-CE2 4.28Å; V378-F421 HydrophobicContact CG1-CZ 3.97Å
379	L	92.5	Very high	90.7	Very high	59 Å²	59	42.6 Å²	42.6	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-61.6	-50.1	175.5	175.5	61.9	0	0	0	111.6	L375 I376 Y377 Y381 A382 L383 F421	L375-L379 PolarHBondContact O-N 3.47Å; I376-L379 WeakPolarHBondContact O-CB 3.25Å; I376-L379 PolarHBondContact O-N 2.84Å; Y377-L379 VanDerWaalsContact C-N 3.34Å; Y377-L379 PolarHBondContact O-N 3.18Å; L379-Y381 VanDerWaalsContact C-N 3.26Å; L379-Y381 PolarHBondContact O-N 3.42Å; L379-A382 PolarHBondContact O-N 2.93Å; L379-L383 HydrophobicContact CD1-CD1 3.95Å; L379-L383 HydrophobicContact CD1-CG 4.05Å; L379-L383 HydrophobicContact CG-CD1 4.02Å; L379-L383 HydrophobicContact CG-CG 4.48Å; L379-L383 WeakPolarHBondContact O-CB 3.39Å; L379-L383 WeakPolarHBondContact O-CG 3.34Å; L379-L383 PolarHBondContact O-N 3.03Å; L379-F421 HydrophobicContact CB-CD1 4.36Å; L379-F421 HydrophobicContact CB-CE1 3.78Å; L379-F421 HydrophobicContact CB-CE2 3.95Å; L379-F421 HydrophobicContact CB-CZ 3.56Å; L379-F421 HydrophobicContact CD1-CB 4.15Å; L379-F421 HydrophobicContact CD1-CD1 3.92Å; L379-F421 HydrophobicContact CD1-CD2 3.54Å; L379-F421 HydrophobicContact CD1-CE1 4.17Å; L379-F421 HydrophobicContact CD1-CE2 3.82Å; L379-F421 HydrophobicContact CD1-CG 3.6Å; L379-F421 HydrophobicContact CD1-CZ 4.13Å; L379-F421 HydrophobicContact CG-CE1 4.42Å; L379-F421 HydrophobicContact CG-CZ 4.42Å
380	L	92.9	Very high	90.9	Very high	67 Å²	67	38.8 Å²	38.8	35%	0.351	21%	0.206	S	C	.	.	H	α-helix	trans	-61.3	-37.7	178	-70.4	172.5	0	0	0	111.4	I376 Y377 G384 P641 L644	I376-L380 HydrophobicContact CG2-CD1 3.92Å; I376-L380 HydrophobicContact CG2-CG 4.3Å; I376-L380 WeakPolarHBondContact O-CG 3.47Å; I376-L380 PolarHBondContact O-N 3.32Å; Y377-L380 PolarHBondContact O-N 3.45Å; L380-G384 PolarHBondContact O-N 3.5Å; L380-P641 HydrophobicContact CB-CB 3.76Å; L380-L644 HydrophobicContact CD2-CD1 4.12Å; L380-L644 VanDerWaalsContact O-CD1 3.26Å; L380-L644 WeakPolarHBondContact O-CD1 3.38Å
381	Y	93.3	Very high	90.8	Very high	9 Å²	9	35.7 Å²	35.7	4%	0.035	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-50.4	175.5	-173.6	-82.2	0	0	0	111	Y344 F347 Y377 V378 L379 L383 G384 S385 P640	Y344-Y381 HydrophobicContact CD2-CE1 4.47Å; Y344-Y381 VanDerWaalsContact CD2-OH 3.28Å; Y344-Y381 WeakPolarHBondContact CD2-OH 3.34Å; F347-Y381 HydrophobicContact CB-CD1 4.14Å; F347-Y381 HydrophobicContact CB-CD2 3.7Å; F347-Y381 HydrophobicContact CB-CE1 4.14Å; F347-Y381 HydrophobicContact CB-CE2 3.69Å; F347-Y381 HydrophobicContact CB-CG 3.96Å; F347-Y381 HydrophobicContact CD1-CD1 4.07Å; F347-Y381 AromaticContact CD1-CE1 3.81Å; F347-Y381 HydrophobicContact CD1-CE1 3.81Å; F347-Y381 AromaticContact CD2-CD1 3.25Å; F347-Y381 HydrophobicContact CD2-CD1 3.25Å; F347-Y381 HydrophobicContact CD2-CD2 4.06Å; F347-Y381 AromaticContact CD2-CE1 3.87Å; F347-Y381 HydrophobicContact CD2-CE1 3.87Å; F347-Y381 AromaticContact CD2-CG 3.4Å; F347-Y381 HydrophobicContact CD2-CG 3.4Å; F347-Y381 HydrophobicContact CE1-CD1 4.28Å; F347-Y381 HydrophobicContact CE1-CE1 4.12Å; F347-Y381 AromaticContact CE2-CD1 3.48Å; F347-Y381 HydrophobicContact CE2-CD1 3.48Å; F347-Y381 VanDerWaalsContact CE2-CD1 3.48Å; F347-Y381 HydrophobicContact CE2-CE1 4.15Å; F347-Y381 HydrophobicContact CE2-CG 4.02Å; F347-Y381 AromaticContact CG-CD1 3.54Å; F347-Y381 HydrophobicContact CG-CD1 3.54Å; F347-Y381 HydrophobicContact CG-CD2 4.04Å; F347-Y381 AromaticContact CG-CE1 3.66Å; F347-Y381 HydrophobicContact CG-CE1 3.66Å; F347-Y381 HydrophobicContact CG-CE2 4.13Å; F347-Y381 AromaticContact CG-CG 3.78Å; F347-Y381 HydrophobicContact CG-CG 3.78Å; F347-Y381 AromaticContact CG-CZ 3.98Å; F347-Y381 AromaticContact CZ-CD1 3.99Å; F347-Y381 HydrophobicContact CZ-CD1 3.99Å; F347-Y381 HydrophobicContact CZ-CE1 4.25Å; Y377-Y381 WeakPolarHBondContact O-CB 3.4Å; Y377-Y381 PolarHBondContact O-N 3.04Å; V378-Y381 PolarHBondContact O-N 3.48Å; L379-Y381 VanDerWaalsContact C-N 3.26Å; L379-Y381 PolarHBondContact O-N 3.42Å; Y381-L383 PolarHBondContact O-N 3.02Å; Y381-G384 PolarHBondContact O-N 3.48Å; Y381-S385 WeakPolarHBondContact O-CB 2.91Å; Y381-S385 PolarHBondContact O-N 2.99Å; Y381-P640 HydrophobicContact CD2-CB 3.84Å; Y381-P640 HydrophobicContact CE1-CB 4.44Å; Y381-P640 HydrophobicContact CE2-CB 3.71Å; Y381-P640 HydrophobicContact CE2-CG 4.38Å; Y381-P640 WeakPolarHBondContact CE2-O 3.26Å; Y381-P640 HydrophobicContact CG-CB 4.25Å
382	A	92.7	Very high	90.7	Very high	7 Å²	7	35.4 Å²	35.4	6%	0.058	19%	0.19	C	C	.	.	H	α-helix	trans	-61.4	-43.6	-179.6	0	0	0	0	0	111.9	V378 L379 S385 L386 F417 F421	V378-A382 WeakPolarHBondContact O-CB 3.39Å; V378-A382 PolarHBondContact O-N 3.14Å; L379-A382 PolarHBondContact O-N 2.93Å; A382-S385 PolarHBondContact O-N 3.13Å; A382-L386 VanDerWaalsContact O-CB 3.3Å; A382-L386 WeakPolarHBondContact O-CB 2.91Å; A382-L386 PolarHBondContact O-N 3.25Å; A382-F417 HydrophobicContact CB-CB 3.68Å; A382-F417 HydrophobicContact CB-CD1 4.09Å; A382-F417 HydrophobicContact CB-CD2 4.13Å; A382-F417 HydrophobicContact CB-CG 3.71Å; A382-F421 HydrophobicContact CB-CE2 4.48Å
383	L	93	Very high	90.8	Very high	66 Å²	66	34 Å²	34	35%	0.346	19%	0.185	S	C	.	.	H	α-helix	trans	-62.3	-44.9	174	-72.7	175.2	0	0	0	111.4	L379 Y381 L386 T387 L644	L379-L383 HydrophobicContact CD1-CD1 3.95Å; L379-L383 HydrophobicContact CD1-CG 4.05Å; L379-L383 HydrophobicContact CG-CD1 4.02Å; L379-L383 HydrophobicContact CG-CG 4.48Å; L379-L383 WeakPolarHBondContact O-CB 3.39Å; L379-L383 WeakPolarHBondContact O-CG 3.34Å; L379-L383 PolarHBondContact O-N 3.03Å; Y381-L383 PolarHBondContact O-N 3.02Å; L383-L386 PolarHBondContact O-N 3.13Å; L383-T387 WeakPolarHBondContact O-CG2 3.2Å; L383-T387 PolarHBondContact O-N 3.47Å; L383-T387 PolarHBondContact O-OG1 3.44Å; L383-L644 HydrophobicContact CB-CD1 3.84Å; L383-L644 HydrophobicContact CB-CD2 4.32Å
384	G	91.6	Very high	90.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.4	-48.1	176	0	0	0	0	0	112.2	L380 Y381 L386 T387 I388	L380-G384 PolarHBondContact O-N 3.5Å; Y381-G384 PolarHBondContact O-N 3.48Å; G384-L386 PolarHBondContact O-N 2.81Å; G384-T387 PolarHBondContact O-N 3.46Å; G384-T387 PolarHBondContact O-OG1 3.41Å; G384-I388 WeakPolarHBondContact O-CG1 3.38Å; G384-I388 PolarHBondContact O-N 3.3Å; G384-I388 VanDerWaalsContact O-N 3.12Å
385	S	90.9	Very high	89.9	Confident	30 Å²	30	40.9 Å²	40.9	21%	0.21	20%	0.199	C	C	.	.	H	α-helix	trans	-59.4	-45.6	176.1	-168.4	0	0	0	0	111.7	Y381 A382 T387 I388 S389	Y381-S385 WeakPolarHBondContact O-CB 2.91Å; Y381-S385 PolarHBondContact O-N 2.99Å; A382-S385 PolarHBondContact O-N 3.13Å; S385-T387 PolarHBondContact O-N 2.94Å; S385-I388 PolarHBondContact O-N 2.95Å; S385-S389 PolarHBondContact O-N 3.36Å; S385-S389 PolarHBondContact O-OG 3.49Å
386	L	92.5	Very high	89.2	Confident	25 Å²	25	40.9 Å²	40.9	13%	0.131	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-41	178.4	-176.6	65.2	0	0	0	111.6	A382 L383 G384 I388 S389 L390 L411	A382-L386 VanDerWaalsContact O-CB 3.3Å; A382-L386 WeakPolarHBondContact O-CB 2.91Å; A382-L386 PolarHBondContact O-N 3.25Å; L383-L386 PolarHBondContact O-N 3.13Å; G384-L386 PolarHBondContact O-N 2.81Å; L386-I388 VanDerWaalsContact C-N 3.33Å; L386-I388 PolarHBondContact O-N 2.66Å; L386-S389 PolarHBondContact O-N 3.3Å; L386-L390 HydrophobicContact CD1-CD1 4.32Å; L386-L390 HydrophobicContact CD1-CG 4.23Å; L386-L390 HydrophobicContact CG-CD1 3.96Å; L386-L390 HydrophobicContact CG-CG 4.29Å; L386-L390 WeakPolarHBondContact O-CB 3.27Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.38Å; L386-L390 PolarHBondContact O-N 2.79Å; L386-L411 HydrophobicContact CD1-CD1 4.31Å
387	T	90.8	Very high	88.8	Confident	26 Å²	26	39 Å²	39	16%	0.16	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-40.9	175.8	56.1	0	0	0	0	112.1	L383 G384 S385 L390 T391 L644	L383-T387 WeakPolarHBondContact O-CG2 3.2Å; L383-T387 PolarHBondContact O-N 3.47Å; L383-T387 PolarHBondContact O-OG1 3.44Å; G384-T387 PolarHBondContact O-N 3.46Å; G384-T387 PolarHBondContact O-OG1 3.41Å; S385-T387 PolarHBondContact O-N 2.94Å; T387-L390 PolarHBondContact O-N 2.93Å; T387-T391 VanDerWaalsContact O-CG2 3.29Å; T387-T391 WeakPolarHBondContact O-CG2 3.34Å; T387-T391 PolarHBondContact O-N 2.87Å; T387-T391 PolarHBondContact O-OG1 3.29Å; T387-L644 HydrophobicContact CG2-CD2 3.75Å
388	I	89.4	Confident	88.5	Confident	13 Å²	13	44.7 Å²	44.7	7%	0.067	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-51.4	175	-64.1	174.1	0	0	0	109.8	G384 S385 L386 L390 T391 E392 R636 P640 C643	G384-I388 WeakPolarHBondContact O-CG1 3.38Å; G384-I388 PolarHBondContact O-N 3.3Å; G384-I388 VanDerWaalsContact O-N 3.12Å; S385-I388 PolarHBondContact O-N 2.95Å; L386-I388 VanDerWaalsContact C-N 3.33Å; L386-I388 PolarHBondContact O-N 2.66Å; I388-L390 VanDerWaalsContact C-N 3.33Å; I388-L390 PolarHBondContact O-N 3.15Å; I388-T391 PolarHBondContact O-N 3.46Å; I388-T391 VanDerWaalsContact O-N 3.14Å; I388-T391 PolarHBondContact O-OG1 2.83Å; I388-E392 HydrophobicContact CG2-CG 4.44Å; I388-E392 PolarHBondContact O-N 3.46Å; I388-R636 HydrophobicContact CG2-CG 4.28Å; I388-P640 HydrophobicContact CD1-CG 3.79Å; I388-C643 HydrophobicContact CD1-CB 4.34Å; I388-C643 WeakPolarHBondContact CG1-SG 3.19Å
389	S	89.8	Confident	88	Confident	4 Å²	4	47 Å²	47	3%	0.028	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-40.7	-179.6	-57.7	0	0	0	0	112.9	S385 L386 E392 L393	S385-S389 PolarHBondContact O-N 3.36Å; S385-S389 PolarHBondContact O-OG 3.49Å; L386-S389 PolarHBondContact O-N 3.3Å; S389-E392 PolarHBondContact O-N 3.2Å; S389-L393 WeakPolarHBondContact O-CB 3.35Å; S389-L393 PolarHBondContact O-N 2.95Å
390	L	90.2	Very high	87.3	Confident	86 Å²	86	46.9 Å²	46.9	45%	0.45	25%	0.246	S	C	.	.	H	α-helix	trans	-68	-38.5	176.4	-70.4	175.1	0	0	0	112.1	L386 T387 I388 L393 Y394 L411	L386-L390 HydrophobicContact CD1-CD1 4.32Å; L386-L390 HydrophobicContact CD1-CG 4.23Å; L386-L390 HydrophobicContact CG-CD1 3.96Å; L386-L390 HydrophobicContact CG-CG 4.29Å; L386-L390 WeakPolarHBondContact O-CB 3.27Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.38Å; L386-L390 PolarHBondContact O-N 2.79Å; T387-L390 PolarHBondContact O-N 2.93Å; I388-L390 VanDerWaalsContact C-N 3.33Å; I388-L390 PolarHBondContact O-N 3.15Å; L390-L393 PolarHBondContact O-N 2.87Å; L390-Y394 WeakPolarHBondContact O-CB 3.26Å; L390-Y394 PolarHBondContact O-N 3.37Å; L390-L411 HydrophobicContact CD2-CD1 4.36Å
391	T	86.7	Confident	86.9	Confident	20 Å²	20	43.9 Å²	43.9	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-67.6	-37.3	174.5	59.4	0	0	0	0	112.5	T387 I388 Y394 R395 F647 W672	T387-T391 VanDerWaalsContact O-CG2 3.29Å; T387-T391 WeakPolarHBondContact O-CG2 3.34Å; T387-T391 PolarHBondContact O-N 2.87Å; T387-T391 PolarHBondContact O-OG1 3.29Å; I388-T391 PolarHBondContact O-N 3.46Å; I388-T391 VanDerWaalsContact O-N 3.14Å; I388-T391 PolarHBondContact O-OG1 2.83Å; T391-Y394 PolarHBondContact O-N 3.46Å; T391-R395 WeakPolarHBondContact O-CB 3.37Å; T391-R395 PolarHBondContact O-N 3.14Å; T391-F647 HydrophobicContact CG2-CE2 4.13Å; T391-W672 HydrophobicContact CG2-CZ2 3.94Å; T391-W672 PolarHBondContact OG1-NE1 3.5Å
392	E	84.2	Confident	86.5	Confident	3 Å²	3	45.9 Å²	45.9	1%	0.014	25%	0.245	C	C	.	.	H	α-helix	trans	-65	-42.9	173.8	-74.5	-175.6	166	0	0	111.5	I388 S389 R395 L396 F401 C635 R636	I388-E392 HydrophobicContact CG2-CG 4.44Å; I388-E392 PolarHBondContact O-N 3.46Å; S389-E392 PolarHBondContact O-N 3.2Å; E392-R395 PolarHBondContact O-N 2.86Å; E392-L396 WeakPolarHBondContact O-CB 3.4Å; E392-L396 PolarHBondContact O-N 2.91Å; E392-F401 HydrophobicContact CB-CD2 4.37Å; E392-F401 HydrophobicContact CB-CE2 4.16Å; E392-C635 HydrophobicContact CG-CB 4.45Å; E392-R636 IonicContact OE1-CZ 3.54Å; E392-R636 VanDerWaalsContact OE1-CZ 3.31Å; E392-R636 IonicContact OE1-NE 2.69Å; E392-R636 PolarHBondContact OE1-NE 3.42Å; E392-R636 IonicContact OE1-NH2 3.52Å; E392-R636 PolarHBondContact OE1-NH2 3.35Å; E392-R636 IonicContact OE2-CZ 3.5Å; E392-R636 IonicContact OE2-NH2 3.82Å; E392-R636 PolarHBondContact OE2-NH2 2.85Å
393	L	88.6	Confident	85.9	Confident	47 Å²	47	49.8 Å²	49.8	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-45	175.9	177.3	63.2	0	0	0	111.7	S389 L390 G397 Y398 F401	S389-L393 WeakPolarHBondContact O-CB 3.35Å; S389-L393 PolarHBondContact O-N 2.95Å; L390-L393 PolarHBondContact O-N 2.87Å; L393-G397 WeakPolarHBondContact O-CA 3.25Å; L393-G397 PolarHBondContact O-N 3.27Å; L393-G397 VanDerWaalsContact O-N 3.13Å; L393-Y398 HydrophobicContact CD1-CD2 4.42Å; L393-F401 HydrophobicContact CB-CD2 3.95Å; L393-F401 HydrophobicContact CB-CE2 4Å; L393-F401 HydrophobicContact CB-CG 4.32Å; L393-F401 HydrophobicContact CB-CZ 4.42Å; L393-F401 HydrophobicContact CD1-CB 3.9Å; L393-F401 HydrophobicContact CD1-CD1 3.77Å; L393-F401 HydrophobicContact CD1-CD2 4.2Å; L393-F401 HydrophobicContact CD1-CE1 4.34Å; L393-F401 HydrophobicContact CD1-CG 3.69Å
394	Y	85.1	Confident	85.5	Confident	211 Å²	211	48.6 Å²	48.6	83%	0.827	27%	0.269	S	S	*	.	H	α-helix	trans	-64.8	-42.7	177.3	-177	-97.1	0	0	0	111.9	L390 T391	L390-Y394 WeakPolarHBondContact O-CB 3.26Å; L390-Y394 PolarHBondContact O-N 3.37Å; T391-Y394 PolarHBondContact O-N 3.46Å
395	R	77.1	Confident	85.2	Confident	39 Å²	39	57.4 Å²	57.4	15%	0.147	30%	0.303	C	S	.	.	H	α-helix	trans	-71.2	-47.7	-176.8	-170.4	-175.3	69.3	128.7	3.4	112.8	M253 T391 E392 N633	M253-R395 WeakPolarHBondContact CE-O 3.2Å; M253-R395 HydrophobicContact SD-CG 4.49Å; T391-R395 WeakPolarHBondContact O-CB 3.37Å; T391-R395 PolarHBondContact O-N 3.14Å; E392-R395 PolarHBondContact O-N 2.86Å; R395-N633 PolarHBondContact NH1-OD1 3.35Å; R395-N633 PolarHBondContact NH2-ND2 3.43Å; R395-N633 PolarHBondContact NH2-OD1 2.87Å; R395-N633 VanDerWaalsContact NH2-OD1 3.17Å
396	L	76.4	Confident	85.2	Confident	11 Å²	11	58.2 Å²	58.2	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-83.9	-19.1	-173.3	-67.5	168.7	0	0	0	113.2	E392 T400 R407	E392-L396 WeakPolarHBondContact O-CB 3.4Å; E392-L396 PolarHBondContact O-N 2.91Å; L396-T400 HydrophobicContact CD2-CG2 4.5Å; L396-R407 VanDerWaalsContact CD1-NH1 3.27Å
397	G	82.6	Confident	85.1	Confident	32 Å²	32	58 Å²	58	33%	0.33	30%	0.299	S	S	.	.			trans	75.9	164.9	-167.6	0	0	0	0	0	112.6	L393 G399 F401	L393-G397 WeakPolarHBondContact O-CA 3.25Å; L393-G397 PolarHBondContact O-N 3.27Å; L393-G397 VanDerWaalsContact O-N 3.13Å; G397-G399 PolarHBondContact O-N 3.24Å; G397-F401 WeakPolarHBondContact O-CB 3.42Å; G397-F401 PolarHBondContact O-N 3.03Å; G397-F401 VanDerWaalsContact O-N 3.15Å
398	Y	85.6	Confident	85.1	Confident	181 Å²	181	59 Å²	59	71%	0.71	31%	0.306	S	S	*	.	H	α-helix	trans	-62	-45.2	-172.4	-179.9	-102.4	0	0	0	113.5	L393 F401 S402	L393-Y398 HydrophobicContact CD1-CD2 4.42Å; Y398-F401 PolarHBondContact O-N 2.88Å; Y398-S402 WeakPolarHBondContact O-CB 3.33Å; Y398-S402 PolarHBondContact O-N 3.2Å; Y398-S402 PolarHBondContact O-OG 3.2Å
399	G	82	Confident	85.3	Confident	52 Å²	52	59.6 Å²	59.6	54%	0.536	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-46.5	-173.8	0	0	0	0	0	113.9	G397 F401 S402 S403	G397-G399 PolarHBondContact O-N 3.24Å; G399-F401 VanDerWaalsContact C-N 3.34Å; G399-S402 PolarHBondContact O-OG 3.13Å; G399-S403 PolarHBondContact O-N 3.39Å
400	T	78.5	Confident	85.4	Confident	55 Å²	55	60.1 Å²	60.1	34%	0.337	31%	0.31	S	S	.	.	H	α-helix	trans	-72.4	-31.1	177.7	-49.4	0	0	0	0	111.5	L396	L396-T400 HydrophobicContact CD2-CG2 4.5Å
401	F	84.8	Confident	85.5	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.018	30%	0.3	C	S	.	.	H	α-helix	trans	-65.4	-49	174.2	-175.3	-88.3	0	0	0	111.5	E392 L393 G397 Y398 G399 S403 S404 R407 L411	E392-F401 HydrophobicContact CB-CD2 4.37Å; E392-F401 HydrophobicContact CB-CE2 4.16Å; L393-F401 HydrophobicContact CB-CD2 3.95Å; L393-F401 HydrophobicContact CB-CE2 4Å; L393-F401 HydrophobicContact CB-CG 4.32Å; L393-F401 HydrophobicContact CB-CZ 4.42Å; L393-F401 HydrophobicContact CD1-CB 3.9Å; L393-F401 HydrophobicContact CD1-CD1 3.77Å; L393-F401 HydrophobicContact CD1-CD2 4.2Å; L393-F401 HydrophobicContact CD1-CE1 4.34Å; L393-F401 HydrophobicContact CD1-CG 3.69Å; G397-F401 WeakPolarHBondContact O-CB 3.42Å; G397-F401 PolarHBondContact O-N 3.03Å; G397-F401 VanDerWaalsContact O-N 3.15Å; Y398-F401 PolarHBondContact O-N 2.88Å; G399-F401 VanDerWaalsContact C-N 3.34Å; F401-S403 VanDerWaalsContact C-N 3.27Å; F401-S403 PolarHBondContact O-N 2.96Å; F401-S404 PolarHBondContact O-N 3.35Å; F401-R407 HydrophobicContact CD1-CB 4.49Å; F401-R407 HydrophobicContact CD2-CB 4.16Å; F401-R407 HydrophobicContact CE1-CB 4.14Å; F401-R407 HydrophobicContact CE2-CB 3.78Å; F401-R407 HydrophobicContact CE2-CG 4.47Å; F401-R407 HydrophobicContact CG-CB 4.5Å; F401-R407 HydrophobicContact CZ-CB 3.77Å; F401-R407 WeakPolarHBondContact CZ-O 3.3Å; F401-L411 HydrophobicContact CE1-CB 4.31Å; F401-L411 HydrophobicContact CE1-CD2 4.03Å; F401-L411 HydrophobicContact CZ-CB 4.19Å; F401-L411 HydrophobicContact CZ-CD2 4.43Å
402	S	84.8	Confident	85.9	Confident	51 Å²	51	61.8 Å²	61.8	36%	0.357	31%	0.314	S	S	.	.	H	α-helix	trans	-70.3	-21.8	-176.3	64.5	0	0	0	0	114.1	Y398 G399 S404	Y398-S402 WeakPolarHBondContact O-CB 3.33Å; Y398-S402 PolarHBondContact O-N 3.2Å; Y398-S402 PolarHBondContact O-OG 3.2Å; G399-S402 PolarHBondContact O-OG 3.13Å; S402-S404 PolarHBondContact O-N 2.83Å
403	S	79.7	Confident	86.4	Confident	90 Å²	90	62.3 Å²	62.3	63%	0.629	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.1	174.2	174.5	0	0	0	0	112.6	G399 F401	G399-S403 PolarHBondContact O-N 3.39Å; F401-S403 VanDerWaalsContact C-N 3.27Å; F401-S403 PolarHBondContact O-N 2.96Å
404	S	83.6	Confident	86.6	Confident	40 Å²	40	60.3 Å²	60.3	28%	0.28	31%	0.307	S	S	.	.			trans	-96.9	105.9	179.3	-66.1	0	0	0	0	111.9	F401 S402 W406 R407 C408	F401-S404 PolarHBondContact O-N 3.35Å; S402-S404 PolarHBondContact O-N 2.83Å; S404-W406 VanDerWaalsContact C-N 3.26Å; S404-W406 PolarHBondContact O-N 2.61Å; S404-W406 VanDerWaalsContact O-N 3.14Å; S404-R407 PolarHBondContact O-N 2.95Å; S404-C408 PolarHBondContact O-N 3.36Å
405	W	86.6	Confident	87.1	Confident	186 Å²	186	54 Å²	54	71%	0.705	29%	0.291	S	S	*	.	H	α-helix	trans	-48.2	-44.1	179	179.5	-100.2	0	0	0	113.8	R407 C408 Y409	W405-R407 VanDerWaalsContact C-N 3.34Å; W405-R407 PolarHBondContact O-N 2.95Å; W405-C408 PolarHBondContact O-N 2.96Å; W405-Y409 WeakPolarHBondContact O-CB 3.21Å; W405-Y409 PolarHBondContact O-N 2.93Å
406	W	90	Very high	87.9	Confident	47 Å²	47	53.3 Å²	53.3	18%	0.178	29%	0.29	C	S	.	.	H	α-helix	trans	-66.9	-30.1	-178.8	-65.5	114.9	0	0	0	114	S404 Y409 D410 F466 F469 Y470	S404-W406 VanDerWaalsContact C-N 3.26Å; S404-W406 PolarHBondContact O-N 2.61Å; S404-W406 VanDerWaalsContact O-N 3.14Å; W406-Y409 WeakPolarHBondContact O-CB 3.44Å; W406-Y409 PolarHBondContact O-N 3.17Å; W406-D410 VanDerWaalsContact O-CG 3.25Å; W406-D410 PolarHBondContact O-N 3.19Å; W406-F466 HydrophobicContact CH2-CE1 4.31Å; W406-F466 HydrophobicContact CZ3-CE1 4.31Å; W406-F469 HydrophobicContact CH2-CB 3.76Å; W406-F469 HydrophobicContact CZ2-CB 4.35Å; W406-Y470 HydrophobicContact CB-CD2 3.79Å; W406-Y470 HydrophobicContact CB-CE2 4.06Å; W406-Y470 AromaticContact CD1-CD2 3.69Å; W406-Y470 AromaticContact CD2-CD2 3.8Å; W406-Y470 HydrophobicContact CD2-CD2 3.8Å; W406-Y470 HydrophobicContact CD2-CG 4.43Å; W406-Y470 HydrophobicContact CE3-CD2 4.42Å; W406-Y470 AromaticContact CG-CD2 3.49Å; W406-Y470 HydrophobicContact CG-CD2 3.49Å; W406-Y470 VanDerWaalsContact CG-CD2 3.49Å; W406-Y470 HydrophobicContact CG-CE2 4.12Å
407	R	90	Very high	88.8	Confident	20 Å²	20	53.1 Å²	53.1	8%	0.075	29%	0.289	C	S	.	.	H	α-helix	trans	-72.1	-41.1	176.4	-65.5	-176.2	-174.1	150.6	-3.8	111.1	L396 F401 S404 W405 Y409 D410 L411 D630	L396-R407 VanDerWaalsContact CD1-NH1 3.27Å; F401-R407 HydrophobicContact CD1-CB 4.49Å; F401-R407 HydrophobicContact CD2-CB 4.16Å; F401-R407 HydrophobicContact CE1-CB 4.14Å; F401-R407 HydrophobicContact CE2-CB 3.78Å; F401-R407 HydrophobicContact CE2-CG 4.47Å; F401-R407 HydrophobicContact CG-CB 4.5Å; F401-R407 HydrophobicContact CZ-CB 3.77Å; F401-R407 WeakPolarHBondContact CZ-O 3.3Å; S404-R407 PolarHBondContact O-N 2.95Å; W405-R407 VanDerWaalsContact C-N 3.34Å; W405-R407 PolarHBondContact O-N 2.95Å; R407-Y409 VanDerWaalsContact C-N 3.28Å; R407-Y409 PolarHBondContact O-N 3.07Å; R407-D410 PolarHBondContact O-N 2.82Å; R407-L411 PolarHBondContact O-N 2.73Å; R407-D630 IonicContact CZ-OD1 2.65Å; R407-D630 IonicContact NE-OD1 3.59Å; R407-D630 IonicContact NH2-OD1 3.29Å; R407-D630 PolarHBondContact NH2-OD1 3.47Å
408	C	91.6	Very high	89.4	Confident	46 Å²	46	56 Å²	56	31%	0.311	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-40.6	170.4	-69.6	0	0	0	0	111.7	S404 W405 L411 F412	S404-C408 PolarHBondContact O-N 3.36Å; W405-C408 PolarHBondContact O-N 2.96Å; C408-L411 PolarHBondContact O-N 3.01Å; C408-F412 WeakPolarHBondContact O-CB 3.46Å; C408-F412 PolarHBondContact O-N 3.45Å
409	Y	93.2	Very high	89.8	Confident	27 Å²	27	49.8 Å²	49.8	11%	0.106	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-44.1	176.2	-171.3	-87.7	0	0	0	112.3	W405 W406 R407 L411 F412 Q413 C463 F466 R467	W405-Y409 WeakPolarHBondContact O-CB 3.21Å; W405-Y409 PolarHBondContact O-N 2.93Å; W406-Y409 WeakPolarHBondContact O-CB 3.44Å; W406-Y409 PolarHBondContact O-N 3.17Å; R407-Y409 VanDerWaalsContact C-N 3.28Å; R407-Y409 PolarHBondContact O-N 3.07Å; Y409-L411 VanDerWaalsContact C-N 3.34Å; Y409-L411 PolarHBondContact O-N 3.21Å; Y409-F412 WeakPolarHBondContact O-CB 3.35Å; Y409-F412 PolarHBondContact O-N 3.22Å; Y409-Q413 WeakPolarHBondContact O-CB 3.42Å; Y409-Q413 PolarHBondContact O-N 2.99Å; Y409-C463 WeakPolarHBondContact OH-CA 3.46Å; Y409-C463 WeakPolarHBondContact OH-CB 3.5Å; Y409-C463 PolarHBondContact OH-O 2.89Å; Y409-F466 AromaticContact CE2-CD1 3.83Å; Y409-F466 HydrophobicContact CE2-CD1 3.83Å; Y409-F466 HydrophobicContact CE2-CE1 4.3Å; Y409-F466 AromaticContact CZ-CD1 3.81Å; Y409-R467 HydrophobicContact CE1-CB 3.94Å; Y409-R467 HydrophobicContact CE1-CG 4.42Å
410	D	92	Very high	90.4	Very high	15 Å²	15	47.4 Å²	47.4	8%	0.08	26%	0.257	C	S	.	.	H	α-helix	trans	-62.6	-41.4	176.9	-72	-17.5	0	0	0	111.8	W406 R407 G414 R467	W406-D410 VanDerWaalsContact O-CG 3.25Å; W406-D410 PolarHBondContact O-N 3.19Å; R407-D410 PolarHBondContact O-N 2.82Å; D410-G414 PolarHBondContact O-N 3.47Å; D410-R467 IonicContact OD1-CZ 3.91Å; D410-R467 IonicContact OD1-NE 2.75Å; D410-R467 PolarHBondContact OD1-NE 2.69Å; D410-R467 IonicContact OD1-NH2 3.45Å; D410-R467 PolarHBondContact OD1-NH2 3.2Å; D410-R467 IonicContact OD2-CZ 3.76Å; D410-R467 IonicContact OD2-NE 3.42Å; D410-R467 IonicContact OD2-NH2 2.81Å; D410-R467 PolarHBondContact OD2-NH2 3.36Å
411	L	93.3	Very high	91	Very high	43 Å²	43	45.6 Å²	45.6	23%	0.225	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-46.3	174	-176.8	63.6	0	0	0	111.3	L386 L390 F401 R407 C408 Y409 Q413 G414 V415	L386-L411 HydrophobicContact CD1-CD1 4.31Å; L390-L411 HydrophobicContact CD2-CD1 4.36Å; F401-L411 HydrophobicContact CE1-CB 4.31Å; F401-L411 HydrophobicContact CE1-CD2 4.03Å; F401-L411 HydrophobicContact CZ-CB 4.19Å; F401-L411 HydrophobicContact CZ-CD2 4.43Å; R407-L411 PolarHBondContact O-N 2.73Å; C408-L411 PolarHBondContact O-N 3.01Å; Y409-L411 VanDerWaalsContact C-N 3.34Å; Y409-L411 PolarHBondContact O-N 3.21Å; L411-Q413 PolarHBondContact O-N 2.85Å; L411-G414 PolarHBondContact O-N 3.12Å; L411-V415 WeakPolarHBondContact O-CG2 3.26Å; L411-V415 PolarHBondContact O-N 3.28Å
412	F	94.5	Very high	91.4	Very high	97 Å²	97	50 Å²	50	43%	0.425	27%	0.268	S	S	.	.	H	α-helix	trans	-58.9	-47.6	177.5	174.8	-107.3	0	0	0	111.7	C408 Y409 G414 V415 L416 F459	C408-F412 WeakPolarHBondContact O-CB 3.46Å; C408-F412 PolarHBondContact O-N 3.45Å; Y409-F412 WeakPolarHBondContact O-CB 3.35Å; Y409-F412 PolarHBondContact O-N 3.22Å; F412-G414 VanDerWaalsContact C-N 3.32Å; F412-G414 PolarHBondContact O-N 3.34Å; F412-V415 PolarHBondContact O-N 3.46Å; F412-L416 HydrophobicContact CD1-CD1 3.98Å; F412-L416 HydrophobicContact CE1-CD1 3.5Å; F412-L416 VanDerWaalsContact CE1-CD1 3.5Å; F412-L416 HydrophobicContact CE1-CG 4.29Å; F412-L416 HydrophobicContact CE2-CD1 4.44Å; F412-L416 HydrophobicContact CE2-CD2 4.44Å; F412-L416 HydrophobicContact CE2-CG 4.41Å; F412-L416 HydrophobicContact CZ-CD1 3.77Å; F412-L416 HydrophobicContact CZ-CD2 4.26Å; F412-L416 HydrophobicContact CZ-CG 4.19Å; F412-L416 WeakPolarHBondContact O-CG 3.32Å; F412-L416 PolarHBondContact O-N 3.19Å; F412-F459 HydrophobicContact CE1-CE1 4Å; F412-F459 HydrophobicContact CE1-CZ 4.43Å; F412-F459 AromaticContact CZ-CE1 3.86Å; F412-F459 HydrophobicContact CZ-CE1 3.86Å; F412-F459 HydrophobicContact CZ-CZ 4.33Å
413	Q	94	Very high	91.7	Very high	14 Å²	14	48.3 Å²	48.3	7%	0.065	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-42.2	175.9	-175.1	175.3	-9.8	0	0	111.2	Y409 L411 V415 L416 F417 S464	Y409-Q413 WeakPolarHBondContact O-CB 3.42Å; Y409-Q413 PolarHBondContact O-N 2.99Å; L411-Q413 PolarHBondContact O-N 2.85Å; Q413-V415 PolarHBondContact O-N 3.2Å; Q413-L416 PolarHBondContact O-N 3.45Å; Q413-F417 HydrophobicContact CG-CD2 3.95Å; Q413-F417 HydrophobicContact CG-CE2 3.69Å; Q413-F417 VanDerWaalsContact O-CD2 3.23Å; Q413-F417 WeakPolarHBondContact O-CD2 3.42Å; Q413-F417 PolarHBondContact O-N 3.14Å; Q413-S464 PolarHBondContact NE2-OG 3.25Å; Q413-S464 VanDerWaalsContact NE2-OG 3.13Å
414	G	93.4	Very high	92.1	Very high	5 Å²	5	44.8 Å²	44.8	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-42.1	174.9	0	0	0	0	0	113.5	D410 L411 F412 F417 L418	D410-G414 PolarHBondContact O-N 3.47Å; L411-G414 PolarHBondContact O-N 3.12Å; F412-G414 VanDerWaalsContact C-N 3.32Å; F412-G414 PolarHBondContact O-N 3.34Å; G414-F417 PolarHBondContact O-N 3.33Å; G414-L418 PolarHBondContact O-N 2.91Å
415	V	94.9	Very high	92.3	Very high	80 Å²	80	47.3 Å²	47.3	49%	0.485	24%	0.241	S	C	.	.	H	α-helix	trans	-65.5	-40.9	175.8	175.3	0	0	0	0	111.6	L411 F412 Q413 F417 L418 A419	L411-V415 WeakPolarHBondContact O-CG2 3.26Å; L411-V415 PolarHBondContact O-N 3.28Å; F412-V415 PolarHBondContact O-N 3.46Å; Q413-V415 PolarHBondContact O-N 3.2Å; V415-F417 PolarHBondContact O-N 3.5Å; V415-L418 PolarHBondContact O-N 3.36Å; V415-A419 WeakPolarHBondContact O-CB 3.47Å; V415-A419 PolarHBondContact O-N 2.98Å
416	L	95.6	Very high	92.4	Very high	23 Å²	23	43 Å²	43	12%	0.12	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-44	176.6	-68.4	173.3	0	0	0	112	F412 Q413 L418 A419 F420 L456 F459 I460	F412-L416 HydrophobicContact CD1-CD1 3.98Å; F412-L416 HydrophobicContact CE1-CD1 3.5Å; F412-L416 VanDerWaalsContact CE1-CD1 3.5Å; F412-L416 HydrophobicContact CE1-CG 4.29Å; F412-L416 HydrophobicContact CE2-CD1 4.44Å; F412-L416 HydrophobicContact CE2-CD2 4.44Å; F412-L416 HydrophobicContact CE2-CG 4.41Å; F412-L416 HydrophobicContact CZ-CD1 3.77Å; F412-L416 HydrophobicContact CZ-CD2 4.26Å; F412-L416 HydrophobicContact CZ-CG 4.19Å; F412-L416 WeakPolarHBondContact O-CG 3.32Å; F412-L416 PolarHBondContact O-N 3.19Å; Q413-L416 PolarHBondContact O-N 3.45Å; L416-L418 VanDerWaalsContact C-N 3.34Å; L416-L418 PolarHBondContact O-N 2.85Å; L416-A419 PolarHBondContact O-N 3.24Å; L416-F420 PolarHBondContact O-N 3.17Å; L416-L456 HydrophobicContact CD2-CD1 3.88Å; L416-F459 HydrophobicContact CD1-CD1 3.79Å; L416-F459 HydrophobicContact CD1-CE1 3.69Å; L416-F459 HydrophobicContact CD2-CD1 4.29Å; L416-F459 HydrophobicContact CD2-CE1 4.35Å; L416-I460 HydrophobicContact CB-CD1 4.19Å; L416-I460 HydrophobicContact CB-CG1 3.82Å; L416-I460 WeakPolarHBondContact O-CD1 3.43Å
417	F	94.9	Very high	92.1	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.035	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-43.4	174.4	-84.1	-68.4	0	0	0	111.9	F347 L351 V378 A382 Q413 G414 V415 A419 F420 F421 I460	F347-F417 HydrophobicContact CE2-CZ 4.12Å; F347-F417 HydrophobicContact CZ-CE1 4.31Å; F347-F417 AromaticContact CZ-CE2 3.89Å; F347-F417 HydrophobicContact CZ-CE2 3.89Å; F347-F417 AromaticContact CZ-CZ 3.49Å; F347-F417 HydrophobicContact CZ-CZ 3.49Å; F347-F417 VanDerWaalsContact CZ-CZ 3.49Å; L351-F417 HydrophobicContact CD1-CE1 4.39Å; L351-F417 HydrophobicContact CD2-CZ 4.38Å; V378-F417 HydrophobicContact CG1-CD1 4.43Å; V378-F417 HydrophobicContact CG1-CE1 3.94Å; A382-F417 HydrophobicContact CB-CB 3.68Å; A382-F417 HydrophobicContact CB-CD1 4.09Å; A382-F417 HydrophobicContact CB-CD2 4.13Å; A382-F417 HydrophobicContact CB-CG 3.71Å; Q413-F417 HydrophobicContact CG-CD2 3.95Å; Q413-F417 HydrophobicContact CG-CE2 3.69Å; Q413-F417 VanDerWaalsContact O-CD2 3.23Å; Q413-F417 WeakPolarHBondContact O-CD2 3.42Å; Q413-F417 PolarHBondContact O-N 3.14Å; G414-F417 PolarHBondContact O-N 3.33Å; V415-F417 PolarHBondContact O-N 3.5Å; F417-A419 VanDerWaalsContact C-N 3.33Å; F417-A419 PolarHBondContact O-N 3.44Å; F417-F420 PolarHBondContact O-N 3.31Å; F417-F421 HydrophobicContact CD1-CE2 4.08Å; F417-F421 WeakPolarHBondContact O-CD2 3.4Å; F417-F421 PolarHBondContact O-N 3.02Å; F417-I460 HydrophobicContact CD1-CD1 4.43Å; F417-I460 HydrophobicContact CD1-CG2 3.98Å; F417-I460 HydrophobicContact CD2-CG2 4.47Å; F417-I460 HydrophobicContact CE1-CG2 3.26Å; F417-I460 HydrophobicContact CE2-CG2 3.81Å; F417-I460 HydrophobicContact CZ-CG2 3.12Å
418	L	94.5	Very high	91.7	Very high	92 Å²	92	44.4 Å²	44.4	48%	0.482	24%	0.239	S	C	.	.	H	α-helix	trans	-61.3	-42.8	177.2	-174.2	66	0	0	0	111.6	G414 V415 L416 F421 N422	G414-L418 PolarHBondContact O-N 2.91Å; V415-L418 PolarHBondContact O-N 3.36Å; L416-L418 VanDerWaalsContact C-N 3.34Å; L416-L418 PolarHBondContact O-N 2.85Å; L418-F421 PolarHBondContact O-N 2.88Å; L418-N422 WeakPolarHBondContact O-CB 3.31Å; L418-N422 PolarHBondContact O-N 3.25Å
419	A	94.3	Very high	91.4	Very high	50 Å²	50	48.1 Å²	48.1	41%	0.413	26%	0.255	S	S	.	.	H	α-helix	trans	-62.3	-43.1	176.4	0	0	0	0	0	111.9	V415 L416 F417 N422 G423 L456	V415-A419 WeakPolarHBondContact O-CB 3.47Å; V415-A419 PolarHBondContact O-N 2.98Å; L416-A419 PolarHBondContact O-N 3.24Å; F417-A419 VanDerWaalsContact C-N 3.33Å; F417-A419 PolarHBondContact O-N 3.44Å; A419-N422 PolarHBondContact O-N 3.28Å; A419-G423 PolarHBondContact O-N 3.05Å; A419-L456 HydrophobicContact CB-CD2 4.18Å
420	F	94.1	Very high	90.8	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.009	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-50.4	176.9	175.2	-97.1	0	0	0	111.9	W362 L375 L416 F417 N422 G423 F424 L453 L456 F457 I460	W362-F420 HydrophobicContact CD2-CE2 4.46Å; W362-F420 HydrophobicContact CD2-CZ 4.07Å; W362-F420 AromaticContact CE3-CZ 3.88Å; W362-F420 HydrophobicContact CE3-CZ 3.88Å; W362-F420 AromaticContact CH2-CZ 4Å; W362-F420 HydrophobicContact CH2-CZ 4Å; W362-F420 HydrophobicContact CZ2-CZ 4.2Å; W362-F420 AromaticContact CZ3-CZ 3.84Å; W362-F420 HydrophobicContact CZ3-CZ 3.84Å; L375-F420 HydrophobicContact CD1-CE1 4.48Å; L416-F420 PolarHBondContact O-N 3.17Å; F417-F420 PolarHBondContact O-N 3.31Å; F420-N422 VanDerWaalsContact C-N 3.33Å; F420-N422 PolarHBondContact O-N 3.43Å; F420-G423 PolarHBondContact O-N 2.92Å; F420-F424 WeakPolarHBondContact O-CB 3.34Å; F420-F424 PolarHBondContact O-N 2.95Å; F420-L453 HydrophobicContact CD2-CD2 4.03Å; F420-L453 HydrophobicContact CE2-CB 4.34Å; F420-L453 HydrophobicContact CE2-CD2 4.4Å; F420-L456 HydrophobicContact CB-CD2 3.87Å; F420-L456 HydrophobicContact CB-CG 4.27Å; F420-F457 HydrophobicContact CD2-CB 4.1Å; F420-F457 HydrophobicContact CD2-CD2 4.33Å; F420-F457 HydrophobicContact CE1-CD2 4.04Å; F420-F457 HydrophobicContact CE2-CB 3.68Å; F420-F457 AromaticContact CE2-CD2 3.78Å; F420-F457 HydrophobicContact CE2-CD2 3.78Å; F420-F457 HydrophobicContact CE2-CG 4.11Å; F420-F457 HydrophobicContact CZ-CB 4.35Å; F420-F457 AromaticContact CZ-CD2 3.61Å; F420-F457 HydrophobicContact CZ-CD2 3.61Å; F420-F457 HydrophobicContact CZ-CE2 4.34Å; F420-F457 HydrophobicContact CZ-CG 4.28Å; F420-I460 HydrophobicContact CB-CD1 3.59Å; F420-I460 HydrophobicContact CG-CD1 4.12Å
421	F	92.2	Very high	89.7	Confident	18 Å²	18	53.9 Å²	53.9	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-67.8	-33.1	179.8	-77.4	-66.4	0	0	0	112.7	L375 V378 L379 A382 F417 L418 M425	L375-F421 HydrophobicContact CD1-CE1 3.76Å; L375-F421 HydrophobicContact CD1-CZ 4.15Å; L375-F421 HydrophobicContact CG-CE1 4.04Å; V378-F421 HydrophobicContact CB-CZ 4.47Å; V378-F421 HydrophobicContact CG1-CE2 4.28Å; V378-F421 HydrophobicContact CG1-CZ 3.97Å; L379-F421 HydrophobicContact CB-CD1 4.36Å; L379-F421 HydrophobicContact CB-CE1 3.78Å; L379-F421 HydrophobicContact CB-CE2 3.95Å; L379-F421 HydrophobicContact CB-CZ 3.56Å; L379-F421 HydrophobicContact CD1-CB 4.15Å; L379-F421 HydrophobicContact CD1-CD1 3.92Å; L379-F421 HydrophobicContact CD1-CD2 3.54Å; L379-F421 HydrophobicContact CD1-CE1 4.17Å; L379-F421 HydrophobicContact CD1-CE2 3.82Å; L379-F421 HydrophobicContact CD1-CG 3.6Å; L379-F421 HydrophobicContact CD1-CZ 4.13Å; L379-F421 HydrophobicContact CG-CE1 4.42Å; L379-F421 HydrophobicContact CG-CZ 4.42Å; A382-F421 HydrophobicContact CB-CE2 4.48Å; F417-F421 HydrophobicContact CD1-CE2 4.08Å; F417-F421 WeakPolarHBondContact O-CD2 3.4Å; F417-F421 PolarHBondContact O-N 3.02Å; L418-F421 PolarHBondContact O-N 2.88Å; F421-M425 WeakPolarHBondContact O-CB 3.41Å; F421-M425 VanDerWaalsContact O-CG 3.27Å; F421-M425 WeakPolarHBondContact O-CG 3.12Å; F421-M425 PolarHBondContact O-N 2.77Å
422	N	92.3	Very high	88.5	Confident	96 Å²	96	54.9 Å²	54.9	51%	0.513	30%	0.304	S	S	.	.	H	α-helix	trans	-65	-47.3	173.2	-173.8	-87.3	0	0	0	111.3	L418 A419 F420 F424 M425 I426	L418-N422 WeakPolarHBondContact O-CB 3.31Å; L418-N422 PolarHBondContact O-N 3.25Å; A419-N422 PolarHBondContact O-N 3.28Å; F420-N422 VanDerWaalsContact C-N 3.33Å; F420-N422 PolarHBondContact O-N 3.43Å; N422-F424 VanDerWaalsContact C-N 3.34Å; N422-F424 PolarHBondContact O-N 2.97Å; N422-M425 PolarHBondContact O-N 3.5Å; N422-I426 WeakPolarHBondContact O-CG1 3.45Å; N422-I426 PolarHBondContact O-N 3.44Å; N422-I426 VanDerWaalsContact OD1-CD1 3.25Å; N422-I426 WeakPolarHBondContact OD1-CD1 3.31Å
423	G	90.7	Very high	87	Confident	16 Å²	16	51 Å²	51	17%	0.165	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-36.8	176.4	0	0	0	0	0	113	A419 F420 I426 N427	A419-G423 PolarHBondContact O-N 3.05Å; F420-G423 PolarHBondContact O-N 2.92Å; G423-I426 PolarHBondContact O-N 3.21Å; G423-N427 PolarHBondContact O-N 3.28Å
424	F	88.8	Confident	85.4	Confident	15 Å²	15	55 Å²	55	7%	0.066	31%	0.312	C	S	.	.	H	α-helix	trans	-59.8	-45.3	171.2	177.7	-106.6	0	0	0	111.8	W362 L375 F420 N422 I426 N427 F428	W362-F424 HydrophobicContact CB-CD2 4.03Å; W362-F424 HydrophobicContact CB-CE2 4.4Å; W362-F424 HydrophobicContact CE3-CD2 4.22Å; W362-F424 HydrophobicContact CE3-CE2 4.24Å; W362-F424 WeakPolarHBondContact O-CD2 3.21Å; L375-F424 HydrophobicContact CD2-CE1 4.07Å; L375-F424 HydrophobicContact CD2-CZ 3.99Å; F420-F424 WeakPolarHBondContact O-CB 3.34Å; F420-F424 PolarHBondContact O-N 2.95Å; N422-F424 VanDerWaalsContact C-N 3.34Å; N422-F424 PolarHBondContact O-N 2.97Å; F424-I426 PolarHBondContact O-N 3.05Å; F424-N427 PolarHBondContact O-N 2.97Å; F424-F428 WeakPolarHBondContact O-CB 3.36Å; F424-F428 PolarHBondContact O-N 3.39Å
425	M	88	Confident	83.7	Confident	94 Å²	94	58.9 Å²	58.9	46%	0.463	34%	0.344	S	S	.	.	H	α-helix	trans	-65.1	-36.9	176.8	-73.5	-60.4	-58.5	0	0	112.8	F421 N422 F428 L429	F421-M425 WeakPolarHBondContact O-CB 3.41Å; F421-M425 VanDerWaalsContact O-CG 3.27Å; F421-M425 WeakPolarHBondContact O-CG 3.12Å; F421-M425 PolarHBondContact O-N 2.77Å; N422-M425 PolarHBondContact O-N 3.5Å; M425-F428 PolarHBondContact O-N 3.42Å; M425-L429 WeakPolarHBondContact O-CB 2.88Å; M425-L429 VanDerWaalsContact O-CG 3.29Å; M425-L429 WeakPolarHBondContact O-CG 3.24Å; M425-L429 PolarHBondContact O-N 3.07Å
426	I	87.6	Confident	82.1	Confident	95 Å²	95	58.5 Å²	58.5	49%	0.487	34%	0.337	S	S	.	.	H	α-helix	trans	-64.8	-48.4	175.7	-68.3	166.5	0	0	0	110.4	N422 G423 F424 F428 L429 D430	N422-I426 WeakPolarHBondContact O-CG1 3.45Å; N422-I426 PolarHBondContact O-N 3.44Å; N422-I426 VanDerWaalsContact OD1-CD1 3.25Å; N422-I426 WeakPolarHBondContact OD1-CD1 3.31Å; G423-I426 PolarHBondContact O-N 3.21Å; F424-I426 PolarHBondContact O-N 3.05Å; I426-F428 VanDerWaalsContact C-N 3.26Å; I426-F428 PolarHBondContact O-N 3.4Å; I426-L429 PolarHBondContact O-N 3.06Å; I426-D430 PolarHBondContact O-N 3.35Å; I426-D430 VanDerWaalsContact O-N 3.1Å
427	N	83.6	Confident	80.4	Confident	8 Å²	8	61.4 Å²	61.4	4%	0.043	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-36.1	177.6	-82.8	0.6	0	0	0	112.4	G423 F424 Q433 S449 L453	G423-N427 PolarHBondContact O-N 3.28Å; F424-N427 PolarHBondContact O-N 2.97Å; N427-Q433 PolarHBondContact OD1-NE2 3.17Å; N427-S449 PolarHBondContact ND2-OG 3.42Å; N427-S449 VanDerWaalsContact OD1-CB 3.26Å; N427-S449 WeakPolarHBondContact OD1-CB 3.35Å; N427-S449 PolarHBondContact OD1-OG 3.48Å; N427-L453 WeakPolarHBondContact ND2-CD1 3.48Å
428	F	82.4	Confident	78.7	Confident	89 Å²	89	70 Å²	70	39%	0.39	39%	0.392	S	S	.	.	H	α-helix	trans	-68.7	-36.8	177.1	176.5	-105.1	0	0	0	113.3	L365 F424 M425 I426	L365-F428 HydrophobicContact CD1-CD2 4.38Å; L365-F428 HydrophobicContact CD1-CE2 3.41Å; L365-F428 VanDerWaalsContact CD1-CE2 3.41Å; L365-F428 HydrophobicContact CD1-CZ 3.66Å; L365-F428 HydrophobicContact CG-CD2 4.3Å; L365-F428 HydrophobicContact CG-CE2 3.77Å; L365-F428 HydrophobicContact CG-CZ 4.38Å; F424-F428 WeakPolarHBondContact O-CB 3.36Å; F424-F428 PolarHBondContact O-N 3.39Å; M425-F428 PolarHBondContact O-N 3.42Å; I426-F428 VanDerWaalsContact C-N 3.26Å; I426-F428 PolarHBondContact O-N 3.4Å
429	L	85.2	Confident	77.3	Confident	124 Å²	124	68.4 Å²	68.4	65%	0.649	39%	0.387	S	S	*	.	H	α-helix	trans	-82	-18.4	-178.6	-71.5	172.1	0	0	0	113.5	M425 I426 P431	M425-L429 WeakPolarHBondContact O-CB 2.88Å; M425-L429 VanDerWaalsContact O-CG 3.29Å; M425-L429 WeakPolarHBondContact O-CG 3.24Å; M425-L429 PolarHBondContact O-N 3.07Å; I426-L429 PolarHBondContact O-N 3.06Å; L429-P431 WeakPolarHBondContact O-CD 3.21Å
430	D	80.4	Confident	76.2	Confident	57 Å²	57	71.9 Å²	71.9	31%	0.305	40%	0.398	S	S	.	.			trans	-79.4	109.2	-176.8	-173.3	-5.2	0	0	0	111.2	I426 S432 Q433	I426-D430 PolarHBondContact O-N 3.35Å; I426-D430 VanDerWaalsContact O-N 3.1Å; D430-S432 PolarHBondContact O-N 3.16Å; D430-S432 VanDerWaalsContact OD1-CB 3.3Å; D430-S432 WeakPolarHBondContact OD1-CB 3.5Å; D430-S432 PolarHBondContact OD1-N 3.31Å; D430-S432 PolarHBondContact OD1-OG 3.16Å; D430-S432 PolarHBondContact OD2-OG 3.26Å; D430-Q433 HydrophobicContact CB-CG 3.93Å; D430-Q433 PolarHBondContact O-N 3.04Å
431	P	68.9	Low	75.2	Confident	106 Å²	106	76.8 Å²	76.8	69%	0.688	42%	0.42	S	S	*	.	H	α-helix	trans	-66.5	-19.8	-178.9	29	-35.3	0	0	0	112.7	L429 Q433 V434	L429-P431 WeakPolarHBondContact O-CD 3.21Å; P431-Q433 VanDerWaalsContact C-N 3.28Å; P431-Q433 PolarHBondContact O-N 3.07Å; P431-V434 WeakPolarHBondContact O-CB 3.42Å; P431-V434 PolarHBondContact O-N 3.25Å
432	S	68.4	Low	74.4	Confident	64 Å²	64	84.8 Å²	84.8	45%	0.448	46%	0.457	S	S	.	.	H	α-helix	trans	-68.8	-28.1	180	73.9	0	0	0	0	112.7	D430 V434 A435	D430-S432 PolarHBondContact O-N 3.16Å; D430-S432 VanDerWaalsContact OD1-CB 3.3Å; D430-S432 WeakPolarHBondContact OD1-CB 3.5Å; D430-S432 PolarHBondContact OD1-N 3.31Å; D430-S432 PolarHBondContact OD1-OG 3.16Å; D430-S432 PolarHBondContact OD2-OG 3.26Å; S432-V434 PolarHBondContact O-N 3.35Å; S432-A435 PolarHBondContact O-N 3.2Å
433	Q	63.4	Low	73.7	Confident	15 Å²	15	85.7 Å²	85.7	7%	0.07	47%	0.466	C	S	.	.	H	α-helix	trans	-67.6	-27.8	178.1	-64.6	-95	-13.7	0	0	111.7	N427 D430 P431 A435 Q436 L437 S449	N427-Q433 PolarHBondContact OD1-NE2 3.17Å; D430-Q433 HydrophobicContact CB-CG 3.93Å; D430-Q433 PolarHBondContact O-N 3.04Å; P431-Q433 VanDerWaalsContact C-N 3.28Å; P431-Q433 PolarHBondContact O-N 3.07Å; Q433-A435 VanDerWaalsContact C-N 3.3Å; Q433-A435 PolarHBondContact O-N 2.81Å; Q433-Q436 PolarHBondContact O-N 3.42Å; Q433-Q436 VanDerWaalsContact O-N 3.08Å; Q433-L437 PolarHBondContact O-N 2.96Å; Q433-S449 PolarHBondContact NE2-OG 2.9Å
434	V	59.8	Low	73.1	Confident	98 Å²	98	86.7 Å²	86.7	59%	0.594	47%	0.465	S	S	*	.	H	α-helix	trans	-63.9	-37.8	179.3	-176.3	0	0	0	0	110.8	P431 S432 Q436 L437	P431-V434 WeakPolarHBondContact O-CB 3.42Å; P431-V434 PolarHBondContact O-N 3.25Å; S432-V434 PolarHBondContact O-N 3.35Å; V434-Q436 PolarHBondContact O-N 3.49Å; V434-L437 HydrophobicContact CB-CD1 4.37Å; V434-L437 HydrophobicContact CG1-CD1 4.05Å; V434-L437 WeakPolarHBondContact O-CB 3.3Å; V434-L437 PolarHBondContact O-N 3.04Å
435	A	59	Low	72.7	Confident	87 Å²	87	89.1 Å²	89.1	72%	0.719	48%	0.483	S	S	*	.	H	α-helix	trans	-69.5	-21.3	176.5	0	0	0	0	0	113.1	S432 Q433	S432-A435 PolarHBondContact O-N 3.2Å; Q433-A435 VanDerWaalsContact C-N 3.3Å; Q433-A435 PolarHBondContact O-N 2.81Å
436	Q	60.1	Low	72.3	Confident	72 Å²	72	88 Å²	88	34%	0.336	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-2	-179.2	-65.8	-174.2	-10.4	0	0	113.8	R363 Q433 V434 E438 T439	R363-Q436 PolarHBondContact NH1-O 3.26Å; R363-Q436 VanDerWaalsContact NH1-O 3.1Å; Q433-Q436 PolarHBondContact O-N 3.42Å; Q433-Q436 VanDerWaalsContact O-N 3.08Å; V434-Q436 PolarHBondContact O-N 3.49Å; Q436-E438 PolarHBondContact O-N 3.45Å; Q436-T439 PolarHBondContact O-N 3.32Å; Q436-T439 VanDerWaalsContact O-N 3.11Å; Q436-T439 PolarHBondContact O-OG1 3.35Å
437	L	59.8	Low	71.9	Confident	83 Å²	83	91.7 Å²	91.7	44%	0.435	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-30	178.8	-87	157.1	0	0	0	113.3	Q433 V434	Q433-L437 PolarHBondContact O-N 2.96Å; V434-L437 HydrophobicContact CB-CD1 4.37Å; V434-L437 HydrophobicContact CG1-CD1 4.05Å; V434-L437 WeakPolarHBondContact O-CB 3.3Å; V434-L437 PolarHBondContact O-N 3.04Å
438	E	59.6	Low	71.8	Confident	189 Å²	189	92.9 Å²	92.9	88%	0.883	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-8	-178.1	-62.6	-173.9	166.9	0	0	114	Q436	Q436-E438 PolarHBondContact O-N 3.45Å
439	T	64.5	Low	71.9	Confident	59 Å²	59	90.4 Å²	90.4	36%	0.362	51%	0.51	S	S	.	.	S	Bend	trans	-81.8	126.7	-176.2	61.2	0	0	0	0	111.7	Q436 K441 W444	Q436-T439 PolarHBondContact O-N 3.32Å; Q436-T439 VanDerWaalsContact O-N 3.11Å; Q436-T439 PolarHBondContact O-OG1 3.35Å; T439-K441 PolarHBondContact O-N 3.19Å; T439-W444 PolarHBondContact O-NE1 2.89Å; T439-W444 VanDerWaalsContact O-NE1 3.17Å; T439-W444 PolarHBondContact OG1-NE1 2.89Å
440	N	70.9	Confident	71.8	Confident	123 Å²	123	84.6 Å²	84.6	66%	0.658	48%	0.48	S	S	*	.			trans	-56.9	137.2	172.4	-84.5	-37.2	0	0	0	110.9	Q442 V443	N440-Q442 PolarHBondContact O-N 3.06Å; N440-V443 PolarHBondContact O-N 3.21Å
441	K	74.8	Confident	72.1	Confident	105 Å²	105	83.7 Å²	83.7	46%	0.457	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-51.1	-22	178.4	-174.3	168.1	-176.4	169.7	0	114.7	T439 V443 W444 E454	T439-K441 PolarHBondContact O-N 3.19Å; K441-V443 VanDerWaalsContact C-N 3.31Å; K441-V443 PolarHBondContact O-N 3.17Å; K441-W444 HydrophobicContact CB-CD2 4.29Å; K441-W444 HydrophobicContact CB-CE3 4.31Å; K441-W444 HydrophobicContact CB-CH2 4.33Å; K441-W444 HydrophobicContact CB-CZ2 4.32Å; K441-W444 HydrophobicContact CB-CZ3 4.34Å; K441-W444 HydrophobicContact CD-CZ3 4.23Å; K441-W444 HydrophobicContact CG-CD2 4.2Å; K441-W444 HydrophobicContact CG-CE3 3.81Å; K441-W444 HydrophobicContact CG-CH2 4.38Å; K441-W444 HydrophobicContact CG-CZ3 3.92Å; K441-W444 WeakPolarHBondContact O-CB 3.32Å; K441-W444 PolarHBondContact O-N 3.04Å; K441-E454 IonicContact NZ-OE1 2.74Å; K441-E454 PolarHBondContact NZ-OE1 2.84Å; K441-E454 IonicContact NZ-OE2 2.63Å; K441-E454 PolarHBondContact NZ-OE2 3.27Å
442	Q	74.4	Confident	73	Confident	185 Å²	185	83.3 Å²	83.3	86%	0.864	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-69.7	-23.1	177.7	-65.3	178.8	-10.4	0	0	114.1	N440 W444	N440-Q442 PolarHBondContact O-N 3.06Å; Q442-W444 VanDerWaalsContact C-N 3.33Å
443	V	78.2	Confident	74.1	Confident	116 Å²	116	80.7 Å²	80.7	70%	0.703	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-90.2	-7.1	-178.2	-171.7	0	0	0	0	111.4	N440 K441 S445	N440-V443 PolarHBondContact O-N 3.21Å; K441-V443 VanDerWaalsContact C-N 3.31Å; K441-V443 PolarHBondContact O-N 3.17Å; V443-S445 PolarHBondContact O-N 3.19Å
444	W	77.6	Confident	75.3	Confident	37 Å²	37	82.1 Å²	82.1	14%	0.14	45%	0.453	C	S	.	.			trans	-71.2	128	-175.5	-68.9	8.7	0	0	0	110.5	R363 T439 K441 Q442 H448 E450 I451	R363-W444 VanDerWaalsContact CZ-CZ2 3.45Å; T439-W444 PolarHBondContact O-NE1 2.89Å; T439-W444 VanDerWaalsContact O-NE1 3.17Å; T439-W444 PolarHBondContact OG1-NE1 2.89Å; K441-W444 HydrophobicContact CB-CD2 4.29Å; K441-W444 HydrophobicContact CB-CE3 4.31Å; K441-W444 HydrophobicContact CB-CH2 4.33Å; K441-W444 HydrophobicContact CB-CZ2 4.32Å; K441-W444 HydrophobicContact CB-CZ3 4.34Å; K441-W444 HydrophobicContact CD-CZ3 4.23Å; K441-W444 HydrophobicContact CG-CD2 4.2Å; K441-W444 HydrophobicContact CG-CE3 3.81Å; K441-W444 HydrophobicContact CG-CH2 4.38Å; K441-W444 HydrophobicContact CG-CZ3 3.92Å; K441-W444 WeakPolarHBondContact O-CB 3.32Å; K441-W444 PolarHBondContact O-N 3.04Å; Q442-W444 VanDerWaalsContact C-N 3.33Å; W444-H448 WeakPolarHBondContact CA-CD2 3.27Å; W444-H448 VanDerWaalsContact CA-NE2 3.31Å; W444-H448 WeakPolarHBondContact CA-NE2 3.39Å; W444-H448 WeakPolarHBondContact CB-CD2 3.41Å; W444-H448 AromaticContact CG-CD2 3.88Å; W444-E450 HydrophobicContact CH2-CG 4.16Å; W444-E450 HydrophobicContact CZ3-CB 4Å; W444-E450 HydrophobicContact CZ3-CG 3.71Å; W444-I451 HydrophobicContact CB-CD1 4.4Å; W444-I451 HydrophobicContact CE3-CD1 4.39Å; W444-I451 HydrophobicContact CE3-CG1 4.18Å
445	S	80.2	Confident	76.8	Confident	65 Å²	65	82.8 Å²	82.8	46%	0.455	45%	0.452	S	S	.	.			trans	-52	149.1	163.3	70.8	0	0	0	0	113	V443 E447 H448	V443-S445 PolarHBondContact O-N 3.19Å; S445-E447 PolarHBondContact O-N 3.25Å; S445-H448 PolarHBondContact N-CD2 2.71Å; S445-H448 PolarHBondContact N-NE2 3.27Å; S445-H448 PolarHBondContact O-CD2 3.16Å; S445-H448 PolarHBondContact O-N 3.2Å; S445-H448 PolarHBondContact OG-CD2 3.39Å; S445-H448 PolarHBondContact OG-NE2 3.1Å
446	G	78.6	Confident	78.5	Confident	71 Å²	71	80.2 Å²	80.2	73%	0.732	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-12.7	-178.8	0	0	0	0	0	115
447	E	80.3	Confident	80	Confident	172 Å²	172	77.4 Å²	77.4	80%	0.804	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	9.1	-173.9	-59.9	-179.1	170	0	0	113.1	S445 S449	S445-E447 PolarHBondContact O-N 3.25Å; E447-S449 PolarHBondContact O-N 3.37Å
448	H	82.1	Confident	81.6	Confident	34 Å²	34	76.1 Å²	76.1	16%	0.157	41%	0.414	C	S	.	.			trans	-59.5	133.3	177.2	-77.8	-71.2	0	0	0	111.5	W444 S445 E450 I451 I452	W444-H448 WeakPolarHBondContact CA-CD2 3.27Å; W444-H448 VanDerWaalsContact CA-NE2 3.31Å; W444-H448 WeakPolarHBondContact CA-NE2 3.39Å; W444-H448 WeakPolarHBondContact CB-CD2 3.41Å; W444-H448 AromaticContact CG-CD2 3.88Å; S445-H448 PolarHBondContact N-CD2 2.71Å; S445-H448 PolarHBondContact N-NE2 3.27Å; S445-H448 PolarHBondContact O-CD2 3.16Å; S445-H448 PolarHBondContact O-N 3.2Å; S445-H448 PolarHBondContact OG-CD2 3.39Å; S445-H448 PolarHBondContact OG-NE2 3.1Å; H448-E450 PolarHBondContact O-N 3.46Å; H448-E450 VanDerWaalsContact O-N 3.11Å; H448-I451 HydrophobicContact CB-CD1 4.33Å; H448-I451 HydrophobicContact CB-CG1 4.4Å; H448-I451 PolarHBondContact O-N 3.04Å; H448-I452 PolarHBondContact O-N 3.1Å
449	S	83.8	Confident	83.3	Confident	37 Å²	37	71.8 Å²	71.8	26%	0.259	39%	0.393	S	S	.	.	H	α-helix	trans	-53.5	-35	-178.7	58.6	0	0	0	0	113	N427 Q433 E447 I452 L453	N427-S449 PolarHBondContact ND2-OG 3.42Å; N427-S449 VanDerWaalsContact OD1-CB 3.26Å; N427-S449 WeakPolarHBondContact OD1-CB 3.35Å; N427-S449 PolarHBondContact OD1-OG 3.48Å; Q433-S449 PolarHBondContact NE2-OG 2.9Å; E447-S449 PolarHBondContact O-N 3.37Å; S449-I452 PolarHBondContact O-N 2.93Å; S449-L453 WeakPolarHBondContact O-CG 3.47Å; S449-L453 PolarHBondContact O-N 3.35Å
450	E	83.2	Confident	84.7	Confident	2 Å²	2	69 Å²	69	1%	0.009	38%	0.376	C	S	.	.	H	α-helix	trans	-59.7	-44.9	176.4	-169.7	63.5	-165.8	0	0	113.2	H360 W362 W444 H448 I452 L453 E454	H360-E450 VanDerWaalsContact O-OE1 3.09Å; W362-E450 WeakPolarHBondContact CA-OE1 3.34Å; W362-E450 VanDerWaalsContact CB-OE1 3.26Å; W362-E450 WeakPolarHBondContact CB-OE1 3.49Å; W362-E450 WeakPolarHBondContact CB-OE2 2.94Å; W362-E450 PolarHBondContact N-OE1 2.84Å; W444-E450 HydrophobicContact CH2-CG 4.16Å; W444-E450 HydrophobicContact CZ3-CB 4Å; W444-E450 HydrophobicContact CZ3-CG 3.71Å; H448-E450 PolarHBondContact O-N 3.46Å; H448-E450 VanDerWaalsContact O-N 3.11Å; E450-I452 VanDerWaalsContact C-N 3.3Å; E450-I452 PolarHBondContact O-N 3.3Å; E450-L453 PolarHBondContact O-N 3.17Å; E450-E454 WeakPolarHBondContact O-CG 3.4Å; E450-E454 PolarHBondContact O-N 2.99Å
451	I	85.9	Confident	85.8	Confident	38 Å²	38	65 Å²	65	20%	0.195	35%	0.354	C	S	.	.	H	α-helix	trans	-66	-39.3	179.7	-60.6	174.8	0	0	0	109.5	W444 H448 L453 E454 I455	W444-I451 HydrophobicContact CB-CD1 4.4Å; W444-I451 HydrophobicContact CE3-CD1 4.39Å; W444-I451 HydrophobicContact CE3-CG1 4.18Å; H448-I451 HydrophobicContact CB-CD1 4.33Å; H448-I451 HydrophobicContact CB-CG1 4.4Å; H448-I451 PolarHBondContact O-N 3.04Å; I451-L453 VanDerWaalsContact C-N 3.34Å; I451-L453 PolarHBondContact O-N 2.71Å; I451-E454 PolarHBondContact O-N 3.06Å; I451-I455 HydrophobicContact CG2-CD1 3.95Å; I451-I455 VanDerWaalsContact O-CG1 3.24Å; I451-I455 WeakPolarHBondContact O-CG1 3.42Å; I451-I455 PolarHBondContact O-N 3.03Å
452	I	89.1	Confident	86.8	Confident	97 Å²	97	64.7 Å²	64.7	50%	0.497	36%	0.36	S	S	.	.	H	α-helix	trans	-63	-42.5	176.6	-61	173.3	0	0	0	110.5	H448 S449 E450 I455 L456	H448-I452 PolarHBondContact O-N 3.1Å; S449-I452 PolarHBondContact O-N 2.93Å; E450-I452 VanDerWaalsContact C-N 3.3Å; E450-I452 PolarHBondContact O-N 3.3Å; I452-I455 PolarHBondContact O-N 2.87Å; I452-L456 WeakPolarHBondContact O-CB 3.34Å; I452-L456 PolarHBondContact O-N 2.98Å
453	L	90.2	Very high	87.7	Confident	9 Å²	9	56.4 Å²	56.4	5%	0.047	32%	0.323	C	S	.	.	H	α-helix	trans	-65.9	-40.2	175.8	-73.4	-179.2	0	0	0	112.8	W362 F420 N427 S449 E450 I451 L456 F457	W362-L453 HydrophobicContact CB-CD1 4.12Å; F420-L453 HydrophobicContact CD2-CD2 4.03Å; F420-L453 HydrophobicContact CE2-CB 4.34Å; F420-L453 HydrophobicContact CE2-CD2 4.4Å; N427-L453 WeakPolarHBondContact ND2-CD1 3.48Å; S449-L453 WeakPolarHBondContact O-CG 3.47Å; S449-L453 PolarHBondContact O-N 3.35Å; E450-L453 PolarHBondContact O-N 3.17Å; I451-L453 VanDerWaalsContact C-N 3.34Å; I451-L453 PolarHBondContact O-N 2.71Å; L453-L456 PolarHBondContact O-N 3.43Å; L453-F457 VanDerWaalsContact O-CB 3.31Å; L453-F457 WeakPolarHBondContact O-CB 3.39Å; L453-F457 PolarHBondContact O-N 3.42Å
454	E	89.3	Confident	88.5	Confident	46 Å²	46	50.9 Å²	50.9	22%	0.215	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-44.6	173.9	-74.7	-177.7	177.2	0	0	111.6	K441 E450 I451 F457 A458	K441-E454 IonicContact NZ-OE1 2.74Å; K441-E454 PolarHBondContact NZ-OE1 2.84Å; K441-E454 IonicContact NZ-OE2 2.63Å; K441-E454 PolarHBondContact NZ-OE2 3.27Å; E450-E454 WeakPolarHBondContact O-CG 3.4Å; E450-E454 PolarHBondContact O-N 2.99Å; I451-E454 PolarHBondContact O-N 3.06Å; E454-F457 PolarHBondContact O-N 2.88Å; E454-A458 WeakPolarHBondContact O-CB 3.38Å; E454-A458 PolarHBondContact O-N 3.45Å
455	I	91.6	Very high	89.3	Confident	111 Å²	111	51.6 Å²	51.6	57%	0.569	30%	0.299	S	S	*	.	H	α-helix	trans	-62	-46.4	176.6	-68.1	165.4	0	0	0	110.3	I451 I452 F457 A458 F459	I451-I455 HydrophobicContact CG2-CD1 3.95Å; I451-I455 VanDerWaalsContact O-CG1 3.24Å; I451-I455 WeakPolarHBondContact O-CG1 3.42Å; I451-I455 PolarHBondContact O-N 3.03Å; I452-I455 PolarHBondContact O-N 2.87Å; I455-F457 PolarHBondContact O-N 3.14Å; I455-A458 PolarHBondContact O-N 2.91Å; I455-F459 PolarHBondContact O-N 3.35Å
456	L	93.4	Very high	89.9	Confident	34 Å²	34	52.9 Å²	52.9	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-42.4	179.1	-178.3	59.6	0	0	0	111.5	L416 A419 F420 I452 L453 F459 I460	L416-L456 HydrophobicContact CD2-CD1 3.88Å; A419-L456 HydrophobicContact CB-CD2 4.18Å; F420-L456 HydrophobicContact CB-CD2 3.87Å; F420-L456 HydrophobicContact CB-CG 4.27Å; I452-L456 WeakPolarHBondContact O-CB 3.34Å; I452-L456 PolarHBondContact O-N 2.98Å; L453-L456 PolarHBondContact O-N 3.43Å; L456-F459 WeakPolarHBondContact O-CB 3.38Å; L456-F459 PolarHBondContact O-N 3.47Å; L456-I460 HydrophobicContact CD1-CD1 4.34Å; L456-I460 HydrophobicContact CG-CD1 4.02Å; L456-I460 WeakPolarHBondContact O-CB 3.14Å; L456-I460 VanDerWaalsContact O-CG1 3.25Å; L456-I460 WeakPolarHBondContact O-CG1 3.34Å; L456-I460 PolarHBondContact O-N 2.94Å
457	F	92.6	Very high	90.6	Very high	13 Å²	13	50.1 Å²	50.1	6%	0.057	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-42.4	176.8	-172.1	-101.8	0	0	0	112	L351 V354 A355 W362 F420 L453 E454 I455 F459 I460 L461	L351-F457 HydrophobicContact CD1-CE2 3.85Å; L351-F457 HydrophobicContact CD1-CZ 3.94Å; V354-F457 HydrophobicContact CB-CZ 4.5Å; V354-F457 HydrophobicContact CG1-CZ 3.94Å; A355-F457 HydrophobicContact CB-CE1 3.94Å; W362-F457 HydrophobicContact CH2-CD2 4.27Å; W362-F457 HydrophobicContact CH2-CE1 4.46Å; W362-F457 HydrophobicContact CH2-CE2 4.16Å; W362-F457 HydrophobicContact CH2-CG 4.48Å; W362-F457 HydrophobicContact CH2-CZ 4.26Å; W362-F457 HydrophobicContact CZ2-CD1 4.07Å; W362-F457 HydrophobicContact CZ2-CD2 4.27Å; W362-F457 HydrophobicContact CZ2-CE1 4.31Å; W362-F457 HydrophobicContact CZ2-CG 4.05Å; F420-F457 HydrophobicContact CD2-CB 4.1Å; F420-F457 HydrophobicContact CD2-CD2 4.33Å; F420-F457 HydrophobicContact CE1-CD2 4.04Å; F420-F457 HydrophobicContact CE2-CB 3.68Å; F420-F457 AromaticContact CE2-CD2 3.78Å; F420-F457 HydrophobicContact CE2-CD2 3.78Å; F420-F457 HydrophobicContact CE2-CG 4.11Å; F420-F457 HydrophobicContact CZ-CB 4.35Å; F420-F457 AromaticContact CZ-CD2 3.61Å; F420-F457 HydrophobicContact CZ-CD2 3.61Å; F420-F457 HydrophobicContact CZ-CE2 4.34Å; F420-F457 HydrophobicContact CZ-CG 4.28Å; L453-F457 VanDerWaalsContact O-CB 3.31Å; L453-F457 WeakPolarHBondContact O-CB 3.39Å; L453-F457 PolarHBondContact O-N 3.42Å; E454-F457 PolarHBondContact O-N 2.88Å; I455-F457 PolarHBondContact O-N 3.14Å; F457-F459 VanDerWaalsContact C-N 3.31Å; F457-F459 PolarHBondContact O-N 2.87Å; F457-I460 WeakPolarHBondContact O-CB 3.27Å; F457-I460 PolarHBondContact O-N 3.05Å; F457-L461 PolarHBondContact O-N 3.34Å
458	A	93.4	Very high	91.2	Very high	55 Å²	55	44.6 Å²	44.6	46%	0.455	24%	0.24	S	C	.	.	H	α-helix	trans	-60.9	-41.6	174.7	0	0	0	0	0	111.5	E454 I455 L461 V462	E454-A458 WeakPolarHBondContact O-CB 3.38Å; E454-A458 PolarHBondContact O-N 3.45Å; I455-A458 PolarHBondContact O-N 2.91Å; A458-L461 PolarHBondContact O-N 3.22Å; A458-V462 PolarHBondContact O-N 2.95Å
459	F	94.3	Very high	91.6	Very high	99 Å²	99	46.8 Å²	46.8	43%	0.434	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-44.2	175.6	-170.6	-109.3	0	0	0	112.1	F412 L416 I455 L456 F457 L461 V462 C463	F412-F459 HydrophobicContact CE1-CE1 4Å; F412-F459 HydrophobicContact CE1-CZ 4.43Å; F412-F459 AromaticContact CZ-CE1 3.86Å; F412-F459 HydrophobicContact CZ-CE1 3.86Å; F412-F459 HydrophobicContact CZ-CZ 4.33Å; L416-F459 HydrophobicContact CD1-CD1 3.79Å; L416-F459 HydrophobicContact CD1-CE1 3.69Å; L416-F459 HydrophobicContact CD2-CD1 4.29Å; L416-F459 HydrophobicContact CD2-CE1 4.35Å; I455-F459 PolarHBondContact O-N 3.35Å; L456-F459 WeakPolarHBondContact O-CB 3.38Å; L456-F459 PolarHBondContact O-N 3.47Å; F457-F459 VanDerWaalsContact C-N 3.31Å; F457-F459 PolarHBondContact O-N 2.87Å; F459-L461 VanDerWaalsContact C-N 3.3Å; F459-L461 PolarHBondContact O-N 3.21Å; F459-V462 PolarHBondContact O-N 3.03Å; F459-C463 PolarHBondContact O-N 3.37Å; F459-C463 PolarHBondContact O-SG 3.26Å
460	I	94.8	Very high	91.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-40.4	175.3	-75.3	167.8	0	0	0	112	L416 F417 F420 L456 F457 C463 S464	L416-I460 HydrophobicContact CB-CD1 4.19Å; L416-I460 HydrophobicContact CB-CG1 3.82Å; L416-I460 WeakPolarHBondContact O-CD1 3.43Å; F417-I460 HydrophobicContact CD1-CD1 4.43Å; F417-I460 HydrophobicContact CD1-CG2 3.98Å; F417-I460 HydrophobicContact CD2-CG2 4.47Å; F417-I460 HydrophobicContact CE1-CG2 3.26Å; F417-I460 HydrophobicContact CE2-CG2 3.81Å; F417-I460 HydrophobicContact CZ-CG2 3.12Å; F420-I460 HydrophobicContact CB-CD1 3.59Å; F420-I460 HydrophobicContact CG-CD1 4.12Å; L456-I460 HydrophobicContact CD1-CD1 4.34Å; L456-I460 HydrophobicContact CG-CD1 4.02Å; L456-I460 WeakPolarHBondContact O-CB 3.14Å; L456-I460 VanDerWaalsContact O-CG1 3.25Å; L456-I460 WeakPolarHBondContact O-CG1 3.34Å; L456-I460 PolarHBondContact O-N 2.94Å; F457-I460 WeakPolarHBondContact O-CB 3.27Å; F457-I460 PolarHBondContact O-N 3.05Å; I460-C463 PolarHBondContact O-N 3.03Å; I460-S464 VanDerWaalsContact O-CB 3.31Å; I460-S464 WeakPolarHBondContact O-CB 3.44Å; I460-S464 PolarHBondContact O-N 2.78Å; I460-S464 PolarHBondContact O-OG 2.94Å
461	L	94	Very high	92.3	Very high	39 Å²	39	45.8 Å²	45.8	20%	0.204	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-47	177.7	-177.9	65.9	0	0	0	111.1	L351 A355 F457 A458 F459 S464 C465	L351-L461 HydrophobicContact CD2-CD1 3.97Å; L351-L461 HydrophobicContact CG-CD1 4Å; A355-L461 HydrophobicContact CB-CD2 4.21Å; F457-L461 PolarHBondContact O-N 3.34Å; A458-L461 PolarHBondContact O-N 3.22Å; F459-L461 VanDerWaalsContact C-N 3.3Å; F459-L461 PolarHBondContact O-N 3.21Å; L461-S464 PolarHBondContact O-N 3.39Å; L461-C465 PolarHBondContact O-N 2.94Å; L461-C465 PolarHBondContact O-SG 3.26Å
462	V	95.3	Very high	92.5	Very high	97 Å²	97	47.1 Å²	47.1	59%	0.588	25%	0.247	S	C	*	.	H	α-helix	trans	-61.9	-48.3	177.2	175.5	0	0	0	0	110.8	A458 F459 S464 C465 F466	A458-V462 PolarHBondContact O-N 2.95Å; F459-V462 PolarHBondContact O-N 3.03Å; V462-S464 VanDerWaalsContact C-N 3.28Å; V462-S464 PolarHBondContact O-N 3.03Å; V462-C465 PolarHBondContact O-N 3.48Å; V462-F466 PolarHBondContact O-N 2.94Å
463	C	94.8	Very high	92.6	Very high	11 Å²	11	43 Å²	43	7%	0.074	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-40	177.4	-72	0	0	0	0	112	Y409 F459 I460 F466 R467	Y409-C463 WeakPolarHBondContact OH-CA 3.46Å; Y409-C463 WeakPolarHBondContact OH-CB 3.5Å; Y409-C463 PolarHBondContact OH-O 2.89Å; F459-C463 PolarHBondContact O-N 3.37Å; F459-C463 PolarHBondContact O-SG 3.26Å; I460-C463 PolarHBondContact O-N 3.03Å; C463-F466 PolarHBondContact O-N 2.87Å; C463-R467 PolarHBondContact O-N 3.35Å
464	S	94.3	Very high	92.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-42.9	178.3	-57.9	0	0	0	0	111	Y344 L348 L351 Q413 I460 L461 V462 F466 R467	Y344-S464 VanDerWaalsContact OH-C 3.31Å; Y344-S464 WeakPolarHBondContact OH-CA 3.22Å; Y344-S464 PolarHBondContact OH-O 3.48Å; L348-S464 WeakPolarHBondContact CD2-O 3.02Å; L351-S464 WeakPolarHBondContact CD2-OG 3.42Å; Q413-S464 PolarHBondContact NE2-OG 3.25Å; Q413-S464 VanDerWaalsContact NE2-OG 3.13Å; I460-S464 VanDerWaalsContact O-CB 3.31Å; I460-S464 WeakPolarHBondContact O-CB 3.44Å; I460-S464 PolarHBondContact O-N 2.78Å; I460-S464 PolarHBondContact O-OG 2.94Å; L461-S464 PolarHBondContact O-N 3.39Å; V462-S464 VanDerWaalsContact C-N 3.28Å; V462-S464 PolarHBondContact O-N 3.03Å; S464-F466 PolarHBondContact O-N 3.33Å; S464-R467 WeakPolarHBondContact O-CB 3.29Å; S464-R467 PolarHBondContact O-N 3.4Å
465	C	94.2	Very high	92.6	Very high	52 Å²	52	44.4 Å²	44.4	35%	0.351	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-41.1	174.4	-70.7	0	0	0	0	112.4	L461 V462 R467 L468	L461-C465 PolarHBondContact O-N 2.94Å; L461-C465 PolarHBondContact O-SG 3.26Å; V462-C465 PolarHBondContact O-N 3.48Å; C465-R467 VanDerWaalsContact C-N 3.25Å; C465-R467 PolarHBondContact O-N 3.24Å; C465-L468 VanDerWaalsContact O-CB 3.32Å; C465-L468 WeakPolarHBondContact O-CB 3.19Å; C465-L468 WeakPolarHBondContact O-CG 3.14Å; C465-L468 PolarHBondContact O-N 3.06Å; C465-L468 VanDerWaalsContact O-N 3.14Å
466	F	93.1	Very high	92.3	Very high	93 Å²	93	43.3 Å²	43.3	41%	0.408	24%	0.235	S	C	.	.	H	α-helix	trans	-60.7	-33.1	-179.7	-173.7	-96.6	0	0	0	113	W406 Y409 V462 C463 S464 L468 F469	W406-F466 HydrophobicContact CH2-CE1 4.31Å; W406-F466 HydrophobicContact CZ3-CE1 4.31Å; Y409-F466 AromaticContact CE2-CD1 3.83Å; Y409-F466 HydrophobicContact CE2-CD1 3.83Å; Y409-F466 HydrophobicContact CE2-CE1 4.3Å; Y409-F466 AromaticContact CZ-CD1 3.81Å; V462-F466 PolarHBondContact O-N 2.94Å; C463-F466 PolarHBondContact O-N 2.87Å; S464-F466 PolarHBondContact O-N 3.33Å; F466-L468 PolarHBondContact O-N 3.38Å; F466-F469 AromaticContact CD2-CD2 3.68Å; F466-F469 HydrophobicContact CD2-CD2 3.68Å; F466-F469 AromaticContact CD2-CE2 3.71Å; F466-F469 HydrophobicContact CD2-CE2 3.71Å; F466-F469 AromaticContact CE2-CD2 3.75Å; F466-F469 HydrophobicContact CE2-CD2 3.75Å; F466-F469 AromaticContact CE2-CE2 3.85Å; F466-F469 HydrophobicContact CE2-CE2 3.85Å; F466-F469 HydrophobicContact CG-CD2 4.14Å; F466-F469 HydrophobicContact CZ-CD2 4.28Å; F466-F469 WeakPolarHBondContact O-CB 3.4Å; F466-F469 WeakPolarHBondContact O-CD2 3.37Å; F466-F469 PolarHBondContact O-N 3.26Å; F466-F469 VanDerWaalsContact O-N 3.13Å
467	R	93.1	Very high	92.1	Very high	13 Å²	13	51.5 Å²	51.5	5%	0.049	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.9	177.7	-175	51	173.4	75.2	-5.5	114.4	Y344 Y409 D410 C463 S464 C465 F469 Y470	Y344-R467 HydrophobicContact CE1-CB 4.12Å; Y344-R467 HydrophobicContact CE1-CG 4.16Å; Y344-R467 HydrophobicContact CE2-CB 4.48Å; Y344-R467 HydrophobicContact CE2-CG 4.01Å; Y344-R467 WeakPolarHBondContact OH-CB 3.41Å; Y409-R467 HydrophobicContact CE1-CB 3.94Å; Y409-R467 HydrophobicContact CE1-CG 4.42Å; D410-R467 IonicContact OD1-CZ 3.91Å; D410-R467 IonicContact OD1-NE 2.75Å; D410-R467 PolarHBondContact OD1-NE 2.69Å; D410-R467 IonicContact OD1-NH2 3.45Å; D410-R467 PolarHBondContact OD1-NH2 3.2Å; D410-R467 IonicContact OD2-CZ 3.76Å; D410-R467 IonicContact OD2-NE 3.42Å; D410-R467 IonicContact OD2-NH2 2.81Å; D410-R467 PolarHBondContact OD2-NH2 3.36Å; C463-R467 PolarHBondContact O-N 3.35Å; S464-R467 WeakPolarHBondContact O-CB 3.29Å; S464-R467 PolarHBondContact O-N 3.4Å; C465-R467 VanDerWaalsContact C-N 3.25Å; C465-R467 PolarHBondContact O-N 3.24Å; R467-F469 PolarHBondContact O-N 2.84Å; R467-Y470 WeakPolarHBondContact O-CB 3.36Å; R467-Y470 PolarHBondContact O-N 2.86Å
468	L	91.9	Very high	92	Very high	55 Å²	55	53.7 Å²	53.7	29%	0.288	28%	0.277	S	S	.	.	H	α-helix	trans	-58.3	-28.7	173.6	-75.6	172.6	0	0	0	113.1	Y344 L345 L348 C465 F466 Y470 F471 L472	Y344-L468 HydrophobicContact CD1-CD2 3.94Å; Y344-L468 HydrophobicContact CE1-CD2 4.01Å; Y344-L468 HydrophobicContact CE1-CG 4.23Å; L345-L468 HydrophobicContact CD2-CD2 3.88Å; L348-L468 HydrophobicContact CD1-CD1 3.7Å; L348-L468 HydrophobicContact CD1-CD2 3.59Å; L348-L468 HydrophobicContact CD1-CG 3.61Å; C465-L468 VanDerWaalsContact O-CB 3.32Å; C465-L468 WeakPolarHBondContact O-CB 3.19Å; C465-L468 WeakPolarHBondContact O-CG 3.14Å; C465-L468 PolarHBondContact O-N 3.06Å; C465-L468 VanDerWaalsContact O-N 3.14Å; F466-L468 PolarHBondContact O-N 3.38Å; L468-Y470 PolarHBondContact O-N 3.31Å; L468-F471 PolarHBondContact O-N 2.87Å; L468-L472 PolarHBondContact O-N 2.87Å; L468-L472 VanDerWaalsContact O-N 3.13Å
469	F	91.6	Very high	91.9	Very high	80 Å²	80	51.1 Å²	51.1	35%	0.351	26%	0.255	S	S	.	.	H	α-helix	trans	-58.7	-30	177.9	-75.1	-56.8	0	0	0	113.3	W406 F466 R467 F471 L472 Q473 M482	W406-F469 HydrophobicContact CH2-CB 3.76Å; W406-F469 HydrophobicContact CZ2-CB 4.35Å; F466-F469 AromaticContact CD2-CD2 3.68Å; F466-F469 HydrophobicContact CD2-CD2 3.68Å; F466-F469 AromaticContact CD2-CE2 3.71Å; F466-F469 HydrophobicContact CD2-CE2 3.71Å; F466-F469 AromaticContact CE2-CD2 3.75Å; F466-F469 HydrophobicContact CE2-CD2 3.75Å; F466-F469 AromaticContact CE2-CE2 3.85Å; F466-F469 HydrophobicContact CE2-CE2 3.85Å; F466-F469 HydrophobicContact CG-CD2 4.14Å; F466-F469 HydrophobicContact CZ-CD2 4.28Å; F466-F469 WeakPolarHBondContact O-CB 3.4Å; F466-F469 WeakPolarHBondContact O-CD2 3.37Å; F466-F469 PolarHBondContact O-N 3.26Å; F466-F469 VanDerWaalsContact O-N 3.13Å; R467-F469 PolarHBondContact O-N 2.84Å; F469-F471 VanDerWaalsContact C-N 3.3Å; F469-F471 PolarHBondContact O-N 3.44Å; F469-L472 HydrophobicContact CD1-CD1 3.94Å; F469-L472 HydrophobicContact CE1-CD1 4.32Å; F469-L472 PolarHBondContact O-N 3.27Å; F469-Q473 PolarHBondContact O-N 2.79Å; F469-M482 HydrophobicContact CB-CE 3.6Å; F469-M482 HydrophobicContact CD1-CE 3.29Å; F469-M482 HydrophobicContact CD1-SD 3.83Å; F469-M482 HydrophobicContact CE1-CE 4.14Å; F469-M482 HydrophobicContact CE1-SD 4.26Å; F469-M482 HydrophobicContact CG-CE 3.65Å
470	Y	90.6	Very high	91.7	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-36	172.6	176.1	-90.8	0	0	0	112.6	W406 R467 L468 Q473 V627 D630 Y631 R636	W406-Y470 HydrophobicContact CB-CD2 3.79Å; W406-Y470 HydrophobicContact CB-CE2 4.06Å; W406-Y470 AromaticContact CD1-CD2 3.69Å; W406-Y470 AromaticContact CD2-CD2 3.8Å; W406-Y470 HydrophobicContact CD2-CD2 3.8Å; W406-Y470 HydrophobicContact CD2-CG 4.43Å; W406-Y470 HydrophobicContact CE3-CD2 4.42Å; W406-Y470 AromaticContact CG-CD2 3.49Å; W406-Y470 HydrophobicContact CG-CD2 3.49Å; W406-Y470 VanDerWaalsContact CG-CD2 3.49Å; W406-Y470 HydrophobicContact CG-CE2 4.12Å; R467-Y470 WeakPolarHBondContact O-CB 3.36Å; R467-Y470 PolarHBondContact O-N 2.86Å; L468-Y470 PolarHBondContact O-N 3.31Å; Y470-Q473 WeakPolarHBondContact O-CG 3.5Å; Y470-Q473 PolarHBondContact O-NE2 2.76Å; Y470-V627 HydrophobicContact CE1-CG1 4.18Å; Y470-D630 PolarHBondContact OH-OD2 3.01Å; Y470-Y631 HydrophobicContact CE1-CE2 4.43Å; Y470-R636 PolarHBondContact OH-NH1 2.87Å
471	F	90.8	Very high	91.5	Very high	14 Å²	14	53.2 Å²	53.2	6%	0.061	27%	0.273	C	S	.	.	H	α-helix	trans	-80.6	-33	179.5	-62.7	-74.9	0	0	0	111.4	Y337 T340 L341 Y344 L468 F469 Q473 L474	Y337-F471 AromaticContact CE2-CD1 3.58Å; Y337-F471 HydrophobicContact CE2-CD1 3.58Å; Y337-F471 HydrophobicContact CE2-CE1 4.13Å; Y337-F471 AromaticContact CZ-CD1 3.85Å; Y337-F471 PolarHBondContact OH-O 3.29Å; T340-F471 HydrophobicContact CG2-CE1 4.49Å; T340-F471 HydrophobicContact CG2-CZ 4.42Å; L341-F471 HydrophobicContact CB-CD1 4.03Å; L341-F471 HydrophobicContact CB-CE1 4.06Å; L341-F471 HydrophobicContact CD1-CB 3.8Å; L341-F471 HydrophobicContact CD1-CD1 3.76Å; L341-F471 HydrophobicContact CD1-CD2 3.96Å; L341-F471 HydrophobicContact CD1-CE1 4.29Å; L341-F471 HydrophobicContact CD1-CE2 4.46Å; L341-F471 HydrophobicContact CD1-CG 3.57Å; L341-F471 HydrophobicContact CG-CD1 4.38Å; Y344-F471 HydrophobicContact CD1-CD2 4.14Å; Y344-F471 AromaticContact CD1-CE2 3.54Å; Y344-F471 HydrophobicContact CD1-CE2 3.54Å; Y344-F471 HydrophobicContact CD1-CZ 4.46Å; Y344-F471 HydrophobicContact CD2-CE2 4.27Å; Y344-F471 HydrophobicContact CE1-CE2 4.2Å; Y344-F471 AromaticContact CG-CE2 3.63Å; Y344-F471 HydrophobicContact CG-CE2 3.63Å; Y344-F471 HydrophobicContact CG-CZ 4.13Å; L468-F471 PolarHBondContact O-N 2.87Å; F469-F471 VanDerWaalsContact C-N 3.3Å; F469-F471 PolarHBondContact O-N 3.44Å; F471-Q473 PolarHBondContact O-N 3.47Å; F471-L474 PolarHBondContact O-N 3.16Å
472	L	90.4	Very high	91.3	Very high	66 Å²	66	53 Å²	53	35%	0.346	27%	0.271	S	S	.	.	H	α-helix	trans	-64.6	-24.9	177.1	-68.1	174.1	0	0	0	113	L468 F469 L474 N475 I478	L468-L472 PolarHBondContact O-N 2.87Å; L468-L472 VanDerWaalsContact O-N 3.13Å; F469-L472 HydrophobicContact CD1-CD1 3.94Å; F469-L472 HydrophobicContact CE1-CD1 4.32Å; F469-L472 PolarHBondContact O-N 3.27Å; L472-L474 PolarHBondContact O-N 3.09Å; L472-N475 WeakPolarHBondContact O-CB 3.36Å; L472-N475 PolarHBondContact O-N 3.44Å; L472-N475 VanDerWaalsContact O-N 3.11Å; L472-I478 HydrophobicContact CB-CG2 4.27Å; L472-I478 HydrophobicContact CD2-CD1 4.22Å
473	Q	90.8	Very high	91	Very high	10 Å²	10	49.1 Å²	49.1	5%	0.047	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-22.6	-178.2	84.9	-163.3	-38.1	0	0	114.3	F469 Y470 F471 N475 G479 Y620 V627	F469-Q473 PolarHBondContact O-N 2.79Å; Y470-Q473 WeakPolarHBondContact O-CG 3.5Å; Y470-Q473 PolarHBondContact O-NE2 2.76Å; F471-Q473 PolarHBondContact O-N 3.47Å; Q473-N475 VanDerWaalsContact C-N 3.33Å; Q473-G479 VanDerWaalsContact O-CA 3.3Å; Q473-G479 WeakPolarHBondContact O-CA 3.44Å; Q473-Y620 WeakPolarHBondContact O-CE2 3.26Å; Q473-V627 VanDerWaalsContact CD-CG2 3.46Å; Q473-V627 HydrophobicContact CG-CG2 3.92Å
474	L	89.6	Confident	90.7	Very high	29 Å²	29	49.6 Å²	49.6	15%	0.152	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.9	176.6	-75.1	117.4	0	0	0	113.5	Y337 F471 L472 P476 Y620 V627	Y337-L474 HydrophobicContact CD2-CD1 4.17Å; Y337-L474 HydrophobicContact CE2-CD1 3.34Å; F471-L474 PolarHBondContact O-N 3.16Å; L472-L474 PolarHBondContact O-N 3.09Å; L474-P476 WeakPolarHBondContact O-CD 3.44Å; L474-Y620 PolarHBondContact O-OH 2.86Å; L474-V627 HydrophobicContact CD1-CB 4.2Å; L474-V627 HydrophobicContact CD1-CG1 3.46Å; L474-V627 VanDerWaalsContact CD1-CG1 3.46Å; L474-V627 HydrophobicContact CD1-CG2 4.47Å; L474-V627 HydrophobicContact CD2-CB 4.42Å; L474-V627 HydrophobicContact CD2-CG1 4.21Å; L474-V627 HydrophobicContact CG-CB 4.38Å; L474-V627 HydrophobicContact CG-CG1 4.12Å
475	N	89.4	Confident	90.5	Very high	56 Å²	56	53.8 Å²	53.8	30%	0.299	27%	0.272	S	S	.	.	S	Bend	trans	-73.6	126.7	-179.8	-175.7	-21.9	0	0	0	109.4	L472 Q473 Y477 I478 G479	L472-N475 WeakPolarHBondContact O-CB 3.36Å; L472-N475 PolarHBondContact O-N 3.44Å; L472-N475 VanDerWaalsContact O-N 3.11Å; Q473-N475 VanDerWaalsContact C-N 3.33Å; N475-Y477 PolarHBondContact O-N 2.93Å; N475-Y477 PolarHBondContact OD1-N 2.82Å; N475-Y477 VanDerWaalsContact OD1-N 3.12Å; N475-I478 HydrophobicContact CB-CB 4.26Å; N475-I478 PolarHBondContact O-N 3.39Å; N475-G479 WeakPolarHBondContact O-CA 3.29Å; N475-G479 PolarHBondContact O-N 3.49Å
476	P	86.9	Confident	90.1	Very high	88 Å²	88	55.2 Å²	55.2	57%	0.571	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-29.2	179.5	-27.7	35.2	0	0	0	115.5	L474 P480 Y620	L474-P476 WeakPolarHBondContact O-CD 3.44Å; P476-P480 WeakPolarHBondContact O-CD 3.28Å; P476-Y620 WeakPolarHBondContact CA-OH 3.48Å
477	Y	87.7	Confident	89.7	Confident	207 Å²	207	54.5 Å²	54.5	81%	0.812	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-39.5	-178.2	-59.3	-76.1	0	0	0	113.3	N475	N475-Y477 PolarHBondContact O-N 2.93Å; N475-Y477 PolarHBondContact OD1-N 2.82Å; N475-Y477 VanDerWaalsContact OD1-N 3.12Å
478	I	91.4	Very high	89.5	Confident	59 Å²	59	54.2 Å²	54.2	30%	0.303	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-27.8	-173.9	-59.1	173.7	0	0	0	111.1	L472 N475 L481 M482	L472-I478 HydrophobicContact CB-CG2 4.27Å; L472-I478 HydrophobicContact CD2-CD1 4.22Å; N475-I478 HydrophobicContact CB-CB 4.26Å; N475-I478 PolarHBondContact O-N 3.39Å; I478-L481 WeakPolarHBondContact O-CB 3.38Å; I478-L481 PolarHBondContact O-N 3.35Å; I478-M482 HydrophobicContact CG2-CG 3.85Å; I478-M482 WeakPolarHBondContact O-CG 3.47Å; I478-M482 PolarHBondContact O-N 3.48Å
479	G	90.7	Very high	89.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-56.9	-52.2	-175.9	0	0	0	0	0	114	Q473 N475 L481 M482 V483	Q473-G479 VanDerWaalsContact O-CA 3.3Å; Q473-G479 WeakPolarHBondContact O-CA 3.44Å; N475-G479 WeakPolarHBondContact O-CA 3.29Å; N475-G479 PolarHBondContact O-N 3.49Å; G479-L481 VanDerWaalsContact C-N 3.27Å; G479-L481 PolarHBondContact O-N 2.67Å; G479-M482 PolarHBondContact O-N 3.34Å; G479-M482 VanDerWaalsContact O-N 3.13Å; G479-V483 WeakPolarHBondContact O-CG2 3.4Å; G479-V483 PolarHBondContact O-N 3.07Å
480	P	91	Very high	88.9	Confident	40 Å²	40	54.6 Å²	54.6	26%	0.26	29%	0.288	S	S	.	.	H	α-helix	trans	-56.9	-40.1	176.5	-26.4	35.3	0	0	0	112.9	P476 V483 T484 Y612 Y620	P476-P480 WeakPolarHBondContact O-CD 3.28Å; P480-V483 PolarHBondContact O-N 2.98Å; P480-T484 PolarHBondContact O-N 3.3Å; P480-T484 PolarHBondContact O-OG1 3.18Å; P480-Y612 PolarHBondContact O-OH 3.36Å; P480-Y620 HydrophobicContact CG-CD1 4.27Å; P480-Y620 HydrophobicContact CG-CD2 3.99Å; P480-Y620 HydrophobicContact CG-CE2 4.43Å; P480-Y620 HydrophobicContact CG-CG 3.9Å
481	L	90.1	Very high	88.8	Confident	104 Å²	104	54.7 Å²	54.7	55%	0.545	29%	0.289	S	S	.	.	H	α-helix	trans	-63.1	-42.6	176.9	177.5	66.2	0	0	0	111.9	I478 G479 V483 T484 I485	I478-L481 WeakPolarHBondContact O-CB 3.38Å; I478-L481 PolarHBondContact O-N 3.35Å; G479-L481 VanDerWaalsContact C-N 3.27Å; G479-L481 PolarHBondContact O-N 2.67Å; L481-V483 VanDerWaalsContact C-N 3.33Å; L481-V483 PolarHBondContact O-N 3.13Å; L481-T484 WeakPolarHBondContact O-CB 3.44Å; L481-T484 PolarHBondContact O-N 3.19Å; L481-I485 HydrophobicContact CG-CD1 4.26Å; L481-I485 WeakPolarHBondContact O-CG1 3.49Å; L481-I485 PolarHBondContact O-N 3Å
482	M	90.4	Very high	88.7	Confident	35 Å²	35	56.6 Å²	56.6	17%	0.172	30%	0.3	C	S	.	.	H	α-helix	trans	-64.8	-37.7	177.9	-69.7	-61.9	-64.9	0	0	112.2	F469 I478 G479 I485 S486	F469-M482 HydrophobicContact CB-CE 3.6Å; F469-M482 HydrophobicContact CD1-CE 3.29Å; F469-M482 HydrophobicContact CD1-SD 3.83Å; F469-M482 HydrophobicContact CE1-CE 4.14Å; F469-M482 HydrophobicContact CE1-SD 4.26Å; F469-M482 HydrophobicContact CG-CE 3.65Å; I478-M482 HydrophobicContact CG2-CG 3.85Å; I478-M482 WeakPolarHBondContact O-CG 3.47Å; I478-M482 PolarHBondContact O-N 3.48Å; G479-M482 PolarHBondContact O-N 3.34Å; G479-M482 VanDerWaalsContact O-N 3.13Å; M482-I485 PolarHBondContact O-N 2.93Å; M482-I485 HydrophobicContact SD-CD1 4.37Å; M482-S486 WeakPolarHBondContact O-CB 3.23Å; M482-S486 PolarHBondContact O-N 3.32Å
483	V	88.4	Confident	88.7	Confident	16 Å²	16	58.3 Å²	58.3	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-66.5	-40.7	176	176.5	0	0	0	0	110.9	G479 P480 L481 I485 S486 R487 Y612 D619 Q623	G479-V483 WeakPolarHBondContact O-CG2 3.4Å; G479-V483 PolarHBondContact O-N 3.07Å; P480-V483 PolarHBondContact O-N 2.98Å; L481-V483 VanDerWaalsContact C-N 3.33Å; L481-V483 PolarHBondContact O-N 3.13Å; V483-I485 PolarHBondContact O-N 3.45Å; V483-S486 PolarHBondContact O-N 3.21Å; V483-R487 PolarHBondContact O-N 2.91Å; V483-Y612 HydrophobicContact CB-CE2 4.47Å; V483-Y612 WeakPolarHBondContact CB-OH 3.5Å; V483-Y612 HydrophobicContact CG1-CE2 3.65Å; V483-Y612 VanDerWaalsContact CG1-OH 3.31Å; V483-Y612 WeakPolarHBondContact CG1-OH 3.46Å; V483-D619 HydrophobicContact CG1-CB 4.06Å; V483-Q623 HydrophobicContact CG2-CB 3.89Å; V483-Q623 HydrophobicContact CG2-CG 3.92Å
484	T	89.2	Confident	88.5	Confident	21 Å²	21	65.8 Å²	65.8	13%	0.129	34%	0.336	C	S	.	.	H	α-helix	trans	-57.6	-48.3	172.9	-50.5	0	0	0	0	111.4	P480 L481 S486 R487 S488 I609 Y612	P480-T484 PolarHBondContact O-N 3.3Å; P480-T484 PolarHBondContact O-OG1 3.18Å; L481-T484 WeakPolarHBondContact O-CB 3.44Å; L481-T484 PolarHBondContact O-N 3.19Å; T484-S486 VanDerWaalsContact C-N 3.34Å; T484-S486 PolarHBondContact O-N 3.04Å; T484-R487 PolarHBondContact O-N 3.22Å; T484-S488 PolarHBondContact O-N 3.19Å; T484-S488 PolarHBondContact O-OG 3.34Å; T484-S488 VanDerWaalsContact O-OG 3.06Å; T484-I609 HydrophobicContact CG2-CB 4.49Å; T484-I609 HydrophobicContact CG2-CG1 3.73Å; T484-I609 HydrophobicContact CG2-CG2 4.44Å; T484-Y612 HydrophobicContact CG2-CD1 4.1Å; T484-Y612 WeakPolarHBondContact OG1-CD1 3.4Å; T484-Y612 WeakPolarHBondContact OG1-CE1 3.24Å
485	I	89.3	Confident	88.5	Confident	87 Å²	87	64.9 Å²	64.9	45%	0.446	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-46.6	178.4	-66.7	166.1	0	0	0	110.4	L481 M482 V483 R487 S488 V489	L481-I485 HydrophobicContact CG-CD1 4.26Å; L481-I485 WeakPolarHBondContact O-CG1 3.49Å; L481-I485 PolarHBondContact O-N 3Å; M482-I485 PolarHBondContact O-N 2.93Å; M482-I485 HydrophobicContact SD-CD1 4.37Å; V483-I485 PolarHBondContact O-N 3.45Å; I485-R487 VanDerWaalsContact C-N 3.35Å; I485-R487 PolarHBondContact O-N 3.14Å; I485-S488 PolarHBondContact O-N 3.2Å; I485-V489 WeakPolarHBondContact O-CG2 3.49Å; I485-V489 PolarHBondContact O-N 3.15Å
486	S	86.5	Confident	88.5	Confident	82 Å²	82	66.1 Å²	66.1	57%	0.573	34%	0.336	S	S	*	.	H	α-helix	trans	-58.2	-44.1	-179.4	-173.5	0	0	0	0	112.5	M482 V483 T484 V489	M482-S486 WeakPolarHBondContact O-CB 3.23Å; M482-S486 PolarHBondContact O-N 3.32Å; V483-S486 PolarHBondContact O-N 3.21Å; T484-S486 VanDerWaalsContact C-N 3.34Å; T484-S486 PolarHBondContact O-N 3.04Å; S486-V489 PolarHBondContact O-N 3.1Å
487	R	84.5	Confident	88.7	Confident	79 Å²	79	66.3 Å²	66.3	30%	0.298	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-44.9	176.2	-72.7	-173.3	61.1	165.1	-7	111.7	V483 T484 I485 V489 T490 E608 D619	V483-R487 PolarHBondContact O-N 2.91Å; T484-R487 PolarHBondContact O-N 3.22Å; I485-R487 VanDerWaalsContact C-N 3.35Å; I485-R487 PolarHBondContact O-N 3.14Å; R487-V489 PolarHBondContact O-N 3.3Å; R487-T490 PolarHBondContact O-N 3.32Å; R487-T490 VanDerWaalsContact O-N 3.1Å; R487-E608 IonicContact CZ-OE1 3.14Å; R487-E608 IonicContact NE-OE1 3.46Å; R487-E608 IonicContact NH2-OE1 4Å; R487-E608 PolarHBondContact NH2-OE1 2.89Å; R487-E608 VanDerWaalsContact NH2-OE1 3.1Å; R487-D619 IonicContact CZ-OD2 2.64Å; R487-D619 IonicContact NH1-OD2 3.07Å; R487-D619 PolarHBondContact NH1-OD2 3.48Å
488	S	88	Confident	88.9	Confident	6 Å²	6	60.5 Å²	60.5	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-23.9	179.3	-61.1	0	0	0	0	114.1	T484 I485 T490 C491 L492	T484-S488 PolarHBondContact O-N 3.19Å; T484-S488 PolarHBondContact O-OG 3.34Å; T484-S488 VanDerWaalsContact O-OG 3.06Å; I485-S488 PolarHBondContact O-N 3.2Å; S488-T490 PolarHBondContact O-N 3.19Å; S488-C491 WeakPolarHBondContact O-CB 3.37Å; S488-C491 PolarHBondContact O-N 3.45Å; S488-L492 PolarHBondContact O-N 3.38Å
489	V	87.2	Confident	88.9	Confident	65 Å²	65	58.7 Å²	58.7	39%	0.394	31%	0.308	S	S	.	.	H	α-helix	trans	-61.1	-33.6	174.2	170.5	0	0	0	0	111.7	I485 S486 R487 C491 L492 I493	I485-V489 WeakPolarHBondContact O-CG2 3.49Å; I485-V489 PolarHBondContact O-N 3.15Å; S486-V489 PolarHBondContact O-N 3.1Å; R487-V489 PolarHBondContact O-N 3.3Å; V489-C491 VanDerWaalsContact C-N 3.31Å; V489-C491 PolarHBondContact O-N 3.08Å; V489-L492 WeakPolarHBondContact O-CB 3.47Å; V489-L492 PolarHBondContact O-N 3.15Å; V489-L492 VanDerWaalsContact O-N 3.13Å; V489-I493 HydrophobicContact CG1-CD1 4.07Å; V489-I493 HydrophobicContact CG1-CG1 4.34Å; V489-I493 WeakPolarHBondContact O-CG1 3.25Å; V489-I493 PolarHBondContact O-N 3.1Å
490	T	84	Confident	89	Confident	78 Å²	78	64.4 Å²	64.4	48%	0.479	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-38.1	178	-54.3	0	0	0	0	111.5	R487 S488	R487-T490 PolarHBondContact O-N 3.32Å; R487-T490 VanDerWaalsContact O-N 3.1Å; S488-T490 PolarHBondContact O-N 3.19Å
491	C	88.4	Confident	89.1	Confident	6 Å²	6	66.9 Å²	66.9	4%	0.041	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-46.3	170.5	162.1	0	0	0	0	111	S488 V489 I493 R494 Y495 M604	S488-C491 WeakPolarHBondContact O-CB 3.37Å; S488-C491 PolarHBondContact O-N 3.45Å; V489-C491 VanDerWaalsContact C-N 3.31Å; V489-C491 PolarHBondContact O-N 3.08Å; C491-I493 VanDerWaalsContact C-N 3.32Å; C491-I493 PolarHBondContact O-N 3.33Å; C491-R494 PolarHBondContact O-N 3.44Å; C491-Y495 PolarHBondContact O-N 3.37Å; C491-Y495 VanDerWaalsContact O-N 3.11Å; C491-M604 HydrophobicContact CB-CE 3.97Å; C491-M604 WeakPolarHBondContact SG-CE 3.33Å; C491-M604 WeakPolarHBondContact SG-CG 3.44Å; C491-M604 PolarHBondContact SG-SD 3.2Å
492	L	89.9	Confident	89.2	Confident	55 Å²	55	63.6 Å²	63.6	29%	0.288	33%	0.332	S	S	.	.	H	α-helix	trans	-59.3	-39.3	178.8	-175.9	65.2	0	0	0	112.5	S488 V489 R494 Y495 L496 M601	S488-L492 PolarHBondContact O-N 3.38Å; V489-L492 WeakPolarHBondContact O-CB 3.47Å; V489-L492 PolarHBondContact O-N 3.15Å; V489-L492 VanDerWaalsContact O-N 3.13Å; L492-R494 PolarHBondContact O-N 3.41Å; L492-Y495 HydrophobicContact CD1-CD1 4.14Å; L492-Y495 WeakPolarHBondContact O-CB 3.32Å; L492-Y495 PolarHBondContact O-N 3.33Å; L492-L496 HydrophobicContact CD1-CG 4.47Å; L492-L496 HydrophobicContact CG-CD1 4.22Å; L492-L496 HydrophobicContact CG-CG 4.3Å; L492-L496 VanDerWaalsContact O-CG 3.3Å; L492-L496 WeakPolarHBondContact O-CG 3.38Å; L492-L496 PolarHBondContact O-N 3.29Å; L492-M601 HydrophobicContact CD1-CG 4.5Å; L492-M601 HydrophobicContact CD1-SD 3.84Å
493	I	89.8	Confident	89.3	Confident	101 Å²	101	62.3 Å²	62.3	52%	0.518	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-44.2	177.9	-69.1	166.3	0	0	0	111.1	V489 C491 Y495 L496 V497	V489-I493 HydrophobicContact CG1-CD1 4.07Å; V489-I493 HydrophobicContact CG1-CG1 4.34Å; V489-I493 WeakPolarHBondContact O-CG1 3.25Å; V489-I493 PolarHBondContact O-N 3.1Å; C491-I493 VanDerWaalsContact C-N 3.32Å; C491-I493 PolarHBondContact O-N 3.33Å; I493-Y495 VanDerWaalsContact C-N 3.29Å; I493-Y495 PolarHBondContact O-N 3.49Å; I493-L496 PolarHBondContact O-N 3.06Å; I493-V497 PolarHBondContact O-N 2.96Å
494	R	86.8	Confident	89.6	Confident	167 Å²	167	64.2 Å²	64.2	63%	0.63	33%	0.334	S	S	*	.	H	α-helix	trans	-61.8	-40.6	176.5	-63.7	177.3	-171.3	166.1	3.3	111.4	C491 L492 V497	C491-R494 PolarHBondContact O-N 3.44Å; L492-R494 PolarHBondContact O-N 3.41Å; R494-V497 PolarHBondContact O-N 3.27Å
495	Y	88.6	Confident	89.8	Confident	11 Å²	11	66.2 Å²	66.2	4%	0.043	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-43.8	175	172.1	-93.9	0	0	0	112.7	C491 L492 I493 V497 I498 Y499 W549 L597 M601	C491-Y495 PolarHBondContact O-N 3.37Å; C491-Y495 VanDerWaalsContact O-N 3.11Å; L492-Y495 HydrophobicContact CD1-CD1 4.14Å; L492-Y495 WeakPolarHBondContact O-CB 3.32Å; L492-Y495 PolarHBondContact O-N 3.33Å; I493-Y495 VanDerWaalsContact C-N 3.29Å; I493-Y495 PolarHBondContact O-N 3.49Å; Y495-V497 PolarHBondContact O-N 3.39Å; Y495-I498 PolarHBondContact O-N 3.49Å; Y495-I498 VanDerWaalsContact O-N 3.09Å; Y495-Y499 PolarHBondContact O-N 3.49Å; Y495-W549 WeakPolarHBondContact OH-CH2 3.15Å; Y495-L597 HydrophobicContact CE2-CB 3.76Å; Y495-L597 WeakPolarHBondContact CE2-O 3.5Å; Y495-L597 WeakPolarHBondContact OH-CB 3.04Å; Y495-L597 PolarHBondContact OH-O 3.34Å; Y495-M601 HydrophobicContact CD1-CB 4.46Å; Y495-M601 HydrophobicContact CD1-CG 4.1Å; Y495-M601 HydrophobicContact CD1-SD 3.98Å; Y495-M601 HydrophobicContact CD2-CB 3.89Å; Y495-M601 HydrophobicContact CD2-CG 4.26Å; Y495-M601 HydrophobicContact CE1-CB 4.29Å; Y495-M601 HydrophobicContact CE1-CG 4.21Å; Y495-M601 HydrophobicContact CE1-SD 3.77Å; Y495-M601 HydrophobicContact CE2-CB 3.68Å; Y495-M601 HydrophobicContact CE2-CG 4.35Å; Y495-M601 HydrophobicContact CG-CB 4.27Å; Y495-M601 HydrophobicContact CG-CG 4.13Å
496	L	89.7	Confident	90	Very high	81 Å²	81	63.7 Å²	63.7	42%	0.424	34%	0.339	S	S	.	.	H	α-helix	trans	-60.3	-30.1	179.6	-75.1	174	0	0	0	112.6	L492 I493 Y499 F500	L492-L496 HydrophobicContact CD1-CG 4.47Å; L492-L496 HydrophobicContact CG-CD1 4.22Å; L492-L496 HydrophobicContact CG-CG 4.3Å; L492-L496 VanDerWaalsContact O-CG 3.3Å; L492-L496 WeakPolarHBondContact O-CG 3.38Å; L492-L496 PolarHBondContact O-N 3.29Å; I493-L496 PolarHBondContact O-N 3.06Å; L496-Y499 HydrophobicContact CD2-CD1 4.27Å; L496-F500 WeakPolarHBondContact O-CB 3.32Å; L496-F500 PolarHBondContact O-N 2.95Å
497	V	91.4	Very high	90.3	Very high	92 Å²	92	59.8 Å²	59.8	56%	0.558	31%	0.311	S	S	*	.	H	α-helix	trans	-63.8	-48.6	173.6	176.2	0	0	0	0	111	I493 R494 Y495 Y499 F500 V501	I493-V497 PolarHBondContact O-N 2.96Å; R494-V497 PolarHBondContact O-N 3.27Å; Y495-V497 PolarHBondContact O-N 3.39Å; V497-Y499 VanDerWaalsContact C-N 3.34Å; V497-Y499 PolarHBondContact O-N 2.89Å; V497-F500 PolarHBondContact O-N 2.95Å; V497-V501 WeakPolarHBondContact O-CG2 3.4Å; V497-V501 PolarHBondContact O-N 2.87Å; V497-V501 VanDerWaalsContact O-N 3.13Å
498	I	91.7	Very high	90.8	Very high	85 Å²	85	60.4 Å²	60.4	44%	0.436	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-45.9	177.8	-59.7	172.6	0	0	0	109.8	Y495 F500 V501 C502 L597	Y495-I498 PolarHBondContact O-N 3.49Å; Y495-I498 VanDerWaalsContact O-N 3.09Å; I498-F500 PolarHBondContact O-N 3.16Å; I498-V501 PolarHBondContact O-N 3.44Å; I498-C502 PolarHBondContact O-N 3.08Å; I498-C502 PolarHBondContact O-SG 3.45Å; I498-C502 VanDerWaalsContact O-SG 3.39Å; I498-L597 HydrophobicContact CG2-CD2 4.2Å
499	Y	91.3	Very high	91	Very high	22 Å²	22	61.6 Å²	61.6	9%	0.086	33%	0.333	C	S	.	.	H	α-helix	trans	-58.2	-44.6	177.9	175.6	-112	0	0	0	112.7	Y495 L496 V497 C502 I503 W549 V593	Y495-Y499 PolarHBondContact O-N 3.49Å; L496-Y499 HydrophobicContact CD2-CD1 4.27Å; V497-Y499 VanDerWaalsContact C-N 3.34Å; V497-Y499 PolarHBondContact O-N 2.89Å; Y499-C502 PolarHBondContact O-N 2.86Å; Y499-I503 HydrophobicContact CD1-CD1 4.1Å; Y499-I503 HydrophobicContact CD2-CD1 4.29Å; Y499-I503 HydrophobicContact CD2-CG1 4.48Å; Y499-I503 HydrophobicContact CE1-CD1 3.41Å; Y499-I503 VanDerWaalsContact CE1-CD1 3.41Å; Y499-I503 HydrophobicContact CE1-CG1 4.47Å; Y499-I503 HydrophobicContact CE2-CD1 3.61Å; Y499-I503 HydrophobicContact CE2-CG1 4.09Å; Y499-I503 PolarHBondContact O-N 3.48Å; Y499-I503 VanDerWaalsContact OH-CD1 3.27Å; Y499-I503 WeakPolarHBondContact OH-CD1 3.23Å; Y499-W549 HydrophobicContact CD2-CE3 4.18Å; Y499-W549 HydrophobicContact CD2-CZ3 4.09Å; Y499-W549 AromaticContact CE2-CD2 3.95Å; Y499-W549 HydrophobicContact CE2-CD2 3.95Å; Y499-W549 AromaticContact CE2-CE3 3.37Å; Y499-W549 HydrophobicContact CE2-CE3 3.37Å; Y499-W549 AromaticContact CE2-CZ3 3.74Å; Y499-W549 HydrophobicContact CE2-CZ3 3.74Å; Y499-W549 WeakPolarHBondContact OH-CB 3.39Å; Y499-V593 HydrophobicContact CD2-CG1 3.75Å; Y499-V593 HydrophobicContact CE2-CG1 3.61Å
500	F	92.1	Very high	91.2	Very high	119 Å²	119	58.5 Å²	58.5	52%	0.522	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-41.8	178.4	-177.5	-99	0	0	0	112.4	L496 V497 I498 C502 I503 M504	L496-F500 WeakPolarHBondContact O-CB 3.32Å; L496-F500 PolarHBondContact O-N 2.95Å; V497-F500 PolarHBondContact O-N 2.95Å; I498-F500 PolarHBondContact O-N 3.16Å; F500-C502 VanDerWaalsContact C-N 3.34Å; F500-C502 PolarHBondContact O-N 2.88Å; F500-I503 PolarHBondContact O-N 3.48Å; F500-M504 HydrophobicContact CE1-CE 4.08Å; F500-M504 HydrophobicContact CE2-CE 4.26Å; F500-M504 HydrophobicContact CZ-CE 3.58Å; F500-M504 WeakPolarHBondContact O-CB 3.4Å; F500-M504 PolarHBondContact O-N 3.27Å
501	V	93.5	Very high	91.6	Very high	93 Å²	93	55.3 Å²	55.3	56%	0.564	29%	0.294	S	S	*	.	H	α-helix	trans	-60.5	-45.1	175.8	172.5	0	0	0	0	110.8	V497 I498 M504 A505	V497-V501 WeakPolarHBondContact O-CG2 3.4Å; V497-V501 PolarHBondContact O-N 2.87Å; V497-V501 VanDerWaalsContact O-N 3.13Å; I498-V501 PolarHBondContact O-N 3.44Å; V501-M504 PolarHBondContact O-N 3.17Å; V501-A505 PolarHBondContact O-N 3.27Å
502	C	92.9	Very high	91.8	Very high	35 Å²	35	62 Å²	62	24%	0.236	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-50.5	176.5	-67.1	0	0	0	0	111.8	I498 Y499 F500 M504 A505 F506 V593 L597	I498-C502 PolarHBondContact O-N 3.08Å; I498-C502 PolarHBondContact O-SG 3.45Å; I498-C502 VanDerWaalsContact O-SG 3.39Å; Y499-C502 PolarHBondContact O-N 2.86Å; F500-C502 VanDerWaalsContact C-N 3.34Å; F500-C502 PolarHBondContact O-N 2.88Å; C502-M504 VanDerWaalsContact C-N 3.28Å; C502-M504 PolarHBondContact O-N 2.9Å; C502-A505 PolarHBondContact O-N 3.12Å; C502-F506 VanDerWaalsContact O-CD2 3.23Å; C502-F506 WeakPolarHBondContact O-CD2 3.37Å; C502-F506 PolarHBondContact O-N 2.92Å; C502-V593 HydrophobicContact CB-CG2 3.81Å; C502-L597 HydrophobicContact CB-CD1 4.47Å
503	I	93	Very high	91.8	Very high	8 Å²	8	60.9 Å²	60.9	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	-56.2	-44.2	178.3	-77.2	-175.6	0	0	0	111.4	Y499 F500 F506 A507 I542 L545 Y589	Y499-I503 HydrophobicContact CD1-CD1 4.1Å; Y499-I503 HydrophobicContact CD2-CD1 4.29Å; Y499-I503 HydrophobicContact CD2-CG1 4.48Å; Y499-I503 HydrophobicContact CE1-CD1 3.41Å; Y499-I503 VanDerWaalsContact CE1-CD1 3.41Å; Y499-I503 HydrophobicContact CE1-CG1 4.47Å; Y499-I503 HydrophobicContact CE2-CD1 3.61Å; Y499-I503 HydrophobicContact CE2-CG1 4.09Å; Y499-I503 PolarHBondContact O-N 3.48Å; Y499-I503 VanDerWaalsContact OH-CD1 3.27Å; Y499-I503 WeakPolarHBondContact OH-CD1 3.23Å; F500-I503 PolarHBondContact O-N 3.48Å; I503-F506 PolarHBondContact O-N 3.37Å; I503-A507 WeakPolarHBondContact O-CB 3.32Å; I503-A507 PolarHBondContact O-N 3.28Å; I503-I542 HydrophobicContact CG2-CG1 4.44Å; I503-I542 HydrophobicContact CG2-CG2 4.11Å; I503-L545 HydrophobicContact CG2-CB 4.35Å; I503-Y589 HydrophobicContact CG1-CE2 4.13Å
504	M	93.7	Very high	91.7	Very high	56 Å²	56	56.1 Å²	56.1	28%	0.276	29%	0.293	S	S	.	.	H	α-helix	trans	-63.1	-45	-179.5	-169.9	63.3	70.8	0	0	111.6	F500 V501 C502 F506 A507 I508 I542	F500-M504 HydrophobicContact CE1-CE 4.08Å; F500-M504 HydrophobicContact CE2-CE 4.26Å; F500-M504 HydrophobicContact CZ-CE 3.58Å; F500-M504 WeakPolarHBondContact O-CB 3.4Å; F500-M504 PolarHBondContact O-N 3.27Å; V501-M504 PolarHBondContact O-N 3.17Å; C502-M504 VanDerWaalsContact C-N 3.28Å; C502-M504 PolarHBondContact O-N 2.9Å; M504-F506 PolarHBondContact O-N 2.84Å; M504-A507 PolarHBondContact O-N 3.49Å; M504-I508 HydrophobicContact CG-CD1 3.96Å; M504-I508 VanDerWaalsContact O-CG1 3.28Å; M504-I508 WeakPolarHBondContact O-CG1 3.42Å; M504-I508 PolarHBondContact O-N 3.48Å; M504-I508 HydrophobicContact SD-CD1 4.35Å; M504-I542 HydrophobicContact CE-CD1 3.72Å; M504-I542 HydrophobicContact SD-CD1 3.9Å
505	A	94.2	Very high	91.8	Very high	62 Å²	62	53 Å²	53	51%	0.512	29%	0.285	S	S	.	.	H	α-helix	trans	-60.2	-47.1	178.6	0	0	0	0	0	112.2	V501 C502 G509	V501-A505 PolarHBondContact O-N 3.27Å; C502-A505 PolarHBondContact O-N 3.12Å; A505-G509 PolarHBondContact O-N 3.29Å; A505-G509 VanDerWaalsContact O-N 3.08Å
506	F	93.3	Very high	91.7	Very high	35 Å²	35	59 Å²	59	15%	0.154	31%	0.313	C	S	.	.	H	α-helix	trans	-69.6	-35.5	176.9	-76.5	-77	0	0	0	112.5	C502 I503 M504 G509 L510 L545 I585 I588 Y589 L592 V593	C502-F506 VanDerWaalsContact O-CD2 3.23Å; C502-F506 WeakPolarHBondContact O-CD2 3.37Å; C502-F506 PolarHBondContact O-N 2.92Å; I503-F506 PolarHBondContact O-N 3.37Å; M504-F506 PolarHBondContact O-N 2.84Å; F506-G509 PolarHBondContact O-N 3.44Å; F506-L510 WeakPolarHBondContact O-CB 3.37Å; F506-L510 WeakPolarHBondContact O-CG 3.23Å; F506-L510 PolarHBondContact O-N 2.88Å; F506-L545 HydrophobicContact CB-CD1 3.79Å; F506-I585 HydrophobicContact CD1-CG2 3.92Å; F506-I585 HydrophobicContact CE1-CG2 4.38Å; F506-I588 HydrophobicContact CE1-CG2 4.06Å; F506-I588 HydrophobicContact CZ-CG2 4.08Å; F506-Y589 HydrophobicContact CB-CD2 3.88Å; F506-Y589 HydrophobicContact CD1-CD2 4.36Å; F506-Y589 AromaticContact CD2-CD2 3.62Å; F506-Y589 HydrophobicContact CD2-CD2 3.62Å; F506-Y589 HydrophobicContact CD2-CE2 4.44Å; F506-Y589 HydrophobicContact CE2-CD2 4.24Å; F506-Y589 AromaticContact CG-CD2 3.7Å; F506-Y589 HydrophobicContact CG-CD2 3.7Å; F506-Y589 HydrophobicContact CG-CG 4.35Å; F506-L592 HydrophobicContact CZ-CD1 4.27Å; F506-V593 HydrophobicContact CD2-CG2 4.19Å; F506-V593 HydrophobicContact CE2-CG2 3.98Å
507	A	93.3	Very high	91.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.2	-42.7	176.7	0	0	0	0	0	111.3	I503 M504 N511 A541 I542 L545	I503-A507 WeakPolarHBondContact O-CB 3.32Å; I503-A507 PolarHBondContact O-N 3.28Å; M504-A507 PolarHBondContact O-N 3.49Å; A507-N511 WeakPolarHBondContact O-CB 3.45Å; A507-N511 PolarHBondContact O-N 2.79Å; A507-A541 HydrophobicContact CB-CB 3.97Å; A507-I542 HydrophobicContact CB-CG1 3.69Å; A507-L545 HydrophobicContact CB-CD1 3.89Å
508	I	94.3	Very high	91.1	Very high	92 Å²	92	55.6 Å²	55.6	47%	0.472	29%	0.287	S	S	.	.	H	α-helix	trans	-65.5	-46.5	176.2	-66.9	165.5	0	0	0	110.3	M504 L510 N511 F512	M504-I508 HydrophobicContact CG-CD1 3.96Å; M504-I508 VanDerWaalsContact O-CG1 3.28Å; M504-I508 WeakPolarHBondContact O-CG1 3.42Å; M504-I508 PolarHBondContact O-N 3.48Å; M504-I508 HydrophobicContact SD-CD1 4.35Å; I508-L510 PolarHBondContact O-N 3.46Å; I508-N511 PolarHBondContact O-N 3.2Å; I508-F512 WeakPolarHBondContact O-CB 3.28Å; I508-F512 PolarHBondContact O-N 3.13Å
509	G	92.9	Very high	90.7	Very high	31 Å²	31	59.3 Å²	59.3	32%	0.32	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-44.5	179.8	0	0	0	0	0	113.3	A505 F506 L513	A505-G509 PolarHBondContact O-N 3.29Å; A505-G509 VanDerWaalsContact O-N 3.08Å; F506-G509 PolarHBondContact O-N 3.44Å; G509-L513 PolarHBondContact O-N 3.13Å
510	L	91.1	Very high	90.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-71.6	-40.7	175.7	-71.9	168.5	0	0	0	111.7	F506 I508 F512 L513 Y514 M535 L545 I585	F506-L510 WeakPolarHBondContact O-CB 3.37Å; F506-L510 WeakPolarHBondContact O-CG 3.23Å; F506-L510 PolarHBondContact O-N 2.88Å; I508-L510 PolarHBondContact O-N 3.46Å; L510-F512 VanDerWaalsContact C-N 3.32Å; L510-F512 PolarHBondContact O-N 3.29Å; L510-L513 PolarHBondContact O-N 2.88Å; L510-L513 VanDerWaalsContact O-N 3.13Å; L510-Y514 HydrophobicContact CD2-CD2 4.48Å; L510-Y514 HydrophobicContact CD2-CE2 4.07Å; L510-Y514 VanDerWaalsContact O-CD2 3.31Å; L510-Y514 WeakPolarHBondContact O-CD2 3.48Å; L510-Y514 PolarHBondContact O-N 3.24Å; L510-M535 HydrophobicContact CB-CG 4.28Å; L510-M535 HydrophobicContact CB-SD 3.62Å; L510-M535 HydrophobicContact CD1-CE 4.01Å; L510-M535 HydrophobicContact CD1-SD 3.91Å; L510-M535 HydrophobicContact CG-SD 4.38Å; L510-L545 HydrophobicContact CD1-CD1 4.38Å; L510-L545 HydrophobicContact CD1-CD2 3.84Å; L510-L545 HydrophobicContact CD1-CG 4.48Å; L510-I585 HydrophobicContact CD1-CG2 4.48Å; L510-I585 HydrophobicContact CD2-CB 3.96Å; L510-I585 HydrophobicContact CD2-CG2 3.73Å; L510-I585 HydrophobicContact CG-CG2 3.84Å
511	N	92.2	Very high	90	Very high	11 Å²	11	57.8 Å²	57.8	6%	0.059	30%	0.298	C	S	.	.	H	α-helix	trans	-58	-46.7	176.7	179.6	81.8	0	0	0	111.2	A507 I508 L513 Y514 E515 M535 S537 I538 A541	A507-N511 WeakPolarHBondContact O-CB 3.45Å; A507-N511 PolarHBondContact O-N 2.79Å; I508-N511 PolarHBondContact O-N 3.2Å; N511-L513 PolarHBondContact O-N 3.01Å; N511-Y514 PolarHBondContact O-N 3.12Å; N511-E515 PolarHBondContact ND2-OE2 3.24Å; N511-E515 WeakPolarHBondContact O-CB 3.3Å; N511-E515 PolarHBondContact O-N 3.24Å; N511-M535 WeakPolarHBondContact CA-O 3.29Å; N511-M535 PolarHBondContact OD1-O 2.73Å; N511-S537 WeakPolarHBondContact OD1-CA 3.41Å; N511-S537 PolarHBondContact OD1-N 3.38Å; N511-S537 VanDerWaalsContact OD1-N 3.16Å; N511-I538 HydrophobicContact CB-CG1 4.27Å; N511-I538 PolarHBondContact OD1-N 3.1Å; N511-I538 VanDerWaalsContact OD1-N 3.16Å; N511-A541 HydrophobicContact CB-CB 4.46Å
512	F	92.1	Very high	89.3	Confident	146 Å²	146	53.5 Å²	53.5	64%	0.64	27%	0.272	S	S	*	.	H	α-helix	trans	-55.5	-38.2	177.1	-179.5	-100.1	0	0	0	113	I508 L510 H516	I508-F512 WeakPolarHBondContact O-CB 3.28Å; I508-F512 PolarHBondContact O-N 3.13Å; L510-F512 VanDerWaalsContact C-N 3.32Å; L510-F512 PolarHBondContact O-N 3.29Å; F512-H516 PolarHBondContact O-ND1 3.44Å
513	L	89.3	Confident	88.6	Confident	32 Å²	32	57.1 Å²	57.1	17%	0.168	29%	0.285	C	S	.	.	H	α-helix	trans	-72.6	-41.5	179.3	-168.5	67	0	0	0	112.8	G509 L510 N511 I578 M581 G582	G509-L513 PolarHBondContact O-N 3.13Å; L510-L513 PolarHBondContact O-N 2.88Å; L510-L513 VanDerWaalsContact O-N 3.13Å; N511-L513 PolarHBondContact O-N 3.01Å; L513-I578 HydrophobicContact CD1-CG2 3.85Å; L513-I578 HydrophobicContact CD2-CG2 4.34Å; L513-I578 HydrophobicContact CG-CG2 3.9Å; L513-M581 HydrophobicContact CD2-CB 4.39Å; L513-M581 HydrophobicContact CD2-CG 4.41Å; L513-G582 VanDerWaalsContact CD2-CA 3.46Å
514	Y	88.2	Confident	87.7	Confident	1 Å²	1	64.3 Å²	64.3	0%	0.004	31%	0.312	C	S	.	.	H	α-helix	trans	-95.8	-17.7	-171.4	-76	-85.3	0	0	0	114.5	L510 N511 H516 Y517 M535 L559 V561	L510-Y514 HydrophobicContact CD2-CD2 4.48Å; L510-Y514 HydrophobicContact CD2-CE2 4.07Å; L510-Y514 VanDerWaalsContact O-CD2 3.31Å; L510-Y514 WeakPolarHBondContact O-CD2 3.48Å; L510-Y514 PolarHBondContact O-N 3.24Å; N511-Y514 PolarHBondContact O-N 3.12Å; Y514-H516 VanDerWaalsContact C-N 3.26Å; Y514-H516 PolarHBondContact O-N 3.02Å; Y514-Y517 PolarHBondContact O-N 3.49Å; Y514-M535 HydrophobicContact CD2-CB 3.88Å; Y514-M535 HydrophobicContact CD2-CG 4.26Å; Y514-M535 HydrophobicContact CG-CB 3.84Å; Y514-L559 HydrophobicContact CE1-CG 4.49Å; Y514-L559 WeakPolarHBondContact CE1-O 3.32Å; Y514-L559 HydrophobicContact CE2-CG 4.29Å; Y514-L559 WeakPolarHBondContact OH-CD2 3.41Å; Y514-L559 VanDerWaalsContact OH-CG 3.27Å; Y514-L559 WeakPolarHBondContact OH-CG 3.38Å; Y514-L559 PolarHBondContact OH-O 2.94Å; Y514-V561 HydrophobicContact CD1-CG2 4.11Å; Y514-V561 HydrophobicContact CE1-CG2 3.42Å; Y514-V561 VanDerWaalsContact CE1-CG2 3.42Å
515	E	89.2	Confident	86.8	Confident	100 Å²	100	65.4 Å²	65.4	47%	0.467	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-58.2	-36.7	-177	177.3	168.4	-174.3	0	0	112.8	N511 Y517 K518	N511-E515 PolarHBondContact ND2-OE2 3.24Å; N511-E515 WeakPolarHBondContact O-CB 3.3Å; N511-E515 PolarHBondContact O-N 3.24Å; E515-Y517 PolarHBondContact O-N 3.47Å; E515-K518 VanDerWaalsContact O-CB 3.24Å; E515-K518 WeakPolarHBondContact O-CB 3.29Å; E515-K518 PolarHBondContact O-N 3.49Å
516	H	87.2	Confident	85.9	Confident	139 Å²	139	69.3 Å²	69.3	64%	0.644	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-65.5	-18.6	178.5	-64.3	88.6	0	0	0	114	F512 Y514	F512-H516 PolarHBondContact O-ND1 3.44Å; Y514-H516 VanDerWaalsContact C-N 3.26Å; Y514-H516 PolarHBondContact O-N 3.02Å
517	Y	85.6	Confident	85.2	Confident	22 Å²	22	74.1 Å²	74.1	9%	0.086	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-96.2	3.6	-178.7	-62.5	-78.8	0	0	0	113.1	Y514 E515 Y519 N520 Q531 V561 V563 H575 I578	Y514-Y517 PolarHBondContact O-N 3.49Å; E515-Y517 PolarHBondContact O-N 3.47Å; Y517-Y519 PolarHBondContact O-N 3.2Å; Y517-N520 WeakPolarHBondContact CA-ND2 3.3Å; Y517-N520 WeakPolarHBondContact CD1-ND2 3.47Å; Y517-N520 WeakPolarHBondContact O-CB 3.29Å; Y517-N520 PolarHBondContact O-N 2.87Å; Y517-N520 VanDerWaalsContact O-N 3.14Å; Y517-Q531 WeakPolarHBondContact O-CB 3.37Å; Y517-Q531 VanDerWaalsContact O-CG 3.32Å; Y517-Q531 WeakPolarHBondContact O-CG 3.29Å; Y517-V561 HydrophobicContact CD1-CG1 3.48Å; Y517-V561 VanDerWaalsContact CD1-CG1 3.48Å; Y517-V561 HydrophobicContact CD2-CG1 3.82Å; Y517-V561 HydrophobicContact CE1-CG1 3.61Å; Y517-V561 HydrophobicContact CE2-CG1 3.9Å; Y517-V561 HydrophobicContact CG-CG1 3.63Å; Y517-V563 HydrophobicContact CD1-CG2 4.27Å; Y517-V563 HydrophobicContact CE1-CB 4.34Å; Y517-V563 HydrophobicContact CE1-CG1 4.21Å; Y517-V563 HydrophobicContact CE1-CG2 3.79Å; Y517-H575 AromaticContact CZ-ND1 3.89Å; Y517-H575 PolarHBondContact OH-ND1 3.33Å; Y517-I578 HydrophobicContact CE2-CD1 4.27Å; Y517-I578 HydrophobicContact CE2-CG2 3.93Å; Y517-I578 WeakPolarHBondContact OH-CD1 3.49Å
518	K	83.1	Confident	84.5	Confident	78 Å²	78	78.6 Å²	78.6	34%	0.339	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	129.2	-178.3	-167	-175.2	-172.4	-161.9	0	110.5	E515 N520 T536	E515-K518 VanDerWaalsContact O-CB 3.24Å; E515-K518 WeakPolarHBondContact O-CB 3.29Å; E515-K518 PolarHBondContact O-N 3.49Å; K518-N520 VanDerWaalsContact C-N 3.29Å; K518-N520 PolarHBondContact O-N 3.19Å; K518-T536 HydrophobicContact CB-CG2 4.14Å; K518-T536 HydrophobicContact CG-CG2 4.19Å
519	Y	83.1	Confident	83.7	Confident	163 Å²	163	77 Å²	77	64%	0.639	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	9.1	-178.1	-45	-65.5	0	0	0	116.6	Y517	Y517-Y519 PolarHBondContact O-N 3.2Å
520	N	84.9	Confident	83.2	Confident	42 Å²	42	79.7 Å²	79.7	23%	0.225	41%	0.408	C	S	.	.			trans	-68.2	140.3	174.5	-72.1	-4.3	0	0	0	111.3	Y517 K518 Q531 V562 V563	Y517-N520 WeakPolarHBondContact CA-ND2 3.3Å; Y517-N520 WeakPolarHBondContact CD1-ND2 3.47Å; Y517-N520 WeakPolarHBondContact O-CB 3.29Å; Y517-N520 PolarHBondContact O-N 2.87Å; Y517-N520 VanDerWaalsContact O-N 3.14Å; K518-N520 VanDerWaalsContact C-N 3.29Å; K518-N520 PolarHBondContact O-N 3.19Å; N520-Q531 HydrophobicContact CB-CB 4.41Å; N520-Q531 PolarHBondContact O-N 2.81Å; N520-V562 HydrophobicContact CB-CG1 4.44Å; N520-V562 WeakPolarHBondContact CB-O 3.24Å; N520-V562 PolarHBondContact ND2-O 3.04Å; N520-V563 PolarHBondContact ND2-O 3.37Å
521	V	82.4	Confident	82.7	Confident	68 Å²	68	80 Å²	80	41%	0.412	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.7	179.1	-173.3	0	0	0	0	108.4	V530 G564	V521-V530 HydrophobicContact CG1-CG2 4.26Å; V521-V530 HydrophobicContact CG2-CG1 4.4Å; V521-V530 HydrophobicContact CG2-CG2 4.18Å; V521-G564 VanDerWaalsContact O-CA 3.31Å; V521-G564 WeakPolarHBondContact O-CA 3.46Å
522	M	79.4	Confident	82.1	Confident	2 Å²	2	80.7 Å²	80.7	1%	0.01	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129	175.2	169.2	177.7	155.1	0	0	109.4	R524 I529 V562 N565 P572	M522-R524 HydrophobicContact CE-CB 4.07Å; M522-R524 HydrophobicContact CE-CG 4.27Å; M522-I529 PolarHBondContact N-O 3.28Å; M522-I529 PolarHBondContact O-N 3.03Å; M522-V562 HydrophobicContact CB-CG1 3.43Å; M522-V562 VanDerWaalsContact CB-CG1 3.43Å; M522-N565 WeakPolarHBondContact CA-OD1 3.12Å; M522-P572 HydrophobicContact CE-CB 3.12Å; M522-P572 HydrophobicContact CE-CG 3.73Å; M522-P572 HydrophobicContact CG-CB 3.85Å; M522-P572 HydrophobicContact SD-CB 3.51Å; M522-P572 VanDerWaalsContact SD-CB 3.51Å
523	E	78.9	Confident	81.6	Confident	111 Å²	111	78.2 Å²	78.2	52%	0.519	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	110.2	174.4	-64.1	-177.7	165.7	0	0	108.5	T528 N565	E523-T528 HydrophobicContact CG-CG2 4.4Å; E523-N565 PolarHBondContact N-OD1 2.89Å; E523-N565 PolarHBondContact O-ND2 2.98Å
524	R	73	Confident	81.2	Confident	159 Å²	159	80.4 Å²	80.4	60%	0.6	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	86.4	175.7	-167.6	178.9	-175.8	165.2	3	109	M522 T526 E527 I529	M522-R524 HydrophobicContact CE-CB 4.07Å; M522-R524 HydrophobicContact CE-CG 4.27Å; R524-T526 PolarHBondContact O-N 3.05Å; R524-E527 PolarHBondContact N-O 3.43Å; R524-E527 PolarHBondContact O-N 2.85Å; R524-I529 HydrophobicContact CB-CD1 4.34Å
525	G	75.8	Confident	80.8	Confident	79 Å²	79	80.4 Å²	80.4	81%	0.814	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	-117.2	-174.5	0	0	0	0	0	111.1
526	T	74.7	Confident	80.6	Confident	145 Å²	145	75.9 Å²	75.9	89%	0.89	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-7.2	178.5	51.4	0	0	0	0	113.8	R524	R524-T526 PolarHBondContact O-N 3.05Å
527	E	77.8	Confident	80.7	Confident	135 Å²	135	71.3 Å²	71.3	63%	0.631	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.9	-177.7	-66.1	-176.5	176.1	0	0	111.2	R524	R524-E527 PolarHBondContact N-O 3.43Å; R524-E527 PolarHBondContact O-N 2.85Å
528	T	78.5	Confident	80.9	Confident	95 Å²	95	74 Å²	74	58%	0.583	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	108.5	170.6	55	0	0	0	0	109.1	E523	E523-T528 HydrophobicContact CG-CG2 4.4Å
529	I	78.5	Confident	81.3	Confident	58 Å²	58	79.5 Å²	79.5	30%	0.297	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	115.3	176.4	-54.5	174.2	0	0	0	107.7	M522 R524 V562	M522-I529 PolarHBondContact N-O 3.28Å; M522-I529 PolarHBondContact O-N 3.03Å; R524-I529 HydrophobicContact CB-CD1 4.34Å; I529-V562 HydrophobicContact CG2-CG2 4Å
530	V	82	Confident	81.6	Confident	88 Å²	88	72.6 Å²	72.6	53%	0.533	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	140.5	177.7	-176.1	0	0	0	0	109.4	V521 S532	V521-V530 HydrophobicContact CG1-CG2 4.26Å; V521-V530 HydrophobicContact CG2-CG1 4.4Å; V521-V530 HydrophobicContact CG2-CG2 4.18Å; V530-S532 PolarHBondContact O-N 2.92Å
531	Q	80.6	Confident	81.9	Confident	5 Å²	5	70.6 Å²	70.6	2%	0.023	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-54.6	128.1	171.9	-178.9	60.9	21.8	0	0	109.8	Y517 N520 T536 H560 V562	Y517-Q531 WeakPolarHBondContact O-CB 3.37Å; Y517-Q531 VanDerWaalsContact O-CG 3.32Å; Y517-Q531 WeakPolarHBondContact O-CG 3.29Å; N520-Q531 HydrophobicContact CB-CB 4.41Å; N520-Q531 PolarHBondContact O-N 2.81Å; Q531-T536 HydrophobicContact CG-CG2 4.37Å; Q531-H560 PolarHBondContact NE2-O 3.3Å; Q531-H560 PolarHBondContact OE1-O 2.64Å; Q531-V562 HydrophobicContact CB-CB 4.13Å
532	S	80.7	Confident	82.4	Confident	26 Å²	26	69.6 Å²	69.6	18%	0.182	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-66.9	143.7	179.1	77.1	0	0	0	0	111.4	V530 Y534 K558	V530-S532 PolarHBondContact O-N 2.92Å; S532-Y534 PolarHBondContact O-N 3.04Å; S532-Y534 WeakPolarHBondContact OG-CD2 3.47Å; S532-K558 PolarHBondContact OG-O 2.95Å; S532-K558 VanDerWaalsContact OG-O 3.08Å
533	D	81.7	Confident	82.9	Confident	94 Å²	94	75.4 Å²	75.4	50%	0.503	39%	0.388	S	S	.	.	S	Bend	trans	-68.6	-1.6	177.9	-74.4	-23.4	0	0	0	114.1	T536 N540	D533-T536 PolarHBondContact O-OG1 3.09Å; D533-N540 VanDerWaalsContact O-CB 3.25Å; D533-N540 WeakPolarHBondContact O-CB 3.44Å; D533-N540 PolarHBondContact O-ND2 3.19Å
534	Y	79.2	Confident	83.4	Confident	78 Å²	78	70.3 Å²	70.3	31%	0.306	37%	0.365	S	S	.	.	S	Bend	trans	-71.1	133.2	174.9	-52.7	-69.7	0	0	0	108.7	S532 T536 Y544 K558	S532-Y534 PolarHBondContact O-N 3.04Å; S532-Y534 WeakPolarHBondContact OG-CD2 3.47Å; Y534-T536 PolarHBondContact O-N 3.41Å; Y534-Y544 AromaticContact CD1-CD2 3.61Å; Y534-Y544 HydrophobicContact CD1-CD2 3.61Å; Y534-Y544 HydrophobicContact CD1-CE2 4.33Å; Y534-Y544 HydrophobicContact CD1-CG 4.33Å; Y534-Y544 HydrophobicContact CE1-CD2 4.24Å; Y534-Y544 AromaticContact CG-CD2 3.98Å; Y534-Y544 HydrophobicContact CG-CD2 3.98Å; Y534-Y544 HydrophobicContact CG-CE2 4.38Å; Y534-K558 HydrophobicContact CD2-CB 3.9Å; Y534-K558 HydrophobicContact CD2-CD 4.05Å; Y534-K558 HydrophobicContact CD2-CG 3.93Å; Y534-K558 HydrophobicContact CE2-CB 4.37Å; Y534-K558 HydrophobicContact CE2-CD 3.83Å; Y534-K558 HydrophobicContact CE2-CG 3.88Å
535	M	81.7	Confident	84.2	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	34%	0.336	C	S	.	.	S	Bend	trans	68.3	-6.4	-177.6	-53.3	-61.4	158.3	0	0	118	L510 N511 Y514 S537 A541 Y544 L545	L510-M535 HydrophobicContact CB-CG 4.28Å; L510-M535 HydrophobicContact CB-SD 3.62Å; L510-M535 HydrophobicContact CD1-CE 4.01Å; L510-M535 HydrophobicContact CD1-SD 3.91Å; L510-M535 HydrophobicContact CG-SD 4.38Å; N511-M535 WeakPolarHBondContact CA-O 3.29Å; N511-M535 PolarHBondContact OD1-O 2.73Å; Y514-M535 HydrophobicContact CD2-CB 3.88Å; Y514-M535 HydrophobicContact CD2-CG 4.26Å; Y514-M535 HydrophobicContact CG-CB 3.84Å; M535-S537 PolarHBondContact O-N 2.9Å; M535-A541 VanDerWaalsContact SD-CA 3.56Å; M535-A541 HydrophobicContact SD-CB 3.5Å; M535-A541 WeakPolarHBondContact SD-CB 3.49Å; M535-Y544 HydrophobicContact CE-CD1 3.04Å; M535-Y544 HydrophobicContact CE-CE1 3.86Å; M535-Y544 HydrophobicContact CE-CG 3.67Å; M535-L545 HydrophobicContact CE-CD2 4.06Å; M535-L545 HydrophobicContact CE-CG 4.02Å
536	T	83.8	Confident	84.9	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.031	32%	0.315	C	S	.	.	S	Bend	trans	-78.7	-7.9	179.2	60.8	0	0	0	0	114.4	K518 Q531 D533 Y534	K518-T536 HydrophobicContact CB-CG2 4.14Å; K518-T536 HydrophobicContact CG-CG2 4.19Å; Q531-T536 HydrophobicContact CG-CG2 4.37Å; D533-T536 PolarHBondContact O-OG1 3.09Å; Y534-T536 PolarHBondContact O-N 3.41Å
537	S	89.2	Confident	85.6	Confident	43 Å²	43	62.6 Å²	62.6	30%	0.301	30%	0.295	S	S	.	.	S	Bend	trans	-145	143.9	175	174.9	0	0	0	0	108.5	N511 M535 R539 N540 A541	N511-S537 WeakPolarHBondContact OD1-CA 3.41Å; N511-S537 PolarHBondContact OD1-N 3.38Å; N511-S537 VanDerWaalsContact OD1-N 3.16Å; M535-S537 PolarHBondContact O-N 2.9Å; S537-R539 PolarHBondContact O-N 3.45Å; S537-R539 VanDerWaalsContact O-N 3.17Å; S537-N540 CarbonylContact O-C 3.56Å; S537-N540 PolarHBondContact O-N 2.57Å; S537-A541 WeakPolarHBondContact O-CB 3.43Å; S537-A541 PolarHBondContact O-N 3.27Å
538	I	90.9	Very high	86.1	Confident	80 Å²	80	56.1 Å²	56.1	41%	0.41	27%	0.265	S	S	.	.	H	α-helix	trans	-50.5	-43.3	177.8	-63.4	167.3	0	0	0	111.6	N511 N540 A541 I542	N511-I538 HydrophobicContact CB-CG1 4.27Å; N511-I538 PolarHBondContact OD1-N 3.1Å; N511-I538 VanDerWaalsContact OD1-N 3.16Å; I538-N540 PolarHBondContact O-N 3.23Å; I538-A541 WeakPolarHBondContact O-CB 3.23Å; I538-A541 PolarHBondContact O-N 3.39Å; I538-I542 HydrophobicContact CG2-CD1 3.81Å; I538-I542 HydrophobicContact CG2-CG1 4.39Å; I538-I542 VanDerWaalsContact O-CG1 3.31Å; I538-I542 WeakPolarHBondContact O-CG1 3.41Å; I538-I542 PolarHBondContact O-N 2.85Å
539	R	91.8	Very high	86.5	Confident	193 Å²	193	53.6 Å²	53.6	73%	0.728	25%	0.245	S	C	*	.	H	α-helix	trans	-61.5	-43.7	178.4	-177.9	-177.7	65.1	177.5	-3.2	112	S537 R543	S537-R539 PolarHBondContact O-N 3.45Å; S537-R539 VanDerWaalsContact O-N 3.17Å; R539-R543 WeakPolarHBondContact O-CB 3.29Å; R539-R543 PolarHBondContact O-N 3.04Å
540	N	89.2	Confident	86.9	Confident	17 Å²	17	57.2 Å²	57.2	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-72.6	-34.1	179.4	-69.9	-11.4	0	0	0	111.3	D533 S537 I538 R543 Y544	D533-N540 VanDerWaalsContact O-CB 3.25Å; D533-N540 WeakPolarHBondContact O-CB 3.44Å; D533-N540 PolarHBondContact O-ND2 3.19Å; S537-N540 CarbonylContact O-C 3.56Å; S537-N540 PolarHBondContact O-N 2.57Å; I538-N540 PolarHBondContact O-N 3.23Å; N540-R543 PolarHBondContact O-N 3.37Å; N540-Y544 VanDerWaalsContact O-CB 3.32Å; N540-Y544 WeakPolarHBondContact O-CB 3.35Å; N540-Y544 PolarHBondContact O-N 3.25Å
541	A	90.4	Very high	87.1	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-51.3	174.6	0	0	0	0	0	111.2	A507 N511 M535 S537 I538 R543 Y544 L545	A507-A541 HydrophobicContact CB-CB 3.97Å; N511-A541 HydrophobicContact CB-CB 4.46Å; M535-A541 VanDerWaalsContact SD-CA 3.56Å; M535-A541 HydrophobicContact SD-CB 3.5Å; M535-A541 WeakPolarHBondContact SD-CB 3.49Å; S537-A541 WeakPolarHBondContact O-CB 3.43Å; S537-A541 PolarHBondContact O-N 3.27Å; I538-A541 WeakPolarHBondContact O-CB 3.23Å; I538-A541 PolarHBondContact O-N 3.39Å; A541-R543 PolarHBondContact O-N 3.13Å; A541-Y544 PolarHBondContact O-N 3.21Å; A541-L545 WeakPolarHBondContact O-CG 3.08Å; A541-L545 PolarHBondContact O-N 3.46Å
542	I	92.2	Very high	87.2	Confident	47 Å²	47	62.7 Å²	62.7	24%	0.241	29%	0.286	C	S	.	.	H	α-helix	trans	-58.2	-48.6	175.4	-66.9	167.7	0	0	0	110.5	I503 M504 A507 I538 Y544 L545 Y546	I503-I542 HydrophobicContact CG2-CG1 4.44Å; I503-I542 HydrophobicContact CG2-CG2 4.11Å; M504-I542 HydrophobicContact CE-CD1 3.72Å; M504-I542 HydrophobicContact SD-CD1 3.9Å; A507-I542 HydrophobicContact CB-CG1 3.69Å; I538-I542 HydrophobicContact CG2-CD1 3.81Å; I538-I542 HydrophobicContact CG2-CG1 4.39Å; I538-I542 VanDerWaalsContact O-CG1 3.31Å; I538-I542 WeakPolarHBondContact O-CG1 3.41Å; I538-I542 PolarHBondContact O-N 2.85Å; I542-Y544 VanDerWaalsContact C-N 3.27Å; I542-Y544 PolarHBondContact O-N 2.95Å; I542-L545 PolarHBondContact O-N 3.41Å; I542-Y546 WeakPolarHBondContact O-CB 3.31Å; I542-Y546 PolarHBondContact O-N 3.13Å
543	R	90.6	Very high	87	Confident	124 Å²	124	62.5 Å²	62.5	47%	0.468	28%	0.282	S	S	.	.	H	α-helix	trans	-56.8	-43.2	178	-178.8	177	66.1	168.9	-0.4	111.5	R539 N540 A541 W547	R539-R543 WeakPolarHBondContact O-CB 3.29Å; R539-R543 PolarHBondContact O-N 3.04Å; N540-R543 PolarHBondContact O-N 3.37Å; A541-R543 PolarHBondContact O-N 3.13Å; R543-W547 PolarHBondContact O-N 3.21Å
544	Y	88.7	Confident	86.6	Confident	5 Å²	5	61.5 Å²	61.5	2%	0.02	27%	0.274	C	S	.	.	H	α-helix	trans	-70.2	-45.8	-179.3	-174.8	-96.3	0	0	0	112.6	Y534 M535 N540 A541 I542 Y546 W547 A548 M553 H554 K558 L559	Y534-Y544 AromaticContact CD1-CD2 3.61Å; Y534-Y544 HydrophobicContact CD1-CD2 3.61Å; Y534-Y544 HydrophobicContact CD1-CE2 4.33Å; Y534-Y544 HydrophobicContact CD1-CG 4.33Å; Y534-Y544 HydrophobicContact CE1-CD2 4.24Å; Y534-Y544 AromaticContact CG-CD2 3.98Å; Y534-Y544 HydrophobicContact CG-CD2 3.98Å; Y534-Y544 HydrophobicContact CG-CE2 4.38Å; M535-Y544 HydrophobicContact CE-CD1 3.04Å; M535-Y544 HydrophobicContact CE-CE1 3.86Å; M535-Y544 HydrophobicContact CE-CG 3.67Å; N540-Y544 VanDerWaalsContact O-CB 3.32Å; N540-Y544 WeakPolarHBondContact O-CB 3.35Å; N540-Y544 PolarHBondContact O-N 3.25Å; A541-Y544 PolarHBondContact O-N 3.21Å; I542-Y544 VanDerWaalsContact C-N 3.27Å; I542-Y544 PolarHBondContact O-N 2.95Å; Y544-Y546 VanDerWaalsContact C-N 3.26Å; Y544-Y546 PolarHBondContact O-N 2.76Å; Y544-W547 PolarHBondContact O-N 3.06Å; Y544-W547 VanDerWaalsContact O-N 3.15Å; Y544-A548 PolarHBondContact O-N 3.27Å; Y544-M553 HydrophobicContact CE1-CE 4.04Å; Y544-M553 HydrophobicContact CE1-CG 3.96Å; Y544-M553 HydrophobicContact CE1-SD 4.01Å; Y544-H554 PolarHBondContact OH-N 3.11Å; Y544-H554 PolarHBondContact OH-O 3.25Å; Y544-K558 HydrophobicContact CD2-CD 4.41Å; Y544-K558 HydrophobicContact CE2-CB 4.04Å; Y544-K558 HydrophobicContact CE2-CD 3.47Å; Y544-K558 VanDerWaalsContact CE2-CD 3.47Å; Y544-K558 HydrophobicContact CE2-CG 4.43Å; Y544-L559 HydrophobicContact CE1-CD1 4.09Å
545	L	90.9	Very high	86	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-35.2	176.7	-70.5	-179.5	0	0	0	112.1	I503 F506 A507 L510 M535 A541 I542 A548 W549 Y589	I503-L545 HydrophobicContact CG2-CB 4.35Å; F506-L545 HydrophobicContact CB-CD1 3.79Å; A507-L545 HydrophobicContact CB-CD1 3.89Å; L510-L545 HydrophobicContact CD1-CD1 4.38Å; L510-L545 HydrophobicContact CD1-CD2 3.84Å; L510-L545 HydrophobicContact CD1-CG 4.48Å; M535-L545 HydrophobicContact CE-CD2 4.06Å; M535-L545 HydrophobicContact CE-CG 4.02Å; A541-L545 WeakPolarHBondContact O-CG 3.08Å; A541-L545 PolarHBondContact O-N 3.46Å; I542-L545 PolarHBondContact O-N 3.41Å; L545-A548 VanDerWaalsContact O-CB 3.3Å; L545-A548 WeakPolarHBondContact O-CB 3.35Å; L545-A548 PolarHBondContact O-N 3.29Å; L545-W549 PolarHBondContact O-N 3.34Å; L545-Y589 HydrophobicContact CB-CE1 4.44Å; L545-Y589 HydrophobicContact CB-CE2 4.31Å; L545-Y589 HydrophobicContact CD1-CE2 4.43Å; L545-Y589 HydrophobicContact CD2-CD1 3.85Å; L545-Y589 HydrophobicContact CD2-CD2 4.2Å; L545-Y589 HydrophobicContact CD2-CE1 3.84Å; L545-Y589 HydrophobicContact CD2-CE2 4.18Å; L545-Y589 HydrophobicContact CD2-CG 4.03Å; L545-Y589 PolarHBondContact O-OH 2.84Å
546	Y	90.8	Very high	85.1	Confident	93 Å²	93	65.4 Å²	65.4	37%	0.365	31%	0.308	S	S	.	.	H	α-helix	trans	-59	-50.7	171	171.5	-99.5	0	0	0	111.6	I542 Y544 A548 W549 Y550	I542-Y546 WeakPolarHBondContact O-CB 3.31Å; I542-Y546 PolarHBondContact O-N 3.13Å; Y544-Y546 VanDerWaalsContact C-N 3.26Å; Y544-Y546 PolarHBondContact O-N 2.76Å; Y546-A548 PolarHBondContact O-N 3.33Å; Y546-W549 WeakPolarHBondContact O-CB 3.42Å; Y546-W549 PolarHBondContact O-N 3.29Å; Y546-W549 VanDerWaalsContact O-N 3.1Å; Y546-Y550 HydrophobicContact CE1-CE2 4.18Å; Y546-Y550 HydrophobicContact CE2-CE2 4.22Å; Y546-Y550 AromaticContact CZ-CE2 3.79Å
547	W	89.6	Confident	84.1	Confident	127 Å²	127	72.8 Å²	72.8	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-66.9	-25	177.3	-72.2	116.6	0	0	0	113.3	R543 Y544 W549 Y550 Y552	R543-W547 PolarHBondContact O-N 3.21Å; Y544-W547 PolarHBondContact O-N 3.06Å; Y544-W547 VanDerWaalsContact O-N 3.15Å; W547-W549 PolarHBondContact O-N 3.12Å; W547-Y550 HydrophobicContact CE3-CD2 4.21Å; W547-Y550 HydrophobicContact CZ3-CD2 4.47Å; W547-Y550 PolarHBondContact O-N 2.87Å; W547-Y552 HydrophobicContact CE3-CD2 4.06Å; W547-Y552 HydrophobicContact CE3-CE2 4.42Å; W547-Y552 WeakPolarHBondContact O-CB 3.13Å; W547-Y552 PolarHBondContact O-N 2.87Å
548	A	87.4	Confident	83.2	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-27.5	173	0	0	0	0	0	112.7	Y544 L545 Y546 Y550 G551 M553 Y589 H590	Y544-A548 PolarHBondContact O-N 3.27Å; L545-A548 VanDerWaalsContact O-CB 3.3Å; L545-A548 WeakPolarHBondContact O-CB 3.35Å; L545-A548 PolarHBondContact O-N 3.29Å; Y546-A548 PolarHBondContact O-N 3.33Å; A548-Y550 VanDerWaalsContact C-N 3.26Å; A548-Y550 PolarHBondContact O-N 2.84Å; A548-G551 PolarHBondContact O-N 2.97Å; A548-G551 VanDerWaalsContact O-N 3.1Å; A548-M553 HydrophobicContact CB-CB 3.7Å; A548-M553 HydrophobicContact CB-CG 4.22Å; A548-M553 HydrophobicContact CB-SD 3.59Å; A548-M553 VanDerWaalsContact CB-SD 3.59Å; A548-Y589 HydrophobicContact CB-CE1 3.81Å; A548-H590 PolarHBondContact O-CE1 2.97Å
549	W	87.3	Confident	82.4	Confident	42 Å²	42	70 Å²	70	16%	0.159	32%	0.319	C	S	.	.	H	α-helix	trans	-56.9	-39	173	-179.5	-97.7	0	0	0	112.8	Y495 Y499 L545 Y546 W547 G551 V593 V594 L598	Y495-W549 WeakPolarHBondContact OH-CH2 3.15Å; Y499-W549 HydrophobicContact CD2-CE3 4.18Å; Y499-W549 HydrophobicContact CD2-CZ3 4.09Å; Y499-W549 AromaticContact CE2-CD2 3.95Å; Y499-W549 HydrophobicContact CE2-CD2 3.95Å; Y499-W549 AromaticContact CE2-CE3 3.37Å; Y499-W549 HydrophobicContact CE2-CE3 3.37Å; Y499-W549 AromaticContact CE2-CZ3 3.74Å; Y499-W549 HydrophobicContact CE2-CZ3 3.74Å; Y499-W549 WeakPolarHBondContact OH-CB 3.39Å; L545-W549 PolarHBondContact O-N 3.34Å; Y546-W549 WeakPolarHBondContact O-CB 3.42Å; Y546-W549 PolarHBondContact O-N 3.29Å; Y546-W549 VanDerWaalsContact O-N 3.1Å; W547-W549 PolarHBondContact O-N 3.12Å; W549-G551 VanDerWaalsContact C-N 3.31Å; W549-G551 PolarHBondContact O-N 2.83Å; W549-V593 HydrophobicContact CE3-CG1 4.05Å; W549-V593 HydrophobicContact CZ3-CG1 3.97Å; W549-V593 VanDerWaalsContact CZ3-O 3.32Å; W549-V593 WeakPolarHBondContact CZ3-O 3.16Å; W549-V594 HydrophobicContact CE3-CG2 4.11Å; W549-L598 HydrophobicContact CH2-CB 3.78Å; W549-L598 HydrophobicContact CH2-CD1 4.19Å; W549-L598 HydrophobicContact CZ2-CB 4.17Å; W549-L598 HydrophobicContact CZ2-CD1 3.7Å; W549-L598 HydrophobicContact CZ2-CG 4.5Å
550	Y	87.2	Confident	81.8	Confident	133 Å²	133	63.2 Å²	63.2	52%	0.522	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	7.8	179.9	-61.8	-74.5	0	0	0	113.6	Y546 W547 A548	Y546-Y550 HydrophobicContact CE1-CE2 4.18Å; Y546-Y550 HydrophobicContact CE2-CE2 4.22Å; Y546-Y550 AromaticContact CZ-CE2 3.79Å; W547-Y550 HydrophobicContact CE3-CD2 4.21Å; W547-Y550 HydrophobicContact CZ3-CD2 4.47Å; W547-Y550 PolarHBondContact O-N 2.87Å; A548-Y550 VanDerWaalsContact C-N 3.26Å; A548-Y550 PolarHBondContact O-N 2.84Å
551	G	85.1	Confident	81.3	Confident	58 Å²	58	62.5 Å²	62.5	60%	0.598	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	9.5	179.3	0	0	0	0	0	115.3	A548 W549 M553	A548-G551 PolarHBondContact O-N 2.97Å; A548-G551 VanDerWaalsContact O-N 3.1Å; W549-G551 VanDerWaalsContact C-N 3.31Å; W549-G551 PolarHBondContact O-N 2.83Å; G551-M553 PolarHBondContact O-N 3.46Å
552	Y	83	Confident	80.8	Confident	150 Å²	150	62.7 Å²	62.7	59%	0.588	29%	0.293	S	S	*	.			trans	-83	19.1	176.9	-67	-77	0	0	0	114.3	W547 H554	W547-Y552 HydrophobicContact CE3-CD2 4.06Å; W547-Y552 HydrophobicContact CE3-CE2 4.42Å; W547-Y552 WeakPolarHBondContact O-CB 3.13Å; W547-Y552 PolarHBondContact O-N 2.87Å; Y552-H554 PolarHBondContact O-N 3.28Å
553	M	76	Confident	80.2	Confident	22 Å²	22	62.1 Å²	62.1	11%	0.108	29%	0.292	C	S	.	.			trans	-83.9	101.9	175.1	-172.3	143.2	-179.6	0	0	109.6	Y544 A548 G551 P555 L559 A586 H590	Y544-M553 HydrophobicContact CE1-CE 4.04Å; Y544-M553 HydrophobicContact CE1-CG 3.96Å; Y544-M553 HydrophobicContact CE1-SD 4.01Å; A548-M553 HydrophobicContact CB-CB 3.7Å; A548-M553 HydrophobicContact CB-CG 4.22Å; A548-M553 HydrophobicContact CB-SD 3.59Å; A548-M553 VanDerWaalsContact CB-SD 3.59Å; G551-M553 PolarHBondContact O-N 3.46Å; M553-P555 VanDerWaalsContact O-CD 3.23Å; M553-P555 WeakPolarHBondContact O-CD 3.43Å; M553-L559 HydrophobicContact CE-CD1 4.16Å; M553-A586 HydrophobicContact CE-CB 3.14Å; M553-H590 WeakPolarHBondContact CB-NE2 3.45Å; M553-H590 WeakPolarHBondContact CG-NE2 3.3Å; M553-H590 VanDerWaalsContact SD-CD2 3.59Å; M553-H590 PolarHBondContact SD-NE2 3.49Å
554	H	73.1	Confident	79.6	Confident	74 Å²	74	56.7 Å²	56.7	34%	0.343	28%	0.275	S	S	.	.			trans	-95.5	103.3	175.9	-162.3	-56.4	0	0	0	109.3	Y544 Y552 T556 F557 K558	Y544-H554 PolarHBondContact OH-N 3.11Å; Y544-H554 PolarHBondContact OH-O 3.25Å; Y552-H554 PolarHBondContact O-N 3.28Å; H554-T556 VanDerWaalsContact C-N 3.32Å; H554-T556 PolarHBondContact CE1-OG1 2.74Å; H554-T556 PolarHBondContact ND1-N 2.97Å; H554-T556 PolarHBondContact O-N 2.76Å; H554-F557 AromaticContact CD2-CD2 3.91Å; H554-F557 AromaticContact CE1-CD2 3.12Å; H554-F557 WeakPolarHBondContact CE1-CD2 3.37Å; H554-F557 AromaticContact CE1-CE2 3.52Å; H554-F557 AromaticContact CG-CD2 3.96Å; H554-F557 AromaticContact ND1-CD2 3.49Å; H554-F557 WeakPolarHBondContact ND1-CD2 3.34Å; H554-F557 PolarHBondContact ND1-N 2.9Å; H554-F557 AromaticContact NE2-CD2 3.38Å; H554-F557 WeakPolarHBondContact NE2-CD2 3.48Å; H554-F557 AromaticContact NE2-CE2 3.63Å; H554-K558 HydrophobicContact CB-CD 4.39Å; H554-K558 HydrophobicContact CB-CG 4.43Å; H554-K558 PolarHBondContact O-N 3.18Å
555	P	67.1	Low	79.2	Confident	69 Å²	69	58.9 Å²	58.9	45%	0.448	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-40.7	-174.9	24.4	-33.2	0	0	0	111.5	M553 L559	M553-P555 VanDerWaalsContact O-CD 3.23Å; M553-P555 WeakPolarHBondContact O-CD 3.43Å; P555-L559 WeakPolarHBondContact O-CB 3.34Å; P555-L559 PolarHBondContact O-N 3.24Å
556	T	62.3	Low	78.3	Confident	92 Å²	92	61.5 Å²	61.5	56%	0.564	31%	0.308	S	S	*	.	H	α-helix	trans	-73	-43.6	-170.2	-31.1	0	0	0	0	114.3	H554	H554-T556 VanDerWaalsContact C-N 3.32Å; H554-T556 PolarHBondContact CE1-OG1 2.74Å; H554-T556 PolarHBondContact ND1-N 2.97Å; H554-T556 PolarHBondContact O-N 2.76Å
557	F	63.1	Low	77.5	Confident	160 Å²	160	59.7 Å²	59.7	70%	0.702	32%	0.318	S	S	*	.	H	α-helix	trans	-94.1	-25.3	-173.7	-66.6	-63.4	0	0	0	114.2	H554	H554-F557 AromaticContact CD2-CD2 3.91Å; H554-F557 AromaticContact CE1-CD2 3.12Å; H554-F557 WeakPolarHBondContact CE1-CD2 3.37Å; H554-F557 AromaticContact CE1-CE2 3.52Å; H554-F557 AromaticContact CG-CD2 3.96Å; H554-F557 AromaticContact ND1-CD2 3.49Å; H554-F557 WeakPolarHBondContact ND1-CD2 3.34Å; H554-F557 PolarHBondContact ND1-N 2.9Å; H554-F557 AromaticContact NE2-CD2 3.38Å; H554-F557 WeakPolarHBondContact NE2-CD2 3.48Å; H554-F557 AromaticContact NE2-CE2 3.63Å
558	K	70.6	Confident	76.7	Confident	62 Å²	62	59.9 Å²	59.9	27%	0.27	34%	0.335	S	S	.	.	H	α-helix	trans	-109.6	-18.4	-170.7	-62.3	-176.2	-178.6	177.6	0	114.2	S532 Y534 Y544 H554	S532-K558 PolarHBondContact OG-O 2.95Å; S532-K558 VanDerWaalsContact OG-O 3.08Å; Y534-K558 HydrophobicContact CD2-CB 3.9Å; Y534-K558 HydrophobicContact CD2-CD 4.05Å; Y534-K558 HydrophobicContact CD2-CG 3.93Å; Y534-K558 HydrophobicContact CE2-CB 4.37Å; Y534-K558 HydrophobicContact CE2-CD 3.83Å; Y534-K558 HydrophobicContact CE2-CG 3.88Å; Y544-K558 HydrophobicContact CD2-CD 4.41Å; Y544-K558 HydrophobicContact CE2-CB 4.04Å; Y544-K558 HydrophobicContact CE2-CD 3.47Å; Y544-K558 VanDerWaalsContact CE2-CD 3.47Å; Y544-K558 HydrophobicContact CE2-CG 4.43Å; H554-K558 HydrophobicContact CB-CD 4.39Å; H554-K558 HydrophobicContact CB-CG 4.43Å; H554-K558 PolarHBondContact O-N 3.18Å
559	L	74.7	Confident	76	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	37%	0.367	C	S	.	.	S	Bend	trans	-104.7	1.1	177.3	-127.5	82.4	0	0	0	113.3	Y514 Y544 M553 P555 V561 N583 A586	Y514-L559 HydrophobicContact CE1-CG 4.49Å; Y514-L559 WeakPolarHBondContact CE1-O 3.32Å; Y514-L559 HydrophobicContact CE2-CG 4.29Å; Y514-L559 WeakPolarHBondContact OH-CD2 3.41Å; Y514-L559 VanDerWaalsContact OH-CG 3.27Å; Y514-L559 WeakPolarHBondContact OH-CG 3.38Å; Y514-L559 PolarHBondContact OH-O 2.94Å; Y544-L559 HydrophobicContact CE1-CD1 4.09Å; M553-L559 HydrophobicContact CE-CD1 4.16Å; P555-L559 WeakPolarHBondContact O-CB 3.34Å; P555-L559 PolarHBondContact O-N 3.24Å; L559-V561 PolarHBondContact O-N 3.11Å; L559-N583 WeakPolarHBondContact CD2-OD1 3.49Å; L559-A586 HydrophobicContact CD2-CB 3.81Å
560	H	78.4	Confident	75.4	Confident	51 Å²	51	70.6 Å²	70.6	24%	0.236	39%	0.389	C	S	.	.			trans	-63	130.4	176.7	-173.5	-81.6	0	0	0	110.2	Q531	Q531-H560 PolarHBondContact NE2-O 3.3Å; Q531-H560 PolarHBondContact OE1-O 2.64Å
561	V	79.6	Confident	74.9	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.018	39%	0.388	C	S	.	.			trans	-92.3	116.6	179.6	179.8	0	0	0	0	108.5	Y514 Y517 L559 V563 I578 Q579	Y514-V561 HydrophobicContact CD1-CG2 4.11Å; Y514-V561 HydrophobicContact CE1-CG2 3.42Å; Y514-V561 VanDerWaalsContact CE1-CG2 3.42Å; Y517-V561 HydrophobicContact CD1-CG1 3.48Å; Y517-V561 VanDerWaalsContact CD1-CG1 3.48Å; Y517-V561 HydrophobicContact CD2-CG1 3.82Å; Y517-V561 HydrophobicContact CE1-CG1 3.61Å; Y517-V561 HydrophobicContact CE2-CG1 3.9Å; Y517-V561 HydrophobicContact CG-CG1 3.63Å; L559-V561 PolarHBondContact O-N 3.11Å; V561-V563 HydrophobicContact CG1-CG2 4.18Å; V561-I578 HydrophobicContact CG2-CG2 4.16Å; V561-Q579 HydrophobicContact CG2-CB 4.16Å
562	V	79.1	Confident	74.5	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.018	38%	0.375	C	S	.	.			trans	-97	113.8	173.3	-176.3	0	0	0	0	107.7	N520 M522 I529 Q531	N520-V562 HydrophobicContact CB-CG1 4.44Å; N520-V562 WeakPolarHBondContact CB-O 3.24Å; N520-V562 PolarHBondContact ND2-O 3.04Å; M522-V562 HydrophobicContact CB-CG1 3.43Å; M522-V562 VanDerWaalsContact CB-CG1 3.43Å; I529-V562 HydrophobicContact CG2-CG2 4Å; Q531-V562 HydrophobicContact CB-CB 4.13Å
563	V	79.2	Confident	74.2	Confident	36 Å²	36	63.5 Å²	63.5	22%	0.218	36%	0.361	C	S	.	.			trans	-92.4	-41.3	178	-169	0	0	0	0	110.5	Y517 N520 V561 V573 H575	Y517-V563 HydrophobicContact CD1-CG2 4.27Å; Y517-V563 HydrophobicContact CE1-CB 4.34Å; Y517-V563 HydrophobicContact CE1-CG1 4.21Å; Y517-V563 HydrophobicContact CE1-CG2 3.79Å; N520-V563 PolarHBondContact ND2-O 3.37Å; V561-V563 HydrophobicContact CG1-CG2 4.18Å; V563-V573 HydrophobicContact CB-CB 4.47Å; V563-V573 WeakPolarHBondContact CB-O 3.31Å; V563-V573 HydrophobicContact CG1-CG1 4.43Å; V563-V573 WeakPolarHBondContact CG2-O 3.42Å; V563-H575 HydrophobicContact CG2-CB 4.01Å
564	G	79	Confident	74.3	Confident	10 Å²	10	67.8 Å²	67.8	10%	0.103	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	121.3	-173.7	-176.4	0	0	0	0	0	112	V521 V573	V521-G564 VanDerWaalsContact O-CA 3.31Å; V521-G564 WeakPolarHBondContact O-CA 3.46Å; G564-V573 PolarHBondContact O-N 2.79Å
565	N	80.3	Confident	74.8	Confident	50 Å²	50	67.8 Å²	67.8	27%	0.267	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126	179.8	-64.4	32.6	0	0	0	109	M522 E523 K570 N571	M522-N565 WeakPolarHBondContact CA-OD1 3.12Å; E523-N565 PolarHBondContact N-OD1 2.89Å; E523-N565 PolarHBondContact O-ND2 2.98Å; N565-K570 HydrophobicContact CB-CB 4.25Å; N565-K570 WeakPolarHBondContact CB-O 3.38Å; N565-K570 PolarHBondContact ND2-O 3.37Å; N565-N571 WeakPolarHBondContact CA-O 3.39Å
566	A	72.4	Confident	75.6	Confident	56 Å²	56	66.6 Å²	66.6	46%	0.463	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	161.4	177	0	0	0	0	0	112	N571 V573	A566-N571 PolarHBondContact N-O 3.49Å; A566-V573 HydrophobicContact CB-CG2 3.47Å; A566-V573 VanDerWaalsContact CB-CG2 3.47Å
567	G	73.5	Confident	76.8	Confident	54 Å²	54	68.9 Å²	68.9	56%	0.557	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	172.6	-174.2	0	0	0	0	0	113.6	D569 K570	G567-D569 VanDerWaalsContact C-N 3.27Å; G567-D569 PolarHBondContact O-N 2.64Å; G567-K570 PolarHBondContact O-N 2.84Å
568	P	73.2	Confident	78	Confident	132 Å²	132	63.3 Å²	63.3	86%	0.857	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-31.7	-175.3	23.9	-32.3	0	0	0	113	K570	P568-K570 VanDerWaalsContact C-N 3.33Å; P568-K570 PolarHBondContact O-N 2.66Å
569	D	72.5	Confident	78.8	Confident	122 Å²	122	62.3 Å²	62.3	65%	0.652	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	3.1	-176.8	-60.9	-26.2	0	0	0	113.5	G567 N571	G567-D569 VanDerWaalsContact C-N 3.27Å; G567-D569 PolarHBondContact O-N 2.64Å; D569-N571 PolarHBondContact O-N 3.07Å
570	K	74.3	Confident	79.4	Confident	145 Å²	145	69.9 Å²	69.9	63%	0.63	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	36.5	-171.6	-60.8	-178.2	176.9	-176.4	0	112.8	N565 G567 P568	N565-K570 HydrophobicContact CB-CB 4.25Å; N565-K570 WeakPolarHBondContact CB-O 3.38Å; N565-K570 PolarHBondContact ND2-O 3.37Å; G567-K570 PolarHBondContact O-N 2.84Å; P568-K570 VanDerWaalsContact C-N 3.33Å; P568-K570 PolarHBondContact O-N 2.66Å
571	N	75.7	Confident	80	Confident	92 Å²	92	71 Å²	71	49%	0.492	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	145.7	176.1	-70.9	-29.1	0	0	0	109.9	N565 A566 D569 V573	N565-N571 WeakPolarHBondContact CA-O 3.39Å; A566-N571 PolarHBondContact N-O 3.49Å; D569-N571 PolarHBondContact O-N 3.07Å; N571-V573 PolarHBondContact O-N 2.93Å
572	P	76.5	Confident	80.5	Confident	53 Å²	53	70.9 Å²	70.9	34%	0.344	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	130	175.5	27	-33.8	0	0	0	110.8	M522	M522-P572 HydrophobicContact CE-CB 3.12Å; M522-P572 HydrophobicContact CE-CG 3.73Å; M522-P572 HydrophobicContact CG-CB 3.85Å; M522-P572 HydrophobicContact SD-CB 3.51Å; M522-P572 VanDerWaalsContact SD-CB 3.51Å
573	V	78.1	Confident	81	Confident	47 Å²	47	73.4 Å²	73.4	29%	0.285	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	126.3	174.7	177.7	0	0	0	0	109.4	V563 G564 A566 N571	V563-V573 HydrophobicContact CB-CB 4.47Å; V563-V573 WeakPolarHBondContact CB-O 3.31Å; V563-V573 HydrophobicContact CG1-CG1 4.43Å; V563-V573 WeakPolarHBondContact CG2-O 3.42Å; G564-V573 PolarHBondContact O-N 2.79Å; A566-V573 HydrophobicContact CB-CG2 3.47Å; A566-V573 VanDerWaalsContact CB-CG2 3.47Å; N571-V573 PolarHBondContact O-N 2.93Å
574	E	78.1	Confident	81.6	Confident	112 Å²	112	75.1 Å²	75.1	52%	0.523	42%	0.417	S	S	.	.			trans	-110.8	125.1	176.2	-66.7	-178.3	-178.5	0	0	110.1	G576	E574-G576 PolarHBondContact O-N 3.23Å
575	H	83	Confident	82.2	Confident	74 Å²	74	76.5 Å²	76.5	34%	0.343	42%	0.421	S	S	.	.			trans	-92	75.8	171.5	-75.6	-164	0	0	0	110	Y517 V563 I577 I578 Q579	Y517-H575 AromaticContact CZ-ND1 3.89Å; Y517-H575 PolarHBondContact OH-ND1 3.33Å; V563-H575 HydrophobicContact CG2-CB 4.01Å; H575-I577 VanDerWaalsContact C-N 3.26Å; H575-I577 PolarHBondContact O-N 3.35Å; H575-I578 HydrophobicContact CB-CB 4.18Å; H575-I578 HydrophobicContact CB-CD1 4.15Å; H575-I578 HydrophobicContact CB-CG1 4.44Å; H575-I578 PolarHBondContact O-N 3.46Å; H575-I578 VanDerWaalsContact O-N 3.13Å; H575-Q579 PolarHBondContact O-N 3.35Å; H575-Q579 VanDerWaalsContact O-N 3.1Å
576	G	84.1	Confident	82.6	Confident	44 Å²	44	74.3 Å²	74.3	45%	0.454	41%	0.41	S	S	.	.	H	α-helix	trans	-56.5	-35.5	-175.8	0	0	0	0	0	114.3	E574 W580	E574-G576 PolarHBondContact O-N 3.23Å; G576-W580 VanDerWaalsContact O-CB 3.25Å; G576-W580 WeakPolarHBondContact O-CB 3.43Å; G576-W580 PolarHBondContact O-N 2.88Å
577	I	88	Confident	83.5	Confident	139 Å²	139	73.2 Å²	73.2	71%	0.713	40%	0.404	S	S	*	.	H	α-helix	trans	-65.2	-42.7	179	-61.2	173.5	0	0	0	111.3	H575 W580 M581	H575-I577 VanDerWaalsContact C-N 3.26Å; H575-I577 PolarHBondContact O-N 3.35Å; I577-W580 PolarHBondContact O-N 2.96Å; I577-M581 WeakPolarHBondContact O-CB 3.35Å; I577-M581 PolarHBondContact O-N 3.19Å
578	I	88.3	Confident	84.4	Confident	43 Å²	43	74 Å²	74	22%	0.221	40%	0.395	C	S	.	.	H	α-helix	trans	-70.7	-42.5	-178.5	-69.4	173.7	0	0	0	109.8	L513 Y517 V561 H575 W580 M581 G582	L513-I578 HydrophobicContact CD1-CG2 3.85Å; L513-I578 HydrophobicContact CD2-CG2 4.34Å; L513-I578 HydrophobicContact CG-CG2 3.9Å; Y517-I578 HydrophobicContact CE2-CD1 4.27Å; Y517-I578 HydrophobicContact CE2-CG2 3.93Å; Y517-I578 WeakPolarHBondContact OH-CD1 3.49Å; V561-I578 HydrophobicContact CG2-CG2 4.16Å; H575-I578 HydrophobicContact CB-CB 4.18Å; H575-I578 HydrophobicContact CB-CD1 4.15Å; H575-I578 HydrophobicContact CB-CG1 4.44Å; H575-I578 PolarHBondContact O-N 3.46Å; H575-I578 VanDerWaalsContact O-N 3.13Å; I578-W580 VanDerWaalsContact C-N 3.32Å; I578-W580 PolarHBondContact O-N 2.94Å; I578-M581 PolarHBondContact O-N 3.2Å; I578-G582 PolarHBondContact O-N 3.31Å
579	Q	86	Confident	85.3	Confident	41 Å²	41	67.7 Å²	67.7	19%	0.192	35%	0.354	C	S	.	.	H	α-helix	trans	-61.7	-41.6	174	-175.2	175.9	2.9	0	0	111.7	V561 H575 G582 N583	V561-Q579 HydrophobicContact CG2-CB 4.16Å; H575-Q579 PolarHBondContact O-N 3.35Å; H575-Q579 VanDerWaalsContact O-N 3.1Å; Q579-G582 PolarHBondContact O-N 3.44Å; Q579-N583 WeakPolarHBondContact O-CB 3.34Å; Q579-N583 VanDerWaalsContact O-CG 3.25Å; Q579-N583 PolarHBondContact O-N 3.04Å; Q579-N583 PolarHBondContact O-ND2 3.33Å; Q579-N583 VanDerWaalsContact O-ND2 3.17Å
580	W	88.4	Confident	86.2	Confident	160 Å²	160	64.4 Å²	64.4	61%	0.606	34%	0.335	S	S	*	.	H	α-helix	trans	-63.6	-44.6	175.4	-176.5	80.6	0	0	0	111.8	G576 I577 I578 N583 L584	G576-W580 VanDerWaalsContact O-CB 3.25Å; G576-W580 WeakPolarHBondContact O-CB 3.43Å; G576-W580 PolarHBondContact O-N 2.88Å; I577-W580 PolarHBondContact O-N 2.96Å; I578-W580 VanDerWaalsContact C-N 3.32Å; I578-W580 PolarHBondContact O-N 2.94Å; W580-N583 PolarHBondContact O-N 2.94Å; W580-L584 HydrophobicContact CH2-CD2 4.06Å; W580-L584 HydrophobicContact CZ3-CD2 4.12Å; W580-L584 WeakPolarHBondContact O-CB 3.23Å; W580-L584 PolarHBondContact O-N 3.47Å
581	M	91.7	Very high	87	Confident	76 Å²	76	62.6 Å²	62.6	37%	0.374	33%	0.331	S	S	.	.	H	α-helix	trans	-63.5	-42.3	176.4	-173.1	60.4	71.2	0	0	112.1	L513 I577 I578 L584 I585	L513-M581 HydrophobicContact CD2-CB 4.39Å; L513-M581 HydrophobicContact CD2-CG 4.41Å; I577-M581 WeakPolarHBondContact O-CB 3.35Å; I577-M581 PolarHBondContact O-N 3.19Å; I578-M581 PolarHBondContact O-N 3.2Å; M581-L584 WeakPolarHBondContact O-CB 3.34Å; M581-L584 PolarHBondContact O-N 2.7Å; M581-L584 HydrophobicContact SD-CD2 4.13Å; M581-I585 HydrophobicContact CG-CD1 4.11Å; M581-I585 WeakPolarHBondContact O-CG1 3.38Å; M581-I585 PolarHBondContact O-N 3.46Å; M581-I585 HydrophobicContact SD-CD1 4.48Å; M581-I585 HydrophobicContact SD-CG1 4.49Å
582	G	89.4	Confident	87.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-45.1	175.6	0	0	0	0	0	111.9	L513 I578 Q579 L584 I585 A586	L513-G582 VanDerWaalsContact CD2-CA 3.46Å; I578-G582 PolarHBondContact O-N 3.31Å; Q579-G582 PolarHBondContact O-N 3.44Å; G582-L584 VanDerWaalsContact C-N 3.31Å; G582-L584 PolarHBondContact O-N 2.72Å; G582-I585 PolarHBondContact O-N 3.45Å; G582-A586 WeakPolarHBondContact O-CB 3.21Å; G582-A586 PolarHBondContact O-N 3.29Å
583	N	88.8	Confident	88.3	Confident	56 Å²	56	60.3 Å²	60.3	30%	0.299	32%	0.316	S	S	.	.	H	α-helix	trans	-63.2	-35.4	173.4	-75.1	-30.9	0	0	0	112.6	L559 Q579 W580 A586 G587	L559-N583 WeakPolarHBondContact CD2-OD1 3.49Å; Q579-N583 WeakPolarHBondContact O-CB 3.34Å; Q579-N583 VanDerWaalsContact O-CG 3.25Å; Q579-N583 PolarHBondContact O-N 3.04Å; Q579-N583 PolarHBondContact O-ND2 3.33Å; Q579-N583 VanDerWaalsContact O-ND2 3.17Å; W580-N583 PolarHBondContact O-N 2.94Å; N583-A586 WeakPolarHBondContact O-CB 3.34Å; N583-G587 PolarHBondContact O-N 3.46Å
584	L	91.5	Very high	88.7	Confident	72 Å²	72	59.3 Å²	59.3	38%	0.377	31%	0.309	S	S	.	.	H	α-helix	trans	-67.4	-49.6	176.7	-176.2	70.3	0	0	0	111.3	W580 M581 G582 A586 G587 I588	W580-L584 HydrophobicContact CH2-CD2 4.06Å; W580-L584 HydrophobicContact CZ3-CD2 4.12Å; W580-L584 WeakPolarHBondContact O-CB 3.23Å; W580-L584 PolarHBondContact O-N 3.47Å; M581-L584 WeakPolarHBondContact O-CB 3.34Å; M581-L584 PolarHBondContact O-N 2.7Å; M581-L584 HydrophobicContact SD-CD2 4.13Å; G582-L584 VanDerWaalsContact C-N 3.31Å; G582-L584 PolarHBondContact O-N 2.72Å; L584-A586 VanDerWaalsContact C-N 3.3Å; L584-A586 PolarHBondContact O-N 2.95Å; L584-G587 PolarHBondContact O-N 3.47Å; L584-G587 VanDerWaalsContact O-N 3.14Å; L584-I588 HydrophobicContact CG-CD1 4.1Å; L584-I588 VanDerWaalsContact O-CG1 3.3Å; L584-I588 WeakPolarHBondContact O-CG1 3.32Å; L584-I588 PolarHBondContact O-N 2.87Å
585	I	92.4	Very high	89.3	Confident	39 Å²	39	59 Å²	59	20%	0.2	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-42.7	177.2	-65.8	168.2	0	0	0	110.3	F506 L510 M581 G582 I588 Y589	F506-I585 HydrophobicContact CD1-CG2 3.92Å; F506-I585 HydrophobicContact CE1-CG2 4.38Å; L510-I585 HydrophobicContact CD1-CG2 4.48Å; L510-I585 HydrophobicContact CD2-CB 3.96Å; L510-I585 HydrophobicContact CD2-CG2 3.73Å; L510-I585 HydrophobicContact CG-CG2 3.84Å; M581-I585 HydrophobicContact CG-CD1 4.11Å; M581-I585 WeakPolarHBondContact O-CG1 3.38Å; M581-I585 PolarHBondContact O-N 3.46Å; M581-I585 HydrophobicContact SD-CD1 4.48Å; M581-I585 HydrophobicContact SD-CG1 4.49Å; G582-I585 PolarHBondContact O-N 3.45Å; I585-I588 PolarHBondContact O-N 3.49Å; I585-Y589 PolarHBondContact O-N 2.94Å
586	A	89	Confident	89.7	Confident	4 Å²	4	58 Å²	58	3%	0.033	31%	0.312	C	S	.	.	H	α-helix	trans	-57.8	-45.5	171.6	0	0	0	0	0	113.5	M553 L559 G582 N583 L584 Y589 H590	M553-A586 HydrophobicContact CE-CB 3.14Å; L559-A586 HydrophobicContact CD2-CB 3.81Å; G582-A586 WeakPolarHBondContact O-CB 3.21Å; G582-A586 PolarHBondContact O-N 3.29Å; N583-A586 WeakPolarHBondContact O-CB 3.34Å; L584-A586 VanDerWaalsContact C-N 3.3Å; L584-A586 PolarHBondContact O-N 2.95Å; A586-Y589 WeakPolarHBondContact O-CB 3.41Å; A586-Y589 PolarHBondContact O-N 2.96Å; A586-H590 PolarHBondContact O-N 3.15Å
587	G	90.3	Very high	90	Very high	33 Å²	33	56.8 Å²	56.8	34%	0.34	30%	0.295	S	S	.	.	H	α-helix	trans	-64.3	-41.9	176.6	0	0	0	0	0	112	N583 L584 H590 L591	N583-G587 PolarHBondContact O-N 3.46Å; L584-G587 PolarHBondContact O-N 3.47Å; L584-G587 VanDerWaalsContact O-N 3.14Å; G587-H590 PolarHBondContact O-N 3.31Å; G587-L591 WeakPolarHBondContact O-CG 3.42Å; G587-L591 PolarHBondContact O-N 3.49Å
588	I	92.8	Very high	90	Very high	70 Å²	70	53.6 Å²	53.6	36%	0.359	28%	0.279	S	S	.	.	H	α-helix	trans	-63.1	-42.3	174.8	-67.8	167.3	0	0	0	110.7	F506 L584 I585 H590 L591 L592	F506-I588 HydrophobicContact CE1-CG2 4.06Å; F506-I588 HydrophobicContact CZ-CG2 4.08Å; L584-I588 HydrophobicContact CG-CD1 4.1Å; L584-I588 VanDerWaalsContact O-CG1 3.3Å; L584-I588 WeakPolarHBondContact O-CG1 3.32Å; L584-I588 PolarHBondContact O-N 2.87Å; I585-I588 PolarHBondContact O-N 3.49Å; I588-H590 VanDerWaalsContact C-N 3.33Å; I588-H590 PolarHBondContact O-N 3.42Å; I588-L591 PolarHBondContact O-N 2.83Å; I588-L592 HydrophobicContact CG2-CD1 3.58Å; I588-L592 HydrophobicContact CG2-CG 4.09Å; I588-L592 WeakPolarHBondContact O-CB 3.04Å; I588-L592 PolarHBondContact O-N 2.81Å
589	Y	92.7	Very high	90.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.5	-46.1	173.3	169.5	-97.3	0	0	0	111.5	I503 F506 L545 A548 I585 A586 L591 L592 V593 V594	I503-Y589 HydrophobicContact CG1-CE2 4.13Å; F506-Y589 HydrophobicContact CB-CD2 3.88Å; F506-Y589 HydrophobicContact CD1-CD2 4.36Å; F506-Y589 AromaticContact CD2-CD2 3.62Å; F506-Y589 HydrophobicContact CD2-CD2 3.62Å; F506-Y589 HydrophobicContact CD2-CE2 4.44Å; F506-Y589 HydrophobicContact CE2-CD2 4.24Å; F506-Y589 AromaticContact CG-CD2 3.7Å; F506-Y589 HydrophobicContact CG-CD2 3.7Å; F506-Y589 HydrophobicContact CG-CG 4.35Å; L545-Y589 HydrophobicContact CB-CE1 4.44Å; L545-Y589 HydrophobicContact CB-CE2 4.31Å; L545-Y589 HydrophobicContact CD1-CE2 4.43Å; L545-Y589 HydrophobicContact CD2-CD1 3.85Å; L545-Y589 HydrophobicContact CD2-CD2 4.2Å; L545-Y589 HydrophobicContact CD2-CE1 3.84Å; L545-Y589 HydrophobicContact CD2-CE2 4.18Å; L545-Y589 HydrophobicContact CD2-CG 4.03Å; L545-Y589 PolarHBondContact O-OH 2.84Å; A548-Y589 HydrophobicContact CB-CE1 3.81Å; I585-Y589 PolarHBondContact O-N 2.94Å; A586-Y589 WeakPolarHBondContact O-CB 3.41Å; A586-Y589 PolarHBondContact O-N 2.96Å; Y589-L591 PolarHBondContact O-N 3.1Å; Y589-L592 PolarHBondContact O-N 3.05Å; Y589-V593 HydrophobicContact CD2-CB 3.93Å; Y589-V593 HydrophobicContact CD2-CG1 4.47Å; Y589-V593 HydrophobicContact CD2-CG2 3.57Å; Y589-V593 HydrophobicContact CE2-CB 3.71Å; Y589-V593 HydrophobicContact CE2-CG1 3.75Å; Y589-V593 HydrophobicContact CE2-CG2 3.61Å; Y589-V593 HydrophobicContact CG-CG2 4.46Å; Y589-V593 WeakPolarHBondContact O-CA 3.37Å; Y589-V593 VanDerWaalsContact O-CB 3.24Å; Y589-V593 WeakPolarHBondContact O-CB 3.48Å; Y589-V593 PolarHBondContact O-N 3.22Å; Y589-V594 HydrophobicContact CE1-CG2 4.31Å
590	H	90.6	Very high	90.4	Very high	52 Å²	52	60.3 Å²	60.3	24%	0.241	31%	0.311	C	S	.	.	I	π-helix	trans	-62.1	-43.6	177	-90.1	-66.9	0	0	0	113.1	A548 M553 A586 G587 I588 V594 I595	A548-H590 PolarHBondContact O-CE1 2.97Å; M553-H590 WeakPolarHBondContact CB-NE2 3.45Å; M553-H590 WeakPolarHBondContact CG-NE2 3.3Å; M553-H590 VanDerWaalsContact SD-CD2 3.59Å; M553-H590 PolarHBondContact SD-NE2 3.49Å; A586-H590 PolarHBondContact O-N 3.15Å; G587-H590 PolarHBondContact O-N 3.31Å; I588-H590 VanDerWaalsContact C-N 3.33Å; I588-H590 PolarHBondContact O-N 3.42Å; H590-V594 WeakPolarHBondContact O-CA 3.36Å; H590-V594 WeakPolarHBondContact O-CB 3.17Å; H590-V594 PolarHBondContact O-N 3.09Å; H590-V594 VanDerWaalsContact O-N 3.16Å; H590-I595 PolarHBondContact O-N 3.31Å
591	L	90.8	Very high	90.6	Very high	108 Å²	108	54.3 Å²	54.3	57%	0.565	29%	0.29	S	S	*	.	I	π-helix	trans	-65.4	-46.9	178.1	-68.7	176.3	0	0	0	112.1	G587 I588 Y589 I595 S596	G587-L591 WeakPolarHBondContact O-CG 3.42Å; G587-L591 PolarHBondContact O-N 3.49Å; I588-L591 PolarHBondContact O-N 2.83Å; Y589-L591 PolarHBondContact O-N 3.1Å; L591-I595 HydrophobicContact CD2-CD1 3.82Å; L591-I595 WeakPolarHBondContact O-CB 3.2Å; L591-S596 PolarHBondContact O-N 3.4Å; L591-S596 PolarHBondContact O-OG 3.45Å
592	L	90.5	Very high	90.5	Very high	97 Å²	97	53.9 Å²	53.9	51%	0.508	29%	0.292	S	S	.	.	I	π-helix	trans	-86.4	-26.7	-172.1	-69.3	-176.6	0	0	0	114.9	F506 I588 Y589 S596	F506-L592 HydrophobicContact CZ-CD1 4.27Å; I588-L592 HydrophobicContact CG2-CD1 3.58Å; I588-L592 HydrophobicContact CG2-CG 4.09Å; I588-L592 WeakPolarHBondContact O-CB 3.04Å; I588-L592 PolarHBondContact O-N 2.81Å; Y589-L592 PolarHBondContact O-N 3.05Å; L592-S596 WeakPolarHBondContact CA-OG 3.41Å; L592-S596 PolarHBondContact O-OG 3.19Å
593	V	89.5	Confident	90.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.313	C	S	.	.	I	π-helix	trans	-101.9	-60.9	179.5	179.4	0	0	0	0	108.1	Y499 C502 F506 W549 Y589 L597	Y499-V593 HydrophobicContact CD2-CG1 3.75Å; Y499-V593 HydrophobicContact CE2-CG1 3.61Å; C502-V593 HydrophobicContact CB-CG2 3.81Å; F506-V593 HydrophobicContact CD2-CG2 4.19Å; F506-V593 HydrophobicContact CE2-CG2 3.98Å; W549-V593 HydrophobicContact CE3-CG1 4.05Å; W549-V593 HydrophobicContact CZ3-CG1 3.97Å; W549-V593 VanDerWaalsContact CZ3-O 3.32Å; W549-V593 WeakPolarHBondContact CZ3-O 3.16Å; Y589-V593 HydrophobicContact CD2-CB 3.93Å; Y589-V593 HydrophobicContact CD2-CG1 4.47Å; Y589-V593 HydrophobicContact CD2-CG2 3.57Å; Y589-V593 HydrophobicContact CE2-CB 3.71Å; Y589-V593 HydrophobicContact CE2-CG1 3.75Å; Y589-V593 HydrophobicContact CE2-CG2 3.61Å; Y589-V593 HydrophobicContact CG-CG2 4.46Å; Y589-V593 WeakPolarHBondContact O-CA 3.37Å; Y589-V593 VanDerWaalsContact O-CB 3.24Å; Y589-V593 WeakPolarHBondContact O-CB 3.48Å; Y589-V593 PolarHBondContact O-N 3.22Å; V593-L597 HydrophobicContact CB-CD1 4.37Å; V593-L597 HydrophobicContact CG1-CD1 4.09Å; V593-L597 HydrophobicContact CG2-CD1 4.42Å; V593-L597 WeakPolarHBondContact O-CB 3.25Å; V593-L597 PolarHBondContact O-N 2.81Å
594	V	87.6	Confident	90.8	Very high	25 Å²	25	57.9 Å²	57.9	15%	0.152	32%	0.317	C	S	.	.	I	π-helix	trans	-68.7	-45.5	-172.3	-174.5	0	0	0	0	112.4	W549 Y589 H590 L598	W549-V594 HydrophobicContact CE3-CG2 4.11Å; Y589-V594 HydrophobicContact CE1-CG2 4.31Å; H590-V594 WeakPolarHBondContact O-CA 3.36Å; H590-V594 WeakPolarHBondContact O-CB 3.17Å; H590-V594 PolarHBondContact O-N 3.09Å; H590-V594 VanDerWaalsContact O-N 3.16Å; V594-L598 WeakPolarHBondContact O-CB 3.04Å
595	I	90.1	Very high	90.7	Very high	106 Å²	106	57.1 Å²	57.1	54%	0.544	31%	0.312	S	S	.	.	I	π-helix	trans	-81.8	-57.6	-176.1	-58.1	-179.2	0	0	0	111.6	H590 L591 H599	H590-I595 PolarHBondContact O-N 3.31Å; L591-I595 HydrophobicContact CD2-CD1 3.82Å; L591-I595 WeakPolarHBondContact O-CB 3.2Å; I595-H599 WeakPolarHBondContact O-CB 3.34Å; I595-H599 PolarHBondContact O-N 3.24Å; I595-H599 VanDerWaalsContact O-N 3.15Å
596	S	90.8	Very high	90.7	Very high	53 Å²	53	58 Å²	58	37%	0.371	33%	0.325	S	S	.	.	H	α-helix	trans	-72.8	-42.4	-172.8	61.1	0	0	0	0	113.3	L591 L592 H599 L600	L591-S596 PolarHBondContact O-N 3.4Å; L591-S596 PolarHBondContact O-OG 3.45Å; L592-S596 WeakPolarHBondContact CA-OG 3.41Å; L592-S596 PolarHBondContact O-OG 3.19Å; S596-H599 PolarHBondContact O-N 3.32Å; S596-L600 WeakPolarHBondContact O-CB 3.19Å; S596-L600 PolarHBondContact O-N 3.13Å
597	L	90	Very high	90.8	Very high	18 Å²	18	61.8 Å²	61.8	9%	0.094	35%	0.348	C	S	.	.	H	α-helix	trans	-71.2	-35.9	179.1	-61.6	179.1	0	0	0	112	Y495 I498 C502 V593 H599 L600 M601	Y495-L597 HydrophobicContact CE2-CB 3.76Å; Y495-L597 WeakPolarHBondContact CE2-O 3.5Å; Y495-L597 WeakPolarHBondContact OH-CB 3.04Å; Y495-L597 PolarHBondContact OH-O 3.34Å; I498-L597 HydrophobicContact CG2-CD2 4.2Å; C502-L597 HydrophobicContact CB-CD1 4.47Å; V593-L597 HydrophobicContact CB-CD1 4.37Å; V593-L597 HydrophobicContact CG1-CD1 4.09Å; V593-L597 HydrophobicContact CG2-CD1 4.42Å; V593-L597 WeakPolarHBondContact O-CB 3.25Å; V593-L597 PolarHBondContact O-N 2.81Å; L597-H599 VanDerWaalsContact C-N 3.33Å; L597-H599 PolarHBondContact O-N 2.85Å; L597-L600 HydrophobicContact CD2-CD2 4.31Å; L597-L600 PolarHBondContact O-N 2.96Å; L597-M601 WeakPolarHBondContact O-CB 3.35Å; L597-M601 PolarHBondContact O-N 2.97Å
598	L	89.8	Confident	90.7	Very high	72 Å²	72	62.8 Å²	62.8	38%	0.377	34%	0.344	S	S	.	.	H	α-helix	trans	-61.1	-44.9	173.3	-178	67.5	0	0	0	111	W549 V594 L600 M601 T602	W549-L598 HydrophobicContact CH2-CB 3.78Å; W549-L598 HydrophobicContact CH2-CD1 4.19Å; W549-L598 HydrophobicContact CZ2-CB 4.17Å; W549-L598 HydrophobicContact CZ2-CD1 3.7Å; W549-L598 HydrophobicContact CZ2-CG 4.5Å; V594-L598 WeakPolarHBondContact O-CB 3.04Å; L598-L600 PolarHBondContact O-N 2.92Å; L598-M601 HydrophobicContact CD1-CE 3.79Å; L598-M601 PolarHBondContact O-N 3.49Å; L598-T602 WeakPolarHBondContact O-CG2 3.41Å; L598-T602 PolarHBondContact O-N 2.91Å; L598-T602 PolarHBondContact O-OG1 3.4Å
599	H	91.6	Very high	90.6	Very high	134 Å²	134	63.3 Å²	63.3	62%	0.62	35%	0.346	S	S	*	.	H	α-helix	trans	-62.2	-44	176.8	-176.1	-150.2	0	0	0	111.5	I595 S596 L597 M601 T602 S603	I595-H599 WeakPolarHBondContact O-CB 3.34Å; I595-H599 PolarHBondContact O-N 3.24Å; I595-H599 VanDerWaalsContact O-N 3.15Å; S596-H599 PolarHBondContact O-N 3.32Å; L597-H599 VanDerWaalsContact C-N 3.33Å; L597-H599 PolarHBondContact O-N 2.85Å; H599-M601 PolarHBondContact O-N 3.13Å; H599-T602 WeakPolarHBondContact CA-OG1 3.47Å; H599-T602 PolarHBondContact O-N 3.35Å; H599-T602 PolarHBondContact O-OG1 3.47Å; H599-S603 WeakPolarHBondContact O-CB 3.43Å; H599-S603 PolarHBondContact O-N 3.43Å
600	L	91.1	Very high	90.5	Very high	91 Å²	91	66.9 Å²	66.9	48%	0.476	37%	0.371	S	S	.	.	H	α-helix	trans	-58.9	-45.2	175.1	-178.7	64.3	0	0	0	112	S596 L597 L598 S603 M604	S596-L600 WeakPolarHBondContact O-CB 3.19Å; S596-L600 PolarHBondContact O-N 3.13Å; L597-L600 HydrophobicContact CD2-CD2 4.31Å; L597-L600 PolarHBondContact O-N 2.96Å; L598-L600 PolarHBondContact O-N 2.92Å; L600-S603 PolarHBondContact O-N 3.4Å; L600-M604 WeakPolarHBondContact O-CB 3.34Å; L600-M604 PolarHBondContact O-N 3.28Å
601	M	90.9	Very high	90.4	Very high	34 Å²	34	68.8 Å²	68.8	17%	0.167	38%	0.384	C	S	.	.	H	α-helix	trans	-59.7	-49.2	176.8	-173.5	-170.2	76.8	0	0	111	L492 Y495 L597 L598 H599 S603 M604 M605	L492-M601 HydrophobicContact CD1-CG 4.5Å; L492-M601 HydrophobicContact CD1-SD 3.84Å; Y495-M601 HydrophobicContact CD1-CB 4.46Å; Y495-M601 HydrophobicContact CD1-CG 4.1Å; Y495-M601 HydrophobicContact CD1-SD 3.98Å; Y495-M601 HydrophobicContact CD2-CB 3.89Å; Y495-M601 HydrophobicContact CD2-CG 4.26Å; Y495-M601 HydrophobicContact CE1-CB 4.29Å; Y495-M601 HydrophobicContact CE1-CG 4.21Å; Y495-M601 HydrophobicContact CE1-SD 3.77Å; Y495-M601 HydrophobicContact CE2-CB 3.68Å; Y495-M601 HydrophobicContact CE2-CG 4.35Å; Y495-M601 HydrophobicContact CG-CB 4.27Å; Y495-M601 HydrophobicContact CG-CG 4.13Å; L597-M601 WeakPolarHBondContact O-CB 3.35Å; L597-M601 PolarHBondContact O-N 2.97Å; L598-M601 HydrophobicContact CD1-CE 3.79Å; L598-M601 PolarHBondContact O-N 3.49Å; H599-M601 PolarHBondContact O-N 3.13Å; M601-S603 VanDerWaalsContact C-N 3.32Å; M601-S603 PolarHBondContact O-N 3.26Å; M601-M604 PolarHBondContact O-N 2.95Å; M601-M605 HydrophobicContact CE-SD 4.43Å; M601-M605 HydrophobicContact CG-SD 4.13Å; M601-M605 WeakPolarHBondContact O-CB 3.48Å; M601-M605 VanDerWaalsContact O-CG 3.3Å; M601-M605 WeakPolarHBondContact O-CG 3.42Å; M601-M605 PolarHBondContact O-N 3.45Å
602	T	91.2	Very high	90.3	Very high	68 Å²	68	64.1 Å²	64.1	42%	0.417	36%	0.358	S	S	.	.	H	α-helix	trans	-62.5	-39.3	179.6	56.5	0	0	0	0	112.3	L598 H599 A606	L598-T602 WeakPolarHBondContact O-CG2 3.41Å; L598-T602 PolarHBondContact O-N 2.91Å; L598-T602 PolarHBondContact O-OG1 3.4Å; H599-T602 WeakPolarHBondContact CA-OG1 3.47Å; H599-T602 PolarHBondContact O-N 3.35Å; H599-T602 PolarHBondContact O-OG1 3.47Å; T602-A606 WeakPolarHBondContact O-CB 3.45Å; T602-A606 PolarHBondContact O-N 3.4Å
603	S	92.4	Very high	90.2	Very high	63 Å²	63	66.5 Å²	66.5	44%	0.441	37%	0.367	S	S	.	.	H	α-helix	trans	-65.3	-46.4	176.5	177.6	0	0	0	0	111.6	H599 L600 M601 M605 A606 V607	H599-S603 WeakPolarHBondContact O-CB 3.43Å; H599-S603 PolarHBondContact O-N 3.43Å; L600-S603 PolarHBondContact O-N 3.4Å; M601-S603 VanDerWaalsContact C-N 3.32Å; M601-S603 PolarHBondContact O-N 3.26Å; S603-M605 PolarHBondContact O-N 3.5Å; S603-A606 PolarHBondContact O-N 2.82Å; S603-V607 PolarHBondContact O-N 3.42Å; S603-V607 VanDerWaalsContact O-N 3.13Å
604	M	90.6	Very high	90.2	Very high	76 Å²	76	71.4 Å²	71.4	37%	0.374	40%	0.401	S	S	.	.	H	α-helix	trans	-63.9	-41.2	178.8	-167.7	-179.2	171.3	0	0	111.9	C491 L600 M601 A606 V607 E608	C491-M604 HydrophobicContact CB-CE 3.97Å; C491-M604 WeakPolarHBondContact SG-CE 3.33Å; C491-M604 WeakPolarHBondContact SG-CG 3.44Å; C491-M604 PolarHBondContact SG-SD 3.2Å; L600-M604 WeakPolarHBondContact O-CB 3.34Å; L600-M604 PolarHBondContact O-N 3.28Å; M601-M604 PolarHBondContact O-N 2.95Å; M604-A606 VanDerWaalsContact C-N 3.33Å; M604-A606 PolarHBondContact O-N 2.89Å; M604-V607 PolarHBondContact O-N 2.98Å; M604-E608 PolarHBondContact O-N 3.44Å
605	M	90.6	Very high	90.3	Very high	56 Å²	56	72.1 Å²	72.1	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-64.8	-36.6	175.3	-69.7	-177.5	89.8	0	0	112.1	M601 S603 E608 I609	M601-M605 HydrophobicContact CE-SD 4.43Å; M601-M605 HydrophobicContact CG-SD 4.13Å; M601-M605 WeakPolarHBondContact O-CB 3.48Å; M601-M605 VanDerWaalsContact O-CG 3.3Å; M601-M605 WeakPolarHBondContact O-CG 3.42Å; M601-M605 PolarHBondContact O-N 3.45Å; S603-M605 PolarHBondContact O-N 3.5Å; M605-E608 PolarHBondContact O-N 2.95Å; M605-I609 WeakPolarHBondContact O-CB 3.49Å; M605-I609 WeakPolarHBondContact O-CD1 3.28Å; M605-I609 WeakPolarHBondContact O-CG1 3.25Å; M605-I609 PolarHBondContact O-N 2.74Å
606	A	91.3	Very high	90.3	Very high	58 Å²	58	68.5 Å²	68.5	48%	0.479	39%	0.39	S	S	.	.	H	α-helix	trans	-65.8	-40	177.8	0	0	0	0	0	112.4	T602 S603 M604 I609 S610	T602-A606 WeakPolarHBondContact O-CB 3.45Å; T602-A606 PolarHBondContact O-N 3.4Å; S603-A606 PolarHBondContact O-N 2.82Å; M604-A606 VanDerWaalsContact C-N 3.33Å; M604-A606 PolarHBondContact O-N 2.89Å; A606-I609 PolarHBondContact O-N 2.84Å; A606-S610 PolarHBondContact O-N 3.36Å
607	V	91	Very high	90.3	Very high	83 Å²	83	70 Å²	70	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-62.9	-48.7	175.2	175.5	0	0	0	0	110.8	S603 M604 I609 S610 D611	S603-V607 PolarHBondContact O-N 3.42Å; S603-V607 VanDerWaalsContact O-N 3.13Å; M604-V607 PolarHBondContact O-N 2.98Å; V607-I609 VanDerWaalsContact C-N 3.3Å; V607-I609 PolarHBondContact O-N 3.28Å; V607-S610 WeakPolarHBondContact O-CB 3.47Å; V607-S610 PolarHBondContact O-N 2.95Å; V607-S610 VanDerWaalsContact O-N 3.14Å; V607-D611 PolarHBondContact O-N 3.37Å
608	E	88.9	Confident	90.4	Very high	54 Å²	54	70.6 Å²	70.6	25%	0.252	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-36.7	179.3	-174.8	69.5	-155.9	0	0	112.3	R487 M604 M605 Y612	R487-E608 IonicContact CZ-OE1 3.14Å; R487-E608 IonicContact NE-OE1 3.46Å; R487-E608 IonicContact NH2-OE1 4Å; R487-E608 PolarHBondContact NH2-OE1 2.89Å; R487-E608 VanDerWaalsContact NH2-OE1 3.1Å; M604-E608 PolarHBondContact O-N 3.44Å; M605-E608 PolarHBondContact O-N 2.95Å; E608-Y612 WeakPolarHBondContact O-CB 3.47Å; E608-Y612 PolarHBondContact O-N 3.36Å
609	I	89.7	Confident	90.5	Very high	81 Å²	81	67.6 Å²	67.6	42%	0.415	39%	0.386	S	S	.	.	H	α-helix	trans	-65.6	-42.9	175.6	-69.9	164.5	0	0	0	111.1	T484 M605 A606 V607 Y612 E613	T484-I609 HydrophobicContact CG2-CB 4.49Å; T484-I609 HydrophobicContact CG2-CG1 3.73Å; T484-I609 HydrophobicContact CG2-CG2 4.44Å; M605-I609 WeakPolarHBondContact O-CB 3.49Å; M605-I609 WeakPolarHBondContact O-CD1 3.28Å; M605-I609 WeakPolarHBondContact O-CG1 3.25Å; M605-I609 PolarHBondContact O-N 2.74Å; A606-I609 PolarHBondContact O-N 2.84Å; V607-I609 VanDerWaalsContact C-N 3.3Å; V607-I609 PolarHBondContact O-N 3.28Å; I609-Y612 PolarHBondContact O-N 3.23Å; I609-E613 PolarHBondContact O-N 3.3Å; I609-E613 VanDerWaalsContact O-N 3.13Å
610	S	91.3	Very high	90.6	Very high	75 Å²	75	62.9 Å²	62.9	52%	0.524	36%	0.363	S	S	.	.	H	α-helix	trans	-61.7	-44.1	177.2	-176.3	0	0	0	0	111.4	A606 V607 Y612 E613	A606-S610 PolarHBondContact O-N 3.36Å; V607-S610 WeakPolarHBondContact O-CB 3.47Å; V607-S610 PolarHBondContact O-N 2.95Å; V607-S610 VanDerWaalsContact O-N 3.14Å; S610-Y612 VanDerWaalsContact C-N 3.3Å; S610-Y612 PolarHBondContact O-N 3.01Å; S610-E613 PolarHBondContact O-N 3.31Å
611	D	89.1	Confident	90.7	Very high	93 Å²	93	62.5 Å²	62.5	50%	0.497	36%	0.355	S	S	.	.	H	α-helix	trans	-64.4	-39.1	178	-69.3	-14.5	0	0	0	111	V607 E613 S614	V607-D611 PolarHBondContact O-N 3.37Å; D611-E613 PolarHBondContact O-N 3.18Å; D611-S614 PolarHBondContact O-OG 3.24Å
612	Y	88.6	Confident	90.8	Very high	9 Å²	9	61.2 Å²	61.2	4%	0.035	35%	0.348	C	S	.	.	H	α-helix	trans	-64.4	-33.4	177.9	174.2	-101.2	0	0	0	113.7	P480 V483 T484 E608 I609 S610 S614 T615 S616 D619	P480-Y612 PolarHBondContact O-OH 3.36Å; V483-Y612 HydrophobicContact CB-CE2 4.47Å; V483-Y612 WeakPolarHBondContact CB-OH 3.5Å; V483-Y612 HydrophobicContact CG1-CE2 3.65Å; V483-Y612 VanDerWaalsContact CG1-OH 3.31Å; V483-Y612 WeakPolarHBondContact CG1-OH 3.46Å; T484-Y612 HydrophobicContact CG2-CD1 4.1Å; T484-Y612 WeakPolarHBondContact OG1-CD1 3.4Å; T484-Y612 WeakPolarHBondContact OG1-CE1 3.24Å; E608-Y612 WeakPolarHBondContact O-CB 3.47Å; E608-Y612 PolarHBondContact O-N 3.36Å; I609-Y612 PolarHBondContact O-N 3.23Å; S610-Y612 VanDerWaalsContact C-N 3.3Å; S610-Y612 PolarHBondContact O-N 3.01Å; Y612-S614 PolarHBondContact O-N 3.45Å; Y612-T615 CarbonylContact O-C 3.59Å; Y612-T615 PolarHBondContact O-N 2.55Å; Y612-T615 PolarHBondContact O-OG1 3.49Å; Y612-S616 VanDerWaalsContact CE1-CB 3.47Å; Y612-S616 WeakPolarHBondContact O-CA 3.5Å; Y612-S616 WeakPolarHBondContact O-CB 3.32Å; Y612-S616 PolarHBondContact O-N 2.95Å; Y612-D619 HydrophobicContact CE2-CB 3.75Å; Y612-D619 WeakPolarHBondContact CE2-OD2 3.19Å
613	E	88.9	Confident	90.8	Very high	147 Å²	147	60 Å²	60	69%	0.687	34%	0.338	S	S	*	.	H	α-helix	trans	-53.7	-43.4	-175.9	-172.9	174.3	-177.5	0	0	111.7	I609 S610 D611 T615 S616	I609-E613 PolarHBondContact O-N 3.3Å; I609-E613 VanDerWaalsContact O-N 3.13Å; S610-E613 PolarHBondContact O-N 3.31Å; D611-E613 PolarHBondContact O-N 3.18Å; E613-T615 VanDerWaalsContact C-N 3.3Å; E613-T615 PolarHBondContact O-N 3.37Å; E613-S616 WeakPolarHBondContact O-CB 3.31Å; E613-S616 PolarHBondContact O-N 3.14Å; E613-S616 PolarHBondContact O-OG 3.1Å
614	S	88.7	Confident	90.8	Very high	104 Å²	104	57.2 Å²	57.2	73%	0.727	32%	0.319	S	S	*	.	H	α-helix	trans	-62	-33.1	178.3	72.1	0	0	0	0	113.7	D611 Y612	D611-S614 PolarHBondContact O-OG 3.24Å; Y612-S614 PolarHBondContact O-N 3.45Å
615	T	89.6	Confident	90.9	Very high	40 Å²	40	53.6 Å²	53.6	25%	0.245	30%	0.301	C	S	.	.	H	α-helix	trans	-103.8	-0.4	-177.7	58.1	0	0	0	0	114.1	Y612 E613 T617 T618 D619	Y612-T615 CarbonylContact O-C 3.59Å; Y612-T615 PolarHBondContact O-N 2.55Å; Y612-T615 PolarHBondContact O-OG1 3.49Å; E613-T615 VanDerWaalsContact C-N 3.3Å; E613-T615 PolarHBondContact O-N 3.37Å; T615-T617 VanDerWaalsContact C-N 3.34Å; T615-T617 PolarHBondContact O-N 2.96Å; T615-T618 WeakPolarHBondContact O-CB 3.47Å; T615-T618 PolarHBondContact O-N 3.25Å; T615-D619 PolarHBondContact O-N 2.96Å
616	S	89.9	Confident	90.8	Very high	29 Å²	29	53.7 Å²	53.7	20%	0.203	30%	0.3	C	S	.	.	H	α-helix	trans	-57.3	-42.4	-166.7	59.7	0	0	0	0	113.7	Y612 E613 Y620	Y612-S616 VanDerWaalsContact CE1-CB 3.47Å; Y612-S616 WeakPolarHBondContact O-CA 3.5Å; Y612-S616 WeakPolarHBondContact O-CB 3.32Å; Y612-S616 PolarHBondContact O-N 2.95Å; E613-S616 WeakPolarHBondContact O-CB 3.31Å; E613-S616 PolarHBondContact O-N 3.14Å; E613-S616 PolarHBondContact O-OG 3.1Å; S616-Y620 WeakPolarHBondContact O-CB 3.49Å; S616-Y620 PolarHBondContact O-N 2.81Å
617	T	91.2	Very high	90.8	Very high	86 Å²	86	51 Å²	51	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-66.5	-40.2	179.1	58.1	0	0	0	0	112.1	T615 R621	T615-T617 VanDerWaalsContact C-N 3.34Å; T615-T617 PolarHBondContact O-N 2.96Å; T617-R621 WeakPolarHBondContact O-CB 3.32Å; T617-R621 VanDerWaalsContact O-CG 3.26Å; T617-R621 WeakPolarHBondContact O-CG 3.47Å; T617-R621 PolarHBondContact O-N 3.5Å
618	T	92	Very high	90.7	Very high	30 Å²	30	47.7 Å²	47.7	18%	0.184	26%	0.256	C	S	.	.	H	α-helix	trans	-68.2	-48	179.7	-64.8	0	0	0	0	110.3	K271 Y272 A275 T615 R621 F622	K271-T618 HydrophobicContact CB-CG2 3.96Å; Y272-T618 HydrophobicContact CD1-CG2 4.29Å; A275-T618 HydrophobicContact CB-CG2 3.7Å; T615-T618 WeakPolarHBondContact O-CB 3.47Å; T615-T618 PolarHBondContact O-N 3.25Å; T618-R621 PolarHBondContact O-N 2.94Å; T618-F622 WeakPolarHBondContact O-CB 3.33Å; T618-F622 PolarHBondContact O-N 3.19Å
619	D	91.8	Very high	90.6	Very high	9 Å²	9	45.4 Å²	45.4	5%	0.048	25%	0.245	C	C	.	.	H	α-helix	trans	-65.1	-41	178.4	-82.7	-14.5	0	0	0	112.2	K271 V483 R487 Y612 T615 F622 Q623	K271-D619 WeakPolarHBondContact CD-OD1 3.5Å; K271-D619 WeakPolarHBondContact CE-OD1 3.41Å; K271-D619 IonicContact NZ-OD1 2.64Å; K271-D619 PolarHBondContact NZ-OD1 3.47Å; K271-D619 IonicContact NZ-OD2 3.46Å; V483-D619 HydrophobicContact CG1-CB 4.06Å; R487-D619 IonicContact CZ-OD2 2.64Å; R487-D619 IonicContact NH1-OD2 3.07Å; R487-D619 PolarHBondContact NH1-OD2 3.48Å; Y612-D619 HydrophobicContact CE2-CB 3.75Å; Y612-D619 WeakPolarHBondContact CE2-OD2 3.19Å; T615-D619 PolarHBondContact O-N 2.96Å; D619-F622 PolarHBondContact O-N 3.33Å; D619-Q623 WeakPolarHBondContact O-CB 3.48Å; D619-Q623 PolarHBondContact O-N 3.22Å
620	Y	92.8	Very high	90.3	Very high	35 Å²	35	42 Å²	42	14%	0.137	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-44.8	176.4	170.5	-111.6	0	0	0	112.6	Q473 L474 P476 P480 S616 F622 Q623 C624	Q473-Y620 WeakPolarHBondContact O-CE2 3.26Å; L474-Y620 PolarHBondContact O-OH 2.86Å; P476-Y620 WeakPolarHBondContact CA-OH 3.48Å; P480-Y620 HydrophobicContact CG-CD1 4.27Å; P480-Y620 HydrophobicContact CG-CD2 3.99Å; P480-Y620 HydrophobicContact CG-CE2 4.43Å; P480-Y620 HydrophobicContact CG-CG 3.9Å; S616-Y620 WeakPolarHBondContact O-CB 3.49Å; S616-Y620 PolarHBondContact O-N 2.81Å; Y620-F622 VanDerWaalsContact C-N 3.33Å; Y620-F622 PolarHBondContact O-N 2.86Å; Y620-Q623 PolarHBondContact O-N 3.06Å; Y620-C624 VanDerWaalsContact CE2-SG 3.59Å; Y620-C624 PolarHBondContact O-N 3Å; Y620-C624 PolarHBondContact O-SG 2.69Å; Y620-C624 VanDerWaalsContact O-SG 3.35Å
621	R	93.6	Very high	90.1	Very high	82 Å²	82	38.5 Å²	38.5	31%	0.309	20%	0.203	S	C	.	.	H	α-helix	trans	-62	-43.6	176.3	-75.8	-178.9	-178.3	172.8	5.5	111.2	A275 F280 T617 T618 Q623 C624 C625	A275-R621 HydrophobicContact CB-CB 4.14Å; A275-R621 WeakPolarHBondContact O-CD 3.25Å; A275-R621 PolarHBondContact O-NH1 3.03Å; F280-R621 HydrophobicContact CD1-CG 4.32Å; F280-R621 HydrophobicContact CD2-CB 3.71Å; F280-R621 HydrophobicContact CD2-CG 3.77Å; F280-R621 HydrophobicContact CE1-CG 4.15Å; F280-R621 HydrophobicContact CE2-CB 3.57Å; F280-R621 HydrophobicContact CE2-CG 3.58Å; F280-R621 HydrophobicContact CG-CB 4.49Å; F280-R621 HydrophobicContact CG-CG 4.13Å; F280-R621 HydrophobicContact CZ-CB 4.25Å; F280-R621 HydrophobicContact CZ-CG 3.78Å; T617-R621 WeakPolarHBondContact O-CB 3.32Å; T617-R621 VanDerWaalsContact O-CG 3.26Å; T617-R621 WeakPolarHBondContact O-CG 3.47Å; T617-R621 PolarHBondContact O-N 3.5Å; T618-R621 PolarHBondContact O-N 2.94Å; R621-Q623 VanDerWaalsContact C-N 3.33Å; R621-Q623 PolarHBondContact O-N 3.45Å; R621-C624 WeakPolarHBondContact O-CB 3.25Å; R621-C624 PolarHBondContact O-N 3.11Å; R621-C625 PolarHBondContact O-N 3.47Å; R621-C625 PolarHBondContact O-SG 3.1Å; R621-C625 VanDerWaalsContact O-SG 3.36Å
622	F	93.3	Very high	89.7	Confident	7 Å²	7	34.7 Å²	34.7	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-40.8	175.1	179.5	-110.5	0	0	0	112.3	E269 K271 L274 T618 D619 Y620 C624 C625 K626	E269-F622 HydrophobicContact CB-CZ 4.06Å; E269-F622 HydrophobicContact CG-CZ 4.29Å; K271-F622 HydrophobicContact CB-CB 4.48Å; K271-F622 HydrophobicContact CB-CD2 4.43Å; K271-F622 HydrophobicContact CB-CG 4.36Å; K271-F622 HydrophobicContact CD-CD1 4.46Å; K271-F622 HydrophobicContact CG-CB 4.36Å; K271-F622 HydrophobicContact CG-CD1 3.89Å; K271-F622 HydrophobicContact CG-CD2 4.08Å; K271-F622 HydrophobicContact CG-CE1 4.1Å; K271-F622 HydrophobicContact CG-CE2 4.31Å; K271-F622 HydrophobicContact CG-CG 3.86Å; K271-F622 HydrophobicContact CG-CZ 4.32Å; L274-F622 HydrophobicContact CD1-CD2 3.87Å; L274-F622 HydrophobicContact CD1-CE2 3.96Å; T618-F622 WeakPolarHBondContact O-CB 3.33Å; T618-F622 PolarHBondContact O-N 3.19Å; D619-F622 PolarHBondContact O-N 3.33Å; Y620-F622 VanDerWaalsContact C-N 3.33Å; Y620-F622 PolarHBondContact O-N 2.86Å; F622-C624 PolarHBondContact O-N 3.23Å; F622-C625 WeakPolarHBondContact O-CB 3.29Å; F622-C625 PolarHBondContact O-N 3.06Å; F622-K626 HydrophobicContact CD1-CD 4.25Å; F622-K626 HydrophobicContact CE1-CD 3.71Å; F622-K626 HydrophobicContact CE1-CG 4.27Å; F622-K626 HydrophobicContact CZ-CD 4.08Å; F622-K626 HydrophobicContact CZ-CG 4.29Å; F622-K626 PolarHBondContact O-N 3.21Å
623	Q	91.3	Very high	88.9	Confident	43 Å²	43	34.4 Å²	34.4	20%	0.201	18%	0.181	C	C	.	.	H	α-helix	trans	-63.4	-40.9	174.3	-171.7	63	14.5	0	0	111.7	V483 D619 Y620 R621 C625 K626 V627	V483-Q623 HydrophobicContact CG2-CB 3.89Å; V483-Q623 HydrophobicContact CG2-CG 3.92Å; D619-Q623 WeakPolarHBondContact O-CB 3.48Å; D619-Q623 PolarHBondContact O-N 3.22Å; Y620-Q623 PolarHBondContact O-N 3.06Å; R621-Q623 VanDerWaalsContact C-N 3.33Å; R621-Q623 PolarHBondContact O-N 3.45Å; Q623-C625 VanDerWaalsContact C-N 3.33Å; Q623-C625 PolarHBondContact O-N 2.79Å; Q623-K626 PolarHBondContact O-N 3.34Å; Q623-V627 WeakPolarHBondContact O-CG2 3.49Å; Q623-V627 PolarHBondContact O-N 3.06Å; Q623-V627 VanDerWaalsContact O-N 3.16Å
624	C	92.7	Very high	87.9	Confident	5 Å²	5	28.7 Å²	28.7	3%	0.034	16%	0.155	C	C	.	.	H	α-helix	trans	-56.7	-47.3	171.9	-68.3	0	0	0	0	111.2	F280 Y620 R621 F622 K626 V627 W628	F280-C624 HydrophobicContact CE2-CB 4.23Å; F280-C624 HydrophobicContact CZ-CB 4.44Å; Y620-C624 VanDerWaalsContact CE2-SG 3.59Å; Y620-C624 PolarHBondContact O-N 3Å; Y620-C624 PolarHBondContact O-SG 2.69Å; Y620-C624 VanDerWaalsContact O-SG 3.35Å; R621-C624 WeakPolarHBondContact O-CB 3.25Å; R621-C624 PolarHBondContact O-N 3.11Å; F622-C624 PolarHBondContact O-N 3.23Å; C624-K626 PolarHBondContact O-N 3.48Å; C624-V627 PolarHBondContact O-N 3.45Å; C624-V627 VanDerWaalsContact O-N 3.09Å; C624-W628 HydrophobicContact CB-CH2 4.4Å; C624-W628 HydrophobicContact CB-CZ2 4Å; C624-W628 PolarHBondContact O-N 2.9Å
625	C	92	Very high	87	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-42.8	177.4	-67.9	0	0	0	0	112.7	F262 L274 R621 F622 Q623 V627 W628 I629	F262-C625 HydrophobicContact CE2-CB 3.75Å; F262-C625 HydrophobicContact CZ-CB 3.82Å; L274-C625 HydrophobicContact CD1-CB 4.17Å; R621-C625 PolarHBondContact O-N 3.47Å; R621-C625 PolarHBondContact O-SG 3.1Å; R621-C625 VanDerWaalsContact O-SG 3.36Å; F622-C625 WeakPolarHBondContact O-CB 3.29Å; F622-C625 PolarHBondContact O-N 3.06Å; Q623-C625 VanDerWaalsContact C-N 3.33Å; Q623-C625 PolarHBondContact O-N 2.79Å; C625-V627 PolarHBondContact O-N 2.99Å; C625-W628 PolarHBondContact O-N 3.36Å; C625-I629 PolarHBondContact O-N 3.26Å
626	K	89.5	Confident	86.2	Confident	58 Å²	58	22.9 Å²	22.9	25%	0.252	11%	0.114	S	C	.	.	H	α-helix	trans	-58.3	-29.9	174	-86.8	-175.2	166.7	177.8	0	112.9	V266 E269 F622 Q623 C624 I629	V266-K626 HydrophobicContact CG1-CG 3.78Å; E269-K626 IonicContact OE1-NZ 3.28Å; E269-K626 PolarHBondContact OE1-NZ 3.32Å; F622-K626 HydrophobicContact CD1-CD 4.25Å; F622-K626 HydrophobicContact CE1-CD 3.71Å; F622-K626 HydrophobicContact CE1-CG 4.27Å; F622-K626 HydrophobicContact CZ-CD 4.08Å; F622-K626 HydrophobicContact CZ-CG 4.29Å; F622-K626 PolarHBondContact O-N 3.21Å; Q623-K626 PolarHBondContact O-N 3.34Å; C624-K626 PolarHBondContact O-N 3.48Å; K626-I629 VanDerWaalsContact O-CG2 3.26Å; K626-I629 WeakPolarHBondContact O-CG2 3.27Å
627	V	89.9	Confident	85.5	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.012	11%	0.11	C	C	.	.	H	α-helix	trans	-85.8	-38.9	175.4	-175.8	0	0	0	0	111.6	Y470 Q473 L474 Q623 C624 C625 I629 D630 Y631	Y470-V627 HydrophobicContact CE1-CG1 4.18Å; Q473-V627 VanDerWaalsContact CD-CG2 3.46Å; Q473-V627 HydrophobicContact CG-CG2 3.92Å; L474-V627 HydrophobicContact CD1-CB 4.2Å; L474-V627 HydrophobicContact CD1-CG1 3.46Å; L474-V627 VanDerWaalsContact CD1-CG1 3.46Å; L474-V627 HydrophobicContact CD1-CG2 4.47Å; L474-V627 HydrophobicContact CD2-CB 4.42Å; L474-V627 HydrophobicContact CD2-CG1 4.21Å; L474-V627 HydrophobicContact CG-CB 4.38Å; L474-V627 HydrophobicContact CG-CG1 4.12Å; Q623-V627 WeakPolarHBondContact O-CG2 3.49Å; Q623-V627 PolarHBondContact O-N 3.06Å; Q623-V627 VanDerWaalsContact O-N 3.16Å; C624-V627 PolarHBondContact O-N 3.45Å; C624-V627 VanDerWaalsContact O-N 3.09Å; C625-V627 PolarHBondContact O-N 2.99Å; V627-I629 VanDerWaalsContact C-N 3.29Å; V627-I629 PolarHBondContact O-N 2.97Å; V627-D630 WeakPolarHBondContact O-CB 3.5Å; V627-D630 PolarHBondContact O-N 3.11Å; V627-Y631 HydrophobicContact CG1-CE2 4.05Å; V627-Y631 WeakPolarHBondContact O-CD2 3.49Å
628	W	90.5	Very high	85	Confident	12 Å²	12	19.5 Å²	19.5	5%	0.045	9%	0.089	C	C	.	.	H	α-helix	trans	-61.6	-39	-179.2	-66.7	-14.5	0	0	0	112.3	F280 L283 Q284 W287 C624 C625 D630 Y631 F632	F280-W628 HydrophobicContact CD2-CH2 4.35Å; F280-W628 HydrophobicContact CD2-CZ3 4.25Å; F280-W628 HydrophobicContact CE1-CH2 4.13Å; F280-W628 AromaticContact CE2-CH2 3.58Å; F280-W628 HydrophobicContact CE2-CH2 3.58Å; F280-W628 AromaticContact CE2-CZ3 3.81Å; F280-W628 HydrophobicContact CE2-CZ3 3.81Å; F280-W628 AromaticContact CZ-CH2 3.46Å; F280-W628 HydrophobicContact CZ-CH2 3.46Å; F280-W628 VanDerWaalsContact CZ-CH2 3.46Å; F280-W628 HydrophobicContact CZ-CZ2 4.21Å; F280-W628 HydrophobicContact CZ-CZ3 4.16Å; L283-W628 HydrophobicContact CB-CE3 4.32Å; L283-W628 HydrophobicContact CB-CZ3 4.01Å; Q284-W628 HydrophobicContact CB-CH2 3.82Å; Q284-W628 HydrophobicContact CB-CZ3 4.3Å; Q284-W628 HydrophobicContact CG-CH2 4.13Å; W287-W628 HydrophobicContact CB-CD2 4.36Å; W287-W628 HydrophobicContact CD2-CB 4.18Å; W287-W628 AromaticContact CD2-CD1 3.42Å; W287-W628 VanDerWaalsContact CD2-CD1 3.42Å; W287-W628 HydrophobicContact CD2-CD2 4.14Å; W287-W628 AromaticContact CD2-CG 3.67Å; W287-W628 HydrophobicContact CD2-CG 3.67Å; W287-W628 AromaticContact CD2-NE1 3.76Å; W287-W628 AromaticContact CE2-CD1 3.46Å; W287-W628 VanDerWaalsContact CE2-CD1 3.46Å; W287-W628 AromaticContact CE2-NE1 3.65Å; W287-W628 HydrophobicContact CE3-CB 3.47Å; W287-W628 VanDerWaalsContact CE3-CB 3.47Å; W287-W628 AromaticContact CE3-CD1 3.54Å; W287-W628 HydrophobicContact CE3-CD2 4.3Å; W287-W628 AromaticContact CE3-CG 3.49Å; W287-W628 HydrophobicContact CE3-CG 3.49Å; W287-W628 VanDerWaalsContact CE3-CG 3.49Å; W287-W628 HydrophobicContact CG-CD2 4.16Å; W287-W628 HydrophobicContact CG-CG 4.19Å; W287-W628 AromaticContact CG-NE1 4Å; W287-W628 HydrophobicContact CH2-CB 4.42Å; W287-W628 AromaticContact CH2-CD1 3.74Å; W287-W628 HydrophobicContact CH2-CG 4.36Å; W287-W628 AromaticContact CZ2-CD1 3.63Å; W287-W628 HydrophobicContact CZ3-CB 3.64Å; W287-W628 AromaticContact CZ3-CD1 3.71Å; W287-W628 AromaticContact CZ3-CG 3.88Å; W287-W628 HydrophobicContact CZ3-CG 3.88Å; W287-W628 VanDerWaalsContact CZ3-O 3.29Å; W287-W628 WeakPolarHBondContact CZ3-O 3.3Å; W287-W628 AromaticContact NE1-NE1 3.8Å; C624-W628 HydrophobicContact CB-CH2 4.4Å; C624-W628 HydrophobicContact CB-CZ2 4Å; C624-W628 PolarHBondContact O-N 2.9Å; C625-W628 PolarHBondContact O-N 3.36Å; W628-D630 PolarHBondContact O-N 3.23Å; W628-Y631 PolarHBondContact O-N 2.72Å; W628-F632 HydrophobicContact CB-CD2 4.22Å; W628-F632 HydrophobicContact CB-CE2 3.87Å; W628-F632 WeakPolarHBondContact O-CD2 3.26Å; W628-F632 PolarHBondContact O-N 3.28Å
629	I	86.2	Confident	84.6	Confident	7 Å²	7	18.2 Å²	18.2	4%	0.036	8%	0.082	C	C	.	.	H	α-helix	trans	-58.4	-33	178.7	-164.5	163	0	0	0	113.4	F262 E263 V266 C625 K626 V627 Y631 F632 N633	F262-I629 HydrophobicContact CD1-CB 4.45Å; F262-I629 HydrophobicContact CD1-CD1 4.17Å; F262-I629 HydrophobicContact CD1-CG1 4.31Å; F262-I629 HydrophobicContact CE1-CB 3.7Å; F262-I629 HydrophobicContact CE1-CD1 4.19Å; F262-I629 HydrophobicContact CE1-CG1 4.05Å; F262-I629 HydrophobicContact CZ-CB 4.34Å; E263-I629 VanDerWaalsContact CA-CD1 3.41Å; E263-I629 HydrophobicContact CB-CD1 3.64Å; E263-I629 HydrophobicContact CG-CD1 3.73Å; V266-I629 HydrophobicContact CB-CD1 4.24Å; V266-I629 HydrophobicContact CG1-CG2 4.46Å; V266-I629 HydrophobicContact CG2-CD1 4.24Å; C625-I629 PolarHBondContact O-N 3.26Å; K626-I629 VanDerWaalsContact O-CG2 3.26Å; K626-I629 WeakPolarHBondContact O-CG2 3.27Å; V627-I629 VanDerWaalsContact C-N 3.29Å; V627-I629 PolarHBondContact O-N 2.97Å; I629-Y631 PolarHBondContact O-N 3.37Å; I629-F632 PolarHBondContact O-N 3.09Å; I629-N633 PolarHBondContact O-N 3.4Å; I629-N633 PolarHBondContact O-ND2 2.97Å
630	D	83.6	Confident	84.3	Confident	9 Å²	9	18 Å²	18	5%	0.048	8%	0.081	C	C	.	.	H	α-helix	trans	-62.1	-31	177.8	-73.6	-16.2	0	0	0	112.4	R407 Y470 V627 W628 R636	R407-D630 IonicContact CZ-OD1 2.65Å; R407-D630 IonicContact NE-OD1 3.59Å; R407-D630 IonicContact NH2-OD1 3.29Å; R407-D630 PolarHBondContact NH2-OD1 3.47Å; Y470-D630 PolarHBondContact OH-OD2 3.01Å; V627-D630 WeakPolarHBondContact O-CB 3.5Å; V627-D630 PolarHBondContact O-N 3.11Å; W628-D630 PolarHBondContact O-N 3.23Å; D630-R636 IonicContact OD2-CZ 3.14Å; D630-R636 IonicContact OD2-NH1 3.43Å; D630-R636 PolarHBondContact OD2-NH1 3.5Å; D630-R636 IonicContact OD2-NH2 2.64Å
631	Y	86.3	Confident	83.8	Confident	1 Å²	1	16.8 Å²	16.8	0%	0.004	8%	0.077	C	C	.	.	H	α-helix	trans	-102.2	-11.4	-178.8	-57.9	-90.6	0	0	0	113.8	W287 K336 Y337 T340 Y470 V627 W628 I629 R636	W287-Y631 AromaticContact CH2-CD2 3.63Å; W287-Y631 HydrophobicContact CH2-CD2 3.63Å; W287-Y631 AromaticContact CH2-CG 3.83Å; W287-Y631 HydrophobicContact CH2-CG 3.83Å; W287-Y631 HydrophobicContact CZ3-CD2 4.28Å; W287-Y631 HydrophobicContact CZ3-CG 4.35Å; K336-Y631 HydrophobicContact CB-CD1 4.17Å; K336-Y631 WeakPolarHBondContact CD-O 3.49Å; Y337-Y631 HydrophobicContact CD2-CD2 4.25Å; Y337-Y631 HydrophobicContact CD2-CE1 4.29Å; Y337-Y631 AromaticContact CD2-CE2 3.57Å; Y337-Y631 HydrophobicContact CD2-CE2 3.57Å; Y337-Y631 AromaticContact CD2-CZ 3.58Å; Y337-Y631 HydrophobicContact CE2-CE2 4.43Å; Y337-Y631 HydrophobicContact CG-CE2 4.44Å; T340-Y631 HydrophobicContact CG2-CE1 4.3Å; Y470-Y631 HydrophobicContact CE1-CE2 4.43Å; V627-Y631 HydrophobicContact CG1-CE2 4.05Å; V627-Y631 WeakPolarHBondContact O-CD2 3.49Å; W628-Y631 PolarHBondContact O-N 2.72Å; I629-Y631 PolarHBondContact O-N 3.37Å; Y631-R636 HydrophobicContact CD1-CB 4.02Å; Y631-R636 HydrophobicContact CE1-CB 4.34Å
632	F	81	Confident	83.3	Confident	14 Å²	14	15.7 Å²	15.7	6%	0.061	8%	0.075	C	C	.	.	H	α-helix	trans	-65.4	-34.3	162.4	-79.4	-62.5	0	0	0	110.8	F262 H286 W287 P333 W628 I629	F262-F632 HydrophobicContact CD1-CD2 4.4Å; F262-F632 AromaticContact CE1-CD2 3.86Å; F262-F632 HydrophobicContact CE1-CD2 3.86Å; F262-F632 HydrophobicContact CE1-CE2 4.02Å; H286-F632 AromaticContact CE1-CE1 3.84Å; H286-F632 AromaticContact ND1-CE1 3.14Å; H286-F632 WeakPolarHBondContact ND1-CE1 3.36Å; H286-F632 AromaticContact ND1-CZ 3.72Å; W287-F632 HydrophobicContact CB-CZ 4.28Å; W287-F632 HydrophobicContact CE3-CE2 4.06Å; W287-F632 HydrophobicContact CE3-CZ 4.18Å; P333-F632 HydrophobicContact CB-CD1 4.26Å; P333-F632 HydrophobicContact CB-CE1 4.17Å; P333-F632 HydrophobicContact CG-CD1 3.57Å; P333-F632 HydrophobicContact CG-CE1 3.42Å; P333-F632 VanDerWaalsContact CG-CE1 3.42Å; P333-F632 HydrophobicContact CG-CG 4.45Å; P333-F632 HydrophobicContact CG-CZ 4.24Å; W628-F632 HydrophobicContact CB-CD2 4.22Å; W628-F632 HydrophobicContact CB-CE2 3.87Å; W628-F632 WeakPolarHBondContact O-CD2 3.26Å; W628-F632 PolarHBondContact O-N 3.28Å; I629-F632 PolarHBondContact O-N 3.09Å
633	N	71.5	Confident	82.8	Confident	2 Å²	2	15.4 Å²	15.4	1%	0.011	7%	0.073	C	C	.	.	S	Bend	trans	-66.3	147.6	174.7	-71.6	-52.9	0	0	0	112.9	I257 R395 I629 C635	I257-N633 WeakPolarHBondContact CD1-OD1 3.43Å; I257-N633 WeakPolarHBondContact CG1-OD1 3.5Å; R395-N633 PolarHBondContact NH1-OD1 3.35Å; R395-N633 PolarHBondContact NH2-ND2 3.43Å; R395-N633 PolarHBondContact NH2-OD1 2.87Å; R395-N633 VanDerWaalsContact NH2-OD1 3.17Å; I629-N633 PolarHBondContact O-N 3.4Å; I629-N633 PolarHBondContact O-ND2 2.97Å; N633-C635 VanDerWaalsContact C-N 3.27Å; N633-C635 PolarHBondContact O-N 2.91Å
634	D	67.8	Low	82.4	Confident	27 Å²	27	14.4 Å²	14.4	14%	0.144	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-67.8	-23	-178.3	-75.4	-14.2	0	0	0	114.6	R636 T637 W672 S673 Y676	D634-R636 PolarHBondContact O-N 3.49Å; D634-R636 VanDerWaalsContact O-N 3.13Å; D634-T637 WeakPolarHBondContact O-CB 3.41Å; D634-T637 PolarHBondContact O-N 2.86Å; D634-T637 VanDerWaalsContact O-N 3.13Å; D634-T637 PolarHBondContact O-OG1 3.3Å; D634-W672 HydrophobicContact CB-CB 4.3Å; D634-S673 VanDerWaalsContact OD2-CB 3.24Å; D634-S673 WeakPolarHBondContact OD2-CB 3.46Å; D634-Y676 WeakPolarHBondContact OD2-CD2 3.41Å; D634-Y676 WeakPolarHBondContact OD2-CE2 3.44Å
635	C	69.4	Low	81.8	Confident	7 Å²	7	20.4 Å²	20.4	5%	0.047	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-60	-29.6	-171.8	-61.5	0	0	0	0	113.1	E392 N633	E392-C635 HydrophobicContact CG-CB 4.45Å; N633-C635 VanDerWaalsContact C-N 3.27Å; N633-C635 PolarHBondContact O-N 2.91Å
636	R	74.3	Confident	81.1	Confident	15 Å²	15	20.6 Å²	20.6	6%	0.057	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-103.9	22	-177.3	-60.2	-173.9	-176.7	-170.6	-1.1	113.4	I388 E392 Y470 D630 Y631 D634 Y638	I388-R636 HydrophobicContact CG2-CG 4.28Å; E392-R636 IonicContact OE1-CZ 3.54Å; E392-R636 VanDerWaalsContact OE1-CZ 3.31Å; E392-R636 IonicContact OE1-NE 2.69Å; E392-R636 PolarHBondContact OE1-NE 3.42Å; E392-R636 IonicContact OE1-NH2 3.52Å; E392-R636 PolarHBondContact OE1-NH2 3.35Å; E392-R636 IonicContact OE2-CZ 3.5Å; E392-R636 IonicContact OE2-NH2 3.82Å; E392-R636 PolarHBondContact OE2-NH2 2.85Å; Y470-R636 PolarHBondContact OH-NH1 2.87Å; D630-R636 IonicContact OD2-CZ 3.14Å; D630-R636 IonicContact OD2-NH1 3.43Å; D630-R636 PolarHBondContact OD2-NH1 3.5Å; D630-R636 IonicContact OD2-NH2 2.64Å; Y631-R636 HydrophobicContact CD1-CB 4.02Å; Y631-R636 HydrophobicContact CE1-CB 4.34Å; D634-R636 PolarHBondContact O-N 3.49Å; D634-R636 VanDerWaalsContact O-N 3.13Å; R636-Y638 VanDerWaalsContact C-N 3.27Å; R636-Y638 PolarHBondContact O-N 2.94Å
637	T	74.9	Confident	80.7	Confident	18 Å²	18	20.9 Å²	20.9	11%	0.11	10%	0.097	C	C	.	.	S	Bend	trans	-66.1	-32.4	178.3	-56.8	0	0	0	0	112.2	F331 K336 D634	F331-T637 HydrophobicContact CD2-CG2 3.77Å; F331-T637 HydrophobicContact CE2-CG2 4.37Å; K336-T637 PolarHBondContact NZ-OG1 2.54Å; K336-T637 VanDerWaalsContact NZ-OG1 3.1Å; D634-T637 WeakPolarHBondContact O-CB 3.41Å; D634-T637 PolarHBondContact O-N 2.86Å; D634-T637 VanDerWaalsContact O-N 3.13Å; D634-T637 PolarHBondContact O-OG1 3.3Å
638	Y	80.2	Confident	80.4	Confident	27 Å²	27	25.7 Å²	25.7	11%	0.106	12%	0.122	C	C	.	.	S	Bend	trans	-118.6	126.1	179.1	-54.5	-69.3	0	0	0	110.1	I317 F331 R636 V646	I317-Y638 HydrophobicContact CD1-CD1 4.09Å; I317-Y638 HydrophobicContact CG1-CD1 3.55Å; I317-Y638 HydrophobicContact CG1-CE1 3.81Å; F331-Y638 HydrophobicContact CE2-CE1 4.21Å; R636-Y638 VanDerWaalsContact C-N 3.27Å; R636-Y638 PolarHBondContact O-N 2.94Å; Y638-V646 HydrophobicContact CD2-CB 4.15Å; Y638-V646 HydrophobicContact CD2-CG1 3.98Å; Y638-V646 HydrophobicContact CD2-CG2 3.8Å; Y638-V646 HydrophobicContact CE2-CB 4.36Å; Y638-V646 HydrophobicContact CE2-CG1 3.81Å; Y638-V646 HydrophobicContact CE2-CG2 3.93Å; Y638-V646 HydrophobicContact CG-CG2 4.1Å
639	P	84.7	Confident	79.9	Confident	3 Å²	3	29.9 Å²	29.9	2%	0.019	14%	0.139	C	C	.	.			trans	-72.3	149.7	179.7	31.4	-33.4	0	0	0	110.5	H313 F642 C643	H313-P639 WeakPolarHBondContact CE1-CD 3.44Å; H313-P639 WeakPolarHBondContact NE2-CD 3.36Å; P639-F642 PolarHBondContact O-N 3.3Å; P639-F642 VanDerWaalsContact O-N 3.09Å; P639-C643 PolarHBondContact O-N 2.97Å
640	P	84.5	Confident	79.4	Confident	5 Å²	5	30.4 Å²	30.4	3%	0.032	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	145.6	166.2	-18.7	30.7	0	0	0	109.9	S343 Y381 I388	S343-P640 WeakPolarHBondContact CB-O 3.03Å; S343-P640 PolarHBondContact OG-O 3.36Å; Y381-P640 HydrophobicContact CD2-CB 3.84Å; Y381-P640 HydrophobicContact CE1-CB 4.44Å; Y381-P640 HydrophobicContact CE2-CB 3.71Å; Y381-P640 HydrophobicContact CE2-CG 4.38Å; Y381-P640 WeakPolarHBondContact CE2-O 3.26Å; Y381-P640 HydrophobicContact CG-CB 4.25Å; I388-P640 HydrophobicContact CD1-CG 3.79Å
641	P	83.6	Confident	79	Confident	9 Å²	9	31.2 Å²	31.2	6%	0.058	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	cis	-82.3	-12.8	-0.1	33.5	-36	0	0	0	114.1	Y377 L380 C643 L644	Y377-P641 HydrophobicContact CD2-CG 4.26Å; Y377-P641 HydrophobicContact CE2-CG 3.85Å; L380-P641 HydrophobicContact CB-CB 3.76Å; P641-C643 PolarHBondContact O-N 3.11Å; P641-C643 VanDerWaalsContact O-N 3.11Å; P641-L644 WeakPolarHBondContact O-CB 3.23Å; P641-L644 PolarHBondContact O-N 3.5Å
642	F	81.7	Confident	78.6	Confident	59 Å²	59	34.6 Å²	34.6	26%	0.259	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-24	-167.3	-57.1	-69.5	0	0	0	114.4	P314 I317 P639 L644 F645	P314-F642 HydrophobicContact CB-CD1 4.4Å; P314-F642 HydrophobicContact CB-CE1 3.82Å; P314-F642 HydrophobicContact CB-CZ 3.97Å; P314-F642 HydrophobicContact CG-CE1 4.49Å; P314-F642 HydrophobicContact CG-CZ 4.17Å; I317-F642 HydrophobicContact CD1-CB 3.35Å; I317-F642 HydrophobicContact CD1-CD2 4.35Å; I317-F642 HydrophobicContact CD1-CG 3.87Å; P639-F642 PolarHBondContact O-N 3.3Å; P639-F642 VanDerWaalsContact O-N 3.09Å; F642-L644 PolarHBondContact O-N 3.25Å; F642-F645 HydrophobicContact CD1-CD2 4.49Å; F642-F645 HydrophobicContact CD1-CE2 4.46Å; F642-F645 PolarHBondContact O-N 3.33Å; F642-F645 VanDerWaalsContact O-N 3.11Å
643	C	82.5	Confident	78.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-43.3	-40	166.9	179.4	0	0	0	0	113.7	I388 P639 P641 F645 V646 F647 W672	I388-C643 HydrophobicContact CD1-CB 4.34Å; I388-C643 WeakPolarHBondContact CG1-SG 3.19Å; P639-C643 PolarHBondContact O-N 2.97Å; P641-C643 PolarHBondContact O-N 3.11Å; P641-C643 VanDerWaalsContact O-N 3.11Å; C643-F645 VanDerWaalsContact C-N 3.34Å; C643-F645 PolarHBondContact O-N 2.99Å; C643-V646 PolarHBondContact O-N 3.33Å; C643-F647 WeakPolarHBondContact O-CB 3.33Å; C643-F647 PolarHBondContact O-N 3.49Å; C643-W672 HydrophobicContact CB-CZ3 4.48Å; C643-W672 WeakPolarHBondContact SG-CH2 3.46Å; C643-W672 WeakPolarHBondContact SG-CZ3 3.36Å
644	L	83	Confident	78.3	Confident	23 Å²	23	37.5 Å²	37.5	12%	0.12	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-38.3	-179.7	-69.9	175.7	0	0	0	113.2	L380 L383 T387 P641 F642 V646 F647 I648	L380-L644 HydrophobicContact CD2-CD1 4.12Å; L380-L644 VanDerWaalsContact O-CD1 3.26Å; L380-L644 WeakPolarHBondContact O-CD1 3.38Å; L383-L644 HydrophobicContact CB-CD1 3.84Å; L383-L644 HydrophobicContact CB-CD2 4.32Å; T387-L644 HydrophobicContact CG2-CD2 3.75Å; P641-L644 WeakPolarHBondContact O-CB 3.23Å; P641-L644 PolarHBondContact O-N 3.5Å; F642-L644 PolarHBondContact O-N 3.25Å; L644-V646 VanDerWaalsContact C-N 3.33Å; L644-V646 PolarHBondContact O-N 2.86Å; L644-F647 PolarHBondContact O-N 2.88Å; L644-I648 WeakPolarHBondContact O-CB 3.49Å; L644-I648 VanDerWaalsContact O-CG1 3.25Å; L644-I648 WeakPolarHBondContact O-CG1 3.48Å; L644-I648 PolarHBondContact O-N 3.48Å
645	F	80.1	Confident	78.6	Confident	130 Å²	130	40.9 Å²	40.9	57%	0.57	21%	0.208	S	C	*	.	H	α-helix	trans	-64.4	-41.4	179.2	-67	-70.4	0	0	0	111.3	F642 C643 Y649	F642-F645 HydrophobicContact CD1-CD2 4.49Å; F642-F645 HydrophobicContact CD1-CE2 4.46Å; F642-F645 PolarHBondContact O-N 3.33Å; F642-F645 VanDerWaalsContact O-N 3.11Å; C643-F645 VanDerWaalsContact C-N 3.34Å; C643-F645 PolarHBondContact O-N 2.99Å; F645-Y649 VanDerWaalsContact O-CB 3.25Å; F645-Y649 WeakPolarHBondContact O-CB 3.17Å; F645-Y649 PolarHBondContact O-N 3.35Å
646	V	78.4	Confident	78.9	Confident	4 Å²	4	44 Å²	44	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-43.5	176.9	179.5	0	0	0	0	110.3	I317 Y638 C643 L644 I648 Y649 N650 W672	I317-V646 HydrophobicContact CG2-CG2 3.89Å; Y638-V646 HydrophobicContact CD2-CB 4.15Å; Y638-V646 HydrophobicContact CD2-CG1 3.98Å; Y638-V646 HydrophobicContact CD2-CG2 3.8Å; Y638-V646 HydrophobicContact CE2-CB 4.36Å; Y638-V646 HydrophobicContact CE2-CG1 3.81Å; Y638-V646 HydrophobicContact CE2-CG2 3.93Å; Y638-V646 HydrophobicContact CG-CG2 4.1Å; C643-V646 PolarHBondContact O-N 3.33Å; L644-V646 VanDerWaalsContact C-N 3.33Å; L644-V646 PolarHBondContact O-N 2.86Å; V646-I648 PolarHBondContact O-N 3.2Å; V646-Y649 PolarHBondContact O-N 2.91Å; V646-N650 WeakPolarHBondContact CG1-ND2 3.34Å; V646-N650 VanDerWaalsContact O-CB 3.32Å; V646-N650 WeakPolarHBondContact O-CB 3.44Å; V646-N650 PolarHBondContact O-N 3.42Å; V646-W672 HydrophobicContact CG1-CE3 4.41Å
647	F	80.7	Confident	78.6	Confident	64 Å²	64	49.2 Å²	49.2	28%	0.281	25%	0.246	S	C	.	.	H	α-helix	trans	-59.1	-47.7	177.3	-175	-97.6	0	0	0	112.1	T391 C643 L644 G651 I671 W672	T391-F647 HydrophobicContact CG2-CE2 4.13Å; C643-F647 WeakPolarHBondContact O-CB 3.33Å; C643-F647 PolarHBondContact O-N 3.49Å; L644-F647 PolarHBondContact O-N 2.88Å; F647-G651 WeakPolarHBondContact O-CA 3.49Å; F647-G651 PolarHBondContact O-N 3.42Å; F647-I671 HydrophobicContact CD2-CG2 3.75Å; F647-I671 HydrophobicContact CE2-CD1 4.28Å; F647-I671 HydrophobicContact CE2-CG2 3.95Å; F647-W672 HydrophobicContact CB-CH2 3.76Å; F647-W672 HydrophobicContact CB-CZ3 3.95Å; F647-W672 AromaticContact CD2-CH2 3.68Å; F647-W672 HydrophobicContact CD2-CH2 3.68Å; F647-W672 AromaticContact CD2-CZ2 3.87Å; F647-W672 HydrophobicContact CD2-CZ2 3.87Å; F647-W672 HydrophobicContact CD2-CZ3 4.41Å; F647-W672 HydrophobicContact CG-CH2 4.13Å
648	I	82.6	Confident	78.4	Confident	103 Å²	103	56.4 Å²	56.4	53%	0.528	27%	0.273	S	S	.	.	H	α-helix	trans	-65.8	-44.9	178.4	-66.4	165.4	0	0	0	110.6	L644 V646 T652	L644-I648 WeakPolarHBondContact O-CB 3.49Å; L644-I648 VanDerWaalsContact O-CG1 3.25Å; L644-I648 WeakPolarHBondContact O-CG1 3.48Å; L644-I648 PolarHBondContact O-N 3.48Å; V646-I648 PolarHBondContact O-N 3.2Å; I648-T652 HydrophobicContact CG2-CG2 4.36Å; I648-T652 WeakPolarHBondContact O-CB 3.48Å; I648-T652 WeakPolarHBondContact O-CG2 3.34Å; I648-T652 PolarHBondContact O-N 3.43Å; I648-T652 PolarHBondContact O-OG1 3.42Å
649	Y	80.7	Confident	78.2	Confident	101 Å²	101	62.3 Å²	62.3	40%	0.396	30%	0.299	S	S	.	.	H	α-helix	trans	-65	-47.7	-179.6	178.8	-101.8	0	0	0	112.6	V321 F645 V646 T652 A653	V321-Y649 HydrophobicContact CG1-CD1 3.89Å; V321-Y649 HydrophobicContact CG1-CD2 4.25Å; V321-Y649 HydrophobicContact CG1-CE1 3.75Å; V321-Y649 HydrophobicContact CG1-CE2 4.15Å; V321-Y649 HydrophobicContact CG1-CG 4.12Å; F645-Y649 VanDerWaalsContact O-CB 3.25Å; F645-Y649 WeakPolarHBondContact O-CB 3.17Å; F645-Y649 PolarHBondContact O-N 3.35Å; V646-Y649 PolarHBondContact O-N 2.91Å; Y649-T652 PolarHBondContact O-OG1 2.75Å; Y649-A653 WeakPolarHBondContact O-CB 3.42Å; Y649-A653 PolarHBondContact O-N 2.94Å; Y649-A653 VanDerWaalsContact O-N 3.11Å
650	N	75.8	Confident	77.5	Confident	18 Å²	18	71 Å²	71	10%	0.096	34%	0.337	C	S	.	.	H	α-helix	trans	-71.4	-39.4	178.3	-71.7	-15.9	0	0	0	111.4	V646 A653 I654 I671	V646-N650 WeakPolarHBondContact CG1-ND2 3.34Å; V646-N650 VanDerWaalsContact O-CB 3.32Å; V646-N650 WeakPolarHBondContact O-CB 3.44Å; V646-N650 PolarHBondContact O-N 3.42Å; N650-A653 WeakPolarHBondContact O-CB 3.4Å; N650-A653 PolarHBondContact O-N 2.83Å; N650-I654 VanDerWaalsContact O-CG1 3.3Å; N650-I654 WeakPolarHBondContact O-CG1 3.42Å; N650-I654 PolarHBondContact O-N 3.47Å; N650-I671 VanDerWaalsContact CB-O 3.29Å; N650-I671 WeakPolarHBondContact CB-O 3.37Å; N650-I671 PolarHBondContact ND2-O 3.01Å
651	G	76.1	Confident	76.4	Confident	26 Å²	26	73.1 Å²	73.1	27%	0.268	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-45.6	177.1	0	0	0	0	0	112.4	F647 A653 I654 L655	F647-G651 WeakPolarHBondContact O-CA 3.49Å; F647-G651 PolarHBondContact O-N 3.42Å; G651-A653 VanDerWaalsContact C-N 3.35Å; G651-A653 PolarHBondContact O-N 2.87Å; G651-I654 PolarHBondContact O-N 2.69Å; G651-L655 VanDerWaalsContact O-CB 3.32Å; G651-L655 WeakPolarHBondContact O-CB 3.31Å; G651-L655 PolarHBondContact O-N 3Å
652	T	77.3	Confident	75.1	Confident	72 Å²	72	77 Å²	77	44%	0.442	40%	0.397	S	S	.	.	H	α-helix	trans	-65	-36.9	173.9	52.7	0	0	0	0	112.2	I648 Y649 L655 T656	I648-T652 HydrophobicContact CG2-CG2 4.36Å; I648-T652 WeakPolarHBondContact O-CB 3.48Å; I648-T652 WeakPolarHBondContact O-CG2 3.34Å; I648-T652 PolarHBondContact O-N 3.43Å; I648-T652 PolarHBondContact O-OG1 3.42Å; Y649-T652 PolarHBondContact O-OG1 2.75Å; T652-L655 PolarHBondContact O-N 2.97Å; T652-T656 WeakPolarHBondContact O-CB 3.29Å; T652-T656 VanDerWaalsContact O-CG2 3.23Å; T652-T656 WeakPolarHBondContact O-CG2 3.25Å; T652-T656 PolarHBondContact O-N 2.91Å; T652-T656 PolarHBondContact O-OG1 2.95Å
653	A	73.8	Confident	73.7	Confident	14 Å²	14	78.5 Å²	78.5	12%	0.116	41%	0.414	C	S	.	.	H	α-helix	trans	-66.8	-33.3	174.5	0	0	0	0	0	113.6	Y649 N650 G651 T656 R657	Y649-A653 WeakPolarHBondContact O-CB 3.42Å; Y649-A653 PolarHBondContact O-N 2.94Å; Y649-A653 VanDerWaalsContact O-N 3.11Å; N650-A653 WeakPolarHBondContact O-CB 3.4Å; N650-A653 PolarHBondContact O-N 2.83Å; G651-A653 VanDerWaalsContact C-N 3.35Å; G651-A653 PolarHBondContact O-N 2.87Å; A653-T656 WeakPolarHBondContact CA-OG1 3.48Å; A653-T656 PolarHBondContact O-OG1 3.02Å; A653-T656 VanDerWaalsContact O-OG1 3.08Å; A653-R657 VanDerWaalsContact O-CG 3.28Å; A653-R657 WeakPolarHBondContact O-CG 3.43Å; A653-R657 PolarHBondContact O-N 2.87Å
654	I	71.6	Confident	72.3	Confident	62 Å²	62	87.2 Å²	87.2	32%	0.318	45%	0.452	S	S	.	.	H	α-helix	trans	-73.5	-45.3	173.9	-68.7	163.6	0	0	0	110.1	N650 G651 T656 R657 Y658 I669 I671	N650-I654 VanDerWaalsContact O-CG1 3.3Å; N650-I654 WeakPolarHBondContact O-CG1 3.42Å; N650-I654 PolarHBondContact O-N 3.47Å; G651-I654 PolarHBondContact O-N 2.69Å; I654-T656 PolarHBondContact O-N 2.63Å; I654-R657 WeakPolarHBondContact O-CB 3.44Å; I654-R657 PolarHBondContact O-N 2.91Å; I654-Y658 PolarHBondContact O-N 2.94Å; I654-I669 HydrophobicContact CD1-CG2 4.1Å; I654-I671 HydrophobicContact CD1-CG1 4.34Å
655	L	75	Confident	70.7	Confident	99 Å²	99	91.2 Å²	91.2	52%	0.518	48%	0.48	S	S	.	.	H	α-helix	trans	-61.3	-45.5	179.2	-166.9	74.2	0	0	0	111.5	G651 T652 R657 Y658 F659	G651-L655 VanDerWaalsContact O-CB 3.32Å; G651-L655 WeakPolarHBondContact O-CB 3.31Å; G651-L655 PolarHBondContact O-N 3Å; T652-L655 PolarHBondContact O-N 2.97Å; L655-R657 VanDerWaalsContact C-N 3.33Å; L655-R657 PolarHBondContact O-N 3.34Å; L655-Y658 WeakPolarHBondContact O-CB 3.31Å; L655-Y658 PolarHBondContact O-N 2.85Å; L655-Y658 VanDerWaalsContact O-N 3.16Å; L655-F659 HydrophobicContact CD1-CD2 4.18Å; L655-F659 HydrophobicContact CD1-CE2 3.7Å; L655-F659 HydrophobicContact CD2-CE2 4.31Å; L655-F659 HydrophobicContact CG-CD2 3.86Å; L655-F659 HydrophobicContact CG-CE2 3.75Å; L655-F659 VanDerWaalsContact O-CD2 3.29Å; L655-F659 WeakPolarHBondContact O-CD2 3.4Å; L655-F659 PolarHBondContact O-N 2.9Å
656	T	75.4	Confident	69	Low	72 Å²	72	93.8 Å²	93.8	44%	0.442	49%	0.486	S	S	.	.	H	α-helix	trans	-62.5	-37.9	175.1	48.6	0	0	0	0	112.1	T652 A653 I654 F659 F660	T652-T656 WeakPolarHBondContact O-CB 3.29Å; T652-T656 VanDerWaalsContact O-CG2 3.23Å; T652-T656 WeakPolarHBondContact O-CG2 3.25Å; T652-T656 PolarHBondContact O-N 2.91Å; T652-T656 PolarHBondContact O-OG1 2.95Å; A653-T656 WeakPolarHBondContact CA-OG1 3.48Å; A653-T656 PolarHBondContact O-OG1 3.02Å; A653-T656 VanDerWaalsContact O-OG1 3.08Å; I654-T656 PolarHBondContact O-N 2.63Å; T656-F659 PolarHBondContact O-N 3.1Å; T656-F660 WeakPolarHBondContact O-CB 3.39Å; T656-F660 WeakPolarHBondContact O-CD2 3.29Å; T656-F660 PolarHBondContact O-N 3.04Å
657	R	69	Low	67.6	Low	124 Å²	124	102.1 Å²	102.1	47%	0.468	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-42.3	172	-77.5	175.7	177.6	-173.8	-1.7	111.9	A653 I654 L655 F659 A661	A653-R657 VanDerWaalsContact O-CG 3.28Å; A653-R657 WeakPolarHBondContact O-CG 3.43Å; A653-R657 PolarHBondContact O-N 2.87Å; I654-R657 WeakPolarHBondContact O-CB 3.44Å; I654-R657 PolarHBondContact O-N 2.91Å; L655-R657 VanDerWaalsContact C-N 3.33Å; L655-R657 PolarHBondContact O-N 3.34Å; R657-F659 PolarHBondContact O-N 3.38Å; R657-A661 WeakPolarHBondContact O-CA 3.45Å; R657-A661 WeakPolarHBondContact O-CB 3.38Å; R657-A661 PolarHBondContact O-N 2.89Å
658	Y	70	Confident	66.2	Low	170 Å²	170	104.1 Å²	104.1	67%	0.667	53%	0.53	S	S	*	.	H	α-helix	trans	-62.1	-41.7	178.5	-170.8	-95.2	0	0	0	112.1	I654 L655	I654-Y658 PolarHBondContact O-N 2.94Å; L655-Y658 WeakPolarHBondContact O-CB 3.31Å; L655-Y658 PolarHBondContact O-N 2.85Å; L655-Y658 VanDerWaalsContact O-N 3.16Å
659	F	76.1	Confident	64.7	Low	151 Å²	151	102.1 Å²	102.1	66%	0.662	52%	0.52	S	S	*	.	H	α-helix	trans	-79.5	-38.9	179.3	-79.9	-71.1	0	0	0	114.3	L655 T656 R657	L655-F659 HydrophobicContact CD1-CD2 4.18Å; L655-F659 HydrophobicContact CD1-CE2 3.7Å; L655-F659 HydrophobicContact CD2-CE2 4.31Å; L655-F659 HydrophobicContact CG-CD2 3.86Å; L655-F659 HydrophobicContact CG-CE2 3.75Å; L655-F659 VanDerWaalsContact O-CD2 3.29Å; L655-F659 WeakPolarHBondContact O-CD2 3.4Å; L655-F659 PolarHBondContact O-N 2.9Å; T656-F659 PolarHBondContact O-N 3.1Å; R657-F659 PolarHBondContact O-N 3.38Å
660	F	69.7	Low	63.7	Low	185 Å²	185	98.6 Å²	98.6	81%	0.811	51%	0.51	S	S	*	.	H	α-helix	trans	-95.4	-26.9	-172.7	-78.8	-84.2	0	0	0	114.8	T656	T656-F660 WeakPolarHBondContact O-CB 3.39Å; T656-F660 WeakPolarHBondContact O-CD2 3.29Å; T656-F660 PolarHBondContact O-N 3.04Å
661	A	60.7	Low	63.2	Low	50 Å²	50	100.6 Å²	100.6	41%	0.413	52%	0.52	S	S	.	.			trans	-112	97.4	178.3	0	0	0	0	0	108	R657 S663	R657-A661 WeakPolarHBondContact O-CA 3.45Å; R657-A661 WeakPolarHBondContact O-CB 3.38Å; R657-A661 PolarHBondContact O-N 2.89Å; A661-S663 PolarHBondContact O-N 2.98Å
662	G	56	Low	62.8	Low	91 Å²	91	99.9 Å²	99.9	94%	0.938	51%	0.509	S	S	*	.			trans	-60.8	20.7	171.4	0	0	0	0	0	115.2
663	S	52.5	Low	62.1	Low	89 Å²	89	98 Å²	98	62%	0.622	50%	0.499	S	S	*	.	S	Bend	trans	-73.6	130.2	168	-179.6	0	0	0	0	108.4	A661	A661-S663 PolarHBondContact O-N 2.98Å
664	K	53.3	Low	61.1	Low	184 Å²	184	102.9 Å²	102.9	80%	0.8	51%	0.514	S	S	*	.			trans	-44.9	131	161.8	-69.6	-177.1	178	-178	0	107.8	R666	K664-R666 PolarHBondContact O-N 3.28Å
665	P	49.1	Very low	60.2	Low	107 Å²	107	105 Å²	105	70%	0.695	52%	0.521	S	S	*	.			trans	-57.7	116.8	172.9	24.8	-30.7	0	0	0	106	E667	P665-E667 PolarHBondContact O-N 2.73Å
666	R	44.7	Very low	59	Low	183 Å²	183	102.5 Å²	102.5	69%	0.691	51%	0.505	S	S	*	.			trans	-49.2	135.9	156.1	-85.2	173.7	156	-179.6	-1.3	105.2	K664 R668	K664-R666 PolarHBondContact O-N 3.28Å; R666-R668 HydrophobicContact CB-CG 4.04Å; R666-R668 PolarHBondContact O-N 3.4Å
667	E	50.5	Low	57.7	Low	179 Å²	179	104.5 Å²	104.5	84%	0.836	51%	0.513	S	S	*	.	S	Bend	trans	-59.2	41.8	-175.1	-66.6	170.2	151.1	0	0	114.5	P665	P665-E667 PolarHBondContact O-N 2.73Å
668	R	50.1	Low	56.9	Low	107 Å²	107	101.1 Å²	101.1	40%	0.404	50%	0.504	S	S	.	.			trans	-123.9	148.9	-164.3	-59.6	-176.4	-156.7	-159	1.9	108.2	R666 L678	R666-R668 HydrophobicContact CB-CG 4.04Å; R666-R668 PolarHBondContact O-N 3.4Å; R668-L678 HydrophobicContact CG-CD1 4.36Å
669	I	52.3	Low	56.1	Low	60 Å²	60	96.6 Å²	96.6	31%	0.308	50%	0.495	S	S	.	.			trans	103	93.1	164.3	-48	151.2	0	0	0	112.3	I654 I671	I654-I669 HydrophobicContact CD1-CG2 4.1Å; I669-I671 PolarHBondContact O-N 3.36Å
670	S	59.1	Low	55.1	Low	27 Å²	27	94.9 Å²	94.9	19%	0.189	50%	0.497	C	S	.	.	B	Isolated β-bridge	trans	-55.9	133.3	149.1	68.4	0	0	0	0	107.6	W672 S673	S670-W672 PolarHBondContact O-N 3.02Å; S670-S673 PolarHBondContact O-N 3.38Å; S670-S673 VanDerWaalsContact O-N 3.12Å; S670-S673 VanDerWaalsContact O-O 3.13Å; S670-S673 WeakPolarHBondContact OG-CB 3.2Å; S670-S673 PolarHBondContact OG-N 3.37Å; S670-S673 PolarHBondContact OG-O 3.06Å
671	I	65.1	Low	54.6	Low	60 Å²	60	91 Å²	91	31%	0.308	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-22.8	-177.2	-62.6	169.5	0	0	0	111.7	F647 N650 I654 I669	F647-I671 HydrophobicContact CD2-CG2 3.75Å; F647-I671 HydrophobicContact CE2-CD1 4.28Å; F647-I671 HydrophobicContact CE2-CG2 3.95Å; N650-I671 VanDerWaalsContact CB-O 3.29Å; N650-I671 WeakPolarHBondContact CB-O 3.37Å; N650-I671 PolarHBondContact ND2-O 3.01Å; I654-I671 HydrophobicContact CD1-CG1 4.34Å; I669-I671 PolarHBondContact O-N 3.36Å
672	W	68.4	Low	54.8	Low	12 Å²	12	92.8 Å²	92.8	5%	0.045	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-24.5	-174.7	-56.2	109.8	0	0	0	114.4	T391 D634 C643 V646 F647 S670	T391-W672 HydrophobicContact CG2-CZ2 3.94Å; T391-W672 PolarHBondContact OG1-NE1 3.5Å; D634-W672 HydrophobicContact CB-CB 4.3Å; C643-W672 HydrophobicContact CB-CZ3 4.48Å; C643-W672 WeakPolarHBondContact SG-CH2 3.46Å; C643-W672 WeakPolarHBondContact SG-CZ3 3.36Å; V646-W672 HydrophobicContact CG1-CE3 4.41Å; F647-W672 HydrophobicContact CB-CH2 3.76Å; F647-W672 HydrophobicContact CB-CZ3 3.95Å; F647-W672 AromaticContact CD2-CH2 3.68Å; F647-W672 HydrophobicContact CD2-CH2 3.68Å; F647-W672 AromaticContact CD2-CZ2 3.87Å; F647-W672 HydrophobicContact CD2-CZ2 3.87Å; F647-W672 HydrophobicContact CD2-CZ3 4.41Å; F647-W672 HydrophobicContact CG-CH2 4.13Å; S670-W672 PolarHBondContact O-N 3.02Å
673	S	62.7	Low	55.6	Low	32 Å²	32	96.1 Å²	96.1	22%	0.224	48%	0.475	C	S	.	.	B	Isolated β-bridge	trans	-132.3	115.4	179.8	-175.9	0	0	0	0	111.6	D634 S670 K675	D634-S673 VanDerWaalsContact OD2-CB 3.24Å; D634-S673 WeakPolarHBondContact OD2-CB 3.46Å; S670-S673 PolarHBondContact O-N 3.38Å; S670-S673 VanDerWaalsContact O-N 3.12Å; S670-S673 VanDerWaalsContact O-O 3.13Å; S670-S673 WeakPolarHBondContact OG-CB 3.2Å; S670-S673 PolarHBondContact OG-N 3.37Å; S670-S673 PolarHBondContact OG-O 3.06Å; S673-K675 VanDerWaalsContact C-N 3.28Å; S673-K675 PolarHBondContact O-N 3.36Å
674	R	52.6	Low	56.9	Low	116 Å²	116	98.6 Å²	98.6	44%	0.438	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.7	179.8	-148	174.7	-173.8	173.8	1.2	113.2
675	K	51.6	Low	57.9	Low	107 Å²	107	94.2 Å²	94.2	47%	0.465	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	12.2	179.9	-78.2	-172.3	177.4	179.4	0	113.2	G325 D328 S673 D677	G325-K675 PolarHBondContact O-NZ 3.04Å; D328-K675 IonicContact OD1-NZ 3.96Å; D328-K675 PolarHBondContact OD1-NZ 3.32Å; D328-K675 VanDerWaalsContact OD1-NZ 3.07Å; D328-K675 WeakPolarHBondContact OD2-CD 3.34Å; D328-K675 IonicContact OD2-NZ 3.34Å; D328-K675 PolarHBondContact OD2-NZ 3.2Å; S673-K675 VanDerWaalsContact C-N 3.28Å; S673-K675 PolarHBondContact O-N 3.36Å; K675-D677 VanDerWaalsContact C-N 3.3Å; K675-D677 PolarHBondContact O-N 3.33Å
676	Y	51.1	Low	59.2	Low	47 Å²	47	90.7 Å²	90.7	18%	0.184	44%	0.436	C	S	.	.			trans	-68.9	93.5	175.3	-140.4	-77.3	0	0	0	109.5	H255 V256 I257 D634	H255-Y676 WeakPolarHBondContact O-CD1 3.42Å; H255-Y676 WeakPolarHBondContact O-CE1 3.48Å; V256-Y676 VanDerWaalsContact CA-CZ 3.5Å; V256-Y676 WeakPolarHBondContact CA-OH 3.46Å; V256-Y676 PolarHBondContact O-OH 3.39Å; I257-Y676 PolarHBondContact N-OH 3.44Å; D634-Y676 WeakPolarHBondContact OD2-CD2 3.41Å; D634-Y676 WeakPolarHBondContact OD2-CE2 3.44Å
677	D	47.1	Very low	61	Low	114 Å²	114	87.9 Å²	87.9	61%	0.61	43%	0.431	S	S	*	.			trans	-82.8	131.2	163.8	-73.5	-38.9	0	0	0	107.2	K675	K675-D677 VanDerWaalsContact C-N 3.3Å; K675-D677 PolarHBondContact O-N 3.33Å
678	L	52.4	Low	62.6	Low	53 Å²	53	84 Å²	84	28%	0.277	41%	0.408	S	S	.	.			trans	-53.4	123.7	166.3	-75.9	150.3	0	0	0	106.5	H255 R668 V680	H255-L678 HydrophobicContact CB-CD2 3.39Å; H255-L678 WeakPolarHBondContact ND1-CD2 3.4Å; R668-L678 HydrophobicContact CG-CD1 4.36Å; L678-V680 PolarHBondContact O-N 3.19Å
679	P	53.5	Low	64.2	Low	74 Å²	74	79.5 Å²	79.5	48%	0.481	39%	0.392	S	S	.	.			trans	-56.2	115.6	171.2	21.9	-28.6	0	0	0	106.6	E681	P679-E681 PolarHBondContact O-N 3.32Å
680	V	54.9	Low	65.8	Low	115 Å²	115	79.8 Å²	79.8	70%	0.697	39%	0.392	S	S	*	.			trans	-67.1	125.2	167.1	178.8	0	0	0	0	104.1	L678 D682	L678-V680 PolarHBondContact O-N 3.19Å; V680-D682 VanDerWaalsContact C-N 3.33Å; V680-D682 PolarHBondContact O-N 3.48Å
681	E	57.9	Low	67.1	Low	105 Å²	105	82.4 Å²	82.4	49%	0.491	40%	0.404	S	S	.	.			trans	-59.9	102.6	173	-70	-169.6	151.4	0	0	107.3	T248 Q249 P679 E683	T248-E681 PolarHBondContact OG1-OE1 3.29Å; Q249-E681 PolarHBondContact NE2-OE1 2.98Å; P679-E681 PolarHBondContact O-N 3.32Å; E681-E683 PolarHBondContact O-N 3.43Å
682	D	65.9	Low	68.3	Low	87 Å²	87	79.9 Å²	79.9	47%	0.465	39%	0.391	S	S	.	.			trans	-72.3	112.9	172.6	-74.3	-26	0	0	0	106.6	V680 E684 E685 T686	V680-D682 VanDerWaalsContact C-N 3.33Å; V680-D682 PolarHBondContact O-N 3.48Å; D682-E684 PolarHBondContact O-N 3.35Å; D682-E684 VanDerWaalsContact O-N 3.1Å; D682-E685 HydrophobicContact CB-CB 4.21Å; D682-E685 HydrophobicContact CB-CG 4Å; D682-E685 WeakPolarHBondContact O-CA 3.36Å; D682-E685 WeakPolarHBondContact O-CB 3.38Å; D682-E685 PolarHBondContact O-N 3.26Å; D682-T686 PolarHBondContact O-N 3.41Å
683	E	73.5	Confident	69.2	Low	160 Å²	160	79.8 Å²	79.8	75%	0.748	39%	0.391	S	S	*	.	H	α-helix	trans	-50.1	-38.1	177.7	-69.5	178.7	170.7	0	0	110.9	E681 E685 T686 E687	E681-E683 PolarHBondContact O-N 3.43Å; E683-E685 VanDerWaalsContact C-N 3.32Å; E683-E685 PolarHBondContact O-N 3.12Å; E683-T686 WeakPolarHBondContact CA-OG1 3.47Å; E683-T686 PolarHBondContact O-N 3.36Å; E683-T686 PolarHBondContact O-OG1 3Å; E683-E687 PolarHBondContact O-N 2.88Å
684	E	78.6	Confident	70.5	Confident	141 Å²	141	84.8 Å²	84.8	66%	0.659	41%	0.405	S	S	*	.	H	α-helix	trans	-62	-32	175.1	-64	-174.2	178.2	0	0	114.3	D682 R688	D682-E684 PolarHBondContact O-N 3.35Å; D682-E684 VanDerWaalsContact O-N 3.1Å; E684-R688 WeakPolarHBondContact O-CB 3.32Å; E684-R688 VanDerWaalsContact O-CG 3.25Å; E684-R688 WeakPolarHBondContact O-CG 3.37Å; E684-R688 PolarHBondContact O-N 3.38Å; E684-R688 PolarHBondContact O-NE 3.38Å
685	E	74.7	Confident	72.3	Confident	93 Å²	93	82.9 Å²	82.9	44%	0.435	40%	0.403	S	S	.	.	H	α-helix	trans	-74.1	-34.2	174	-71.7	-159.5	156.2	0	0	111	D682 E683 H689	D682-E685 HydrophobicContact CB-CB 4.21Å; D682-E685 HydrophobicContact CB-CG 4Å; D682-E685 WeakPolarHBondContact O-CA 3.36Å; D682-E685 WeakPolarHBondContact O-CB 3.38Å; D682-E685 PolarHBondContact O-N 3.26Å; E683-E685 VanDerWaalsContact C-N 3.32Å; E683-E685 PolarHBondContact O-N 3.12Å; E685-H689 WeakPolarHBondContact O-CB 3.33Å; E685-H689 PolarHBondContact O-N 3.33Å
686	T	76.7	Confident	74.1	Confident	33 Å²	33	77.8 Å²	77.8	20%	0.202	38%	0.381	C	S	.	.	H	α-helix	trans	-66.8	-45.9	177	66.6	0	0	0	0	112.1	R247 D682 E683 H689 E690	R247-T686 PolarHBondContact NH1-O 3.08Å; D682-T686 PolarHBondContact O-N 3.41Å; E683-T686 WeakPolarHBondContact CA-OG1 3.47Å; E683-T686 PolarHBondContact O-N 3.36Å; E683-T686 PolarHBondContact O-OG1 3Å; T686-H689 PolarHBondContact O-N 3.42Å; T686-E690 WeakPolarHBondContact O-CG 3.33Å; T686-E690 PolarHBondContact O-N 3Å
687	E	83	Confident	75.9	Confident	124 Å²	124	76.2 Å²	76.2	58%	0.579	38%	0.376	S	S	*	.	H	α-helix	trans	-61.6	-46.6	176.1	-69.4	-175.9	165.5	0	0	111.4	E683 H689 E690 D691	E683-E687 PolarHBondContact O-N 2.88Å; E687-H689 PolarHBondContact O-N 3.22Å; E687-E690 PolarHBondContact O-N 3.33Å; E687-E690 VanDerWaalsContact O-N 3.16Å; E687-D691 PolarHBondContact O-N 2.97Å
688	R	84.1	Confident	77.9	Confident	96 Å²	96	78.1 Å²	78.1	36%	0.362	38%	0.379	S	S	.	.	H	α-helix	trans	-60.9	-31	177.5	-80.1	-176.1	-76.5	157.6	-10.9	113.1	E684 L692	E684-R688 WeakPolarHBondContact O-CB 3.32Å; E684-R688 VanDerWaalsContact O-CG 3.25Å; E684-R688 WeakPolarHBondContact O-CG 3.37Å; E684-R688 PolarHBondContact O-N 3.38Å; E684-R688 PolarHBondContact O-NE 3.38Å; R688-L692 WeakPolarHBondContact O-CB 3.19Å; R688-L692 PolarHBondContact O-N 3.33Å
689	H	83	Confident	79.7	Confident	14 Å²	14	78 Å²	78	7%	0.065	38%	0.375	C	S	.	.	H	α-helix	trans	-75.5	-43.7	175.5	179.4	99.6	0	0	0	111.2	R243 R247 E685 T686 E687 D691 L692 I693	R243-H689 PolarHBondContact O-ND1 2.89Å; R243-H689 VanDerWaalsContact O-ND1 3.12Å; R247-H689 WeakPolarHBondContact CD-CD2 3.26Å; R247-H689 VanDerWaalsContact CD-CG 3.49Å; R247-H689 WeakPolarHBondContact CD-NE2 3.46Å; R247-H689 PolarHBondContact NH1-CD2 3Å; E685-H689 WeakPolarHBondContact O-CB 3.33Å; E685-H689 PolarHBondContact O-N 3.33Å; T686-H689 PolarHBondContact O-N 3.42Å; E687-H689 PolarHBondContact O-N 3.22Å; H689-D691 VanDerWaalsContact C-N 3.31Å; H689-D691 PolarHBondContact O-N 2.9Å; H689-L692 WeakPolarHBondContact O-CA 3.44Å; H689-L692 WeakPolarHBondContact O-CB 3.13Å; H689-L692 PolarHBondContact O-N 2.87Å; H689-L692 VanDerWaalsContact O-N 3.11Å; H689-I693 WeakPolarHBondContact NE2-CG1 3.36Å; H689-I693 WeakPolarHBondContact O-CG1 3.41Å; H689-I693 PolarHBondContact O-N 3.21Å
690	E	84.9	Confident	81.3	Confident	65 Å²	65	74.5 Å²	74.5	30%	0.304	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-41.3	176.6	-73.2	175.3	-161.6	0	0	111.7	R247 T686 E687 L692 I693 R694	R247-E690 IonicContact NH1-OE1 3.62Å; R247-E690 IonicContact NH2-OE1 3.73Å; R247-E690 PolarHBondContact NH2-OE1 2.78Å; T686-E690 WeakPolarHBondContact O-CG 3.33Å; T686-E690 PolarHBondContact O-N 3Å; E687-E690 PolarHBondContact O-N 3.33Å; E687-E690 VanDerWaalsContact O-N 3.16Å; E690-L692 VanDerWaalsContact C-N 3.34Å; E690-L692 PolarHBondContact O-N 3.03Å; E690-I693 PolarHBondContact O-N 2.88Å; E690-R694 WeakPolarHBondContact O-CG 3.35Å; E690-R694 PolarHBondContact O-N 3.48Å
691	D	88	Confident	82.8	Confident	82 Å²	82	72.5 Å²	72.5	44%	0.439	33%	0.332	S	S	.	.	H	α-helix	trans	-62.6	-40.3	173	-77.3	-17.5	0	0	0	112.2	E687 H689 R694 I695	E687-D691 PolarHBondContact O-N 2.97Å; H689-D691 VanDerWaalsContact C-N 3.31Å; H689-D691 PolarHBondContact O-N 2.9Å; D691-R694 PolarHBondContact O-N 3.39Å; D691-R694 IonicContact OD1-NH1 2.92Å; D691-R694 PolarHBondContact OD1-NH1 3.27Å; D691-I695 WeakPolarHBondContact O-CD1 3.43Å; D691-I695 VanDerWaalsContact O-CG1 3.25Å; D691-I695 WeakPolarHBondContact O-CG1 3.47Å; D691-I695 PolarHBondContact O-N 3.43Å
692	L	89.4	Confident	84	Confident	8 Å²	8	71 Å²	71	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-46.8	174	175.5	65.7	0	0	0	111.1	Q240 R243 R688 H689 E690 R694 I695 L696	Q240-L692 HydrophobicContact CB-CD1 3.79Å; Q240-L692 HydrophobicContact CB-CD2 4.25Å; Q240-L692 HydrophobicContact CG-CD1 3.71Å; Q240-L692 VanDerWaalsContact O-CD2 3.27Å; Q240-L692 WeakPolarHBondContact O-CD2 3.28Å; R243-L692 HydrophobicContact CB-CD2 3.98Å; R688-L692 WeakPolarHBondContact O-CB 3.19Å; R688-L692 PolarHBondContact O-N 3.33Å; H689-L692 WeakPolarHBondContact O-CA 3.44Å; H689-L692 WeakPolarHBondContact O-CB 3.13Å; H689-L692 PolarHBondContact O-N 2.87Å; H689-L692 VanDerWaalsContact O-N 3.11Å; E690-L692 VanDerWaalsContact C-N 3.34Å; E690-L692 PolarHBondContact O-N 3.03Å; L692-R694 PolarHBondContact O-N 3.25Å; L692-I695 PolarHBondContact O-N 3.31Å; L692-L696 HydrophobicContact CD1-CD1 4.19Å; L692-L696 HydrophobicContact CD1-CG 4.18Å; L692-L696 HydrophobicContact CG-CD1 3.99Å; L692-L696 HydrophobicContact CG-CG 4.38Å; L692-L696 VanDerWaalsContact O-CG 3.32Å; L692-L696 WeakPolarHBondContact O-CG 3.34Å; L692-L696 PolarHBondContact O-N 3.1Å
693	I	88.2	Confident	84.7	Confident	10 Å²	10	69.3 Å²	69.3	5%	0.051	32%	0.322	C	S	.	.	H	α-helix	trans	-59.6	-46.7	177.5	-68.6	-55.6	0	0	0	110.6	P192 L244 H689 E690 I695 L696 V697	P192-I693 HydrophobicContact CG-CD1 4.25Å; P192-I693 HydrophobicContact CG-CG2 3.55Å; L244-I693 HydrophobicContact CD1-CD1 3.78Å; H689-I693 WeakPolarHBondContact NE2-CG1 3.36Å; H689-I693 WeakPolarHBondContact O-CG1 3.41Å; H689-I693 PolarHBondContact O-N 3.21Å; E690-I693 PolarHBondContact O-N 2.88Å; I693-I695 VanDerWaalsContact C-N 3.29Å; I693-I695 PolarHBondContact O-N 2.72Å; I693-L696 PolarHBondContact O-N 2.83Å; I693-L696 VanDerWaalsContact O-N 3.14Å; I693-V697 HydrophobicContact CG2-CG2 4.16Å; I693-V697 WeakPolarHBondContact O-CB 3.25Å; I693-V697 VanDerWaalsContact O-CG2 3.31Å; I693-V697 WeakPolarHBondContact O-CG2 3.33Å; I693-V697 PolarHBondContact O-N 3.47Å
694	R	88.8	Confident	84.9	Confident	136 Å²	136	63.7 Å²	63.7	51%	0.513	30%	0.296	S	S	.	.	H	α-helix	trans	-57.8	-41.2	176.2	-72.3	173.5	-177.9	161	2	112.3	E690 D691 L692 K698	E690-R694 WeakPolarHBondContact O-CG 3.35Å; E690-R694 PolarHBondContact O-N 3.48Å; D691-R694 PolarHBondContact O-N 3.39Å; D691-R694 IonicContact OD1-NH1 2.92Å; D691-R694 PolarHBondContact OD1-NH1 3.27Å; L692-R694 PolarHBondContact O-N 3.25Å; R694-K698 WeakPolarHBondContact O-CB 3.5Å; R694-K698 VanDerWaalsContact O-CG 3.29Å; R694-K698 WeakPolarHBondContact O-CG 3.35Å; R694-K698 PolarHBondContact O-N 2.93Å; R694-K698 VanDerWaalsContact O-N 3.07Å
695	I	90.1	Very high	84.7	Confident	77 Å²	77	62.1 Å²	62.1	40%	0.395	29%	0.291	S	S	.	.	H	α-helix	trans	-65.2	-45.2	176.2	-68.8	164.4	0	0	0	110.8	D691 L692 I693 K698 R699	D691-I695 WeakPolarHBondContact O-CD1 3.43Å; D691-I695 VanDerWaalsContact O-CG1 3.25Å; D691-I695 WeakPolarHBondContact O-CG1 3.47Å; D691-I695 PolarHBondContact O-N 3.43Å; L692-I695 PolarHBondContact O-N 3.31Å; I693-I695 VanDerWaalsContact C-N 3.29Å; I693-I695 PolarHBondContact O-N 2.72Å; I695-K698 PolarHBondContact O-N 3.38Å; I695-R699 WeakPolarHBondContact O-CG 3.4Å; I695-R699 PolarHBondContact O-N 3.34Å
696	L	90.4	Very high	84.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.9	-43.5	179.4	-69	174	0	0	0	111.9	F231 L692 I693 K698 R699 I700	F231-L696 HydrophobicContact CD1-CB 4.33Å; F231-L696 HydrophobicContact CD1-CD1 4.36Å; L692-L696 HydrophobicContact CD1-CD1 4.19Å; L692-L696 HydrophobicContact CD1-CG 4.18Å; L692-L696 HydrophobicContact CG-CD1 3.99Å; L692-L696 HydrophobicContact CG-CG 4.38Å; L692-L696 VanDerWaalsContact O-CG 3.32Å; L692-L696 WeakPolarHBondContact O-CG 3.34Å; L692-L696 PolarHBondContact O-N 3.1Å; I693-L696 PolarHBondContact O-N 2.83Å; I693-L696 VanDerWaalsContact O-N 3.14Å; L696-K698 VanDerWaalsContact C-N 3.34Å; L696-K698 PolarHBondContact O-N 3.31Å; L696-R699 WeakPolarHBondContact O-CB 3.32Å; L696-R699 PolarHBondContact O-N 2.88Å; L696-I700 VanDerWaalsContact O-CG1 3.29Å; L696-I700 WeakPolarHBondContact O-CG1 3.43Å; L696-I700 PolarHBondContact O-N 3.37Å
697	V	89.6	Confident	84.3	Confident	13 Å²	13	64.8 Å²	64.8	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-45.9	175	169	0	0	0	0	110.4	L186 F231 I693 R699 I700 R701	L186-V697 HydrophobicContact CB-CG1 4.28Å; L186-V697 HydrophobicContact CD2-CB 4.44Å; L186-V697 HydrophobicContact CD2-CG1 4.11Å; L186-V697 HydrophobicContact CD2-CG2 4.2Å; F231-V697 HydrophobicContact CE1-CG2 4.43Å; I693-V697 HydrophobicContact CG2-CG2 4.16Å; I693-V697 WeakPolarHBondContact O-CB 3.25Å; I693-V697 VanDerWaalsContact O-CG2 3.31Å; I693-V697 WeakPolarHBondContact O-CG2 3.33Å; I693-V697 PolarHBondContact O-N 3.47Å; V697-R699 VanDerWaalsContact C-N 3.35Å; V697-R699 PolarHBondContact O-N 3.44Å; V697-I700 PolarHBondContact O-N 2.86Å; V697-R701 WeakPolarHBondContact O-CG 3.46Å; V697-R701 PolarHBondContact O-N 3.01Å
698	K	88.2	Confident	83.6	Confident	154 Å²	154	65 Å²	65	67%	0.67	31%	0.305	S	S	*	.	H	α-helix	trans	-59.7	-42.7	175.2	-75.7	175.9	-179.3	-179.9	0	112.5	R694 I695 L696 S702	R694-K698 WeakPolarHBondContact O-CB 3.5Å; R694-K698 VanDerWaalsContact O-CG 3.29Å; R694-K698 WeakPolarHBondContact O-CG 3.35Å; R694-K698 PolarHBondContact O-N 2.93Å; R694-K698 VanDerWaalsContact O-N 3.07Å; I695-K698 PolarHBondContact O-N 3.38Å; L696-K698 VanDerWaalsContact C-N 3.34Å; L696-K698 PolarHBondContact O-N 3.31Å; K698-S702 WeakPolarHBondContact O-CB 3.41Å; K698-S702 PolarHBondContact O-N 2.65Å
699	R	89.8	Confident	83	Confident	51 Å²	51	63.5 Å²	63.5	19%	0.192	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-46.8	176.9	-72.7	172	-178.1	-175.6	-3.4	111.5	Y234 E236 I695 L696 V697 S702 E703	Y234-R699 HydrophobicContact CD1-CB 4.17Å; Y234-R699 HydrophobicContact CG-CB 4.29Å; Y234-R699 PolarHBondContact O-NH1 3.49Å; E236-R699 VanDerWaalsContact CD-CZ 3.42Å; E236-R699 VanDerWaalsContact CD-NH1 3.33Å; E236-R699 IonicContact OE1-CZ 2.77Å; E236-R699 IonicContact OE1-NE 3.48Å; E236-R699 IonicContact OE1-NH1 3.76Å; E236-R699 IonicContact OE1-NH2 3.72Å; E236-R699 PolarHBondContact OE1-NH2 3.23Å; E236-R699 VanDerWaalsContact OE1-NH2 3.16Å; E236-R699 IonicContact OE2-CZ 2.9Å; E236-R699 IonicContact OE2-NH1 2.58Å; E236-R699 PolarHBondContact OE2-NH1 2.78Å; E236-R699 IonicContact OE2-NH2 4Å; E236-R699 PolarHBondContact OE2-NH2 2.93Å; I695-R699 WeakPolarHBondContact O-CG 3.4Å; I695-R699 PolarHBondContact O-N 3.34Å; L696-R699 WeakPolarHBondContact O-CB 3.32Å; L696-R699 PolarHBondContact O-N 2.88Å; V697-R699 VanDerWaalsContact C-N 3.35Å; V697-R699 PolarHBondContact O-N 3.44Å; R699-S702 PolarHBondContact O-N 2.74Å; R699-S702 PolarHBondContact O-OG 3.33Å; R699-E703 PolarHBondContact O-N 2.82Å; R699-E703 VanDerWaalsContact O-N 3.11Å
700	I	88.3	Confident	82.5	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-45.3	178.8	-65.3	163.5	0	0	0	110.9	L186 F227 K230 F231 Y234 L696 V697 S702 E703 Q704	L186-I700 HydrophobicContact CD1-CG2 4.05Å; L186-I700 HydrophobicContact CD2-CB 4.25Å; L186-I700 HydrophobicContact CD2-CD1 4.4Å; L186-I700 HydrophobicContact CD2-CG2 4.01Å; F227-I700 HydrophobicContact CE2-CG2 4.29Å; F227-I700 HydrophobicContact CZ-CG2 4.15Å; K230-I700 HydrophobicContact CB-CD1 4.39Å; K230-I700 HydrophobicContact CB-CG1 4.44Å; K230-I700 HydrophobicContact CD-CG2 4.47Å; F231-I700 HydrophobicContact CD1-CD1 4.09Å; F231-I700 HydrophobicContact CD2-CD1 4.24Å; F231-I700 HydrophobicContact CE1-CD1 4.11Å; F231-I700 HydrophobicContact CE2-CD1 4.25Å; F231-I700 HydrophobicContact CG-CD1 4.16Å; F231-I700 HydrophobicContact CZ-CD1 4.19Å; Y234-I700 HydrophobicContact CD2-CD1 4.32Å; Y234-I700 HydrophobicContact CD2-CG1 3.42Å; Y234-I700 VanDerWaalsContact CD2-CG1 3.42Å; Y234-I700 HydrophobicContact CE2-CG1 3.87Å; Y234-I700 HydrophobicContact CG-CG1 4.25Å; L696-I700 VanDerWaalsContact O-CG1 3.29Å; L696-I700 WeakPolarHBondContact O-CG1 3.43Å; L696-I700 PolarHBondContact O-N 3.37Å; V697-I700 PolarHBondContact O-N 2.86Å; I700-S702 VanDerWaalsContact C-N 3.3Å; I700-S702 PolarHBondContact O-N 3.36Å; I700-E703 WeakPolarHBondContact O-CB 3.19Å; I700-E703 PolarHBondContact O-N 3.29Å; I700-Q704 PolarHBondContact O-N 2.85Å; I700-Q704 VanDerWaalsContact O-N 3.13Å
701	R	85.3	Confident	81.7	Confident	74 Å²	74	67.4 Å²	67.4	28%	0.279	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-40.9	175.5	-72.4	-170.9	-165	-178.8	11.5	111.8	E132 L186 V697 E703 Q704 I705	E132-R701 IonicContact OE1-CZ 2.73Å; E132-R701 IonicContact OE1-NE 3.03Å; E132-R701 IonicContact OE1-NH1 2.65Å; E132-R701 PolarHBondContact OE1-NH1 2.9Å; L186-R701 HydrophobicContact CD1-CG 3.8Å; L186-R701 PolarHBondContact O-NH2 3.17Å; V697-R701 WeakPolarHBondContact O-CG 3.46Å; V697-R701 PolarHBondContact O-N 3.01Å; R701-E703 VanDerWaalsContact C-N 3.31Å; R701-E703 PolarHBondContact O-N 3.44Å; R701-Q704 PolarHBondContact O-N 3.45Å; R701-I705 WeakPolarHBondContact O-CG1 3.42Å; R701-I705 PolarHBondContact O-N 2.96Å; R701-I705 VanDerWaalsContact O-N 3.08Å
702	S	84.1	Confident	80.7	Confident	72 Å²	72	71.4 Å²	71.4	50%	0.503	35%	0.351	S	S	.	.	H	α-helix	trans	-64.1	-34.6	178.6	74.6	0	0	0	0	113.1	K698 R699 I700 Y706	K698-S702 WeakPolarHBondContact O-CB 3.41Å; K698-S702 PolarHBondContact O-N 2.65Å; R699-S702 PolarHBondContact O-N 2.74Å; R699-S702 PolarHBondContact O-OG 3.33Å; I700-S702 VanDerWaalsContact C-N 3.3Å; I700-S702 PolarHBondContact O-N 3.36Å; S702-Y706 WeakPolarHBondContact O-CB 3.34Å; S702-Y706 PolarHBondContact O-N 2.8Å
703	E	80.9	Confident	79.6	Confident	52 Å²	52	74.5 Å²	74.5	24%	0.243	37%	0.37	C	S	.	.	H	α-helix	trans	-65.2	-48.2	172.4	-177.6	-161.5	-152.8	0	0	110.8	K230 Y234 R699 I700 R701 I705 Y706 D707	K230-E703 IonicContact NZ-OE2 2.81Å; Y234-E703 WeakPolarHBondContact CE2-OE2 3.38Å; Y234-E703 WeakPolarHBondContact OH-CG 3.35Å; Y234-E703 PolarHBondContact OH-OE1 2.99Å; Y234-E703 PolarHBondContact OH-OE2 2.9Å; R699-E703 PolarHBondContact O-N 2.82Å; R699-E703 VanDerWaalsContact O-N 3.11Å; I700-E703 WeakPolarHBondContact O-CB 3.19Å; I700-E703 PolarHBondContact O-N 3.29Å; R701-E703 VanDerWaalsContact C-N 3.31Å; R701-E703 PolarHBondContact O-N 3.44Å; E703-I705 PolarHBondContact O-N 2.87Å; E703-Y706 CarbonylContact O-C 3.58Å; E703-Y706 WeakPolarHBondContact O-CA 3.47Å; E703-Y706 WeakPolarHBondContact O-CB 3.29Å; E703-Y706 PolarHBondContact O-N 3.1Å; E703-D707 PolarHBondContact O-N 3.19Å
704	Q	76	Confident	78.3	Confident	43 Å²	43	77.4 Å²	77.4	20%	0.201	38%	0.381	C	S	.	.	H	α-helix	trans	-57.2	-39.9	179.6	-72.3	172	-29.6	0	0	111.8	E182 I700 R701 D707 L708	E182-Q704 PolarHBondContact OE2-NE2 3.31Å; I700-Q704 PolarHBondContact O-N 2.85Å; I700-Q704 VanDerWaalsContact O-N 3.13Å; R701-Q704 PolarHBondContact O-N 3.45Å; Q704-D707 PolarHBondContact O-N 3.49Å; Q704-L708 WeakPolarHBondContact O-CG 3.48Å; Q704-L708 PolarHBondContact O-N 3.4Å
705	I	75.1	Confident	76.9	Confident	108 Å²	108	77.8 Å²	77.8	55%	0.554	39%	0.388	S	S	*	.	H	α-helix	trans	-66.1	-42.5	175.1	-64.2	166.2	0	0	0	110.9	R701 E703 D707 L708	R701-I705 WeakPolarHBondContact O-CG1 3.42Å; R701-I705 PolarHBondContact O-N 2.96Å; R701-I705 VanDerWaalsContact O-N 3.08Å; E703-I705 PolarHBondContact O-N 2.87Å; I705-D707 VanDerWaalsContact C-N 3.28Å; I705-D707 PolarHBondContact O-N 3.38Å; I705-L708 PolarHBondContact O-N 2.92Å
706	Y	72.3	Confident	75.3	Confident	102 Å²	102	77.5 Å²	77.5	40%	0.4	40%	0.397	S	S	.	.	H	α-helix	trans	-63.4	-35	176.2	-171.8	-101.1	0	0	0	112.2	S702 E703 L708 I709 R714	S702-Y706 WeakPolarHBondContact O-CB 3.34Å; S702-Y706 PolarHBondContact O-N 2.8Å; E703-Y706 CarbonylContact O-C 3.58Å; E703-Y706 WeakPolarHBondContact O-CA 3.47Å; E703-Y706 WeakPolarHBondContact O-CB 3.29Å; E703-Y706 PolarHBondContact O-N 3.1Å; Y706-L708 VanDerWaalsContact C-N 3.34Å; Y706-I709 HydrophobicContact CD2-CD1 4.31Å; Y706-I709 WeakPolarHBondContact O-CB 3.37Å; Y706-I709 PolarHBondContact O-N 3.35Å; Y706-R714 HydrophobicContact CE1-CG 3.73Å; Y706-R714 HydrophobicContact CE2-CG 4.25Å; Y706-R714 VanDerWaalsContact CZ-CG 3.46Å; Y706-R714 PolarHBondContact O-NH2 3.4Å; Y706-R714 WeakPolarHBondContact OH-CG 3.27Å
707	D	70.8	Confident	73.5	Confident	79 Å²	79	81.7 Å²	81.7	42%	0.422	43%	0.426	S	S	.	.	H	α-helix	trans	-72.3	-26.5	179	-84.5	-25	0	0	0	114	E703 Q704 I705 I709 R714	E703-D707 PolarHBondContact O-N 3.19Å; Q704-D707 PolarHBondContact O-N 3.49Å; I705-D707 VanDerWaalsContact C-N 3.28Å; I705-D707 PolarHBondContact O-N 3.38Å; D707-I709 PolarHBondContact O-N 2.93Å; D707-R714 PolarHBondContact O-NH2 2.95Å; D707-R714 IonicContact OD1-CZ 2.89Å; D707-R714 IonicContact OD1-NH1 3.46Å; D707-R714 PolarHBondContact OD1-NH1 3.45Å; D707-R714 VanDerWaalsContact OD1-NH1 3.14Å; D707-R714 IonicContact OD1-NH2 3.15Å; D707-R714 PolarHBondContact OD1-NH2 2.94Å
708	L	68.8	Low	71.8	Confident	130 Å²	130	83.7 Å²	83.7	68%	0.681	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.2	172	-70.9	163.4	0	0	0	113.2	Q704 I705 Y706	Q704-L708 WeakPolarHBondContact O-CG 3.48Å; Q704-L708 PolarHBondContact O-N 3.4Å; I705-L708 PolarHBondContact O-N 2.92Å; Y706-L708 VanDerWaalsContact C-N 3.34Å
709	I	70.4	Confident	69.4	Low	63 Å²	63	79.5 Å²	79.5	32%	0.323	44%	0.441	S	S	.	.	S	Bend	trans	-75.5	126.2	178.7	-58.9	173	0	0	0	109.3	Y706 D707 V713	Y706-I709 HydrophobicContact CD2-CD1 4.31Å; Y706-I709 WeakPolarHBondContact O-CB 3.37Å; Y706-I709 PolarHBondContact O-N 3.35Å; D707-I709 PolarHBondContact O-N 2.93Å; I709-V713 HydrophobicContact CG2-CB 3.74Å; I709-V713 HydrophobicContact CG2-CG1 3.84Å
710	P	73.2	Confident	66.9	Low	75 Å²	75	85.1 Å²	85.1	49%	0.487	47%	0.469	S	S	.	.			trans	-52.6	142.6	176.8	-26.2	33.6	0	0	0	112.1	E712 V713 R714	P710-E712 PolarHBondContact O-N 2.87Å; P710-E712 VanDerWaalsContact O-N 3.15Å; P710-V713 PolarHBondContact O-N 3.5Å; P710-R714 PolarHBondContact O-N 3.34Å
711	P	67.4	Low	64.3	Low	87 Å²	87	93.4 Å²	93.4	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-58.5	-33	-174.5	22.7	-33	0	0	0	112.9	V713 R714 E715	P711-V713 VanDerWaalsContact C-N 3.32Å; P711-V713 PolarHBondContact O-N 3.21Å; P711-R714 VanDerWaalsContact O-CB 3.32Å; P711-R714 WeakPolarHBondContact O-CB 3.28Å; P711-R714 PolarHBondContact O-N 3.42Å; P711-R714 VanDerWaalsContact O-N 3.15Å; P711-E715 PolarHBondContact O-N 3.16Å
712	E	68.5	Low	61.8	Low	166 Å²	166	95.3 Å²	95.3	78%	0.776	52%	0.521	S	S	*	.	H	α-helix	trans	-59.5	-39.8	176.8	-61.3	176.4	-174.4	0	0	112.6	P710 A716	P710-E712 PolarHBondContact O-N 2.87Å; P710-E712 VanDerWaalsContact O-N 3.15Å; E712-A716 PolarHBondContact O-N 3.11Å
713	V	65.9	Low	59.2	Low	73 Å²	73	101.1 Å²	101.1	44%	0.442	54%	0.54	S	S	.	.	H	α-helix	trans	-78.8	-33.8	177.2	-176.7	0	0	0	0	110.4	I709 P710 P711 E715 A716 C717	I709-V713 HydrophobicContact CG2-CB 3.74Å; I709-V713 HydrophobicContact CG2-CG1 3.84Å; P710-V713 PolarHBondContact O-N 3.5Å; P711-V713 VanDerWaalsContact C-N 3.32Å; P711-V713 PolarHBondContact O-N 3.21Å; V713-E715 PolarHBondContact O-N 3.31Å; V713-A716 PolarHBondContact O-N 3.45Å; V713-C717 PolarHBondContact O-N 3.1Å; V713-C717 PolarHBondContact O-SG 3.24Å
714	R	61.5	Low	57	Low	71 Å²	71	102.9 Å²	102.9	27%	0.268	56%	0.558	S	S	.	*	H	α-helix	trans	-60.1	-45.9	176.5	-165.7	-173.9	-63.2	-161.1	3.1	111.4	Y706 D707 P710 P711 C717 S718	Y706-R714 HydrophobicContact CE1-CG 3.73Å; Y706-R714 HydrophobicContact CE2-CG 4.25Å; Y706-R714 VanDerWaalsContact CZ-CG 3.46Å; Y706-R714 PolarHBondContact O-NH2 3.4Å; Y706-R714 WeakPolarHBondContact OH-CG 3.27Å; D707-R714 PolarHBondContact O-NH2 2.95Å; D707-R714 IonicContact OD1-CZ 2.89Å; D707-R714 IonicContact OD1-NH1 3.46Å; D707-R714 PolarHBondContact OD1-NH1 3.45Å; D707-R714 VanDerWaalsContact OD1-NH1 3.14Å; D707-R714 IonicContact OD1-NH2 3.15Å; D707-R714 PolarHBondContact OD1-NH2 2.94Å; P710-R714 PolarHBondContact O-N 3.34Å; P711-R714 VanDerWaalsContact O-CB 3.32Å; P711-R714 WeakPolarHBondContact O-CB 3.28Å; P711-R714 PolarHBondContact O-N 3.42Å; P711-R714 VanDerWaalsContact O-N 3.15Å; R714-C717 PolarHBondContact O-N 3.17Å; R714-S718 WeakPolarHBondContact O-CB 3.46Å; R714-S718 PolarHBondContact O-N 2.75Å; R714-S718 PolarHBondContact O-OG 3.21Å
715	E	58.2	Low	54.9	Low	143 Å²	143	107.5 Å²	107.5	67%	0.668	58%	0.583	S	S	*	*	H	α-helix	trans	-64.8	-43.5	177.9	-74.1	-177.8	179.4	0	0	111.4	P711 V713 C717 S718 G719	P711-E715 PolarHBondContact O-N 3.16Å; V713-E715 PolarHBondContact O-N 3.31Å; E715-C717 PolarHBondContact O-N 3.06Å; E715-S718 WeakPolarHBondContact CA-OG 3.24Å; E715-S718 PolarHBondContact O-N 3.47Å; E715-S718 PolarHBondContact O-OG 3.4Å; E715-G719 PolarHBondContact O-N 2.97Å
716	A	57.4	Low	52.7	Low	71 Å²	71	113 Å²	113	59%	0.587	60%	0.598	S	S	*	*	H	α-helix	trans	-60.6	-41.3	175.1	0	0	0	0	0	113.1	E712 V713	E712-A716 PolarHBondContact O-N 3.11Å; V713-A716 PolarHBondContact O-N 3.45Å
717	C	52.4	Low	50.5	Low	89 Å²	89	112.7 Å²	112.7	60%	0.601	61%	0.61	S	S	*	*	H	α-helix	trans	-77.4	-25.4	176.3	-68.5	0	0	0	0	113.4	V713 R714 E715	V713-C717 PolarHBondContact O-N 3.1Å; V713-C717 PolarHBondContact O-SG 3.24Å; R714-C717 PolarHBondContact O-N 3.17Å; E715-C717 PolarHBondContact O-N 3.06Å
718	S	53.7	Low	48.5	Very low	54 Å²	54	113.6 Å²	113.6	38%	0.378	62%	0.62	S	S	.	*	H	α-helix	trans	-81	-21.9	178	73.3	0	0	0	0	113.3	R714 E715 K721	R714-S718 WeakPolarHBondContact O-CB 3.46Å; R714-S718 PolarHBondContact O-N 2.75Å; R714-S718 PolarHBondContact O-OG 3.21Å; E715-S718 WeakPolarHBondContact CA-OG 3.24Å; E715-S718 PolarHBondContact O-N 3.47Å; E715-S718 PolarHBondContact O-OG 3.4Å; S718-K721 PolarHBondContact O-N 3.11Å
719	G	37.7	Very low	46.7	Very low	66 Å²	66	116.8 Å²	116.8	68%	0.68	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-12.5	179.3	0	0	0	0	0	115.7	E715	E715-G719 PolarHBondContact O-N 2.97Å
720	E	37.8	Very low	44.7	Very low	170 Å²	170	121.4 Å²	121.4	79%	0.794	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	32.7	171	-77	-172.1	156.9	0	0	112	N722	E720-N722 PolarHBondContact O-N 3.46Å
721	K	32.6	Very low	42.6	Very low	174 Å²	174	126.3 Å²	126.3	76%	0.757	67%	0.668	S	S	*	*			trans	-64.5	91.1	165.6	-103.2	-176.3	177.9	176.3	0	109.1	S718 E723	S718-K721 PolarHBondContact O-N 3.11Å; K721-E723 PolarHBondContact O-N 3.45Å
722	N	32.2	Very low	40.8	Very low	114 Å²	114	129.7 Å²	129.7	61%	0.61	68%	0.682	S	S	*	*			trans	-37.3	103.4	161	-85.9	-34.3	0	0	0	110.4	E720 S724 L725	E720-N722 PolarHBondContact O-N 3.46Å; N722-S724 WeakPolarHBondContact CB-OG 3.32Å; N722-S724 PolarHBondContact O-N 2.84Å; N722-L725 PolarHBondContact O-N 3Å
723	E	29.6	Very low	39	Very low	193 Å²	193	127.2 Å²	127.2	90%	0.902	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	10.3	165.3	-68.6	-176.5	142.7	0	0	112.7	K721	K721-E723 PolarHBondContact O-N 3.45Å
724	S	35.1	Very low	37.2	Very low	90 Å²	90	132.8 Å²	132.8	63%	0.629	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-5.2	-177.2	59.2	0	0	0	0	115.2	N722	N722-S724 WeakPolarHBondContact CB-OG 3.32Å; N722-S724 PolarHBondContact O-N 2.84Å
725	L	32.3	Very low	35.8	Very low	139 Å²	139	132.2 Å²	132.2	73%	0.728	73%	0.725	S	S	*	*	S	Bend	trans	-106.2	-5.8	176.5	-98.5	131.2	0	0	0	114.8	N722	N722-L725 PolarHBondContact O-N 3Å
726	W	29.6	Very low	34.5	Very low	225 Å²	225	133.7 Å²	133.7	85%	0.852	74%	0.736	S	S	*	*			trans	-125.1	71.8	168.8	-65.5	80.9	0	0	0	108.1	P728	W726-P728 VanDerWaalsContact O-CD 3.32Å; W726-P728 WeakPolarHBondContact O-CD 3.29Å
727	S	26	Very low	33.1	Very low	95 Å²	95	141.6 Å²	141.6	66%	0.664	75%	0.751	S	S	*	*			trans	-66.2	122.4	163	53.7	0	0	0	0	107.5	Q729	S727-Q729 PolarHBondContact O-N 3.04Å
728	P	28.7	Very low	32	Very low	98 Å²	98	147 Å²	147	64%	0.636	77%	0.765	S	S	*	*			trans	-64.3	121.2	160.4	26	-24.2	0	0	0	104.9	W726 Q730	W726-P728 VanDerWaalsContact O-CD 3.32Å; W726-P728 WeakPolarHBondContact O-CD 3.29Å; P728-Q730 PolarHBondContact O-N 2.92Å
729	Q	31	Very low	31	Very low	196 Å²	196	149 Å²	149	92%	0.916	78%	0.784	S	S	*	*			trans	-61	79.6	161.8	-79.2	-177.2	-33.4	0	0	108	S727	S727-Q729 PolarHBondContact O-N 3.04Å
730	Q	28.5	Very low	30.7	Very low	161 Å²	161	149.8 Å²	149.8	75%	0.752	78%	0.784	S	S	*	*			trans	-95.9	84.6	158.8	-85.1	-177.1	-33.1	0	0	106.2	P728	P728-Q730 PolarHBondContact O-N 2.92Å
731	Q	29.5	Very low	30.3	Very low	177 Å²	177	151.6 Å²	151.6	83%	0.827	79%	0.79	S	S	*	*			trans	-146.2	124.6	154	-111	160.9	-8.9	0	0	108
732	D	28.3	Very low	30.2	Very low	158 Å²	158	150.8 Å²	150.8	85%	0.845	79%	0.793	S	S	*	*	S	Bend	trans	83.4	67.2	162.7	-52.5	-17.9	0	0	0	119.6
733	S	30.7	Very low	29.9	Very low	114 Å²	114	158.1 Å²	158.1	80%	0.797	82%	0.819	S	S	*	*				-154.7	96.2	126.3	69.2	0	0	0	0	111	G735	S733-G735 PolarHBondContact O-N 3.24Å
734	L	28.1	Very low	29.9	Very low	191 Å²	191	156.4 Å²	156.4	100%	1	82%	0.815	S	S	*	*			trans	-61.9	95.2	168.3	-163.5	109.4	0	0	0	109.3
735	G	33	Very low	29.7	Very low	58 Å²	58	159.8 Å²	159.8	60%	0.598	83%	0.825	S	S	*	*			trans	144.2	81.7	164.6	0	0	0	0	0	115.4	S733	S733-G735 PolarHBondContact O-N 3.24Å
736	L	31.5	Very low	29.5	Very low	174 Å²	174	161 Å²	161	91%	0.911	83%	0.83	S	S	*	*			trans	-178.3	38.2	147.1	-99.1	145	0	0	0	112.2	K738	L736-K738 PolarHBondContact O-N 3.05Å
737	R	26.8	Very low	29.5	Very low	237 Å²	237	157.2 Å²	157.2	89%	0.894	83%	0.829	S	S	*	*			trans	-87.4	86.7	159.1	-88.2	-175.6	169.8	175.6	-2	108.3
738	K	29.2	Very low	29.7	Very low	204 Å²	204	161.1 Å²	161.1	89%	0.887	84%	0.839	S	S	*	*			trans	177.6	83	159.2	-102.3	169.6	-174.9	-175.5	0	110.4	L736	L736-K738 PolarHBondContact O-N 3.05Å
739	A	33.7	Very low	29.8	Very low	94 Å²	94	165.3 Å²	165.3	78%	0.777	85%	0.853	S	S	*	*			trans	175.8	91.7	151.1	0	0	0	0	0	106.8
740	A	31.5	Very low	29.7	Very low	83 Å²	83	163.1 Å²	163.1	69%	0.686	85%	0.848	S	S	*	*				86.6	99.8	104.1	0	0	0	0	0	109.7
741	F	28.4	Very low	29.8	Very low	209 Å²	209	163.3 Å²	163.3	92%	0.917	86%	0.856	S	S	*	*				36.2	102.9	54.9	-107.4	-79.9	0	0	0	109.5
742	L	30.4	Very low	29.9	Very low	157 Å²	157	162.2 Å²	162.2	82%	0.822	86%	0.858	S	S	*	*			trans	127	120	176	-71.7	163.6	0	0	0	109.1
743	K	26.6	Very low	30	Very low	267 Å²	267	162.5 Å²	162.5	100%	1.161	86%	0.859	S	S	*	*				56.9	0	50.9	-136.9	-172.8	-167.5	-174.5	0	113.4

Retrieved 743 of 743 residues in 365.7 ms (Link to these results)

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