A0A077YXU6_TRITR Loading...

Integrator complex subunit 10

AlphaFold DB , UniProt , Accession A0A077YXU6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 634 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.7	Very low	50.8	Low	237 Å²	237	133.7 Å²	133.7	100%	1.167	67%	0.67	S	S	*	*				0	72	0	-76.1	-159.6	-154.9	0	0	106.6	S3	M1-S3 PolarHBondContact O-N 3.43Å
2	D	38.8	Very low	52.7	Low	158 Å²	158	125.2 Å²	125.2	85%	0.845	63%	0.626	S	S	*	*			trans	-92.6	109.5	-170.9	-66.7	-31.2	0	0	0	111.1	Q4	D2-Q4 PolarHBondContact O-N 3.22Å
3	S	40.5	Very low	54.4	Low	108 Å²	108	129.3 Å²	129.3	76%	0.755	63%	0.63	S	S	*	*	S	Bend	trans	-4.3	95.3	147.6	51	0	0	0	0	116.8	M1	M1-S3 PolarHBondContact O-N 3.43Å
4	Q	44.8	Very low	56.3	Low	178 Å²	178	128.6 Å²	128.6	83%	0.832	62%	0.617	S	S	*	*				-176.9	92	128.4	-98.2	168.3	20	0	0	107	D2 P6	D2-Q4 PolarHBondContact O-N 3.22Å; Q4-P6 WeakPolarHBondContact O-CD 3.36Å
5	R	47.7	Very low	57.7	Low	240 Å²	240	121.2 Å²	121.2	91%	0.906	58%	0.582	S	S	*	*			trans	-81.2	113	161.9	-90.4	-174.8	-178	173.2	0.7	106.4
6	P	45.3	Very low	59	Low	43 Å²	43	115.4 Å²	115.4	28%	0.279	55%	0.554	S	S	.	*			trans	-84.1	166.5	-176	41	-38.5	0	0	0	109.5	Q4 D10 L11 W14	Q4-P6 WeakPolarHBondContact O-CD 3.36Å; P6-D10 HydrophobicContact CB-CB 3.37Å; P6-D10 HydrophobicContact CG-CB 3.6Å; P6-L11 HydrophobicContact CG-CD1 4.49Å; P6-W14 HydrophobicContact CG-CB 4.27Å
7	A	51.5	Low	60.3	Low	69 Å²	69	114.4 Å²	114.4	57%	0.57	55%	0.549	S	S	*	.			trans	-59.5	163.2	-174.3	0	0	0	0	0	111.8	R9 D10 L11	A7-R9 PolarHBondContact O-N 3.43Å; A7-D10 WeakPolarHBondContact O-CA 3.32Å; A7-D10 WeakPolarHBondContact O-CB 3.46Å; A7-D10 PolarHBondContact O-N 3.35Å; A7-L11 PolarHBondContact O-N 3.31Å
8	N	54.9	Low	61.4	Low	118 Å²	118	113.8 Å²	113.8	63%	0.631	54%	0.543	S	S	*	.	H	α-helix	trans	-52	-31.7	-163.9	-139	-0.3	0	0	0	115.8	Y39	N8-Y39 PolarHBondContact O-OH 3.41Å; N8-Y39 PolarHBondContact OD1-OH 2.97Å
9	R	56.5	Low	62.3	Low	208 Å²	208	107.8 Å²	107.8	79%	0.785	52%	0.515	S	S	*	.	H	α-helix	trans	-81.9	-27.5	173.7	-80.2	-169.3	173.6	-171.2	-2.2	114.5	A7 L11 R13	A7-R9 PolarHBondContact O-N 3.43Å; R9-L11 VanDerWaalsContact C-N 3.31Å; R9-R13 PolarHBondContact O-N 3.45Å
10	D	68.3	Low	63.2	Low	79 Å²	79	110.1 Å²	110.1	42%	0.422	52%	0.518	S	S	.	.	H	α-helix	trans	-75.9	-26.9	174.3	-63.7	-35.8	0	0	0	111	P6 A7 R13 W14	P6-D10 HydrophobicContact CB-CB 3.37Å; P6-D10 HydrophobicContact CG-CB 3.6Å; A7-D10 WeakPolarHBondContact O-CA 3.32Å; A7-D10 WeakPolarHBondContact O-CB 3.46Å; A7-D10 PolarHBondContact O-N 3.35Å; D10-R13 PolarHBondContact O-N 3.42Å; D10-W14 WeakPolarHBondContact O-CB 3.09Å; D10-W14 PolarHBondContact O-N 3.45Å
11	L	74.8	Confident	64.1	Low	33 Å²	33	110.6 Å²	110.6	17%	0.173	52%	0.523	C	S	.	.	H	α-helix	trans	-67.5	-42.1	177.1	-164	73.9	0	0	0	111.3	P6 A7 R9 W14 M15	P6-L11 HydrophobicContact CG-CD1 4.49Å; A7-L11 PolarHBondContact O-N 3.31Å; R9-L11 VanDerWaalsContact C-N 3.31Å; L11-W14 HydrophobicContact CD1-CE3 4.35Å; L11-W14 PolarHBondContact O-N 3.45Å; L11-M15 HydrophobicContact CD1-CE 4.28Å; L11-M15 HydrophobicContact CD2-CE 3.61Å; L11-M15 HydrophobicContact CG-CE 3.64Å; L11-M15 WeakPolarHBondContact O-CB 3.33Å; L11-M15 VanDerWaalsContact O-CG 3.3Å; L11-M15 WeakPolarHBondContact O-CG 3.43Å; L11-M15 PolarHBondContact O-N 3.47Å
12	E	73.8	Confident	66.1	Low	31 Å²	31	100.2 Å²	100.2	15%	0.145	48%	0.475	C	S	.	.	H	α-helix	trans	-54.7	-54.4	171.7	174.6	172.5	-152.5	0	0	111	W14 M15 L16 Y39 T41 I44	E12-W14 PolarHBondContact O-N 2.93Å; E12-M15 PolarHBondContact O-N 3.46Å; E12-L16 WeakPolarHBondContact O-CG 3.32Å; E12-L16 PolarHBondContact O-N 3.16Å; E12-L16 VanDerWaalsContact O-N 3.07Å; E12-Y39 HydrophobicContact CB-CD2 4.11Å; E12-Y39 HydrophobicContact CB-CE2 4.2Å; E12-Y39 HydrophobicContact CB-CG 4.44Å; E12-T41 PolarHBondContact OE1-OG1 3.07Å; E12-I44 HydrophobicContact CG-CD1 3.96Å; E12-I44 HydrophobicContact CG-CG1 4.33Å
13	R	74.9	Confident	67.9	Low	179 Å²	179	102.5 Å²	102.5	68%	0.675	48%	0.477	S	S	*	.	H	α-helix	trans	-61.9	-41.4	178.3	-73.4	-177.6	174.3	-179.2	-2.7	112.8	R9 D10 L16 E17	R9-R13 PolarHBondContact O-N 3.45Å; D10-R13 PolarHBondContact O-N 3.42Å; R13-L16 PolarHBondContact O-N 2.95Å; R13-E17 WeakPolarHBondContact O-CB 3.4Å; R13-E17 PolarHBondContact O-N 3.18Å
14	W	80.8	Confident	69.9	Low	120 Å²	120	101 Å²	101	46%	0.455	46%	0.461	S	S	.	.	H	α-helix	trans	-64.3	-41.7	178.9	179.8	87.5	0	0	0	111.5	P6 D10 L11 E12 E17 K18	P6-W14 HydrophobicContact CG-CB 4.27Å; D10-W14 WeakPolarHBondContact O-CB 3.09Å; D10-W14 PolarHBondContact O-N 3.45Å; L11-W14 HydrophobicContact CD1-CE3 4.35Å; L11-W14 PolarHBondContact O-N 3.45Å; E12-W14 PolarHBondContact O-N 2.93Å; W14-E17 PolarHBondContact O-N 3.26Å; W14-K18 HydrophobicContact CH2-CD 3.73Å; W14-K18 HydrophobicContact CZ2-CD 3.96Å; W14-K18 HydrophobicContact CZ3-CD 4.17Å; W14-K18 WeakPolarHBondContact O-CB 3.49Å; W14-K18 PolarHBondContact O-N 3.24Å
15	M	77.3	Confident	71.5	Confident	17 Å²	17	94.5 Å²	94.5	8%	0.084	43%	0.431	C	S	.	.	H	α-helix	trans	-64.5	-41.4	176.1	-71.7	-160.9	-154.1	0	0	111.8	L11 E12 K18 A19 T34 A35 L38	L11-M15 HydrophobicContact CD1-CE 4.28Å; L11-M15 HydrophobicContact CD2-CE 3.61Å; L11-M15 HydrophobicContact CG-CE 3.64Å; L11-M15 WeakPolarHBondContact O-CB 3.33Å; L11-M15 VanDerWaalsContact O-CG 3.3Å; L11-M15 WeakPolarHBondContact O-CG 3.43Å; L11-M15 PolarHBondContact O-N 3.47Å; E12-M15 PolarHBondContact O-N 3.46Å; M15-K18 PolarHBondContact O-N 3.18Å; M15-A19 WeakPolarHBondContact O-CB 3.44Å; M15-A19 PolarHBondContact O-N 3.35Å; M15-T34 HydrophobicContact SD-CG2 4.38Å; M15-A35 HydrophobicContact CB-CB 4.31Å; M15-A35 HydrophobicContact SD-CB 4.3Å; M15-L38 HydrophobicContact CE-CD1 3.4Å; M15-L38 VanDerWaalsContact CE-CD1 3.4Å; M15-L38 HydrophobicContact SD-CD1 4.18Å
16	L	79.2	Confident	73.3	Confident	28 Å²	28	91.1 Å²	91.1	15%	0.147	42%	0.42	C	S	.	.	H	α-helix	trans	-64.8	-44.1	176.4	-71.9	-179	0	0	0	112.4	E12 R13 K18 A19 R20 L32 I44 A47	E12-L16 WeakPolarHBondContact O-CG 3.32Å; E12-L16 PolarHBondContact O-N 3.16Å; E12-L16 VanDerWaalsContact O-N 3.07Å; R13-L16 PolarHBondContact O-N 2.95Å; L16-K18 VanDerWaalsContact C-N 3.31Å; L16-K18 PolarHBondContact O-N 3.43Å; L16-A19 PolarHBondContact O-N 3.35Å; L16-R20 WeakPolarHBondContact O-CB 3.48Å; L16-R20 PolarHBondContact O-N 3.06Å; L16-L32 HydrophobicContact CD2-CD2 4.23Å; L16-I44 HydrophobicContact CD1-CG1 4.12Å; L16-I44 HydrophobicContact CD2-CG1 4.04Å; L16-I44 HydrophobicContact CG-CG1 4.28Å; L16-A47 HydrophobicContact CD1-CB 4.15Å; L16-A47 HydrophobicContact CD2-CB 3.47Å; L16-A47 VanDerWaalsContact CD2-CB 3.47Å; L16-A47 HydrophobicContact CG-CB 4.37Å
17	E	80.3	Confident	75.1	Confident	99 Å²	99	93.7 Å²	93.7	46%	0.463	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-41.6	177.4	-170	58.7	-157.7	0	0	111	R13 W14 A19 R20 I21	R13-E17 WeakPolarHBondContact O-CB 3.4Å; R13-E17 PolarHBondContact O-N 3.18Å; W14-E17 PolarHBondContact O-N 3.26Å; E17-A19 VanDerWaalsContact C-N 3.34Å; E17-A19 PolarHBondContact O-N 2.78Å; E17-R20 PolarHBondContact O-N 3.49Å; E17-I21 HydrophobicContact CG-CD1 3.94Å; E17-I21 VanDerWaalsContact O-CG1 3.32Å; E17-I21 WeakPolarHBondContact O-CG1 3.44Å; E17-I21 PolarHBondContact O-N 3.3Å; E17-I21 VanDerWaalsContact O-N 3.07Å
18	K	80.5	Confident	76.6	Confident	103 Å²	103	90.4 Å²	90.4	45%	0.448	40%	0.404	S	S	.	.	H	α-helix	trans	-65.3	-37.8	176.8	-151	-168.2	-175.9	-162	0	112.4	W14 M15 L16 R20 A22 M31	W14-K18 HydrophobicContact CH2-CD 3.73Å; W14-K18 HydrophobicContact CZ2-CD 3.96Å; W14-K18 HydrophobicContact CZ3-CD 4.17Å; W14-K18 WeakPolarHBondContact O-CB 3.49Å; W14-K18 PolarHBondContact O-N 3.24Å; M15-K18 PolarHBondContact O-N 3.18Å; L16-K18 VanDerWaalsContact C-N 3.31Å; L16-K18 PolarHBondContact O-N 3.43Å; K18-R20 VanDerWaalsContact C-N 3.32Å; K18-A22 PolarHBondContact O-N 2.94Å; K18-M31 HydrophobicContact CD-SD 3.99Å
19	A	78.9	Confident	77.9	Confident	1 Å²	1	88.1 Å²	88.1	1%	0.008	39%	0.39	C	S	.	.	H	α-helix	trans	-67.2	-33.7	174.6	0	0	0	0	0	112	M15 L16 E17 A22 A28 M31 L32 I51	M15-A19 WeakPolarHBondContact O-CB 3.44Å; M15-A19 PolarHBondContact O-N 3.35Å; L16-A19 PolarHBondContact O-N 3.35Å; E17-A19 VanDerWaalsContact C-N 3.34Å; E17-A19 PolarHBondContact O-N 2.78Å; A19-A22 WeakPolarHBondContact O-CB 3.41Å; A19-A28 WeakPolarHBondContact O-CB 3.38Å; A19-M31 HydrophobicContact CB-CB 3.91Å; A19-L32 HydrophobicContact CB-CG 4.21Å; A19-I51 HydrophobicContact CB-CD1 3.65Å
20	R	79.6	Confident	79.2	Confident	153 Å²	153	80.6 Å²	80.6	58%	0.577	37%	0.372	S	S	*	.	H	α-helix	trans	-73.4	-32.3	179.1	-166.4	178.4	179.3	-178.7	-1.2	113.7	L16 E17 K18 A22 M54	L16-R20 WeakPolarHBondContact O-CB 3.48Å; L16-R20 PolarHBondContact O-N 3.06Å; E17-R20 PolarHBondContact O-N 3.49Å; K18-R20 VanDerWaalsContact C-N 3.32Å; R20-A22 VanDerWaalsContact C-N 3.33Å; R20-M54 HydrophobicContact CG-SD 4.26Å
21	I	82.6	Confident	80	Confident	120 Å²	120	79.3 Å²	79.3	62%	0.615	36%	0.364	S	S	*	.	H	α-helix	trans	-82	-15.4	178.7	-61.5	164.1	0	0	0	111.7	E17 K23	E17-I21 HydrophobicContact CG-CD1 3.94Å; E17-I21 VanDerWaalsContact O-CG1 3.32Å; E17-I21 WeakPolarHBondContact O-CG1 3.44Å; E17-I21 PolarHBondContact O-N 3.3Å; E17-I21 VanDerWaalsContact O-N 3.07Å; I21-K23 PolarHBondContact O-N 3.22Å
22	A	77.9	Confident	80.4	Confident	19 Å²	19	78 Å²	78	16%	0.157	36%	0.357	C	S	.	.			trans	-60.3	127.4	-178.1	0	0	0	0	0	111.5	K18 A19 R20 D27 A28 H55	K18-A22 PolarHBondContact O-N 2.94Å; A19-A22 WeakPolarHBondContact O-CB 3.41Å; R20-A22 VanDerWaalsContact C-N 3.33Å; A22-D27 HydrophobicContact CB-CB 4.13Å; A22-A28 HydrophobicContact CB-CB 3.97Å; A22-H55 PolarHBondContact O-CE1 3.12Å
23	K	76.5	Confident	81	Confident	206 Å²	206	82.8 Å²	82.8	90%	0.896	38%	0.383	S	S	*	.	S	Bend	trans	-73.4	-29.8	178.5	-77.5	-175.8	176.2	-179.2	0	112.8	I21	I21-K23 PolarHBondContact O-N 3.22Å
24	N	81.5	Confident	81.4	Confident	76 Å²	76	77.1 Å²	77.1	41%	0.406	37%	0.369	S	S	.	.	S	Bend	trans	-108.3	137.3	-175.7	-167.3	-7	0	0	0	110.5	Y26 D27 A28	N24-Y26 PolarHBondContact O-N 2.76Å; N24-Y26 WeakPolarHBondContact OD1-CD2 3.41Å; N24-Y26 PolarHBondContact OD1-N 3.02Å; N24-D27 PolarHBondContact O-N 2.93Å; N24-A28 PolarHBondContact O-N 3.35Å
25	I	78.5	Confident	81.6	Confident	42 Å²	42	71.4 Å²	71.4	22%	0.215	35%	0.347	C	S	.	.	H	α-helix	trans	-56.4	-40.6	178.7	-69.4	170	0	0	0	111.1	D27 A28 E29 H55 N57	I25-D27 VanDerWaalsContact C-N 3.34Å; I25-D27 PolarHBondContact O-N 2.9Å; I25-A28 WeakPolarHBondContact O-CB 3.3Å; I25-A28 PolarHBondContact O-N 3.36Å; I25-E29 HydrophobicContact CG2-CG 4.14Å; I25-E29 WeakPolarHBondContact O-CB 3.37Å; I25-E29 WeakPolarHBondContact O-CG 3.39Å; I25-E29 PolarHBondContact O-N 2.79Å; I25-H55 HydrophobicContact CD1-CB 3.6Å; I25-H55 HydrophobicContact CG1-CB 3.4Å; I25-H55 VanDerWaalsContact CG1-CG 3.42Å; I25-N57 HydrophobicContact CD1-CB 4.3Å
26	Y	85.5	Confident	81.9	Confident	169 Å²	169	72.4 Å²	72.4	66%	0.663	35%	0.351	S	S	*	.	H	α-helix	trans	-66.9	-35.3	-177.2	-58.4	-67.1	0	0	0	112.9	N24 E29 A30	N24-Y26 PolarHBondContact O-N 2.76Å; N24-Y26 WeakPolarHBondContact OD1-CD2 3.41Å; N24-Y26 PolarHBondContact OD1-N 3.02Å; Y26-E29 PolarHBondContact O-N 3.43Å; Y26-A30 WeakPolarHBondContact O-CB 3.47Å; Y26-A30 PolarHBondContact O-N 3.48Å
27	D	83.1	Confident	82.1	Confident	97 Å²	97	75.1 Å²	75.1	52%	0.519	38%	0.377	S	S	.	.	H	α-helix	trans	-69.4	-40.5	175.5	-68.3	-29.3	0	0	0	110.5	A22 N24 I25 M31	A22-D27 HydrophobicContact CB-CB 4.13Å; N24-D27 PolarHBondContact O-N 2.93Å; I25-D27 VanDerWaalsContact C-N 3.34Å; I25-D27 PolarHBondContact O-N 2.9Å; D27-M31 WeakPolarHBondContact O-CG 3.4Å; D27-M31 PolarHBondContact O-N 3.5Å; D27-M31 VanDerWaalsContact O-N 3.16Å
28	A	82.9	Confident	82.1	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.008	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-44.5	174.7	0	0	0	0	0	111.4	A19 A22 N24 I25 M31 L32 I51	A19-A28 WeakPolarHBondContact O-CB 3.38Å; A22-A28 HydrophobicContact CB-CB 3.97Å; N24-A28 PolarHBondContact O-N 3.35Å; I25-A28 WeakPolarHBondContact O-CB 3.3Å; I25-A28 PolarHBondContact O-N 3.36Å; A28-M31 PolarHBondContact O-N 2.88Å; A28-L32 WeakPolarHBondContact O-CB 3.34Å; A28-L32 VanDerWaalsContact O-CG 3.27Å; A28-L32 WeakPolarHBondContact O-CG 3.31Å; A28-L32 PolarHBondContact O-N 3.31Å; A28-I51 HydrophobicContact CB-CG2 3.84Å
29	E	82.6	Confident	82.1	Confident	70 Å²	70	71.8 Å²	71.8	33%	0.327	37%	0.365	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176.7	-81.5	-176.7	177.1	0	0	112.1	I25 Y26 M31 L32 L33 H52	I25-E29 HydrophobicContact CG2-CG 4.14Å; I25-E29 WeakPolarHBondContact O-CB 3.37Å; I25-E29 WeakPolarHBondContact O-CG 3.39Å; I25-E29 PolarHBondContact O-N 2.79Å; Y26-E29 PolarHBondContact O-N 3.43Å; E29-M31 VanDerWaalsContact C-N 3.34Å; E29-M31 PolarHBondContact O-N 2.95Å; E29-L32 PolarHBondContact O-N 2.96Å; E29-L33 VanDerWaalsContact O-CB 3.31Å; E29-L33 WeakPolarHBondContact O-CB 3.49Å; E29-L33 PolarHBondContact O-N 3.2Å; E29-H52 IonicContact OE1-CE1 3.37Å; E29-H52 PolarHBondContact OE1-CE1 3.36Å
30	A	84.6	Confident	82.2	Confident	50 Å²	50	75.8 Å²	75.8	41%	0.413	39%	0.39	S	S	.	.	H	α-helix	trans	-62.3	-42.1	177	0	0	0	0	0	111.9	Y26 T34	Y26-A30 WeakPolarHBondContact O-CB 3.47Å; Y26-A30 PolarHBondContact O-N 3.48Å; A30-T34 PolarHBondContact O-N 2.85Å; A30-T34 VanDerWaalsContact O-N 3.17Å; A30-T34 PolarHBondContact O-OG1 3.31Å
31	M	84.6	Confident	82.4	Confident	52 Å²	52	70.7 Å²	70.7	26%	0.256	38%	0.376	S	S	.	.	H	α-helix	trans	-65.8	-43.2	174.4	-68	-65.8	94.7	0	0	111.6	K18 A19 D27 A28 E29 T34 A35	K18-M31 HydrophobicContact CD-SD 3.99Å; A19-M31 HydrophobicContact CB-CB 3.91Å; D27-M31 WeakPolarHBondContact O-CG 3.4Å; D27-M31 PolarHBondContact O-N 3.5Å; D27-M31 VanDerWaalsContact O-N 3.16Å; A28-M31 PolarHBondContact O-N 2.88Å; E29-M31 VanDerWaalsContact C-N 3.34Å; E29-M31 PolarHBondContact O-N 2.95Å; M31-T34 PolarHBondContact O-N 3.26Å; M31-A35 WeakPolarHBondContact O-CB 3.46Å; M31-A35 PolarHBondContact O-N 3.07Å
32	L	83.9	Confident	82.4	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.026	35%	0.353	C	S	.	.	H	α-helix	trans	-63.9	-40.6	176.4	-77.1	168.7	0	0	0	112.3	L16 A19 A28 E29 T34 A35 K36 A48 I51	L16-L32 HydrophobicContact CD2-CD2 4.23Å; A19-L32 HydrophobicContact CB-CG 4.21Å; A28-L32 WeakPolarHBondContact O-CB 3.34Å; A28-L32 VanDerWaalsContact O-CG 3.27Å; A28-L32 WeakPolarHBondContact O-CG 3.31Å; A28-L32 PolarHBondContact O-N 3.31Å; E29-L32 PolarHBondContact O-N 2.96Å; L32-T34 VanDerWaalsContact C-N 3.28Å; L32-T34 PolarHBondContact O-N 3.49Å; L32-A35 PolarHBondContact O-N 3.16Å; L32-K36 WeakPolarHBondContact O-CB 3.27Å; L32-K36 VanDerWaalsContact O-CG 3.23Å; L32-K36 WeakPolarHBondContact O-CG 3.44Å; L32-K36 PolarHBondContact O-N 3.49Å; L32-A48 HydrophobicContact CD1-CB 3.89Å; L32-A48 HydrophobicContact CD2-CB 3.84Å; L32-A48 HydrophobicContact CG-CB 4.38Å; L32-I51 HydrophobicContact CD1-CB 4.28Å; L32-I51 HydrophobicContact CD1-CD1 4.03Å; L32-I51 HydrophobicContact CD1-CG2 4.15Å; L32-I51 HydrophobicContact CD2-CD1 4.07Å; L32-I51 HydrophobicContact CG-CD1 4.25Å
33	L	84.9	Confident	82.6	Confident	131 Å²	131	71.5 Å²	71.5	69%	0.686	37%	0.374	S	S	*	.	H	α-helix	trans	-60.7	-42.8	177.4	-155.4	96.3	0	0	0	110.4	E29 A37	E29-L33 VanDerWaalsContact O-CB 3.31Å; E29-L33 WeakPolarHBondContact O-CB 3.49Å; E29-L33 PolarHBondContact O-N 3.2Å; L33-A37 WeakPolarHBondContact O-CB 3.35Å; L33-A37 PolarHBondContact O-N 2.85Å; L33-A37 VanDerWaalsContact O-N 3.09Å
34	T	84.3	Confident	82.9	Confident	61 Å²	61	61.8 Å²	61.8	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-66.2	-44.5	176.8	-45.3	0	0	0	0	111	M15 A30 M31 L32 A37 L38	M15-T34 HydrophobicContact SD-CG2 4.38Å; A30-T34 PolarHBondContact O-N 2.85Å; A30-T34 VanDerWaalsContact O-N 3.17Å; A30-T34 PolarHBondContact O-OG1 3.31Å; M31-T34 PolarHBondContact O-N 3.26Å; L32-T34 VanDerWaalsContact C-N 3.28Å; L32-T34 PolarHBondContact O-N 3.49Å; T34-A37 PolarHBondContact O-N 2.88Å; T34-L38 HydrophobicContact CG2-CD1 4.08Å; T34-L38 WeakPolarHBondContact O-CG 3.31Å; T34-L38 PolarHBondContact O-N 3.25Å; T34-L38 VanDerWaalsContact O-N 3.11Å
35	A	84.4	Confident	82.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.7	-46.7	177.2	0	0	0	0	0	111.7	M15 M31 L32 A37 L38 Y39 I44	M15-A35 HydrophobicContact CB-CB 4.31Å; M15-A35 HydrophobicContact SD-CB 4.3Å; M31-A35 WeakPolarHBondContact O-CB 3.46Å; M31-A35 PolarHBondContact O-N 3.07Å; L32-A35 PolarHBondContact O-N 3.16Å; A35-A37 VanDerWaalsContact C-N 3.28Å; A35-A37 PolarHBondContact O-N 3.32Å; A35-L38 PolarHBondContact O-N 2.76Å; A35-Y39 PolarHBondContact O-N 3.17Å; A35-I44 HydrophobicContact CB-CD1 4.11Å; A35-I44 HydrophobicContact CB-CG1 4.46Å; A35-I44 HydrophobicContact CB-CG2 3.96Å
36	K	83.4	Confident	83.2	Confident	38 Å²	38	58.7 Å²	58.7	17%	0.165	31%	0.314	C	S	.	.	H	α-helix	trans	-60.6	-35.4	177.5	-73	-179.8	-169.1	-151.8	0	112.8	L32 I44 E45 Q67	L32-K36 WeakPolarHBondContact O-CB 3.27Å; L32-K36 VanDerWaalsContact O-CG 3.23Å; L32-K36 WeakPolarHBondContact O-CG 3.44Å; L32-K36 PolarHBondContact O-N 3.49Å; K36-I44 HydrophobicContact CB-CG2 4.49Å; K36-I44 HydrophobicContact CG-CG2 3.67Å; K36-E45 WeakPolarHBondContact CE-OE2 3.36Å; K36-E45 IonicContact NZ-OE1 3.99Å; K36-E45 IonicContact NZ-OE2 2.66Å; K36-E45 PolarHBondContact NZ-OE2 3.27Å; K36-Q67 VanDerWaalsContact NZ-OE1 3.08Å
37	A	83.2	Confident	83	Confident	85 Å²	85	51.6 Å²	51.6	70%	0.702	29%	0.29	S	S	*	.	H	α-helix	trans	-72.6	-35.9	178.3	0	0	0	0	0	112.5	L33 T34 A35	L33-A37 WeakPolarHBondContact O-CB 3.35Å; L33-A37 PolarHBondContact O-N 2.85Å; L33-A37 VanDerWaalsContact O-N 3.09Å; T34-A37 PolarHBondContact O-N 2.88Å; A35-A37 VanDerWaalsContact C-N 3.28Å; A35-A37 PolarHBondContact O-N 3.32Å
38	L	81.8	Confident	83.1	Confident	94 Å²	94	47 Å²	47	49%	0.492	27%	0.265	S	S	.	.	H	α-helix	trans	-84.5	-37.3	-178.3	-67.6	171.8	0	0	0	112.8	M15 T34 A35	M15-L38 HydrophobicContact CE-CD1 3.4Å; M15-L38 VanDerWaalsContact CE-CD1 3.4Å; M15-L38 HydrophobicContact SD-CD1 4.18Å; T34-L38 HydrophobicContact CG2-CD1 4.08Å; T34-L38 WeakPolarHBondContact O-CG 3.31Å; T34-L38 PolarHBondContact O-N 3.25Å; T34-L38 VanDerWaalsContact O-N 3.11Å; A35-L38 PolarHBondContact O-N 2.76Å
39	Y	80.6	Confident	83.2	Confident	38 Å²	38	47.2 Å²	47.2	15%	0.149	27%	0.266	C	S	.	.			trans	-137.9	88.9	-174.1	-51	-76.3	0	0	0	108.9	N8 E12 A35 T41 I44	N8-Y39 PolarHBondContact O-OH 3.41Å; N8-Y39 PolarHBondContact OD1-OH 2.97Å; E12-Y39 HydrophobicContact CB-CD2 4.11Å; E12-Y39 HydrophobicContact CB-CE2 4.2Å; E12-Y39 HydrophobicContact CB-CG 4.44Å; A35-Y39 PolarHBondContact O-N 3.17Å; Y39-T41 PolarHBondContact O-N 3.5Å; Y39-I44 VanDerWaalsContact CB-CD1 3.4Å; Y39-I44 HydrophobicContact CD2-CD1 4.32Å; Y39-I44 HydrophobicContact CG-CD1 4.31Å; Y39-I44 WeakPolarHBondContact O-CD1 3.18Å
40	P	80.8	Confident	83.3	Confident	84 Å²	84	46.4 Å²	46.4	55%	0.545	27%	0.266	S	S	.	.			trans	-76.6	69	174.2	30.9	-32.8	0	0	0	109.6	F72	P40-F72 WeakPolarHBondContact O-CZ 3.48Å
41	T	83.8	Confident	83.2	Confident	47 Å²	47	44.4 Å²	44.4	29%	0.288	25%	0.248	S	C	.	.			trans	-104.6	154.1	176.9	59.8	0	0	0	0	110.6	E12 Y39 E43 I44 E45	E12-T41 PolarHBondContact OE1-OG1 3.07Å; Y39-T41 PolarHBondContact O-N 3.5Å; T41-E43 PolarHBondContact O-N 3.06Å; T41-I44 PolarHBondContact O-N 2.95Å; T41-E45 PolarHBondContact O-N 2.93Å
42	F	82.8	Confident	83	Confident	29 Å²	29	42.6 Å²	42.6	13%	0.127	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-38	174.6	171.8	-94.5	0	0	0	111.9	I44 E45 H46 M68 F72 E75 A77 F78	F42-I44 VanDerWaalsContact C-N 3.28Å; F42-I44 PolarHBondContact O-N 3.3Å; F42-E45 PolarHBondContact O-N 2.82Å; F42-H46 HydrophobicContact CD1-CB 4.42Å; F42-H46 HydrophobicContact CE1-CB 3.95Å; F42-H46 HydrophobicContact CZ-CB 4.06Å; F42-H46 WeakPolarHBondContact O-CB 3.34Å; F42-H46 PolarHBondContact O-N 3.19Å; F42-M68 HydrophobicContact CD2-CE 3.91Å; F42-M68 HydrophobicContact CE2-CE 3.16Å; F42-M68 HydrophobicContact CZ-CE 3.6Å; F42-F72 HydrophobicContact CB-CD1 4.2Å; F42-F72 HydrophobicContact CB-CG 4.25Å; F42-F72 HydrophobicContact CD2-CB 4.01Å; F42-F72 HydrophobicContact CD2-CG 4.32Å; F42-E75 HydrophobicContact CB-CG 4.26Å; F42-E75 HydrophobicContact CD2-CB 4.07Å; F42-E75 HydrophobicContact CD2-CG 4.21Å; F42-E75 HydrophobicContact CE2-CB 4.33Å; F42-E75 HydrophobicContact CG-CB 4.45Å; F42-E75 HydrophobicContact CG-CG 4.23Å; F42-A77 HydrophobicContact CD1-CB 4.36Å; F42-A77 HydrophobicContact CE1-CB 3.43Å; F42-A77 VanDerWaalsContact CE1-CB 3.43Å; F42-A77 HydrophobicContact CZ-CB 3.56Å; F42-F78 HydrophobicContact CE2-CB 3.72Å; F42-F78 HydrophobicContact CZ-CB 4.38Å
43	E	81.4	Confident	82.9	Confident	127 Å²	127	44 Å²	44	59%	0.593	25%	0.249	S	C	*	.	H	α-helix	trans	-59.5	-38.1	-178.9	-65.9	-161.6	178.6	0	0	112.3	T41 A47	T41-E43 PolarHBondContact O-N 3.06Å; E43-A47 WeakPolarHBondContact O-CB 3.36Å; E43-A47 PolarHBondContact O-N 3.09Å
44	I	82.3	Confident	82.6	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-72.4	-41.9	178.9	-72.9	165.3	0	0	0	111.9	E12 L16 A35 K36 Y39 T41 F42 H46 A47 A48	E12-I44 HydrophobicContact CG-CD1 3.96Å; E12-I44 HydrophobicContact CG-CG1 4.33Å; L16-I44 HydrophobicContact CD1-CG1 4.12Å; L16-I44 HydrophobicContact CD2-CG1 4.04Å; L16-I44 HydrophobicContact CG-CG1 4.28Å; A35-I44 HydrophobicContact CB-CD1 4.11Å; A35-I44 HydrophobicContact CB-CG1 4.46Å; A35-I44 HydrophobicContact CB-CG2 3.96Å; K36-I44 HydrophobicContact CB-CG2 4.49Å; K36-I44 HydrophobicContact CG-CG2 3.67Å; Y39-I44 VanDerWaalsContact CB-CD1 3.4Å; Y39-I44 HydrophobicContact CD2-CD1 4.32Å; Y39-I44 HydrophobicContact CG-CD1 4.31Å; Y39-I44 WeakPolarHBondContact O-CD1 3.18Å; T41-I44 PolarHBondContact O-N 2.95Å; F42-I44 VanDerWaalsContact C-N 3.28Å; F42-I44 PolarHBondContact O-N 3.3Å; I44-H46 VanDerWaalsContact C-N 3.35Å; I44-A47 PolarHBondContact O-N 3.23Å; I44-A48 WeakPolarHBondContact O-CB 3.46Å; I44-A48 PolarHBondContact O-N 3.37Å
45	E	82.3	Confident	82.4	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-67.2	-38.1	176.4	-64.2	-70.2	-174.2	0	0	111.2	K36 T41 F42 A48 F49 Q67 M68 K71 F72	K36-E45 WeakPolarHBondContact CE-OE2 3.36Å; K36-E45 IonicContact NZ-OE1 3.99Å; K36-E45 IonicContact NZ-OE2 2.66Å; K36-E45 PolarHBondContact NZ-OE2 3.27Å; T41-E45 PolarHBondContact O-N 2.93Å; F42-E45 PolarHBondContact O-N 2.82Å; E45-A48 WeakPolarHBondContact O-CB 3.38Å; E45-A48 PolarHBondContact O-N 2.75Å; E45-F49 PolarHBondContact O-N 3.35Å; E45-Q67 PolarHBondContact OE2-OE1 2.94Å; E45-M68 HydrophobicContact CB-CG 3.5Å; E45-M68 VanDerWaalsContact CB-CG 3.5Å; E45-M68 HydrophobicContact CB-SD 4.34Å; E45-M68 HydrophobicContact CG-CG 4.46Å; E45-K71 IonicContact OE1-NZ 2.89Å; E45-K71 PolarHBondContact OE1-NZ 2.83Å; E45-F72 HydrophobicContact CG-CD2 4.3Å; E45-F72 HydrophobicContact CG-CE2 3.76Å
46	H	83.7	Confident	82.3	Confident	53 Å²	53	49.9 Å²	49.9	25%	0.245	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-38.3	173.7	-177.1	-94.4	0	0	0	112.2	F42 I44 A48 F49 T50 M68	F42-H46 HydrophobicContact CD1-CB 4.42Å; F42-H46 HydrophobicContact CE1-CB 3.95Å; F42-H46 HydrophobicContact CZ-CB 4.06Å; F42-H46 WeakPolarHBondContact O-CB 3.34Å; F42-H46 PolarHBondContact O-N 3.19Å; I44-H46 VanDerWaalsContact C-N 3.35Å; H46-A48 VanDerWaalsContact C-N 3.34Å; H46-F49 WeakPolarHBondContact O-CB 3.06Å; H46-F49 PolarHBondContact O-N 3.2Å; H46-T50 PolarHBondContact O-N 3.35Å; H46-T50 PolarHBondContact O-OG1 2.69Å; H46-M68 HydrophobicContact CB-CE 3.78Å
47	A	82.6	Confident	82.3	Confident	19 Å²	19	49.8 Å²	49.8	16%	0.157	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-38.9	173.1	0	0	0	0	0	111.4	L16 E43 I44 F49 T50 I51	L16-A47 HydrophobicContact CD1-CB 4.15Å; L16-A47 HydrophobicContact CD2-CB 3.47Å; L16-A47 VanDerWaalsContact CD2-CB 3.47Å; L16-A47 HydrophobicContact CG-CB 4.37Å; E43-A47 WeakPolarHBondContact O-CB 3.36Å; E43-A47 PolarHBondContact O-N 3.09Å; I44-A47 PolarHBondContact O-N 3.23Å; A47-F49 PolarHBondContact O-N 3.36Å; A47-T50 PolarHBondContact O-N 2.92Å; A47-T50 VanDerWaalsContact O-N 3.16Å; A47-I51 WeakPolarHBondContact O-CB 3.23Å; A47-I51 VanDerWaalsContact O-CG1 3.31Å; A47-I51 WeakPolarHBondContact O-CG1 3.37Å; A47-I51 PolarHBondContact O-N 3.17Å
48	A	84.2	Confident	82.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-48.6	172.6	0	0	0	0	0	111	L32 I44 E45 H46 T50 I51 H52	L32-A48 HydrophobicContact CD1-CB 3.89Å; L32-A48 HydrophobicContact CD2-CB 3.84Å; L32-A48 HydrophobicContact CG-CB 4.38Å; I44-A48 WeakPolarHBondContact O-CB 3.46Å; I44-A48 PolarHBondContact O-N 3.37Å; E45-A48 WeakPolarHBondContact O-CB 3.38Å; E45-A48 PolarHBondContact O-N 2.75Å; H46-A48 VanDerWaalsContact C-N 3.34Å; A48-T50 VanDerWaalsContact C-N 3.31Å; A48-T50 PolarHBondContact O-N 3.03Å; A48-I51 PolarHBondContact O-N 3.32Å; A48-H52 PolarHBondContact O-CD2 3.38Å; A48-H52 PolarHBondContact O-N 2.82Å
49	F	85.1	Confident	82.5	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-55.7	-45.5	173.6	168.7	-96.3	0	0	0	112	E45 H46 A47 I51 H52 C53 A61 A64 V65 M68 Q81 L85 V106	E45-F49 PolarHBondContact O-N 3.35Å; H46-F49 WeakPolarHBondContact O-CB 3.06Å; H46-F49 PolarHBondContact O-N 3.2Å; A47-F49 PolarHBondContact O-N 3.36Å; F49-I51 PolarHBondContact O-N 3.31Å; F49-H52 PolarHBondContact O-N 2.82Å; F49-C53 WeakPolarHBondContact CZ-SG 3.43Å; F49-C53 PolarHBondContact O-N 2.97Å; F49-C53 PolarHBondContact O-SG 2.83Å; F49-A61 HydrophobicContact CD2-CB 4.15Å; F49-A61 HydrophobicContact CE2-CB 4.21Å; F49-A64 HydrophobicContact CB-CB 4.06Å; F49-V65 HydrophobicContact CD2-CG2 3.62Å; F49-V65 HydrophobicContact CE2-CG2 3.74Å; F49-M68 HydrophobicContact CB-SD 4.24Å; F49-Q81 HydrophobicContact CD1-CG 4.37Å; F49-Q81 HydrophobicContact CE1-CG 3.99Å; F49-Q81 HydrophobicContact CZ-CG 4.33Å; F49-Q81 VanDerWaalsContact CZ-NE2 3.32Å; F49-L85 HydrophobicContact CZ-CD2 4.48Å; F49-V106 HydrophobicContact CE2-CG1 4.23Å
50	T	84	Confident	82.7	Confident	53 Å²	53	46.1 Å²	46.1	33%	0.325	25%	0.254	S	S	.	.	H	α-helix	trans	-64.4	-42.5	-178.9	-51.8	0	0	0	0	111.5	H46 A47 A48 C53 M54	H46-T50 PolarHBondContact O-N 3.35Å; H46-T50 PolarHBondContact O-OG1 2.69Å; A47-T50 PolarHBondContact O-N 2.92Å; A47-T50 VanDerWaalsContact O-N 3.16Å; A48-T50 VanDerWaalsContact C-N 3.31Å; A48-T50 PolarHBondContact O-N 3.03Å; T50-C53 WeakPolarHBondContact O-CB 3.43Å; T50-C53 PolarHBondContact O-N 3.07Å; T50-M54 WeakPolarHBondContact O-CG 3.28Å; T50-M54 PolarHBondContact O-N 2.83Å
51	I	82.5	Confident	82.9	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.036	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-44.5	177.1	-72	166.9	0	0	0	110.6	A19 A28 L32 A47 A48 F49 C53 M54 H55	A19-I51 HydrophobicContact CB-CD1 3.65Å; A28-I51 HydrophobicContact CB-CG2 3.84Å; L32-I51 HydrophobicContact CD1-CB 4.28Å; L32-I51 HydrophobicContact CD1-CD1 4.03Å; L32-I51 HydrophobicContact CD1-CG2 4.15Å; L32-I51 HydrophobicContact CD2-CD1 4.07Å; L32-I51 HydrophobicContact CG-CD1 4.25Å; A47-I51 WeakPolarHBondContact O-CB 3.23Å; A47-I51 VanDerWaalsContact O-CG1 3.31Å; A47-I51 WeakPolarHBondContact O-CG1 3.37Å; A47-I51 PolarHBondContact O-N 3.17Å; A48-I51 PolarHBondContact O-N 3.32Å; F49-I51 PolarHBondContact O-N 3.31Å; I51-C53 PolarHBondContact O-N 3.36Å; I51-M54 PolarHBondContact O-N 2.81Å; I51-H55 PolarHBondContact O-CD2 3.33Å; I51-H55 VanDerWaalsContact O-CD2 3.26Å; I51-H55 PolarHBondContact O-N 3.21Å
52	H	81.2	Confident	83.1	Confident	14 Å²	14	40.1 Å²	40.1	7%	0.065	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-34.4	174.1	-72.3	-59.8	0	0	0	112.2	E29 A48 F49 Q56 N57 A61	E29-H52 IonicContact OE1-CE1 3.37Å; E29-H52 PolarHBondContact OE1-CE1 3.36Å; A48-H52 PolarHBondContact O-CD2 3.38Å; A48-H52 PolarHBondContact O-N 2.82Å; F49-H52 PolarHBondContact O-N 2.82Å; H52-Q56 PolarHBondContact O-N 2.79Å; H52-N57 PolarHBondContact O-N 2.92Å; H52-A61 HydrophobicContact CB-CB 3.9Å
53	C	80.7	Confident	83.3	Confident	36 Å²	36	40.9 Å²	40.9	24%	0.243	23%	0.228	C	C	.	.	H	α-helix	trans	-65.5	-43	171.5	-64.7	0	0	0	0	112.5	F49 T50 I51 H55 Q56 F102	F49-C53 WeakPolarHBondContact CZ-SG 3.43Å; F49-C53 PolarHBondContact O-N 2.97Å; F49-C53 PolarHBondContact O-SG 2.83Å; T50-C53 WeakPolarHBondContact O-CB 3.43Å; T50-C53 PolarHBondContact O-N 3.07Å; I51-C53 PolarHBondContact O-N 3.36Å; C53-H55 PolarHBondContact O-N 3.11Å; C53-Q56 PolarHBondContact O-N 3.3Å; C53-Q56 VanDerWaalsContact O-N 3.09Å; C53-F102 HydrophobicContact CB-CD1 4.49Å; C53-F102 HydrophobicContact CB-CE1 3.96Å
54	M	80.3	Confident	83.4	Confident	119 Å²	119	35 Å²	35	59%	0.586	20%	0.201	S	C	*	.	H	α-helix	trans	-62.2	-34.3	178.9	-67.3	-173.2	90.6	0	0	112.1	R20 T50 I51 Q56	R20-M54 HydrophobicContact CG-SD 4.26Å; T50-M54 WeakPolarHBondContact O-CG 3.28Å; T50-M54 PolarHBondContact O-N 2.83Å; I51-M54 PolarHBondContact O-N 2.81Å; M54-Q56 VanDerWaalsContact C-N 3.34Å
55	H	80.3	Confident	83.6	Confident	53 Å²	53	35 Å²	35	25%	0.245	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	7.8	176.4	-67.7	-71.7	0	0	0	114.7	A22 I25 I51 C53 N57	A22-H55 PolarHBondContact O-CE1 3.12Å; I25-H55 HydrophobicContact CD1-CB 3.6Å; I25-H55 HydrophobicContact CG1-CB 3.4Å; I25-H55 VanDerWaalsContact CG1-CG 3.42Å; I51-H55 PolarHBondContact O-CD2 3.33Å; I51-H55 VanDerWaalsContact O-CD2 3.26Å; I51-H55 PolarHBondContact O-N 3.21Å; C53-H55 PolarHBondContact O-N 3.11Å; H55-N57 PolarHBondContact O-N 3.33Å; H55-N57 VanDerWaalsContact O-N 3.12Å
56	Q	82.1	Confident	83.9	Confident	143 Å²	143	38.6 Å²	38.6	67%	0.668	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	29.4	-178	-57.4	-178.5	-2.9	0	0	114.1	H52 C53 M54 V58 F102	H52-Q56 PolarHBondContact O-N 2.79Å; C53-Q56 PolarHBondContact O-N 3.3Å; C53-Q56 VanDerWaalsContact O-N 3.09Å; M54-Q56 VanDerWaalsContact C-N 3.34Å; Q56-V58 PolarHBondContact O-N 2.66Å; Q56-F102 VanDerWaalsContact C-CE2 3.41Å; Q56-F102 VanDerWaalsContact CA-CE2 3.44Å; Q56-F102 HydrophobicContact CB-CD2 4.49Å; Q56-F102 HydrophobicContact CB-CE2 4.08Å; Q56-F102 WeakPolarHBondContact O-CE2 3.37Å
57	N	82.6	Confident	84	Confident	35 Å²	35	40 Å²	40	19%	0.187	23%	0.225	C	C	.	.			trans	-89.4	98.2	177.7	-174.7	-3.1	0	0	0	110.7	I25 H52 H55 S59 G60 A61	I25-N57 HydrophobicContact CD1-CB 4.3Å; H52-N57 PolarHBondContact O-N 2.92Å; H55-N57 PolarHBondContact O-N 3.33Å; H55-N57 VanDerWaalsContact O-N 3.12Å; N57-S59 PolarHBondContact OD1-N 3.04Å; N57-S59 PolarHBondContact OD1-OG 3.16Å; N57-G60 PolarHBondContact OD1-N 3Å; N57-A61 WeakPolarHBondContact O-CB 3.42Å; N57-A61 PolarHBondContact O-N 3.09Å; N57-A61 VanDerWaalsContact O-N 3.07Å
58	V	84.2	Confident	84.1	Confident	40 Å²	40	39.1 Å²	39.1	24%	0.242	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-44.8	-177.3	-178.5	0	0	0	0	112.2	Q56 A61 A62 F102 M105 V106	Q56-V58 PolarHBondContact O-N 2.66Å; V58-A61 PolarHBondContact O-N 3.39Å; V58-A62 WeakPolarHBondContact O-CB 3.44Å; V58-A62 PolarHBondContact O-N 3.06Å; V58-F102 HydrophobicContact CG2-CD2 4.18Å; V58-F102 HydrophobicContact CG2-CE2 3.55Å; V58-F102 HydrophobicContact CG2-CZ 4.21Å; V58-M105 HydrophobicContact CG1-CB 3.97Å; V58-M105 VanDerWaalsContact CG1-O 3.31Å; V58-M105 WeakPolarHBondContact CG1-O 3.34Å; V58-M105 HydrophobicContact CG2-CB 3.99Å; V58-V106 HydrophobicContact CG1-CG2 4.36Å
59	S	85.5	Confident	84.2	Confident	89 Å²	89	41.2 Å²	41.2	62%	0.622	23%	0.226	S	C	*	.	H	α-helix	trans	-70.6	-40.7	-176	58.6	0	0	0	0	111.8	N57 A62 A63	N57-S59 PolarHBondContact OD1-N 3.04Å; N57-S59 PolarHBondContact OD1-OG 3.16Å; S59-A62 PolarHBondContact O-N 3.07Å; S59-A63 WeakPolarHBondContact O-CB 3.05Å; S59-A63 PolarHBondContact O-N 3.34Å
60	G	84.2	Confident	84.3	Confident	11 Å²	11	46.1 Å²	46.1	11%	0.113	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-42	174.3	0	0	0	0	0	112.2	N57 A63 A64	N57-G60 PolarHBondContact OD1-N 3Å; G60-A63 PolarHBondContact O-N 2.77Å; G60-A64 WeakPolarHBondContact O-CB 2.95Å; G60-A64 PolarHBondContact O-N 3.03Å
61	A	85.9	Confident	84.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-42.6	176.1	0	0	0	0	0	112.1	F49 H52 N57 V58 A64 V65 V106	F49-A61 HydrophobicContact CD2-CB 4.15Å; F49-A61 HydrophobicContact CE2-CB 4.21Å; H52-A61 HydrophobicContact CB-CB 3.9Å; N57-A61 WeakPolarHBondContact O-CB 3.42Å; N57-A61 PolarHBondContact O-N 3.09Å; N57-A61 VanDerWaalsContact O-N 3.07Å; V58-A61 PolarHBondContact O-N 3.39Å; A61-A64 PolarHBondContact O-N 3.48Å; A61-V65 WeakPolarHBondContact O-CG2 3.41Å; A61-V65 PolarHBondContact O-N 3.44Å; A61-V106 HydrophobicContact CB-CG1 3.93Å; A61-V106 HydrophobicContact CB-CG2 3.75Å
62	A	87.2	Confident	84.4	Confident	5 Å²	5	50 Å²	50	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-43.3	176.3	0	0	0	0	0	111.7	V58 S59 A64 V65 Q66 V106 L110	V58-A62 WeakPolarHBondContact O-CB 3.44Å; V58-A62 PolarHBondContact O-N 3.06Å; S59-A62 PolarHBondContact O-N 3.07Å; A62-A64 VanDerWaalsContact C-N 3.33Å; A62-A64 PolarHBondContact O-N 3.28Å; A62-V65 PolarHBondContact O-N 3.37Å; A62-Q66 PolarHBondContact O-N 3.43Å; A62-V106 HydrophobicContact CB-CG1 4.44Å; A62-L110 HydrophobicContact CB-CD2 3.96Å; A62-L110 HydrophobicContact CB-CG 4.4Å; A62-L110 VanDerWaalsContact O-CD2 3.3Å; A62-L110 WeakPolarHBondContact O-CD2 3.32Å
63	A	86.6	Confident	84.5	Confident	46 Å²	46	51.1 Å²	51.1	38%	0.38	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-38.5	175.6	0	0	0	0	0	112.3	S59 G60 Q66 Q67	S59-A63 WeakPolarHBondContact O-CB 3.05Å; S59-A63 PolarHBondContact O-N 3.34Å; G60-A63 PolarHBondContact O-N 2.77Å; A63-Q66 PolarHBondContact O-N 3.42Å; A63-Q67 WeakPolarHBondContact O-CG 3.27Å; A63-Q67 PolarHBondContact O-N 2.93Å
64	A	85	Confident	84.7	Confident	2 Å²	2	56.5 Å²	56.5	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-44.5	174.7	0	0	0	0	0	111.5	F49 G60 A61 A62 Q66 Q67 M68	F49-A64 HydrophobicContact CB-CB 4.06Å; G60-A64 WeakPolarHBondContact O-CB 2.95Å; G60-A64 PolarHBondContact O-N 3.03Å; A61-A64 PolarHBondContact O-N 3.48Å; A62-A64 VanDerWaalsContact C-N 3.33Å; A62-A64 PolarHBondContact O-N 3.28Å; A64-Q66 VanDerWaalsContact C-N 3.32Å; A64-Q66 PolarHBondContact O-N 2.91Å; A64-Q67 PolarHBondContact O-N 2.93Å; A64-M68 WeakPolarHBondContact O-CB 3.45Å; A64-M68 WeakPolarHBondContact O-CG 3.37Å; A64-M68 PolarHBondContact O-N 3.25Å
65	V	86.5	Confident	84.9	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-41.2	175.2	172.3	0	0	0	0	111.3	F49 A61 A62 M68 Y69 F78 L85 L110	F49-V65 HydrophobicContact CD2-CG2 3.62Å; F49-V65 HydrophobicContact CE2-CG2 3.74Å; A61-V65 WeakPolarHBondContact O-CG2 3.41Å; A61-V65 PolarHBondContact O-N 3.44Å; A62-V65 PolarHBondContact O-N 3.37Å; V65-M68 PolarHBondContact O-N 3.4Å; V65-Y69 PolarHBondContact O-N 2.95Å; V65-F78 HydrophobicContact CG1-CE2 4.28Å; V65-L85 HydrophobicContact CG1-CD1 4.41Å; V65-L85 HydrophobicContact CG2-CD1 4.08Å; V65-L110 HydrophobicContact CB-CD2 4.05Å; V65-L110 HydrophobicContact CG1-CD1 4.27Å; V65-L110 HydrophobicContact CG1-CD2 3.99Å
66	Q	87	Confident	85.1	Confident	76 Å²	76	57 Å²	57	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-63.9	-41.9	176.2	-178	170.7	4	0	0	112.2	A62 A63 A64 Y69 V70 L114	A62-Q66 PolarHBondContact O-N 3.43Å; A63-Q66 PolarHBondContact O-N 3.42Å; A64-Q66 VanDerWaalsContact C-N 3.32Å; A64-Q66 PolarHBondContact O-N 2.91Å; Q66-Y69 PolarHBondContact O-N 2.9Å; Q66-V70 WeakPolarHBondContact O-CG2 3.31Å; Q66-V70 PolarHBondContact O-N 3.35Å; Q66-V70 VanDerWaalsContact O-N 3.11Å; Q66-L114 HydrophobicContact CB-CD2 3.85Å; Q66-L114 HydrophobicContact CG-CD2 3.82Å
67	Q	85.7	Confident	85.2	Confident	83 Å²	83	52.3 Å²	52.3	39%	0.388	30%	0.299	S	S	.	.	H	α-helix	trans	-66	-39.8	174.8	-74.6	-172.7	-1.6	0	0	112.2	K36 E45 A63 A64 Y69 V70 K71	K36-Q67 VanDerWaalsContact NZ-OE1 3.08Å; E45-Q67 PolarHBondContact OE2-OE1 2.94Å; A63-Q67 WeakPolarHBondContact O-CG 3.27Å; A63-Q67 PolarHBondContact O-N 2.93Å; A64-Q67 PolarHBondContact O-N 2.93Å; Q67-Y69 VanDerWaalsContact C-N 3.3Å; Q67-Y69 PolarHBondContact O-N 3.37Å; Q67-V70 PolarHBondContact O-N 2.87Å; Q67-K71 PolarHBondContact O-N 3.28Å; Q67-K71 VanDerWaalsContact O-N 3.07Å
68	M	85.9	Confident	85.5	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-40.9	174.8	-71.5	172.6	78.8	0	0	111.4	F42 E45 H46 F49 A64 V65 F72 F78	F42-M68 HydrophobicContact CD2-CE 3.91Å; F42-M68 HydrophobicContact CE2-CE 3.16Å; F42-M68 HydrophobicContact CZ-CE 3.6Å; E45-M68 HydrophobicContact CB-CG 3.5Å; E45-M68 VanDerWaalsContact CB-CG 3.5Å; E45-M68 HydrophobicContact CB-SD 4.34Å; E45-M68 HydrophobicContact CG-CG 4.46Å; H46-M68 HydrophobicContact CB-CE 3.78Å; F49-M68 HydrophobicContact CB-SD 4.24Å; A64-M68 WeakPolarHBondContact O-CB 3.45Å; A64-M68 WeakPolarHBondContact O-CG 3.37Å; A64-M68 PolarHBondContact O-N 3.25Å; V65-M68 PolarHBondContact O-N 3.4Å; M68-F72 CarbonylContact O-C 2.98Å; M68-F72 VanDerWaalsContact O-CA 3.29Å; M68-F72 WeakPolarHBondContact O-CA 3.34Å; M68-F72 WeakPolarHBondContact O-CB 3.32Å; M68-F72 PolarHBondContact O-N 3.26Å; M68-F78 HydrophobicContact CB-CD2 3.75Å; M68-F78 HydrophobicContact CB-CE2 3.73Å; M68-F78 HydrophobicContact CE-CD2 4.09Å
69	Y	86.9	Confident	85.6	Confident	44 Å²	44	49.8 Å²	49.8	17%	0.173	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-49	175.9	179.6	-105.9	0	0	0	112.1	V65 Q66 Q67 K71 S73 F78 W79 L114 T117 L118 E121	V65-Y69 PolarHBondContact O-N 2.95Å; Q66-Y69 PolarHBondContact O-N 2.9Å; Q67-Y69 VanDerWaalsContact C-N 3.3Å; Q67-Y69 PolarHBondContact O-N 3.37Å; Y69-K71 VanDerWaalsContact C-N 3.33Å; Y69-K71 PolarHBondContact O-N 3.43Å; Y69-S73 WeakPolarHBondContact O-CB 3.49Å; Y69-S73 PolarHBondContact O-N 3.2Å; Y69-F78 AromaticContact CD2-CE1 3.86Å; Y69-F78 HydrophobicContact CD2-CE1 3.86Å; Y69-F78 HydrophobicContact CD2-CZ 4.01Å; Y69-F78 HydrophobicContact CG-CZ 4.4Å; Y69-W79 HydrophobicContact CE2-CH2 4.45Å; Y69-L114 HydrophobicContact CD1-CD1 3.47Å; Y69-L114 VanDerWaalsContact CD1-CD1 3.47Å; Y69-L114 HydrophobicContact CD2-CD1 4.49Å; Y69-L114 HydrophobicContact CE1-CD1 3.69Å; Y69-L114 HydrophobicContact CG-CD1 3.9Å; Y69-T117 VanDerWaalsContact OH-CG2 3.25Å; Y69-T117 WeakPolarHBondContact OH-CG2 3.43Å; Y69-L118 HydrophobicContact CD2-CD2 3.49Å; Y69-L118 VanDerWaalsContact CD2-CD2 3.49Å; Y69-L118 HydrophobicContact CE2-CD2 3.77Å; Y69-L118 HydrophobicContact CG-CD2 4.22Å; Y69-E121 PolarHBondContact OH-OE1 3.46Å
70	V	86.7	Confident	85.6	Confident	110 Å²	110	47.8 Å²	47.8	67%	0.667	27%	0.271	S	S	*	.	H	α-helix	trans	-63.5	-37.8	-177.3	173.4	0	0	0	0	112.3	Q66 Q67	Q66-V70 WeakPolarHBondContact O-CG2 3.31Å; Q66-V70 PolarHBondContact O-N 3.35Å; Q66-V70 VanDerWaalsContact O-N 3.11Å; Q67-V70 PolarHBondContact O-N 2.87Å
71	K	83.5	Confident	85.6	Confident	104 Å²	104	47.6 Å²	47.6	45%	0.452	27%	0.267	S	S	.	.	H	α-helix	trans	-96.6	-29.3	-174.3	-65.6	-180	-173	169.1	0	114.3	E45 Q67 Y69	E45-K71 IonicContact OE1-NZ 2.89Å; E45-K71 PolarHBondContact OE1-NZ 2.83Å; Q67-K71 PolarHBondContact O-N 3.28Å; Q67-K71 VanDerWaalsContact O-N 3.07Å; Y69-K71 VanDerWaalsContact C-N 3.33Å; Y69-K71 PolarHBondContact O-N 3.43Å
72	F	84.5	Confident	85.7	Confident	37 Å²	37	47.7 Å²	47.7	16%	0.162	27%	0.268	C	S	.	.	H	α-helix	trans	-136.7	31.7	-164.9	-55.3	-72.7	0	0	0	113.7	P40 F42 E45 M68 N74 E75	P40-F72 WeakPolarHBondContact O-CZ 3.48Å; F42-F72 HydrophobicContact CB-CD1 4.2Å; F42-F72 HydrophobicContact CB-CG 4.25Å; F42-F72 HydrophobicContact CD2-CB 4.01Å; F42-F72 HydrophobicContact CD2-CG 4.32Å; E45-F72 HydrophobicContact CG-CD2 4.3Å; E45-F72 HydrophobicContact CG-CE2 3.76Å; M68-F72 CarbonylContact O-C 2.98Å; M68-F72 VanDerWaalsContact O-CA 3.29Å; M68-F72 WeakPolarHBondContact O-CA 3.34Å; M68-F72 WeakPolarHBondContact O-CB 3.32Å; M68-F72 PolarHBondContact O-N 3.26Å; F72-N74 PolarHBondContact O-N 3.47Å; F72-E75 HydrophobicContact CB-CG 4.31Å; F72-E75 PolarHBondContact O-N 3.09Å
73	S	83.9	Confident	85.6	Confident	37 Å²	37	49.4 Å²	49.4	26%	0.259	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-18	176.8	57.3	0	0	0	0	114.6	Y69 W79	Y69-S73 WeakPolarHBondContact O-CB 3.49Å; Y69-S73 PolarHBondContact O-N 3.2Å; S73-W79 PolarHBondContact O-NE1 3.2Å
74	N	83.8	Confident	85.4	Confident	149 Å²	149	52.2 Å²	52.2	80%	0.797	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-13.8	177.7	-67.9	-24.1	0	0	0	114.2	F72	F72-N74 PolarHBondContact O-N 3.47Å
75	E	85.2	Confident	85.4	Confident	86 Å²	86	52.2 Å²	52.2	40%	0.402	28%	0.28	S	S	.	.			trans	-79.7	126.8	-174.9	-80.7	-66.8	157.8	0	0	112.3	F42 F72 A77 F78	F42-E75 HydrophobicContact CB-CG 4.26Å; F42-E75 HydrophobicContact CD2-CB 4.07Å; F42-E75 HydrophobicContact CD2-CG 4.21Å; F42-E75 HydrophobicContact CE2-CB 4.33Å; F42-E75 HydrophobicContact CG-CB 4.45Å; F42-E75 HydrophobicContact CG-CG 4.23Å; F72-E75 HydrophobicContact CB-CG 4.31Å; F72-E75 PolarHBondContact O-N 3.09Å; E75-A77 VanDerWaalsContact C-N 3.27Å; E75-A77 PolarHBondContact O-N 3.26Å; E75-F78 HydrophobicContact CB-CB 4.39Å; E75-F78 WeakPolarHBondContact O-CB 3.27Å; E75-F78 PolarHBondContact O-N 3.41Å
76	P	83.7	Confident	85.3	Confident	98 Å²	98	52.2 Å²	52.2	64%	0.636	28%	0.28	S	S	*	.	H	α-helix	trans	-64.8	-30.9	179.2	23.7	-32.5	0	0	0	112.8	F78 W79 A80	P76-F78 VanDerWaalsContact C-N 3.26Å; P76-F78 PolarHBondContact O-N 3.42Å; P76-W79 PolarHBondContact O-N 3.32Å; P76-A80 PolarHBondContact O-N 3.13Å
77	A	84.4	Confident	85.1	Confident	44 Å²	44	53 Å²	53	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-65	-30.7	177.3	0	0	0	0	0	112.6	F42 E75 Q81	F42-A77 HydrophobicContact CD1-CB 4.36Å; F42-A77 HydrophobicContact CE1-CB 3.43Å; F42-A77 VanDerWaalsContact CE1-CB 3.43Å; F42-A77 HydrophobicContact CZ-CB 3.56Å; E75-A77 VanDerWaalsContact C-N 3.27Å; E75-A77 PolarHBondContact O-N 3.26Å; A77-Q81 PolarHBondContact O-N 3.34Å
78	F	88.5	Confident	84.9	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.009	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-51.8	171.4	174.8	-113.2	0	0	0	110.4	F42 V65 M68 Y69 E75 P76 A80 Q81 V82 L118	F42-F78 HydrophobicContact CE2-CB 3.72Å; F42-F78 HydrophobicContact CZ-CB 4.38Å; V65-F78 HydrophobicContact CG1-CE2 4.28Å; M68-F78 HydrophobicContact CB-CD2 3.75Å; M68-F78 HydrophobicContact CB-CE2 3.73Å; M68-F78 HydrophobicContact CE-CD2 4.09Å; Y69-F78 AromaticContact CD2-CE1 3.86Å; Y69-F78 HydrophobicContact CD2-CE1 3.86Å; Y69-F78 HydrophobicContact CD2-CZ 4.01Å; Y69-F78 HydrophobicContact CG-CZ 4.4Å; E75-F78 HydrophobicContact CB-CB 4.39Å; E75-F78 WeakPolarHBondContact O-CB 3.27Å; E75-F78 PolarHBondContact O-N 3.41Å; P76-F78 VanDerWaalsContact C-N 3.26Å; P76-F78 PolarHBondContact O-N 3.42Å; F78-A80 VanDerWaalsContact C-N 3.29Å; F78-A80 PolarHBondContact O-N 3.01Å; F78-Q81 CarbonylContact O-C 3.58Å; F78-Q81 WeakPolarHBondContact O-CA 3.48Å; F78-Q81 VanDerWaalsContact O-CB 3.27Å; F78-Q81 WeakPolarHBondContact O-CB 3.41Å; F78-Q81 PolarHBondContact O-N 3.26Å; F78-V82 HydrophobicContact CD1-CG2 4.09Å; F78-V82 HydrophobicContact CD2-CG2 4.19Å; F78-V82 HydrophobicContact CE1-CG2 3.6Å; F78-V82 HydrophobicContact CE2-CG2 3.74Å; F78-V82 HydrophobicContact CG-CG2 4.36Å; F78-V82 HydrophobicContact CZ-CG2 3.42Å; F78-V82 VanDerWaalsContact CZ-CG2 3.42Å; F78-V82 WeakPolarHBondContact O-CG2 3.38Å; F78-V82 PolarHBondContact O-N 3.42Å; F78-L118 HydrophobicContact CE1-CD2 4.05Å; F78-L118 HydrophobicContact CZ-CD2 3.95Å
79	W	87.1	Confident	84.7	Confident	20 Å²	20	49.9 Å²	49.9	8%	0.076	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-32.5	-178.7	-68.4	104.8	0	0	0	113.2	Y69 S73 P76 Q81 V82 S83 L118 E121 L122 K125	Y69-W79 HydrophobicContact CE2-CH2 4.45Å; S73-W79 PolarHBondContact O-NE1 3.2Å; P76-W79 PolarHBondContact O-N 3.32Å; W79-Q81 VanDerWaalsContact C-N 3.25Å; W79-Q81 PolarHBondContact O-N 3.04Å; W79-V82 HydrophobicContact CE3-CB 4.32Å; W79-V82 HydrophobicContact CE3-CG2 4.42Å; W79-V82 PolarHBondContact O-N 3.47Å; W79-S83 WeakPolarHBondContact O-CB 3.5Å; W79-S83 PolarHBondContact O-N 2.89Å; W79-S83 PolarHBondContact O-OG 3.46Å; W79-L118 HydrophobicContact CH2-CD2 4.1Å; W79-L118 HydrophobicContact CZ3-CD2 4.18Å; W79-E121 HydrophobicContact CH2-CB 3.47Å; W79-E121 VanDerWaalsContact CH2-CB 3.47Å; W79-E121 HydrophobicContact CH2-CG 4.36Å; W79-E121 WeakPolarHBondContact CH2-OE2 3.22Å; W79-E121 HydrophobicContact CZ2-CB 4.21Å; W79-E121 WeakPolarHBondContact CZ2-OE2 3.34Å; W79-E121 HydrophobicContact CZ3-CB 4.08Å; W79-L122 HydrophobicContact CE3-CD1 4.47Å; W79-L122 HydrophobicContact CE3-CG 3.91Å; W79-L122 HydrophobicContact CZ3-CD1 4.47Å; W79-L122 HydrophobicContact CZ3-CG 3.99Å; W79-K125 HydrophobicContact CD2-CD 4.04Å; W79-K125 HydrophobicContact CG-CD 4.33Å; W79-K125 HydrophobicContact CZ2-CD 4.37Å
80	A	85.8	Confident	84.2	Confident	47 Å²	47	50 Å²	50	39%	0.388	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-32.3	170.9	0	0	0	0	0	112.5	P76 F78 R84	P76-A80 PolarHBondContact O-N 3.13Å; F78-A80 VanDerWaalsContact C-N 3.29Å; F78-A80 PolarHBondContact O-N 3.01Å; A80-R84 PolarHBondContact O-N 3.19Å; A80-R84 PolarHBondContact O-NE 3.15Å
81	Q	84.8	Confident	83.3	Confident	7 Å²	7	46.9 Å²	46.9	3%	0.033	25%	0.253	C	S	.	.	H	α-helix	trans	-75.7	-43.3	174.8	-170.1	58.5	42.4	0	0	111.5	F49 A77 F78 W79 S83 R84 L85	F49-Q81 HydrophobicContact CD1-CG 4.37Å; F49-Q81 HydrophobicContact CE1-CG 3.99Å; F49-Q81 HydrophobicContact CZ-CG 4.33Å; F49-Q81 VanDerWaalsContact CZ-NE2 3.32Å; A77-Q81 PolarHBondContact O-N 3.34Å; F78-Q81 CarbonylContact O-C 3.58Å; F78-Q81 WeakPolarHBondContact O-CA 3.48Å; F78-Q81 VanDerWaalsContact O-CB 3.27Å; F78-Q81 WeakPolarHBondContact O-CB 3.41Å; F78-Q81 PolarHBondContact O-N 3.26Å; W79-Q81 VanDerWaalsContact C-N 3.25Å; W79-Q81 PolarHBondContact O-N 3.04Å; Q81-S83 VanDerWaalsContact C-N 3.33Å; Q81-S83 PolarHBondContact O-N 3.23Å; Q81-R84 WeakPolarHBondContact O-CB 3.42Å; Q81-R84 PolarHBondContact O-N 2.93Å; Q81-L85 PolarHBondContact O-N 2.85Å; Q81-L85 VanDerWaalsContact O-N 3.09Å
82	V	86.1	Confident	82.2	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-42.4	175.5	-174	0	0	0	0	110.7	F78 W79 R84 L85 V86 L118 L122	F78-V82 HydrophobicContact CD1-CG2 4.09Å; F78-V82 HydrophobicContact CD2-CG2 4.19Å; F78-V82 HydrophobicContact CE1-CG2 3.6Å; F78-V82 HydrophobicContact CE2-CG2 3.74Å; F78-V82 HydrophobicContact CG-CG2 4.36Å; F78-V82 HydrophobicContact CZ-CG2 3.42Å; F78-V82 VanDerWaalsContact CZ-CG2 3.42Å; F78-V82 WeakPolarHBondContact O-CG2 3.38Å; F78-V82 PolarHBondContact O-N 3.42Å; W79-V82 HydrophobicContact CE3-CB 4.32Å; W79-V82 HydrophobicContact CE3-CG2 4.42Å; W79-V82 PolarHBondContact O-N 3.47Å; V82-R84 VanDerWaalsContact C-N 3.27Å; V82-R84 PolarHBondContact O-N 3.24Å; V82-L85 WeakPolarHBondContact O-CA 3.49Å; V82-L85 WeakPolarHBondContact O-CB 3.47Å; V82-L85 PolarHBondContact O-N 2.87Å; V82-V86 HydrophobicContact CG1-CG2 4.32Å; V82-V86 WeakPolarHBondContact O-CG2 3.48Å; V82-V86 PolarHBondContact O-N 2.99Å; V82-L118 HydrophobicContact CG1-CB 4.26Å; V82-L118 HydrophobicContact CG1-CD1 4.42Å; V82-L118 HydrophobicContact CG1-CD2 4.39Å; V82-L118 HydrophobicContact CG2-CD2 4.37Å; V82-L122 HydrophobicContact CB-CD1 4.13Å; V82-L122 HydrophobicContact CG1-CD1 3.41Å; V82-L122 VanDerWaalsContact CG1-CD1 3.41Å
83	S	85.1	Confident	80.9	Confident	41 Å²	41	51 Å²	51	29%	0.287	29%	0.285	S	S	.	.	H	α-helix	trans	-57.2	-40.7	175.9	-57.3	0	0	0	0	111.8	W79 Q81 V86 Q87	W79-S83 WeakPolarHBondContact O-CB 3.5Å; W79-S83 PolarHBondContact O-N 2.89Å; W79-S83 PolarHBondContact O-OG 3.46Å; Q81-S83 VanDerWaalsContact C-N 3.33Å; Q81-S83 PolarHBondContact O-N 3.23Å; S83-V86 PolarHBondContact O-N 3.43Å; S83-Q87 WeakPolarHBondContact O-CB 3.5Å; S83-Q87 PolarHBondContact O-N 3.33Å
84	R	84.2	Confident	79.4	Confident	106 Å²	106	54.6 Å²	54.6	40%	0.4	32%	0.318	S	S	.	.	H	α-helix	trans	-67.2	-33.6	175.1	-80.9	-177.7	-90.6	145.3	-3.4	113.4	A80 Q81 V82 A88	A80-R84 PolarHBondContact O-N 3.19Å; A80-R84 PolarHBondContact O-NE 3.15Å; Q81-R84 WeakPolarHBondContact O-CB 3.42Å; Q81-R84 PolarHBondContact O-N 2.93Å; V82-R84 VanDerWaalsContact C-N 3.27Å; V82-R84 PolarHBondContact O-N 3.24Å; R84-A88 PolarHBondContact O-N 2.77Å
85	L	84.9	Confident	78	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-67.8	-47.1	173.3	-67.4	173.4	0	0	0	110.6	F49 V65 Q81 V82 Q87 A88 V89 R103 V106 F107	F49-L85 HydrophobicContact CZ-CD2 4.48Å; V65-L85 HydrophobicContact CG1-CD1 4.41Å; V65-L85 HydrophobicContact CG2-CD1 4.08Å; Q81-L85 PolarHBondContact O-N 2.85Å; Q81-L85 VanDerWaalsContact O-N 3.09Å; V82-L85 WeakPolarHBondContact O-CA 3.49Å; V82-L85 WeakPolarHBondContact O-CB 3.47Å; V82-L85 PolarHBondContact O-N 2.87Å; L85-Q87 PolarHBondContact O-N 2.98Å; L85-A88 WeakPolarHBondContact O-CB 3.3Å; L85-A88 PolarHBondContact O-N 3.11Å; L85-A88 VanDerWaalsContact O-N 3.13Å; L85-V89 WeakPolarHBondContact O-CG2 3.44Å; L85-V89 PolarHBondContact O-N 3.31Å; L85-R103 HydrophobicContact CD2-CB 3.86Å; L85-R103 HydrophobicContact CD2-CG 3.96Å; L85-V106 HydrophobicContact CD2-CB 4.4Å; L85-V106 HydrophobicContact CD2-CG1 4.34Å; L85-F107 HydrophobicContact CB-CD2 4.2Å
86	V	83.7	Confident	76.9	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.018	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-41.4	179.4	173.8	0	0	0	0	111.5	V82 S83 A88 V89 R90 F107 L119 L122 L135 L138	V82-V86 HydrophobicContact CG1-CG2 4.32Å; V82-V86 WeakPolarHBondContact O-CG2 3.48Å; V82-V86 PolarHBondContact O-N 2.99Å; S83-V86 PolarHBondContact O-N 3.43Å; V86-A88 PolarHBondContact O-N 3.06Å; V86-V89 WeakPolarHBondContact O-CB 3.4Å; V86-V89 PolarHBondContact O-N 3.21Å; V86-V89 VanDerWaalsContact O-N 3.09Å; V86-R90 PolarHBondContact O-N 2.97Å; V86-R90 VanDerWaalsContact O-N 3.13Å; V86-F107 HydrophobicContact CG2-CE2 4Å; V86-L119 HydrophobicContact CB-CD2 4.44Å; V86-L119 HydrophobicContact CG1-CD2 3.8Å; V86-L119 HydrophobicContact CG2-CD2 3.7Å; V86-L122 HydrophobicContact CG2-CD1 3.83Å; V86-L135 HydrophobicContact CG1-CD2 3.75Å; V86-L138 HydrophobicContact CG1-CD2 3.96Å
87	Q	83.2	Confident	76.4	Confident	92 Å²	92	52.5 Å²	52.5	43%	0.43	31%	0.31	S	S	.	.	H	α-helix	trans	-62.2	-33.9	175.4	-164.7	66	7.5	0	0	112.3	S83 L85 V89 R90 C91	S83-Q87 WeakPolarHBondContact O-CB 3.5Å; S83-Q87 PolarHBondContact O-N 3.33Å; L85-Q87 PolarHBondContact O-N 2.98Å; Q87-V89 VanDerWaalsContact C-N 3.33Å; Q87-R90 PolarHBondContact O-N 3.44Å; Q87-R90 VanDerWaalsContact OE1-NH1 3.1Å; Q87-C91 PolarHBondContact O-N 3.32Å; Q87-C91 PolarHBondContact O-SG 2.8Å
88	A	81.4	Confident	75.9	Confident	2 Å²	2	58.5 Å²	58.5	2%	0.017	33%	0.331	C	S	.	.	H	α-helix	trans	-67.5	-33.5	175.5	0	0	0	0	0	112.7	R84 L85 V86 T100 R103 R104	R84-A88 PolarHBondContact O-N 2.77Å; L85-A88 WeakPolarHBondContact O-CB 3.3Å; L85-A88 PolarHBondContact O-N 3.11Å; L85-A88 VanDerWaalsContact O-N 3.13Å; V86-A88 PolarHBondContact O-N 3.06Å; A88-T100 HydrophobicContact CB-CG2 3.6Å; A88-R103 HydrophobicContact CB-CB 3.55Å; A88-R104 WeakPolarHBondContact O-CD 3.39Å; A88-R104 WeakPolarHBondContact O-CG 3.44Å; A88-R104 PolarHBondContact O-NE 3.13Å
89	V	81.2	Confident	75.3	Confident	17 Å²	17	61 Å²	61	10%	0.103	35%	0.351	C	S	.	.	H	α-helix	trans	-70.2	-32.5	175.4	-179.2	0	0	0	0	111.8	L85 V86 Q87 R104 F107 L138 L142	L85-V89 WeakPolarHBondContact O-CG2 3.44Å; L85-V89 PolarHBondContact O-N 3.31Å; V86-V89 WeakPolarHBondContact O-CB 3.4Å; V86-V89 PolarHBondContact O-N 3.21Å; V86-V89 VanDerWaalsContact O-N 3.09Å; Q87-V89 VanDerWaalsContact C-N 3.33Å; V89-R104 HydrophobicContact CB-CG 4.34Å; V89-R104 HydrophobicContact CG2-CG 4.03Å; V89-F107 HydrophobicContact CG2-CB 3.71Å; V89-F107 HydrophobicContact CG2-CD1 3.59Å; V89-F107 HydrophobicContact CG2-CD2 4.47Å; V89-F107 HydrophobicContact CG2-CE1 4.34Å; V89-F107 HydrophobicContact CG2-CG 3.66Å; V89-L138 HydrophobicContact CG1-CD1 4.29Å; V89-L138 HydrophobicContact CG1-CD2 4.36Å; V89-L142 HydrophobicContact CG1-CD1 4.37Å; V89-L142 HydrophobicContact CG1-CD2 4.32Å
90	R	76.3	Confident	74.8	Confident	46 Å²	46	61 Å²	61	17%	0.174	35%	0.354	C	S	.	.	H	α-helix	trans	-67	-34.2	176.8	-73.5	171.5	171.4	177.3	-8.5	113.9	V86 Q87 V92 E131 L135 L138	V86-R90 PolarHBondContact O-N 2.97Å; V86-R90 VanDerWaalsContact O-N 3.13Å; Q87-R90 PolarHBondContact O-N 3.44Å; Q87-R90 VanDerWaalsContact OE1-NH1 3.1Å; R90-V92 PolarHBondContact O-N 3.25Å; R90-E131 PolarHBondContact NH2-O 3.25Å; R90-L135 VanDerWaalsContact NH2-CG 3.3Å; R90-L138 HydrophobicContact CG-CD1 3.59Å
91	C	67.2	Low	74.4	Confident	45 Å²	45	60.7 Å²	60.7	30%	0.304	35%	0.351	S	S	.	.			trans	-76.9	106.9	179.7	-60.9	0	0	0	0	108.6	Q87 V96 R104	Q87-C91 PolarHBondContact O-N 3.32Å; Q87-C91 PolarHBondContact O-SG 2.8Å; C91-V96 HydrophobicContact CB-CG1 4.42Å; C91-V96 HydrophobicContact CB-CG2 4.35Å; C91-R104 PolarHBondContact O-NE 3.41Å; C91-R104 VanDerWaalsContact O-NE 3.15Å; C91-R104 PolarHBondContact O-NH1 3.09Å; C91-R104 PolarHBondContact O-NH2 3.4Å
92	V	62.1	Low	74.3	Confident	111 Å²	111	61.3 Å²	61.3	67%	0.673	35%	0.354	S	S	*	.			trans	-93.3	-15.1	-178.4	-177.1	0	0	0	0	112.4	R90	R90-V92 PolarHBondContact O-N 3.25Å
93	D	55.8	Low	74.1	Confident	115 Å²	115	65 Å²	65	62%	0.615	37%	0.368	S	S	*	.			trans	-60.1	150.3	-172.5	-60.2	-38.6	0	0	0	113.7	T95 V96	D93-T95 PolarHBondContact O-N 3.03Å; D93-V96 WeakPolarHBondContact O-CG2 3.29Å
94	A	52.4	Low	73.9	Confident	113 Å²	113	65.6 Å²	65.6	93%	0.934	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-8.7	-179.2	0	0	0	0	0	113.5
95	T	54.8	Low	73.8	Confident	129 Å²	129	65.1 Å²	65.1	79%	0.791	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	6.1	-172.2	51.5	0	0	0	0	114.2	D93	D93-T95 PolarHBondContact O-N 3.03Å
96	V	62.3	Low	73.8	Confident	42 Å²	42	65.1 Å²	65.1	26%	0.255	37%	0.367	S	S	.	.			trans	-80.5	140.1	-171.1	-135.9	0	0	0	0	112.2	C91 D93 T100	C91-V96 HydrophobicContact CB-CG1 4.42Å; C91-V96 HydrophobicContact CB-CG2 4.35Å; D93-V96 WeakPolarHBondContact O-CG2 3.29Å; V96-T100 HydrophobicContact CB-CG2 4.37Å; V96-T100 HydrophobicContact CG1-CG2 3.63Å
97	D	73.4	Confident	73.9	Confident	119 Å²	119	65 Å²	65	64%	0.636	37%	0.366	S	S	*	.			trans	-42.8	142.5	175.7	-56.4	-32.6	0	0	0	112.8	A99 T100 A101	D97-A99 PolarHBondContact O-N 3.4Å; D97-T100 PolarHBondContact O-N 3.2Å; D97-A101 PolarHBondContact O-N 3.37Å
98	Q	73.8	Confident	74	Confident	169 Å²	169	65 Å²	65	79%	0.79	37%	0.369	S	S	*	.	H	α-helix	trans	-49	-33.5	177.5	-81.7	179.7	-14.5	0	0	112.9	T100 F102	Q98-T100 PolarHBondContact O-N 3.19Å; Q98-F102 WeakPolarHBondContact O-CB 3.37Å; Q98-F102 PolarHBondContact O-N 3.32Å
99	A	75.1	Confident	74	Confident	54 Å²	54	67.1 Å²	67.1	45%	0.446	39%	0.391	S	S	.	.	H	α-helix	trans	-64.5	-36.8	176.7	0	0	0	0	0	113.2	D97 R103	D97-A99 PolarHBondContact O-N 3.4Å; A99-R103 VanDerWaalsContact O-CG 3.28Å; A99-R103 WeakPolarHBondContact O-CG 3.49Å; A99-R103 PolarHBondContact O-N 3.29Å
100	T	76.4	Confident	74.2	Confident	22 Å²	22	66.6 Å²	66.6	14%	0.135	39%	0.388	C	S	.	.	H	α-helix	trans	-76.5	-39.5	179.4	-50.1	0	0	0	0	110.8	A88 V96 D97 Q98 F102 R103 R104	A88-T100 HydrophobicContact CB-CG2 3.6Å; V96-T100 HydrophobicContact CB-CG2 4.37Å; V96-T100 HydrophobicContact CG1-CG2 3.63Å; D97-T100 PolarHBondContact O-N 3.2Å; Q98-T100 PolarHBondContact O-N 3.19Å; T100-F102 VanDerWaalsContact C-N 3.34Å; T100-F102 PolarHBondContact O-N 2.86Å; T100-R103 PolarHBondContact O-N 3.37Å; T100-R104 PolarHBondContact O-N 2.92Å
101	A	78.8	Confident	74.6	Confident	40 Å²	40	69 Å²	69	33%	0.331	40%	0.404	S	S	.	.	H	α-helix	trans	-60.1	-43.7	171.2	0	0	0	0	0	111.6	D97 R104 M105	D97-A101 PolarHBondContact O-N 3.37Å; A101-R104 VanDerWaalsContact O-CB 3.27Å; A101-R104 WeakPolarHBondContact O-CB 3.47Å; A101-R104 PolarHBondContact O-N 3.41Å; A101-M105 PolarHBondContact O-N 2.9Å; A101-M105 VanDerWaalsContact O-N 3.07Å
102	F	82	Confident	75.4	Confident	20 Å²	20	70.7 Å²	70.7	9%	0.088	41%	0.414	C	S	.	.	H	α-helix	trans	-62.4	-46.9	176.5	-174.6	-97.7	0	0	0	112.4	C53 Q56 V58 Q98 T100 R104 M105 V106	C53-F102 HydrophobicContact CB-CD1 4.49Å; C53-F102 HydrophobicContact CB-CE1 3.96Å; Q56-F102 VanDerWaalsContact C-CE2 3.41Å; Q56-F102 VanDerWaalsContact CA-CE2 3.44Å; Q56-F102 HydrophobicContact CB-CD2 4.49Å; Q56-F102 HydrophobicContact CB-CE2 4.08Å; Q56-F102 WeakPolarHBondContact O-CE2 3.37Å; V58-F102 HydrophobicContact CG2-CD2 4.18Å; V58-F102 HydrophobicContact CG2-CE2 3.55Å; V58-F102 HydrophobicContact CG2-CZ 4.21Å; Q98-F102 WeakPolarHBondContact O-CB 3.37Å; Q98-F102 PolarHBondContact O-N 3.32Å; T100-F102 VanDerWaalsContact C-N 3.34Å; T100-F102 PolarHBondContact O-N 2.86Å; F102-R104 PolarHBondContact O-N 2.91Å; F102-M105 HydrophobicContact CB-CE 4.36Å; F102-M105 HydrophobicContact CD2-CE 3.95Å; F102-M105 WeakPolarHBondContact O-CB 3.39Å; F102-M105 PolarHBondContact O-N 2.92Å; F102-V106 HydrophobicContact CD1-CG2 3.86Å; F102-V106 HydrophobicContact CE1-CG2 3.4Å; F102-V106 HydrophobicContact CE2-CG2 4.49Å; F102-V106 HydrophobicContact CZ-CG2 3.77Å; F102-V106 WeakPolarHBondContact O-CG2 3.29Å; F102-V106 PolarHBondContact O-N 3.32Å
103	R	81.4	Confident	76.4	Confident	77 Å²	77	68.6 Å²	68.6	29%	0.291	41%	0.409	S	S	.	.	H	α-helix	trans	-58.5	-35.7	175.6	-75.8	175.4	-170.7	165.4	6.6	112.6	L85 A88 A99 T100 V106 F107	L85-R103 HydrophobicContact CD2-CB 3.86Å; L85-R103 HydrophobicContact CD2-CG 3.96Å; A88-R103 HydrophobicContact CB-CB 3.55Å; A99-R103 VanDerWaalsContact O-CG 3.28Å; A99-R103 WeakPolarHBondContact O-CG 3.49Å; A99-R103 PolarHBondContact O-N 3.29Å; T100-R103 PolarHBondContact O-N 3.37Å; R103-V106 PolarHBondContact O-N 3.37Å; R103-F107 PolarHBondContact O-N 2.74Å
104	R	81.3	Confident	77.8	Confident	55 Å²	55	63.9 Å²	63.9	21%	0.208	38%	0.384	C	S	.	.	H	α-helix	trans	-60.8	-48.3	172.5	-125	-178.6	-71.5	161.1	4.6	111.7	A88 V89 C91 T100 A101 F102 V106 F107 N108	A88-R104 WeakPolarHBondContact O-CD 3.39Å; A88-R104 WeakPolarHBondContact O-CG 3.44Å; A88-R104 PolarHBondContact O-NE 3.13Å; V89-R104 HydrophobicContact CB-CG 4.34Å; V89-R104 HydrophobicContact CG2-CG 4.03Å; C91-R104 PolarHBondContact O-NE 3.41Å; C91-R104 VanDerWaalsContact O-NE 3.15Å; C91-R104 PolarHBondContact O-NH1 3.09Å; C91-R104 PolarHBondContact O-NH2 3.4Å; T100-R104 PolarHBondContact O-N 2.92Å; A101-R104 VanDerWaalsContact O-CB 3.27Å; A101-R104 WeakPolarHBondContact O-CB 3.47Å; A101-R104 PolarHBondContact O-N 3.41Å; F102-R104 PolarHBondContact O-N 2.91Å; R104-V106 VanDerWaalsContact C-N 3.32Å; R104-V106 PolarHBondContact O-N 3.36Å; R104-F107 PolarHBondContact O-N 2.8Å; R104-N108 WeakPolarHBondContact O-CB 3.45Å; R104-N108 VanDerWaalsContact O-CG 3.32Å; R104-N108 PolarHBondContact O-N 2.9Å
105	M	82.6	Confident	79.5	Confident	96 Å²	96	59.3 Å²	59.3	47%	0.473	34%	0.343	S	S	.	.	H	α-helix	trans	-61.3	-40.7	176.5	-67.5	-172.2	-72.8	0	0	111.9	V58 A101 F102 N108 G109	V58-M105 HydrophobicContact CG1-CB 3.97Å; V58-M105 VanDerWaalsContact CG1-O 3.31Å; V58-M105 WeakPolarHBondContact CG1-O 3.34Å; V58-M105 HydrophobicContact CG2-CB 3.99Å; A101-M105 PolarHBondContact O-N 2.9Å; A101-M105 VanDerWaalsContact O-N 3.07Å; F102-M105 HydrophobicContact CB-CE 4.36Å; F102-M105 HydrophobicContact CD2-CE 3.95Å; F102-M105 WeakPolarHBondContact O-CB 3.39Å; F102-M105 PolarHBondContact O-N 2.92Å; M105-N108 PolarHBondContact O-N 3.33Å; M105-G109 PolarHBondContact O-N 3.07Å
106	V	85.3	Confident	80.9	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.8	-45.2	177.1	175.8	0	0	0	0	111.4	F49 V58 A61 A62 L85 F102 R103 R104 G109 L110	F49-V106 HydrophobicContact CE2-CG1 4.23Å; V58-V106 HydrophobicContact CG1-CG2 4.36Å; A61-V106 HydrophobicContact CB-CG1 3.93Å; A61-V106 HydrophobicContact CB-CG2 3.75Å; A62-V106 HydrophobicContact CB-CG1 4.44Å; L85-V106 HydrophobicContact CD2-CB 4.4Å; L85-V106 HydrophobicContact CD2-CG1 4.34Å; F102-V106 HydrophobicContact CD1-CG2 3.86Å; F102-V106 HydrophobicContact CE1-CG2 3.4Å; F102-V106 HydrophobicContact CE2-CG2 4.49Å; F102-V106 HydrophobicContact CZ-CG2 3.77Å; F102-V106 WeakPolarHBondContact O-CG2 3.29Å; F102-V106 PolarHBondContact O-N 3.32Å; R103-V106 PolarHBondContact O-N 3.37Å; R104-V106 VanDerWaalsContact C-N 3.32Å; R104-V106 PolarHBondContact O-N 3.36Å; V106-G109 PolarHBondContact O-N 3.11Å; V106-L110 PolarHBondContact O-N 3.47Å
107	F	85.7	Confident	82.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.7	-46.1	176.8	-172.4	-90.3	0	0	0	111.3	L85 V86 V89 R103 R104 G109 L110 Q115 L119 L142	L85-F107 HydrophobicContact CB-CD2 4.2Å; V86-F107 HydrophobicContact CG2-CE2 4Å; V89-F107 HydrophobicContact CG2-CB 3.71Å; V89-F107 HydrophobicContact CG2-CD1 3.59Å; V89-F107 HydrophobicContact CG2-CD2 4.47Å; V89-F107 HydrophobicContact CG2-CE1 4.34Å; V89-F107 HydrophobicContact CG2-CG 3.66Å; R103-F107 PolarHBondContact O-N 2.74Å; R104-F107 PolarHBondContact O-N 2.8Å; F107-G109 PolarHBondContact O-N 3.11Å; F107-L110 HydrophobicContact CD2-CD1 4.03Å; F107-L110 HydrophobicContact CE2-CD1 4.46Å; F107-L110 HydrophobicContact CG-CD1 4.5Å; F107-L110 VanDerWaalsContact O-CB 3.29Å; F107-L110 WeakPolarHBondContact O-CB 3.48Å; F107-L110 WeakPolarHBondContact O-CG 3.46Å; F107-L110 PolarHBondContact O-N 2.89Å; F107-Q115 HydrophobicContact CD1-CG 4.28Å; F107-Q115 HydrophobicContact CE1-CB 3.99Å; F107-Q115 HydrophobicContact CE1-CG 3.8Å; F107-Q115 HydrophobicContact CZ-CB 3.87Å; F107-Q115 HydrophobicContact CZ-CG 3.98Å; F107-Q115 PolarHBondContact O-NE2 3.36Å; F107-L119 HydrophobicContact CZ-CD1 4Å; F107-L119 HydrophobicContact CZ-CD2 4.5Å; F107-L119 HydrophobicContact CZ-CG 4.11Å; F107-L142 HydrophobicContact CE1-CD1 4.09Å
108	N	84.5	Confident	82.7	Confident	93 Å²	93	51 Å²	51	50%	0.497	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-22.8	178	-69.1	-11.9	0	0	0	113.3	R104 M105 L110 Q115	R104-N108 WeakPolarHBondContact O-CB 3.45Å; R104-N108 VanDerWaalsContact O-CG 3.32Å; R104-N108 PolarHBondContact O-N 2.9Å; M105-N108 PolarHBondContact O-N 3.33Å; N108-L110 VanDerWaalsContact C-N 3.33Å; N108-Q115 PolarHBondContact O-NE2 3.1Å
109	G	80.7	Confident	83.3	Confident	46 Å²	46	43 Å²	43	47%	0.474	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-9.5	174	0	0	0	0	0	114.7	M105 V106 F107	M105-G109 PolarHBondContact O-N 3.07Å; V106-G109 PolarHBondContact O-N 3.11Å; F107-G109 PolarHBondContact O-N 3.11Å
110	L	86.3	Confident	83.8	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.031	25%	0.248	C	C	.	.	S	Bend	trans	-72	153.7	172.2	-62.1	167.2	0	0	0	110.6	A62 V65 V106 F107 N108 L114 Q115 L118	A62-L110 HydrophobicContact CB-CD2 3.96Å; A62-L110 HydrophobicContact CB-CG 4.4Å; A62-L110 VanDerWaalsContact O-CD2 3.3Å; A62-L110 WeakPolarHBondContact O-CD2 3.32Å; V65-L110 HydrophobicContact CB-CD2 4.05Å; V65-L110 HydrophobicContact CG1-CD1 4.27Å; V65-L110 HydrophobicContact CG1-CD2 3.99Å; V106-L110 PolarHBondContact O-N 3.47Å; F107-L110 HydrophobicContact CD2-CD1 4.03Å; F107-L110 HydrophobicContact CE2-CD1 4.46Å; F107-L110 HydrophobicContact CG-CD1 4.5Å; F107-L110 VanDerWaalsContact O-CB 3.29Å; F107-L110 WeakPolarHBondContact O-CB 3.48Å; F107-L110 WeakPolarHBondContact O-CG 3.46Å; F107-L110 PolarHBondContact O-N 2.89Å; N108-L110 VanDerWaalsContact C-N 3.33Å; L110-L114 HydrophobicContact CD2-CD2 4.18Å; L110-Q115 HydrophobicContact CB-CG 3.8Å; L110-Q115 PolarHBondContact O-NE2 3.37Å; L110-Q115 VanDerWaalsContact O-NE2 3.11Å; L110-L118 HydrophobicContact CD1-CD1 4.11Å
111	L	85.4	Confident	84.2	Confident	96 Å²	96	44.8 Å²	44.8	50%	0.503	25%	0.254	S	S	.	.			trans	-57.7	135	172.1	-73.5	160.5	0	0	0	110.1	A113 L114 Q115	L111-A113 PolarHBondContact O-N 3.16Å; L111-A113 VanDerWaalsContact O-N 3.16Å; L111-L114 HydrophobicContact CB-CB 4.28Å; L111-L114 WeakPolarHBondContact O-CA 3.46Å; L111-L114 WeakPolarHBondContact O-CB 3.08Å; L111-L114 PolarHBondContact O-N 2.98Å; L111-Q115 PolarHBondContact O-N 3.06Å
112	P	83.3	Confident	84.5	Confident	81 Å²	81	43.1 Å²	43.1	53%	0.526	24%	0.24	S	C	.	.	H	α-helix	trans	-54.1	-38.4	-178.9	-28.8	34.9	0	0	0	113.7	L114 Q115 Q116 F143	P112-L114 VanDerWaalsContact C-N 3.34Å; P112-L114 PolarHBondContact O-N 3.36Å; P112-Q115 WeakPolarHBondContact O-CB 3.4Å; P112-Q115 PolarHBondContact O-N 3.03Å; P112-Q116 PolarHBondContact O-N 3.25Å; P112-F143 HydrophobicContact CB-CE1 4.26Å
113	A	83.7	Confident	84.6	Confident	68 Å²	68	43.6 Å²	43.6	56%	0.562	24%	0.242	S	C	*	.	H	α-helix	trans	-60.7	-42.2	175.1	0	0	0	0	0	112.2	L111 Q116 T117	L111-A113 PolarHBondContact O-N 3.16Å; L111-A113 VanDerWaalsContact O-N 3.16Å; A113-Q116 PolarHBondContact O-N 3.45Å; A113-T117 PolarHBondContact O-N 2.96Å; A113-T117 PolarHBondContact O-OG1 3Å
114	L	85.1	Confident	84.8	Confident	16 Å²	16	47.3 Å²	47.3	8%	0.084	26%	0.262	C	S	.	.	H	α-helix	trans	-70.9	-37.6	178.5	-178.7	62.2	0	0	0	111.7	Q66 Y69 L110 L111 P112 Q116 T117 L118	Q66-L114 HydrophobicContact CB-CD2 3.85Å; Q66-L114 HydrophobicContact CG-CD2 3.82Å; Y69-L114 HydrophobicContact CD1-CD1 3.47Å; Y69-L114 VanDerWaalsContact CD1-CD1 3.47Å; Y69-L114 HydrophobicContact CD2-CD1 4.49Å; Y69-L114 HydrophobicContact CE1-CD1 3.69Å; Y69-L114 HydrophobicContact CG-CD1 3.9Å; L110-L114 HydrophobicContact CD2-CD2 4.18Å; L111-L114 HydrophobicContact CB-CB 4.28Å; L111-L114 WeakPolarHBondContact O-CA 3.46Å; L111-L114 WeakPolarHBondContact O-CB 3.08Å; L111-L114 PolarHBondContact O-N 2.98Å; P112-L114 VanDerWaalsContact C-N 3.34Å; P112-L114 PolarHBondContact O-N 3.36Å; L114-Q116 VanDerWaalsContact C-N 3.32Å; L114-Q116 PolarHBondContact O-N 2.77Å; L114-T117 PolarHBondContact O-N 2.86Å; L114-L118 HydrophobicContact CD1-CD1 4.24Å; L114-L118 HydrophobicContact CD1-CD2 4.49Å; L114-L118 HydrophobicContact CD1-CG 4Å; L114-L118 HydrophobicContact CG-CD1 3.94Å; L114-L118 HydrophobicContact CG-CG 4.17Å; L114-L118 WeakPolarHBondContact O-CB 3.45Å; L114-L118 VanDerWaalsContact O-CG 3.25Å; L114-L118 WeakPolarHBondContact O-CG 3.31Å; L114-L118 PolarHBondContact O-N 3.21Å
115	Q	87.4	Confident	84.8	Confident	17 Å²	17	50 Å²	50	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-57.2	-47.2	173.8	-69.1	171	-6.8	0	0	110.9	F107 N108 L110 L111 P112 L119 F143	F107-Q115 HydrophobicContact CD1-CG 4.28Å; F107-Q115 HydrophobicContact CE1-CB 3.99Å; F107-Q115 HydrophobicContact CE1-CG 3.8Å; F107-Q115 HydrophobicContact CZ-CB 3.87Å; F107-Q115 HydrophobicContact CZ-CG 3.98Å; F107-Q115 PolarHBondContact O-NE2 3.36Å; N108-Q115 PolarHBondContact O-NE2 3.1Å; L110-Q115 HydrophobicContact CB-CG 3.8Å; L110-Q115 PolarHBondContact O-NE2 3.37Å; L110-Q115 VanDerWaalsContact O-NE2 3.11Å; L111-Q115 PolarHBondContact O-N 3.06Å; P112-Q115 WeakPolarHBondContact O-CB 3.4Å; P112-Q115 PolarHBondContact O-N 3.03Å; Q115-L119 WeakPolarHBondContact O-CB 3.29Å; Q115-L119 WeakPolarHBondContact O-CG 3.06Å; Q115-L119 PolarHBondContact O-N 3.1Å; Q115-L119 VanDerWaalsContact O-N 3.1Å; Q115-F143 HydrophobicContact CB-CZ 3.81Å
116	Q	85.5	Confident	84.8	Confident	59 Å²	59	47.2 Å²	47.2	28%	0.276	26%	0.261	S	S	.	.	H	α-helix	trans	-62.9	-46.8	177.6	-170	-178	9.5	0	0	111.4	P112 A113 L114 L119 L120 L139 F143 F150	P112-Q116 PolarHBondContact O-N 3.25Å; A113-Q116 PolarHBondContact O-N 3.45Å; L114-Q116 VanDerWaalsContact C-N 3.32Å; L114-Q116 PolarHBondContact O-N 2.77Å; Q116-L119 PolarHBondContact O-N 3.4Å; Q116-L120 HydrophobicContact CG-CD1 4.12Å; Q116-L120 VanDerWaalsContact O-CG 3.32Å; Q116-L120 WeakPolarHBondContact O-CG 3.15Å; Q116-L120 PolarHBondContact O-N 2.87Å; Q116-L139 HydrophobicContact CG-CD2 4.31Å; Q116-F143 HydrophobicContact CB-CD2 4.5Å; Q116-F143 HydrophobicContact CB-CE1 4.38Å; Q116-F143 HydrophobicContact CB-CE2 3.94Å; Q116-F143 HydrophobicContact CB-CZ 3.87Å; Q116-F143 HydrophobicContact CG-CD2 4.5Å; Q116-F143 HydrophobicContact CG-CE2 4.37Å; Q116-F150 HydrophobicContact CG-CZ 4.34Å
117	T	86.8	Confident	84.4	Confident	55 Å²	55	52.6 Å²	52.6	34%	0.337	30%	0.296	S	S	.	.	H	α-helix	trans	-62.4	-44.9	178.9	-50.9	0	0	0	0	112.2	Y69 A113 L114 L119 L120 E121	Y69-T117 VanDerWaalsContact OH-CG2 3.25Å; Y69-T117 WeakPolarHBondContact OH-CG2 3.43Å; A113-T117 PolarHBondContact O-N 2.96Å; A113-T117 PolarHBondContact O-OG1 3Å; L114-T117 PolarHBondContact O-N 2.86Å; T117-L119 VanDerWaalsContact C-N 3.31Å; T117-L119 PolarHBondContact O-N 3.35Å; T117-L120 PolarHBondContact O-N 3.34Å; T117-E121 HydrophobicContact CG2-CG 4.48Å; T117-E121 PolarHBondContact O-N 3.03Å
118	L	86.6	Confident	84.2	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-61.5	-40.4	178.5	-73.8	173.8	0	0	0	111.9	Y69 F78 W79 V82 L110 L114 L122	Y69-L118 HydrophobicContact CD2-CD2 3.49Å; Y69-L118 VanDerWaalsContact CD2-CD2 3.49Å; Y69-L118 HydrophobicContact CE2-CD2 3.77Å; Y69-L118 HydrophobicContact CG-CD2 4.22Å; F78-L118 HydrophobicContact CE1-CD2 4.05Å; F78-L118 HydrophobicContact CZ-CD2 3.95Å; W79-L118 HydrophobicContact CH2-CD2 4.1Å; W79-L118 HydrophobicContact CZ3-CD2 4.18Å; V82-L118 HydrophobicContact CG1-CB 4.26Å; V82-L118 HydrophobicContact CG1-CD1 4.42Å; V82-L118 HydrophobicContact CG1-CD2 4.39Å; V82-L118 HydrophobicContact CG2-CD2 4.37Å; L110-L118 HydrophobicContact CD1-CD1 4.11Å; L114-L118 HydrophobicContact CD1-CD1 4.24Å; L114-L118 HydrophobicContact CD1-CD2 4.49Å; L114-L118 HydrophobicContact CD1-CG 4Å; L114-L118 HydrophobicContact CG-CD1 3.94Å; L114-L118 HydrophobicContact CG-CG 4.17Å; L114-L118 WeakPolarHBondContact O-CB 3.45Å; L114-L118 VanDerWaalsContact O-CG 3.25Å; L114-L118 WeakPolarHBondContact O-CG 3.31Å; L114-L118 PolarHBondContact O-N 3.21Å; L118-L122 VanDerWaalsContact O-CB 3.29Å; L118-L122 WeakPolarHBondContact O-CB 3.23Å; L118-L122 PolarHBondContact O-N 3.42Å
119	L	86	Confident	84.1	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.9	-38.6	177.1	-75.5	169	0	0	0	112.2	V86 F107 Q115 Q116 T117 F123 L135 L138 L139 L142 F143	V86-L119 HydrophobicContact CB-CD2 4.44Å; V86-L119 HydrophobicContact CG1-CD2 3.8Å; V86-L119 HydrophobicContact CG2-CD2 3.7Å; F107-L119 HydrophobicContact CZ-CD1 4Å; F107-L119 HydrophobicContact CZ-CD2 4.5Å; F107-L119 HydrophobicContact CZ-CG 4.11Å; Q115-L119 WeakPolarHBondContact O-CB 3.29Å; Q115-L119 WeakPolarHBondContact O-CG 3.06Å; Q115-L119 PolarHBondContact O-N 3.1Å; Q115-L119 VanDerWaalsContact O-N 3.1Å; Q116-L119 PolarHBondContact O-N 3.4Å; T117-L119 VanDerWaalsContact C-N 3.31Å; T117-L119 PolarHBondContact O-N 3.35Å; L119-F123 WeakPolarHBondContact O-CB 3.36Å; L119-F123 PolarHBondContact O-N 3.47Å; L119-L135 HydrophobicContact CD2-CD2 3.96Å; L119-L138 HydrophobicContact CD1-CD2 4.11Å; L119-L138 HydrophobicContact CD2-CD2 3.67Å; L119-L139 HydrophobicContact CB-CD1 4.42Å; L119-L139 HydrophobicContact CB-CD2 3.67Å; L119-L139 HydrophobicContact CB-CG 4.05Å; L119-L139 HydrophobicContact CD1-CD2 3.72Å; L119-L139 HydrophobicContact CD1-CG 4.21Å; L119-L139 HydrophobicContact CG-CD2 4.35Å; L119-L142 HydrophobicContact CD1-CD1 3.81Å; L119-F143 HydrophobicContact CD1-CE2 4.21Å
120	L	85.1	Confident	84.2	Confident	58 Å²	58	57 Å²	57	30%	0.304	30%	0.304	S	S	.	.	H	α-helix	trans	-67.8	-44.4	176.2	-72.8	172.1	0	0	0	112.3	Q116 T117 L122 F123 E124 L139 F150	Q116-L120 HydrophobicContact CG-CD1 4.12Å; Q116-L120 VanDerWaalsContact O-CG 3.32Å; Q116-L120 WeakPolarHBondContact O-CG 3.15Å; Q116-L120 PolarHBondContact O-N 2.87Å; T117-L120 PolarHBondContact O-N 3.34Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L120-F123 WeakPolarHBondContact O-CB 3.33Å; L120-F123 PolarHBondContact O-N 2.91Å; L120-E124 PolarHBondContact O-N 3.49Å; L120-L139 HydrophobicContact CD2-CD1 3.93Å; L120-L139 HydrophobicContact CG-CD1 4.45Å; L120-F150 HydrophobicContact CD2-CE1 4.07Å
121	E	85.4	Confident	83.8	Confident	57 Å²	57	59.8 Å²	59.8	27%	0.266	32%	0.317	S	S	.	.	H	α-helix	trans	-67.4	-36.3	176.1	-73.8	-167.4	-175.7	0	0	112	Y69 W79 T117 F123 E124 K125	Y69-E121 PolarHBondContact OH-OE1 3.46Å; W79-E121 HydrophobicContact CH2-CB 3.47Å; W79-E121 VanDerWaalsContact CH2-CB 3.47Å; W79-E121 HydrophobicContact CH2-CG 4.36Å; W79-E121 WeakPolarHBondContact CH2-OE2 3.22Å; W79-E121 HydrophobicContact CZ2-CB 4.21Å; W79-E121 WeakPolarHBondContact CZ2-OE2 3.34Å; W79-E121 HydrophobicContact CZ3-CB 4.08Å; T117-E121 HydrophobicContact CG2-CG 4.48Å; T117-E121 PolarHBondContact O-N 3.03Å; E121-F123 VanDerWaalsContact C-N 3.32Å; E121-E124 PolarHBondContact O-N 3.23Å; E121-K125 WeakPolarHBondContact O-CB 3.47Å; E121-K125 VanDerWaalsContact O-CG 3.3Å; E121-K125 WeakPolarHBondContact O-CG 3.25Å; E121-K125 PolarHBondContact O-N 2.94Å; E121-K125 VanDerWaalsContact O-N 3.09Å
122	L	84.5	Confident	83.7	Confident	5 Å²	5	57 Å²	57	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-45.6	170.2	-103.3	158	0	0	0	111.1	W79 V82 V86 L118 L120 E124 K125 Q126 L135	W79-L122 HydrophobicContact CE3-CD1 4.47Å; W79-L122 HydrophobicContact CE3-CG 3.91Å; W79-L122 HydrophobicContact CZ3-CD1 4.47Å; W79-L122 HydrophobicContact CZ3-CG 3.99Å; V82-L122 HydrophobicContact CB-CD1 4.13Å; V82-L122 HydrophobicContact CG1-CD1 3.41Å; V82-L122 VanDerWaalsContact CG1-CD1 3.41Å; V86-L122 HydrophobicContact CG2-CD1 3.83Å; L118-L122 VanDerWaalsContact O-CB 3.29Å; L118-L122 WeakPolarHBondContact O-CB 3.23Å; L118-L122 PolarHBondContact O-N 3.42Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L122-E124 VanDerWaalsContact C-N 3.29Å; L122-E124 PolarHBondContact O-N 3.02Å; L122-K125 PolarHBondContact O-N 3.17Å; L122-K125 VanDerWaalsContact O-N 3.14Å; L122-Q126 WeakPolarHBondContact O-CG 3.36Å; L122-Q126 PolarHBondContact O-N 3.48Å; L122-L135 HydrophobicContact CB-CD1 4.21Å
123	F	85.1	Confident	83.6	Confident	30 Å²	30	53.2 Å²	53.2	13%	0.132	28%	0.276	C	S	.	.	H	α-helix	trans	-57.6	-41.7	178	166.3	-89.4	0	0	0	112.3	L119 L120 E121 K132 L135 V136 M153 L157	L119-F123 WeakPolarHBondContact O-CB 3.36Å; L119-F123 PolarHBondContact O-N 3.47Å; L120-F123 WeakPolarHBondContact O-CB 3.33Å; L120-F123 PolarHBondContact O-N 2.91Å; E121-F123 VanDerWaalsContact C-N 3.32Å; F123-K132 HydrophobicContact CD2-CB 3.95Å; F123-K132 HydrophobicContact CD2-CD 4.45Å; F123-K132 HydrophobicContact CD2-CG 3.9Å; F123-K132 HydrophobicContact CE2-CB 3.71Å; F123-K132 HydrophobicContact CE2-CD 4.02Å; F123-K132 HydrophobicContact CE2-CG 3.84Å; F123-K132 HydrophobicContact CZ-CD 4.33Å; F123-K132 VanDerWaalsContact O-CE 3.3Å; F123-K132 WeakPolarHBondContact O-CE 3.41Å; F123-L135 HydrophobicContact CB-CD1 4.14Å; F123-V136 HydrophobicContact CD2-CG2 3.77Å; F123-V136 HydrophobicContact CE2-CG2 3.68Å; F123-M153 HydrophobicContact CZ-SD 4.48Å; F123-L157 HydrophobicContact CE2-CD1 3.53Å; F123-L157 HydrophobicContact CZ-CD1 3.58Å; F123-L157 HydrophobicContact CZ-CD2 4.25Å
124	E	84.8	Confident	83.5	Confident	155 Å²	155	53 Å²	53	72%	0.724	26%	0.263	S	S	*	.	H	α-helix	trans	-66.9	-37.7	176.6	-69.6	-167.1	165.6	0	0	112.7	L120 E121 L122	L120-E124 PolarHBondContact O-N 3.49Å; E121-E124 PolarHBondContact O-N 3.23Å; L122-E124 VanDerWaalsContact C-N 3.29Å; L122-E124 PolarHBondContact O-N 3.02Å
125	K	81.7	Confident	83.3	Confident	110 Å²	110	52.5 Å²	52.5	48%	0.478	26%	0.26	S	S	.	.	H	α-helix	trans	-79.7	-20.8	-176.5	-69.6	179.1	-172.6	-132.6	0	114.4	W79 E121 L122	W79-K125 HydrophobicContact CD2-CD 4.04Å; W79-K125 HydrophobicContact CG-CD 4.33Å; W79-K125 HydrophobicContact CZ2-CD 4.37Å; E121-K125 WeakPolarHBondContact O-CB 3.47Å; E121-K125 VanDerWaalsContact O-CG 3.3Å; E121-K125 WeakPolarHBondContact O-CG 3.25Å; E121-K125 PolarHBondContact O-N 2.94Å; E121-K125 VanDerWaalsContact O-N 3.09Å; L122-K125 PolarHBondContact O-N 3.17Å; L122-K125 VanDerWaalsContact O-N 3.14Å
126	Q	82	Confident	83	Confident	38 Å²	38	51.7 Å²	51.7	18%	0.178	26%	0.256	C	S	.	.			trans	-70	132.5	-179.5	-72.7	-50.9	-27.3	0	0	111.5	L122 E131 K132 L135	L122-Q126 WeakPolarHBondContact O-CG 3.36Å; L122-Q126 PolarHBondContact O-N 3.48Å; Q126-E131 HydrophobicContact CG-CB 4.43Å; Q126-E131 PolarHBondContact OE1-OE2 3.28Å; Q126-K132 HydrophobicContact CB-CG 4.28Å; Q126-K132 WeakPolarHBondContact O-CE 3.34Å; Q126-K132 PolarHBondContact O-NZ 3.16Å; Q126-K132 VanDerWaalsContact O-NZ 3.09Å; Q126-L135 HydrophobicContact CG-CD1 3.93Å
127	P	76.8	Confident	82.6	Confident	114 Å²	114	49.1 Å²	49.1	74%	0.74	25%	0.245	S	C	*	.			trans	-82.3	-29.4	170.8	31.3	-32.2	0	0	0	111.8
128	D	81.9	Confident	82.3	Confident	69 Å²	69	47 Å²	47	37%	0.369	23%	0.232	S	C	.	.			trans	-77.1	131.2	-175.5	-179	34.4	0	0	0	112.3	Q130 E131 K132	D128-Q130 PolarHBondContact OD1-N 3.07Å; D128-E131 HydrophobicContact CB-CB 4.26Å; D128-E131 HydrophobicContact CB-CG 4.28Å; D128-E131 WeakPolarHBondContact OD2-CG 3.41Å; D128-E131 PolarHBondContact OD2-N 3.44Å; D128-E131 VanDerWaalsContact OD2-N 3.16Å; D128-K132 WeakPolarHBondContact O-CG 3.25Å; D128-K132 PolarHBondContact O-N 3.31Å
129	Q	82.5	Confident	82.1	Confident	81 Å²	81	47 Å²	47	38%	0.379	23%	0.231	S	C	.	.	H	α-helix	trans	-73.8	-33.7	-176.8	-61.5	177.3	-5.5	0	0	111.4	K132 C133 Y161 F177	Q129-K132 WeakPolarHBondContact O-CB 3.4Å; Q129-K132 PolarHBondContact O-N 3.42Å; Q129-C133 PolarHBondContact O-N 3.36Å; Q129-Y161 HydrophobicContact CB-CD1 4.18Å; Q129-Y161 HydrophobicContact CB-CD2 3.99Å; Q129-Y161 HydrophobicContact CB-CE1 4.13Å; Q129-Y161 HydrophobicContact CB-CE2 3.93Å; Q129-Y161 HydrophobicContact CB-CG 4.12Å; Q129-Y161 VanDerWaalsContact CD-CE1 3.46Å; Q129-Y161 HydrophobicContact CG-CD1 3.85Å; Q129-Y161 HydrophobicContact CG-CD2 4.47Å; Q129-Y161 HydrophobicContact CG-CE1 3.56Å; Q129-Y161 HydrophobicContact CG-CE2 4.23Å; Q129-Y161 HydrophobicContact CG-CG 4.31Å; Q129-F177 HydrophobicContact CB-CE1 4.17Å; Q129-F177 HydrophobicContact CB-CZ 3.85Å
130	Q	82.1	Confident	81.7	Confident	82 Å²	82	47.4 Å²	47.4	38%	0.383	23%	0.233	S	C	.	.	H	α-helix	trans	-69.2	-46.4	178.3	-60.2	-173.1	-18.5	0	0	110.8	D128 K132 C133 Q134 F176 F177	D128-Q130 PolarHBondContact OD1-N 3.07Å; Q130-K132 VanDerWaalsContact C-N 3.26Å; Q130-K132 PolarHBondContact O-N 3.45Å; Q130-C133 PolarHBondContact O-N 3.32Å; Q130-Q134 WeakPolarHBondContact O-CG 3.3Å; Q130-Q134 PolarHBondContact O-N 3.09Å; Q130-F176 HydrophobicContact CB-CD1 3.95Å; Q130-F176 HydrophobicContact CB-CE1 3.7Å; Q130-F176 HydrophobicContact CB-CZ 4.23Å; Q130-F176 HydrophobicContact CG-CD1 3.58Å; Q130-F176 HydrophobicContact CG-CE1 3.9Å; Q130-F176 HydrophobicContact CG-CG 4.13Å; Q130-F177 HydrophobicContact CG-CE1 4.04Å; Q130-F177 HydrophobicContact CG-CZ 3.78Å
131	E	78.3	Confident	81.4	Confident	64 Å²	64	51.2 Å²	51.2	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-58.5	-37.6	174.9	-73.5	-141.7	157.9	0	0	112.8	R90 Q126 D128 Q134 L135	R90-E131 PolarHBondContact NH2-O 3.25Å; Q126-E131 HydrophobicContact CG-CB 4.43Å; Q126-E131 PolarHBondContact OE1-OE2 3.28Å; D128-E131 HydrophobicContact CB-CB 4.26Å; D128-E131 HydrophobicContact CB-CG 4.28Å; D128-E131 WeakPolarHBondContact OD2-CG 3.41Å; D128-E131 PolarHBondContact OD2-N 3.44Å; D128-E131 VanDerWaalsContact OD2-N 3.16Å; E131-Q134 PolarHBondContact O-N 3.14Å; E131-L135 WeakPolarHBondContact O-CB 3.49Å; E131-L135 VanDerWaalsContact O-CG 3.31Å; E131-L135 WeakPolarHBondContact O-CG 3.38Å; E131-L135 PolarHBondContact O-N 3.03Å
132	K	83.9	Confident	81.1	Confident	38 Å²	38	51 Å²	51	17%	0.165	24%	0.244	C	C	.	.	H	α-helix	trans	-58.3	-50.8	174.3	-80.5	-173.8	-170.9	-165.8	0	112.3	F123 Q126 D128 Q129 Q130 Q134 L135 V136	F123-K132 HydrophobicContact CD2-CB 3.95Å; F123-K132 HydrophobicContact CD2-CD 4.45Å; F123-K132 HydrophobicContact CD2-CG 3.9Å; F123-K132 HydrophobicContact CE2-CB 3.71Å; F123-K132 HydrophobicContact CE2-CD 4.02Å; F123-K132 HydrophobicContact CE2-CG 3.84Å; F123-K132 HydrophobicContact CZ-CD 4.33Å; F123-K132 VanDerWaalsContact O-CE 3.3Å; F123-K132 WeakPolarHBondContact O-CE 3.41Å; Q126-K132 HydrophobicContact CB-CG 4.28Å; Q126-K132 WeakPolarHBondContact O-CE 3.34Å; Q126-K132 PolarHBondContact O-NZ 3.16Å; Q126-K132 VanDerWaalsContact O-NZ 3.09Å; D128-K132 WeakPolarHBondContact O-CG 3.25Å; D128-K132 PolarHBondContact O-N 3.31Å; Q129-K132 WeakPolarHBondContact O-CB 3.4Å; Q129-K132 PolarHBondContact O-N 3.42Å; Q130-K132 VanDerWaalsContact C-N 3.26Å; Q130-K132 PolarHBondContact O-N 3.45Å; K132-Q134 VanDerWaalsContact C-N 3.32Å; K132-Q134 PolarHBondContact O-N 3.21Å; K132-L135 PolarHBondContact O-N 3.18Å; K132-V136 WeakPolarHBondContact O-CG2 3.43Å; K132-V136 PolarHBondContact O-N 2.66Å; K132-V136 VanDerWaalsContact O-N 3.09Å
133	C	80.1	Confident	80.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-41.2	178.6	-68	0	0	0	0	111.7	Q129 Q130 L135 V136 L137 L154 L158 L180	Q129-C133 PolarHBondContact O-N 3.36Å; Q130-C133 PolarHBondContact O-N 3.32Å; C133-L135 PolarHBondContact O-N 2.8Å; C133-V136 PolarHBondContact O-N 3.25Å; C133-L137 WeakPolarHBondContact O-CG 3.21Å; C133-L137 PolarHBondContact O-N 2.99Å; C133-L154 HydrophobicContact CB-CD1 3.95Å; C133-L158 HydrophobicContact CB-CD2 4.43Å; C133-L180 HydrophobicContact CB-CD2 3.62Å
134	Q	81.4	Confident	80.3	Confident	65 Å²	65	54.6 Å²	54.6	30%	0.304	27%	0.268	S	S	.	.	H	α-helix	trans	-65.9	-35.1	176.4	-68.6	-179.4	3.5	0	0	113.2	Q130 E131 K132 L138 F176	Q130-Q134 WeakPolarHBondContact O-CG 3.3Å; Q130-Q134 PolarHBondContact O-N 3.09Å; E131-Q134 PolarHBondContact O-N 3.14Å; K132-Q134 VanDerWaalsContact C-N 3.32Å; K132-Q134 PolarHBondContact O-N 3.21Å; Q134-L138 PolarHBondContact O-N 3.03Å; Q134-F176 HydrophobicContact CG-CZ 3.94Å
135	L	81.3	Confident	79.6	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-42.4	174.2	-75.8	172.1	0	0	0	111.5	V86 R90 L119 L122 F123 Q126 E131 K132 C133 L138 L139	V86-L135 HydrophobicContact CG1-CD2 3.75Å; R90-L135 VanDerWaalsContact NH2-CG 3.3Å; L119-L135 HydrophobicContact CD2-CD2 3.96Å; L122-L135 HydrophobicContact CB-CD1 4.21Å; F123-L135 HydrophobicContact CB-CD1 4.14Å; Q126-L135 HydrophobicContact CG-CD1 3.93Å; E131-L135 WeakPolarHBondContact O-CB 3.49Å; E131-L135 VanDerWaalsContact O-CG 3.31Å; E131-L135 WeakPolarHBondContact O-CG 3.38Å; E131-L135 PolarHBondContact O-N 3.03Å; K132-L135 PolarHBondContact O-N 3.18Å; C133-L135 PolarHBondContact O-N 2.8Å; L135-L138 WeakPolarHBondContact O-CB 3.49Å; L135-L138 PolarHBondContact O-N 3.43Å; L135-L139 PolarHBondContact O-N 2.86Å
136	V	81.5	Confident	79.2	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.5	-38.2	177.1	-176.9	0	0	0	0	111.2	F123 K132 C133 L138 L139 I140 F150 M153 L154 L157	F123-V136 HydrophobicContact CD2-CG2 3.77Å; F123-V136 HydrophobicContact CE2-CG2 3.68Å; K132-V136 WeakPolarHBondContact O-CG2 3.43Å; K132-V136 PolarHBondContact O-N 2.66Å; K132-V136 VanDerWaalsContact O-N 3.09Å; C133-V136 PolarHBondContact O-N 3.25Å; V136-L138 VanDerWaalsContact C-N 3.3Å; V136-L138 PolarHBondContact O-N 3.35Å; V136-L139 WeakPolarHBondContact O-CB 3.48Å; V136-L139 PolarHBondContact O-N 3.32Å; V136-I140 HydrophobicContact CG1-CD1 4.4Å; V136-I140 WeakPolarHBondContact O-CG1 3.34Å; V136-I140 PolarHBondContact O-N 2.87Å; V136-F150 HydrophobicContact CG1-CB 4.19Å; V136-F150 VanDerWaalsContact CG1-O 3.29Å; V136-F150 WeakPolarHBondContact CG1-O 3.36Å; V136-M153 HydrophobicContact CG2-SD 4.35Å; V136-L154 HydrophobicContact CB-CB 4.45Å; V136-L154 HydrophobicContact CB-CD1 4.23Å; V136-L154 HydrophobicContact CG1-CB 3.73Å; V136-L154 HydrophobicContact CG1-CD1 4.43Å; V136-L154 HydrophobicContact CG1-CG 4.46Å; V136-L157 HydrophobicContact CG2-CD1 4.1Å
137	L	77.5	Confident	78.6	Confident	5 Å²	5	51 Å²	51	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-41.1	170.7	-79.7	170.2	0	0	0	112.6	C133 L139 I140 R141 L154 L180 E184 V185 L188	C133-L137 WeakPolarHBondContact O-CG 3.21Å; C133-L137 PolarHBondContact O-N 2.99Å; L137-L139 VanDerWaalsContact C-N 3.33Å; L137-I140 PolarHBondContact O-N 3.47Å; L137-R141 WeakPolarHBondContact O-CG 3.35Å; L137-R141 PolarHBondContact O-N 3.48Å; L137-L154 HydrophobicContact CD2-CD2 3.56Å; L137-L154 HydrophobicContact CG-CD2 3.74Å; L137-L180 HydrophobicContact CD1-CD1 3.53Å; L137-L180 HydrophobicContact CD1-CD2 3.64Å; L137-L180 HydrophobicContact CD1-CG 3.69Å; L137-E184 VanDerWaalsContact CD1-OE2 3.23Å; L137-E184 WeakPolarHBondContact CD1-OE2 3.3Å; L137-V185 HydrophobicContact CD2-CG2 4.11Å; L137-L188 HydrophobicContact CD2-CD1 3.51Å
138	L	80.6	Confident	78.2	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-41.7	175.3	-157.7	92.7	0	0	0	111.4	V86 V89 R90 L119 Q134 L135 V136 I140 R141 L142	V86-L138 HydrophobicContact CG1-CD2 3.96Å; V89-L138 HydrophobicContact CG1-CD1 4.29Å; V89-L138 HydrophobicContact CG1-CD2 4.36Å; R90-L138 HydrophobicContact CG-CD1 3.59Å; L119-L138 HydrophobicContact CD1-CD2 4.11Å; L119-L138 HydrophobicContact CD2-CD2 3.67Å; Q134-L138 PolarHBondContact O-N 3.03Å; L135-L138 WeakPolarHBondContact O-CB 3.49Å; L135-L138 PolarHBondContact O-N 3.43Å; V136-L138 VanDerWaalsContact C-N 3.3Å; V136-L138 PolarHBondContact O-N 3.35Å; L138-I140 VanDerWaalsContact C-N 3.34Å; L138-I140 PolarHBondContact O-N 3.2Å; L138-R141 PolarHBondContact O-N 3.24Å; L138-L142 HydrophobicContact CD2-CD1 3.64Å; L138-L142 HydrophobicContact CG-CD1 3.76Å; L138-L142 HydrophobicContact CG-CG 4.37Å; L138-L142 WeakPolarHBondContact O-CB 3.44Å; L138-L142 WeakPolarHBondContact O-CG 3.46Å; L138-L142 PolarHBondContact O-N 3.44Å
139	L	82.3	Confident	77.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-42.7	175.3	-78.6	166.1	0	0	0	111.7	Q116 L119 L120 L135 V136 L137 R141 L142 F143 F150	Q116-L139 HydrophobicContact CG-CD2 4.31Å; L119-L139 HydrophobicContact CB-CD1 4.42Å; L119-L139 HydrophobicContact CB-CD2 3.67Å; L119-L139 HydrophobicContact CB-CG 4.05Å; L119-L139 HydrophobicContact CD1-CD2 3.72Å; L119-L139 HydrophobicContact CD1-CG 4.21Å; L119-L139 HydrophobicContact CG-CD2 4.35Å; L120-L139 HydrophobicContact CD2-CD1 3.93Å; L120-L139 HydrophobicContact CG-CD1 4.45Å; L135-L139 PolarHBondContact O-N 2.86Å; V136-L139 WeakPolarHBondContact O-CB 3.48Å; V136-L139 PolarHBondContact O-N 3.32Å; L137-L139 VanDerWaalsContact C-N 3.33Å; L139-R141 VanDerWaalsContact C-N 3.35Å; L139-R141 PolarHBondContact O-N 3.09Å; L139-L142 PolarHBondContact O-N 3.37Å; L139-F143 HydrophobicContact CD2-CD2 3.92Å; L139-F143 HydrophobicContact CD2-CE2 3.99Å; L139-F143 PolarHBondContact O-N 3.23Å; L139-F150 HydrophobicContact CB-CD1 4.4Å; L139-F150 HydrophobicContact CB-CD2 4.08Å; L139-F150 HydrophobicContact CB-CE2 4.18Å; L139-F150 HydrophobicContact CB-CG 4.18Å; L139-F150 HydrophobicContact CB-CZ 4.38Å; L139-F150 HydrophobicContact CD1-CD1 4.31Å; L139-F150 HydrophobicContact CD1-CE1 4.07Å; L139-F150 HydrophobicContact CD1-CZ 4.38Å; L139-F150 HydrophobicContact CD2-CE2 4.41Å; L139-F150 HydrophobicContact CD2-CZ 4.15Å
140	I	77.2	Confident	77.5	Confident	9 Å²	9	43.3 Å²	43.3	5%	0.046	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-43	175.9	-64.7	165.2	0	0	0	110.8	V136 L137 L138 F150 A151 L154 L188	V136-I140 HydrophobicContact CG1-CD1 4.4Å; V136-I140 WeakPolarHBondContact O-CG1 3.34Å; V136-I140 PolarHBondContact O-N 2.87Å; L137-I140 PolarHBondContact O-N 3.47Å; L138-I140 VanDerWaalsContact C-N 3.34Å; L138-I140 PolarHBondContact O-N 3.2Å; I140-F150 HydrophobicContact CD1-CB 4.32Å; I140-F150 HydrophobicContact CG1-CB 3.54Å; I140-A151 HydrophobicContact CD1-CB 4.38Å; I140-L154 HydrophobicContact CD1-CB 4.47Å; I140-L154 HydrophobicContact CD1-CD2 3.82Å; I140-L188 HydrophobicContact CG2-CB 4.44Å; I140-L188 HydrophobicContact CG2-CD1 4.05Å; I140-L188 HydrophobicContact CG2-CD2 4.08Å; I140-L188 HydrophobicContact CG2-CG 4.42Å
141	R	78.2	Confident	76.9	Confident	138 Å²	138	39.5 Å²	39.5	52%	0.521	21%	0.211	S	C	.	.	H	α-helix	trans	-68.7	-37.9	-179.6	-71.3	178.8	-176.4	171.2	6.1	112.9	L137 L138 L139 E184	L137-R141 WeakPolarHBondContact O-CG 3.35Å; L137-R141 PolarHBondContact O-N 3.48Å; L138-R141 PolarHBondContact O-N 3.24Å; L139-R141 VanDerWaalsContact C-N 3.35Å; L139-R141 PolarHBondContact O-N 3.09Å; R141-E184 IonicContact NH2-OE1 3.22Å; R141-E184 PolarHBondContact NH2-OE1 3.47Å; R141-E184 IonicContact NH2-OE2 2.66Å
142	L	78.9	Confident	76.6	Confident	53 Å²	53	38.1 Å²	38.1	28%	0.277	21%	0.207	S	C	.	.	H	α-helix	trans	-83.5	-30.2	-176.8	-69.6	169.2	0	0	0	113.2	V89 F107 L119 L138 L139 P144	V89-L142 HydrophobicContact CG1-CD1 4.37Å; V89-L142 HydrophobicContact CG1-CD2 4.32Å; F107-L142 HydrophobicContact CE1-CD1 4.09Å; L119-L142 HydrophobicContact CD1-CD1 3.81Å; L138-L142 HydrophobicContact CD2-CD1 3.64Å; L138-L142 HydrophobicContact CG-CD1 3.76Å; L138-L142 HydrophobicContact CG-CG 4.37Å; L138-L142 WeakPolarHBondContact O-CB 3.44Å; L138-L142 WeakPolarHBondContact O-CG 3.46Å; L138-L142 PolarHBondContact O-N 3.44Å; L139-L142 PolarHBondContact O-N 3.37Å; L142-P144 WeakPolarHBondContact O-CD 3.43Å
143	F	80	Confident	76.3	Confident	27 Å²	27	39.5 Å²	39.5	12%	0.118	22%	0.215	C	C	.	.			trans	-126.4	74	-175.1	-55.9	-74.2	0	0	0	111.5	P112 Q115 Q116 L119 L139 D145 S146 S147 F150	P112-F143 HydrophobicContact CB-CE1 4.26Å; Q115-F143 HydrophobicContact CB-CZ 3.81Å; Q116-F143 HydrophobicContact CB-CD2 4.5Å; Q116-F143 HydrophobicContact CB-CE1 4.38Å; Q116-F143 HydrophobicContact CB-CE2 3.94Å; Q116-F143 HydrophobicContact CB-CZ 3.87Å; Q116-F143 HydrophobicContact CG-CD2 4.5Å; Q116-F143 HydrophobicContact CG-CE2 4.37Å; L119-F143 HydrophobicContact CD1-CE2 4.21Å; L139-F143 HydrophobicContact CD2-CD2 3.92Å; L139-F143 HydrophobicContact CD2-CE2 3.99Å; L139-F143 PolarHBondContact O-N 3.23Å; F143-D145 PolarHBondContact O-N 3.36Å; F143-S146 PolarHBondContact O-N 3.04Å; F143-S146 VanDerWaalsContact O-N 3.14Å; F143-S147 PolarHBondContact O-N 3.2Å; F143-F150 HydrophobicContact CB-CE2 4.41Å
144	P	73	Confident	76.2	Confident	82 Å²	82	39.5 Å²	39.5	53%	0.532	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-60.1	-29.2	-177.9	22.6	-32.3	0	0	0	113.1	L142 S146 S147	L142-P144 WeakPolarHBondContact O-CD 3.43Å; P144-S146 PolarHBondContact O-N 2.93Å; P144-S147 WeakPolarHBondContact O-CB 3.5Å; P144-S147 PolarHBondContact O-N 2.89Å; P144-S147 VanDerWaalsContact O-N 3.11Å; P144-S147 PolarHBondContact O-OG 3.01Å
145	D	71.4	Confident	75.8	Confident	166 Å²	166	37 Å²	37	89%	0.888	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-64.8	-26.7	179.5	-60.3	-31.5	0	0	0	113.4	F143	F143-D145 PolarHBondContact O-N 3.36Å
146	S	72.5	Confident	75.7	Confident	43 Å²	43	43.2 Å²	43.2	30%	0.301	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-107.8	12.7	176.2	-62	0	0	0	0	112.6	F143 P144 A148 S149 F150	F143-S146 PolarHBondContact O-N 3.04Å; F143-S146 VanDerWaalsContact O-N 3.14Å; P144-S146 PolarHBondContact O-N 2.93Å; S146-A148 PolarHBondContact O-N 3.42Å; S146-A148 VanDerWaalsContact O-N 3.16Å; S146-S149 PolarHBondContact O-N 2.81Å; S146-S149 PolarHBondContact O-OG 2.95Å; S146-F150 VanDerWaalsContact O-CD2 3.26Å; S146-F150 WeakPolarHBondContact O-CD2 3.48Å; S146-F150 PolarHBondContact O-N 2.97Å
147	S	70.3	Confident	75.5	Confident	20 Å²	20	44.3 Å²	44.3	14%	0.14	24%	0.238	C	C	.	.	H	α-helix	trans	-55.3	-35.8	-175.7	54.9	0	0	0	0	113.2	F143 P144 F150 A151	F143-S147 PolarHBondContact O-N 3.2Å; P144-S147 WeakPolarHBondContact O-CB 3.5Å; P144-S147 PolarHBondContact O-N 2.89Å; P144-S147 VanDerWaalsContact O-N 3.11Å; P144-S147 PolarHBondContact O-OG 3.01Å; S147-F150 PolarHBondContact O-N 3.36Å; S147-A151 WeakPolarHBondContact O-CB 3.48Å; S147-A151 PolarHBondContact O-N 2.98Å
148	A	67.6	Low	75.4	Confident	23 Å²	23	44.1 Å²	44.1	19%	0.19	24%	0.237	C	C	.	.	H	α-helix	trans	-64.2	-43.2	-177.7	0	0	0	0	0	113.5	S146 T152 S194	S146-A148 PolarHBondContact O-N 3.42Å; S146-A148 VanDerWaalsContact O-N 3.16Å; A148-T152 WeakPolarHBondContact O-CG2 3.36Å; A148-T152 PolarHBondContact O-N 3.33Å; A148-T152 VanDerWaalsContact O-N 3.12Å; A148-T152 PolarHBondContact O-OG1 2.94Å; A148-S194 WeakPolarHBondContact CB-OG 3.15Å
149	S	75	Confident	75.1	Confident	67 Å²	67	47 Å²	47	47%	0.469	25%	0.25	S	S	.	.	H	α-helix	trans	-74.2	-35.5	179.4	61.2	0	0	0	0	111.8	S146 T152 M153	S146-S149 PolarHBondContact O-N 2.81Å; S146-S149 PolarHBondContact O-OG 2.95Å; S149-T152 PolarHBondContact O-OG1 3.09Å; S149-M153 WeakPolarHBondContact O-CB 3.36Å; S149-M153 PolarHBondContact O-N 2.82Å
150	F	75.1	Confident	75	Confident	11 Å²	11	54 Å²	54	5%	0.048	28%	0.281	C	S	.	.	H	α-helix	trans	-71.1	-34.6	173.8	-65.7	-47.4	0	0	0	112.4	Q116 L120 V136 L139 I140 F143 S146 S147 M153 L154	Q116-F150 HydrophobicContact CG-CZ 4.34Å; L120-F150 HydrophobicContact CD2-CE1 4.07Å; V136-F150 HydrophobicContact CG1-CB 4.19Å; V136-F150 VanDerWaalsContact CG1-O 3.29Å; V136-F150 WeakPolarHBondContact CG1-O 3.36Å; L139-F150 HydrophobicContact CB-CD1 4.4Å; L139-F150 HydrophobicContact CB-CD2 4.08Å; L139-F150 HydrophobicContact CB-CE2 4.18Å; L139-F150 HydrophobicContact CB-CG 4.18Å; L139-F150 HydrophobicContact CB-CZ 4.38Å; L139-F150 HydrophobicContact CD1-CD1 4.31Å; L139-F150 HydrophobicContact CD1-CE1 4.07Å; L139-F150 HydrophobicContact CD1-CZ 4.38Å; L139-F150 HydrophobicContact CD2-CE2 4.41Å; L139-F150 HydrophobicContact CD2-CZ 4.15Å; I140-F150 HydrophobicContact CD1-CB 4.32Å; I140-F150 HydrophobicContact CG1-CB 3.54Å; F143-F150 HydrophobicContact CB-CE2 4.41Å; S146-F150 VanDerWaalsContact O-CD2 3.26Å; S146-F150 WeakPolarHBondContact O-CD2 3.48Å; S146-F150 PolarHBondContact O-N 2.97Å; S147-F150 PolarHBondContact O-N 3.36Å; F150-M153 PolarHBondContact O-N 3.47Å; F150-L154 WeakPolarHBondContact O-CB 3.38Å; F150-L154 PolarHBondContact O-N 3.24Å
151	A	69	Low	75	Confident	2 Å²	2	54.6 Å²	54.6	2%	0.017	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-43	174.5	0	0	0	0	0	111.5	I140 S147 L154 L155 L189	I140-A151 HydrophobicContact CD1-CB 4.38Å; S147-A151 WeakPolarHBondContact O-CB 3.48Å; S147-A151 PolarHBondContact O-N 2.98Å; A151-L154 PolarHBondContact O-N 2.99Å; A151-L155 WeakPolarHBondContact O-CB 3.48Å; A151-L155 WeakPolarHBondContact O-CD1 3.32Å; A151-L155 VanDerWaalsContact O-CG 3.29Å; A151-L155 WeakPolarHBondContact O-CG 3.5Å; A151-L155 PolarHBondContact O-N 3.18Å; A151-L189 HydrophobicContact CB-CD2 3.87Å
152	T	71.9	Confident	74.7	Confident	36 Å²	36	48 Å²	48	22%	0.221	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-39.4	174.7	53.7	0	0	0	0	112	A148 S149 L155 Q156	A148-T152 WeakPolarHBondContact O-CG2 3.36Å; A148-T152 PolarHBondContact O-N 3.33Å; A148-T152 VanDerWaalsContact O-N 3.12Å; A148-T152 PolarHBondContact O-OG1 2.94Å; S149-T152 PolarHBondContact O-OG1 3.09Å; T152-L155 PolarHBondContact O-N 2.59Å; T152-Q156 WeakPolarHBondContact O-CG 3.42Å; T152-Q156 PolarHBondContact O-N 3.46Å
153	M	78.5	Confident	74.4	Confident	67 Å²	67	51.8 Å²	51.8	33%	0.33	27%	0.272	S	S	.	.	H	α-helix	trans	-59.9	-45.7	172.6	178.6	176.5	-75.5	0	0	111.6	F123 V136 S149 F150 L155 Q156 L157	F123-M153 HydrophobicContact CZ-SD 4.48Å; V136-M153 HydrophobicContact CG2-SD 4.35Å; S149-M153 WeakPolarHBondContact O-CB 3.36Å; S149-M153 PolarHBondContact O-N 2.82Å; F150-M153 PolarHBondContact O-N 3.47Å; M153-L155 VanDerWaalsContact C-N 3.34Å; M153-L155 PolarHBondContact O-N 3.38Å; M153-Q156 PolarHBondContact O-N 2.7Å; M153-L157 HydrophobicContact CG-CD1 4Å; M153-L157 VanDerWaalsContact O-CG 3.3Å; M153-L157 WeakPolarHBondContact O-CG 3.47Å; M153-L157 PolarHBondContact O-N 3.36Å
154	L	77.6	Confident	74.1	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-42.9	178.4	-175.9	53.5	0	0	0	111.6	C133 V136 L137 I140 F150 A151 L157 L158 V185	C133-L154 HydrophobicContact CB-CD1 3.95Å; V136-L154 HydrophobicContact CB-CB 4.45Å; V136-L154 HydrophobicContact CB-CD1 4.23Å; V136-L154 HydrophobicContact CG1-CB 3.73Å; V136-L154 HydrophobicContact CG1-CD1 4.43Å; V136-L154 HydrophobicContact CG1-CG 4.46Å; L137-L154 HydrophobicContact CD2-CD2 3.56Å; L137-L154 HydrophobicContact CG-CD2 3.74Å; I140-L154 HydrophobicContact CD1-CB 4.47Å; I140-L154 HydrophobicContact CD1-CD2 3.82Å; F150-L154 WeakPolarHBondContact O-CB 3.38Å; F150-L154 PolarHBondContact O-N 3.24Å; A151-L154 PolarHBondContact O-N 2.99Å; L154-L157 PolarHBondContact O-N 2.94Å; L154-L158 HydrophobicContact CD1-CD1 3.84Å; L154-L158 HydrophobicContact CD1-CG 4.01Å; L154-L158 HydrophobicContact CG-CD1 3.76Å; L154-L158 HydrophobicContact CG-CG 4.36Å; L154-L158 WeakPolarHBondContact O-CB 3.26Å; L154-L158 VanDerWaalsContact O-CG 3.28Å; L154-L158 WeakPolarHBondContact O-CG 3.37Å; L154-L158 PolarHBondContact O-N 3.33Å; L154-V185 HydrophobicContact CD2-CB 4.41Å; L154-V185 HydrophobicContact CD2-CG1 4.12Å; L154-V185 HydrophobicContact CD2-CG2 3.43Å; L154-V185 VanDerWaalsContact CD2-CG2 3.43Å; L154-V185 HydrophobicContact CG-CG2 4.04Å
155	L	71.8	Confident	73.9	Confident	13 Å²	13	52.3 Å²	52.3	7%	0.068	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-44.6	177.4	-77.3	160.2	0	0	0	112.3	A151 T152 M153 L157 L158 E159 L181 L189 L197 L205	A151-L155 WeakPolarHBondContact O-CB 3.48Å; A151-L155 WeakPolarHBondContact O-CD1 3.32Å; A151-L155 VanDerWaalsContact O-CG 3.29Å; A151-L155 WeakPolarHBondContact O-CG 3.5Å; A151-L155 PolarHBondContact O-N 3.18Å; T152-L155 PolarHBondContact O-N 2.59Å; M153-L155 VanDerWaalsContact C-N 3.34Å; M153-L155 PolarHBondContact O-N 3.38Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-L157 PolarHBondContact O-N 2.95Å; L155-L158 PolarHBondContact O-N 2.66Å; L155-E159 VanDerWaalsContact O-CB 3.26Å; L155-E159 WeakPolarHBondContact O-CB 3.4Å; L155-E159 PolarHBondContact O-N 2.72Å; L155-L181 HydrophobicContact CD2-CD1 3.91Å; L155-L189 HydrophobicContact CD1-CD1 3.95Å; L155-L189 HydrophobicContact CD1-CD2 3.94Å; L155-L189 HydrophobicContact CD2-CD1 4Å; L155-L189 HydrophobicContact CG-CD1 4.3Å; L155-L197 HydrophobicContact CD1-CD1 3.67Å; L155-L197 HydrophobicContact CD1-CD2 4.05Å; L155-L197 HydrophobicContact CD1-CG 4.1Å; L155-L205 HydrophobicContact CD2-CD1 3.86Å
156	Q	79	Confident	73.5	Confident	133 Å²	133	46.4 Å²	46.4	62%	0.621	24%	0.241	S	C	*	.	H	α-helix	trans	-64.6	-39	177.3	-72.6	177.3	-6.7	0	0	112.4	T152 M153 K160	T152-Q156 WeakPolarHBondContact O-CG 3.42Å; T152-Q156 PolarHBondContact O-N 3.46Å; M153-Q156 PolarHBondContact O-N 2.7Å; Q156-K160 WeakPolarHBondContact O-CB 3.16Å; Q156-K160 PolarHBondContact O-N 2.92Å
157	L	78.6	Confident	73.2	Confident	24 Å²	24	49.9 Å²	49.9	13%	0.126	26%	0.256	C	S	.	.	H	α-helix	trans	-67.5	-45.8	176.6	-71.4	167.3	0	0	0	111.4	F123 V136 M153 L154 L155 K160 Y161	F123-L157 HydrophobicContact CE2-CD1 3.53Å; F123-L157 HydrophobicContact CZ-CD1 3.58Å; F123-L157 HydrophobicContact CZ-CD2 4.25Å; V136-L157 HydrophobicContact CG2-CD1 4.1Å; M153-L157 HydrophobicContact CG-CD1 4Å; M153-L157 VanDerWaalsContact O-CG 3.3Å; M153-L157 WeakPolarHBondContact O-CG 3.47Å; M153-L157 PolarHBondContact O-N 3.36Å; L154-L157 PolarHBondContact O-N 2.94Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-L157 PolarHBondContact O-N 2.95Å; L157-K160 PolarHBondContact O-N 3.44Å; L157-Y161 HydrophobicContact CB-CD2 4.27Å; L157-Y161 HydrophobicContact CB-CE2 3.99Å; L157-Y161 HydrophobicContact CD2-CE2 3.93Å; L157-Y161 WeakPolarHBondContact O-CB 3.3Å; L157-Y161 WeakPolarHBondContact O-CD2 3.48Å; L157-Y161 VanDerWaalsContact O-CG 3.25Å; L157-Y161 PolarHBondContact O-N 2.66Å
158	L	75.8	Confident	73	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-44.9	177.6	-73.1	170.2	0	0	0	110.9	C133 L154 L155 K160 Y161 E162 F177 L180 L181 V185	C133-L158 HydrophobicContact CB-CD2 4.43Å; L154-L158 HydrophobicContact CD1-CD1 3.84Å; L154-L158 HydrophobicContact CD1-CG 4.01Å; L154-L158 HydrophobicContact CG-CD1 3.76Å; L154-L158 HydrophobicContact CG-CG 4.36Å; L154-L158 WeakPolarHBondContact O-CB 3.26Å; L154-L158 VanDerWaalsContact O-CG 3.28Å; L154-L158 WeakPolarHBondContact O-CG 3.37Å; L154-L158 PolarHBondContact O-N 3.33Å; L155-L158 PolarHBondContact O-N 2.66Å; L158-K160 VanDerWaalsContact C-N 3.28Å; L158-K160 PolarHBondContact O-N 3.37Å; L158-Y161 PolarHBondContact O-N 3.31Å; L158-E162 WeakPolarHBondContact O-CB 3.25Å; L158-E162 PolarHBondContact O-N 3.34Å; L158-F177 HydrophobicContact CD2-CB 3.86Å; L158-F177 HydrophobicContact CD2-CD1 3.89Å; L158-F177 HydrophobicContact CD2-CG 4.37Å; L158-L180 HydrophobicContact CD2-CD2 4.12Å; L158-L181 HydrophobicContact CB-CD1 4.06Å; L158-L181 HydrophobicContact CD1-CB 4.09Å; L158-L181 HydrophobicContact CD1-CD1 3.5Å; L158-L181 HydrophobicContact CD1-CG 4.44Å; L158-L181 HydrophobicContact CG-CD1 4.39Å; L158-V185 HydrophobicContact CD1-CG2 3.71Å
159	E	74.2	Confident	72.6	Confident	74 Å²	74	59 Å²	59	35%	0.346	29%	0.291	S	S	.	.	H	α-helix	trans	-58	-41.7	175.1	-172.5	177.9	-172.6	0	0	111.8	L155 K163	L155-E159 VanDerWaalsContact O-CB 3.26Å; L155-E159 WeakPolarHBondContact O-CB 3.4Å; L155-E159 PolarHBondContact O-N 2.72Å; E159-K163 WeakPolarHBondContact O-CB 3.43Å; E159-K163 PolarHBondContact O-N 3.49Å
160	K	80	Confident	71.7	Confident	146 Å²	146	59.3 Å²	59.3	64%	0.635	29%	0.292	S	S	*	.	H	α-helix	trans	-66.3	-42.3	176.8	-178.5	179.9	177.7	178.8	0	113	Q156 L157 L158	Q156-K160 WeakPolarHBondContact O-CB 3.16Å; Q156-K160 PolarHBondContact O-N 2.92Å; L157-K160 PolarHBondContact O-N 3.44Å; L158-K160 VanDerWaalsContact C-N 3.28Å; L158-K160 PolarHBondContact O-N 3.37Å
161	Y	76.5	Confident	71.2	Confident	21 Å²	21	59.5 Å²	59.5	8%	0.082	29%	0.294	C	S	.	.	H	α-helix	trans	-84.7	-24.7	-174.7	-60.9	-39.4	0	0	0	113.4	Q129 L157 L158 P164 F165 F177	Q129-Y161 HydrophobicContact CB-CD1 4.18Å; Q129-Y161 HydrophobicContact CB-CD2 3.99Å; Q129-Y161 HydrophobicContact CB-CE1 4.13Å; Q129-Y161 HydrophobicContact CB-CE2 3.93Å; Q129-Y161 HydrophobicContact CB-CG 4.12Å; Q129-Y161 VanDerWaalsContact CD-CE1 3.46Å; Q129-Y161 HydrophobicContact CG-CD1 3.85Å; Q129-Y161 HydrophobicContact CG-CD2 4.47Å; Q129-Y161 HydrophobicContact CG-CE1 3.56Å; Q129-Y161 HydrophobicContact CG-CE2 4.23Å; Q129-Y161 HydrophobicContact CG-CG 4.31Å; L157-Y161 HydrophobicContact CB-CD2 4.27Å; L157-Y161 HydrophobicContact CB-CE2 3.99Å; L157-Y161 HydrophobicContact CD2-CE2 3.93Å; L157-Y161 WeakPolarHBondContact O-CB 3.3Å; L157-Y161 WeakPolarHBondContact O-CD2 3.48Å; L157-Y161 VanDerWaalsContact O-CG 3.25Å; L157-Y161 PolarHBondContact O-N 2.66Å; L158-Y161 PolarHBondContact O-N 3.31Å; Y161-P164 WeakPolarHBondContact O-CD 2.74Å; Y161-F165 VanDerWaalsContact O-CD2 3.28Å; Y161-F165 WeakPolarHBondContact O-CD2 3.49Å; Y161-F165 VanDerWaalsContact O-CE2 3.3Å; Y161-F165 WeakPolarHBondContact O-CE2 3.45Å; Y161-F177 HydrophobicContact CD2-CE1 4.23Å; Y161-F177 HydrophobicContact CG-CE1 4.48Å
162	E	72.5	Confident	71.1	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-81.4	-34.5	178.8	-177.5	178.2	-156.2	0	0	112.4	L158 P164 F165 M166 T178 R208	L158-E162 WeakPolarHBondContact O-CB 3.25Å; L158-E162 PolarHBondContact O-N 3.34Å; E162-P164 VanDerWaalsContact C-N 3.33Å; E162-P164 VanDerWaalsContact O-N 3.14Å; E162-F165 WeakPolarHBondContact O-CB 3.5Å; E162-F165 PolarHBondContact O-N 2.75Å; E162-M166 HydrophobicContact CG-CG 3.85Å; E162-M166 PolarHBondContact O-N 3.34Å; E162-T178 WeakPolarHBondContact OE1-CB 3.19Å; E162-T178 PolarHBondContact OE1-OG1 2.73Å; E162-R208 WeakPolarHBondContact OE2-CD 3.47Å; E162-R208 IonicContact OE2-CZ 2.66Å; E162-R208 IonicContact OE2-NE 2.72Å; E162-R208 IonicContact OE2-NH1 3.54Å; E162-R208 PolarHBondContact OE2-NH1 3.21Å
163	K	72.7	Confident	70.8	Confident	131 Å²	131	62 Å²	62	57%	0.57	30%	0.302	S	S	*	.	H	α-helix	trans	-47.2	-44.4	-177.1	-169.3	170.5	-174.1	173.9	0	114.6	E159 F165 M166 D167	E159-K163 WeakPolarHBondContact O-CB 3.43Å; E159-K163 PolarHBondContact O-N 3.49Å; K163-F165 PolarHBondContact O-N 3.25Å; K163-M166 PolarHBondContact O-N 2.68Å; K163-D167 WeakPolarHBondContact CG-OD2 3.43Å; K163-D167 WeakPolarHBondContact O-CB 3.46Å; K163-D167 VanDerWaalsContact O-CG 3.28Å; K163-D167 PolarHBondContact O-N 3.11Å
164	P	73.8	Confident	70.3	Confident	73 Å²	73	63.9 Å²	63.9	47%	0.474	31%	0.309	S	S	.	.	H	α-helix	trans	-64.3	-19.3	177.4	-19	32	0	0	0	115.3	Y161 E162 R168	Y161-P164 WeakPolarHBondContact O-CD 2.74Å; E162-P164 VanDerWaalsContact C-N 3.33Å; E162-P164 VanDerWaalsContact O-N 3.14Å; P164-R168 WeakPolarHBondContact O-CG 3.08Å
165	F	68.1	Low	69.9	Low	47 Å²	47	64.5 Å²	64.5	21%	0.206	31%	0.312	C	S	.	.	H	α-helix	trans	-91.4	-29.4	178.3	-62.2	-84.5	0	0	0	111.9	Y161 E162 K163 E172 N175 F177	Y161-F165 VanDerWaalsContact O-CD2 3.28Å; Y161-F165 WeakPolarHBondContact O-CD2 3.49Å; Y161-F165 VanDerWaalsContact O-CE2 3.3Å; Y161-F165 WeakPolarHBondContact O-CE2 3.45Å; E162-F165 WeakPolarHBondContact O-CB 3.5Å; E162-F165 PolarHBondContact O-N 2.75Å; K163-F165 PolarHBondContact O-N 3.25Å; F165-E172 HydrophobicContact CB-CB 4.46Å; F165-E172 PolarHBondContact O-N 3.19Å; F165-E172 VanDerWaalsContact O-N 3.13Å; F165-N175 HydrophobicContact CD1-CB 4.45Å; F165-N175 HydrophobicContact CG-CB 4.49Å; F165-F177 HydrophobicContact CD2-CD2 4.49Å; F165-F177 AromaticContact CE2-CD2 3.98Å; F165-F177 HydrophobicContact CE2-CD2 3.98Å; F165-F177 AromaticContact CE2-CE2 3.98Å; F165-F177 HydrophobicContact CE2-CE2 3.98Å; F165-F177 HydrophobicContact CZ-CE2 4.44Å
166	M	62.4	Low	69.8	Low	42 Å²	42	66.8 Å²	66.8	21%	0.207	32%	0.322	C	S	.	.	H	α-helix	trans	-80.5	-30.8	175.2	-64.3	-64.4	103.4	0	0	112.3	E162 K163 R168 E172 F173	E162-M166 HydrophobicContact CG-CG 3.85Å; E162-M166 PolarHBondContact O-N 3.34Å; K163-M166 PolarHBondContact O-N 2.68Å; M166-R168 PolarHBondContact O-N 3.33Å; M166-E172 WeakPolarHBondContact CE-O 3.47Å; M166-F173 HydrophobicContact CE-CD1 4.43Å; M166-F173 HydrophobicContact SD-CD1 4.47Å; M166-F173 HydrophobicContact SD-CE1 4.38Å
167	D	67.1	Low	69.4	Low	117 Å²	117	60.9 Å²	60.9	63%	0.626	29%	0.294	S	S	*	.	S	Bend	trans	-77.6	-0.9	176.4	-68	-14	0	0	0	113	K163	K163-D167 WeakPolarHBondContact CG-OD2 3.43Å; K163-D167 WeakPolarHBondContact O-CB 3.46Å; K163-D167 VanDerWaalsContact O-CG 3.28Å; K163-D167 PolarHBondContact O-N 3.11Å
168	R	65.6	Low	69	Low	118 Å²	118	59.8 Å²	59.8	45%	0.445	29%	0.288	S	S	.	.	S	Bend	trans	-77.3	147.8	175	-76	177.8	-173.4	-164.7	-0.6	110.9	P164 M166 P170 P171 E172	P164-R168 WeakPolarHBondContact O-CG 3.08Å; M166-R168 PolarHBondContact O-N 3.33Å; R168-P170 CarbonylContact C-O 3.18Å; R168-P170 CarbonylContact O-C 3.47Å; R168-P171 WeakPolarHBondContact O-CA 3.28Å; R168-E172 IonicContact CZ-OE1 3.77Å; R168-E172 IonicContact NH1-OE1 3.2Å; R168-E172 PolarHBondContact NH1-OE1 3.4Å; R168-E172 IonicContact NH1-OE2 2.86Å
169	D	59.2	Low	69	Low	117 Å²	117	61.9 Å²	61.9	63%	0.626	30%	0.302	S	S	*	.	S	Bend	trans	-107.4	103.7	170.2	-84.8	-21	0	0	0	110.3	K377	D169-K377 VanDerWaalsContact CG-CE 3.48Å; D169-K377 WeakPolarHBondContact OD1-CD 3.48Å; D169-K377 WeakPolarHBondContact OD1-CE 3.12Å; D169-K377 IonicContact OD1-NZ 3.07Å; D169-K377 PolarHBondContact OD1-NZ 3.42Å; D169-K377 WeakPolarHBondContact OD2-CE 3.48Å; D169-K377 IonicContact OD2-NZ 2.73Å; D169-K377 PolarHBondContact OD2-NZ 3.14Å
170	P	56.9	Low	68.8	Low	73 Å²	73	58.9 Å²	58.9	47%	0.474	29%	0.288	S	S	.	.	S	Bend	cis	-83.9	160.4	-0	33	-34.1	0	0	0	114.9	R168 A378	R168-P170 CarbonylContact C-O 3.18Å; R168-P170 CarbonylContact O-C 3.47Å; P170-A378 HydrophobicContact CB-CB 4.18Å
171	P	63.7	Low	68.4	Low	15 Å²	15	52.1 Å²	52.1	10%	0.097	26%	0.259	C	S	.	.			trans	-68.1	136	-179.2	21.4	-29.9	0	0	0	112.8	R168 F173 A378	R168-P171 WeakPolarHBondContact O-CA 3.28Å; P171-F173 HydrophobicContact CB-CE2 4.1Å; P171-F173 HydrophobicContact CB-CZ 4.01Å; P171-F173 HydrophobicContact CG-CE2 3.79Å; P171-F173 HydrophobicContact CG-CZ 3.77Å; P171-F173 WeakPolarHBondContact O-CD2 3.39Å; P171-F173 PolarHBondContact O-N 3.27Å; P171-A378 HydrophobicContact CG-CB 4.12Å
172	E	66.8	Low	68.1	Low	81 Å²	81	51.3 Å²	51.3	38%	0.379	26%	0.256	S	S	.	.			trans	-94.8	93.5	-178.2	-78.5	176.5	-150.9	0	0	112	F165 M166 R168 N175	F165-E172 HydrophobicContact CB-CB 4.46Å; F165-E172 PolarHBondContact O-N 3.19Å; F165-E172 VanDerWaalsContact O-N 3.13Å; M166-E172 WeakPolarHBondContact CE-O 3.47Å; R168-E172 IonicContact CZ-OE1 3.77Å; R168-E172 IonicContact NH1-OE1 3.2Å; R168-E172 PolarHBondContact NH1-OE1 3.4Å; R168-E172 IonicContact NH1-OE2 2.86Å; E172-N175 PolarHBondContact O-ND2 2.78Å
173	F	65.9	Low	68.1	Low	8 Å²	8	56.1 Å²	56.1	4%	0.035	28%	0.276	C	S	.	.			trans	-73.6	-28.2	-179.7	-60.5	-78.7	0	0	0	114.1	M166 P171 N175 Y212 A215 L375 A378 Q380 F381	M166-F173 HydrophobicContact CE-CD1 4.43Å; M166-F173 HydrophobicContact SD-CD1 4.47Å; M166-F173 HydrophobicContact SD-CE1 4.38Å; P171-F173 HydrophobicContact CB-CE2 4.1Å; P171-F173 HydrophobicContact CB-CZ 4.01Å; P171-F173 HydrophobicContact CG-CE2 3.79Å; P171-F173 HydrophobicContact CG-CZ 3.77Å; P171-F173 WeakPolarHBondContact O-CD2 3.39Å; P171-F173 PolarHBondContact O-N 3.27Å; F173-N175 VanDerWaalsContact C-N 3.31Å; F173-N175 PolarHBondContact O-N 3.09Å; F173-Y212 WeakPolarHBondContact O-CD2 3.23Å; F173-A215 HydrophobicContact CB-CB 4.15Å; F173-A215 HydrophobicContact CG-CB 4.47Å; F173-L375 HydrophobicContact CE1-CD1 4.08Å; F173-L375 HydrophobicContact CZ-CD1 4.34Å; F173-A378 HydrophobicContact CE2-CB 3.77Å; F173-Q380 VanDerWaalsContact CD2-NE2 3.31Å; F173-F381 HydrophobicContact CD2-CE2 4.12Å; F173-F381 HydrophobicContact CD2-CZ 4.38Å; F173-F381 HydrophobicContact CE2-CD2 4.29Å; F173-F381 AromaticContact CE2-CE2 3.4Å; F173-F381 HydrophobicContact CE2-CE2 3.4Å; F173-F381 HydrophobicContact CE2-CZ 4.07Å; F173-F381 AromaticContact CZ-CE2 3.65Å; F173-F381 HydrophobicContact CZ-CE2 3.65Å; F173-F381 HydrophobicContact CZ-CZ 4.42Å
174	F	67.6	Low	67.8	Low	107 Å²	107	53 Å²	53	47%	0.469	26%	0.264	S	S	.	.	S	Bend	trans	-91.3	61.8	179.9	-61.2	-65.1	0	0	0	111.8	Y212 A215 E216	F174-Y212 HydrophobicContact CD1-CE2 4.18Å; F174-A215 HydrophobicContact CE1-CB 4.36Å; F174-A215 HydrophobicContact CE2-CB 3.93Å; F174-A215 HydrophobicContact CZ-CB 3.67Å; F174-E216 HydrophobicContact CE1-CB 4.39Å
175	N	69.5	Low	67.4	Low	13 Å²	13	49.6 Å²	49.6	7%	0.07	24%	0.242	C	C	.	.	S	Bend	trans	-111.1	159.2	172.1	74.6	55.5	0	0	0	110.5	F165 E172 F173 F177 T178 T179	F165-N175 HydrophobicContact CD1-CB 4.45Å; F165-N175 HydrophobicContact CG-CB 4.49Å; E172-N175 PolarHBondContact O-ND2 2.78Å; F173-N175 VanDerWaalsContact C-N 3.31Å; F173-N175 PolarHBondContact O-N 3.09Å; N175-F177 PolarHBondContact O-N 3.29Å; N175-F177 WeakPolarHBondContact OD1-CA 3.48Å; N175-F177 WeakPolarHBondContact OD1-CB 3.19Å; N175-F177 PolarHBondContact OD1-N 3.36Å; N175-T178 VanDerWaalsContact CG-OG1 3.29Å; N175-T178 PolarHBondContact ND2-OG1 2.95Å; N175-T178 WeakPolarHBondContact OD1-CB 3.28Å; N175-T178 PolarHBondContact OD1-N 2.87Å; N175-T178 PolarHBondContact OD1-OG1 3Å; N175-T178 VanDerWaalsContact OD1-OG1 3.07Å; N175-T179 WeakPolarHBondContact O-CB 3.37Å; N175-T179 PolarHBondContact O-N 2.94Å; N175-T179 PolarHBondContact O-OG1 3.3Å
176	F	69.7	Low	67.1	Low	62 Å²	62	47.5 Å²	47.5	27%	0.272	23%	0.233	S	C	.	.	H	α-helix	trans	-55.4	-41.8	-179.9	172.9	-94.5	0	0	0	111.7	Q130 Q134 T179 L180	Q130-F176 HydrophobicContact CB-CD1 3.95Å; Q130-F176 HydrophobicContact CB-CE1 3.7Å; Q130-F176 HydrophobicContact CB-CZ 4.23Å; Q130-F176 HydrophobicContact CG-CD1 3.58Å; Q130-F176 HydrophobicContact CG-CE1 3.9Å; Q130-F176 HydrophobicContact CG-CG 4.13Å; Q134-F176 HydrophobicContact CG-CZ 3.94Å; F176-T179 PolarHBondContact O-N 3.17Å; F176-L180 HydrophobicContact CE1-CD1 4.34Å; F176-L180 HydrophobicContact CE1-CD2 4.14Å; F176-L180 HydrophobicContact CE2-CD1 4.31Å; F176-L180 HydrophobicContact CZ-CD1 3.83Å; F176-L180 HydrophobicContact CZ-CD2 4.39Å; F176-L180 WeakPolarHBondContact O-CB 3.3Å; F176-L180 PolarHBondContact O-N 3.07Å
177	F	71.9	Confident	67.3	Low	9 Å²	9	48.1 Å²	48.1	4%	0.039	24%	0.241	C	C	.	.	H	α-helix	trans	-70.5	-45.4	-174.3	-56.1	-70	0	0	0	112.7	Q129 Q130 L158 Y161 F165 N175 L180 L181	Q129-F177 HydrophobicContact CB-CE1 4.17Å; Q129-F177 HydrophobicContact CB-CZ 3.85Å; Q130-F177 HydrophobicContact CG-CE1 4.04Å; Q130-F177 HydrophobicContact CG-CZ 3.78Å; L158-F177 HydrophobicContact CD2-CB 3.86Å; L158-F177 HydrophobicContact CD2-CD1 3.89Å; L158-F177 HydrophobicContact CD2-CG 4.37Å; Y161-F177 HydrophobicContact CD2-CE1 4.23Å; Y161-F177 HydrophobicContact CG-CE1 4.48Å; F165-F177 HydrophobicContact CD2-CD2 4.49Å; F165-F177 AromaticContact CE2-CD2 3.98Å; F165-F177 HydrophobicContact CE2-CD2 3.98Å; F165-F177 AromaticContact CE2-CE2 3.98Å; F165-F177 HydrophobicContact CE2-CE2 3.98Å; F165-F177 HydrophobicContact CZ-CE2 4.44Å; N175-F177 PolarHBondContact O-N 3.29Å; N175-F177 WeakPolarHBondContact OD1-CA 3.48Å; N175-F177 WeakPolarHBondContact OD1-CB 3.19Å; N175-F177 PolarHBondContact OD1-N 3.36Å; F177-L180 PolarHBondContact O-N 3.25Å; F177-L181 WeakPolarHBondContact O-CB 3.44Å; F177-L181 PolarHBondContact O-N 3.01Å
178	T	68.8	Low	67	Low	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.9	-41.6	174.5	-52.6	0	0	0	0	110.2	E162 N175 L180 L181 V182 Y212	E162-T178 WeakPolarHBondContact OE1-CB 3.19Å; E162-T178 PolarHBondContact OE1-OG1 2.73Å; N175-T178 VanDerWaalsContact CG-OG1 3.29Å; N175-T178 PolarHBondContact ND2-OG1 2.95Å; N175-T178 WeakPolarHBondContact OD1-CB 3.28Å; N175-T178 PolarHBondContact OD1-N 2.87Å; N175-T178 PolarHBondContact OD1-OG1 3Å; N175-T178 VanDerWaalsContact OD1-OG1 3.07Å; T178-L180 PolarHBondContact O-N 3.35Å; T178-L181 PolarHBondContact O-N 2.63Å; T178-V182 HydrophobicContact CG2-CG2 4.24Å; T178-V182 VanDerWaalsContact O-CB 3.3Å; T178-V182 WeakPolarHBondContact O-CB 3.11Å; T178-V182 WeakPolarHBondContact O-CG2 3.27Å; T178-V182 PolarHBondContact O-N 3.44Å; T178-Y212 HydrophobicContact CG2-CD2 4.03Å; T178-Y212 HydrophobicContact CG2-CG 4.49Å
179	T	75.4	Confident	66.8	Low	45 Å²	45	38.1 Å²	38.1	28%	0.276	20%	0.197	S	C	.	.	H	α-helix	trans	-63	-43.8	175.9	-55.1	0	0	0	0	111.4	N175 F176 K183 Y212	N175-T179 WeakPolarHBondContact O-CB 3.37Å; N175-T179 PolarHBondContact O-N 2.94Å; N175-T179 PolarHBondContact O-OG1 3.3Å; F176-T179 PolarHBondContact O-N 3.17Å; T179-K183 HydrophobicContact CG2-CD 4.16Å; T179-K183 WeakPolarHBondContact O-CB 3.36Å; T179-K183 PolarHBondContact O-N 2.98Å; T179-Y212 HydrophobicContact CG2-CE2 4.42Å; T179-Y212 WeakPolarHBondContact OG1-CE2 3.45Å
180	L	70	Confident	66.7	Low	11 Å²	11	36.5 Å²	36.5	6%	0.058	19%	0.187	C	C	.	.	I	π-helix	trans	-63.4	-47	176.9	-162	84.4	0	0	0	111.2	C133 L137 L158 F176 F177 T178 E184 V185	C133-L180 HydrophobicContact CB-CD2 3.62Å; L137-L180 HydrophobicContact CD1-CD1 3.53Å; L137-L180 HydrophobicContact CD1-CD2 3.64Å; L137-L180 HydrophobicContact CD1-CG 3.69Å; L158-L180 HydrophobicContact CD2-CD2 4.12Å; F176-L180 HydrophobicContact CE1-CD1 4.34Å; F176-L180 HydrophobicContact CE1-CD2 4.14Å; F176-L180 HydrophobicContact CE2-CD1 4.31Å; F176-L180 HydrophobicContact CZ-CD1 3.83Å; F176-L180 HydrophobicContact CZ-CD2 4.39Å; F176-L180 WeakPolarHBondContact O-CB 3.3Å; F176-L180 PolarHBondContact O-N 3.07Å; F177-L180 PolarHBondContact O-N 3.25Å; T178-L180 PolarHBondContact O-N 3.35Å; L180-E184 WeakPolarHBondContact CD1-OE2 3.35Å; L180-E184 WeakPolarHBondContact O-CA 3.29Å; L180-E184 WeakPolarHBondContact O-CB 3.4Å; L180-E184 PolarHBondContact O-N 3.34Å; L180-V185 WeakPolarHBondContact O-CG2 3.34Å; L180-V185 PolarHBondContact O-N 3.29Å
181	L	71.6	Confident	67	Low	4 Å²	4	40.3 Å²	40.3	2%	0.021	20%	0.199	C	C	.	.	I	π-helix	trans	-58.4	-50	179.3	-175	75.1	0	0	0	110.8	L155 L158 F177 T178 V185 V186 L205	L155-L181 HydrophobicContact CD2-CD1 3.91Å; L158-L181 HydrophobicContact CB-CD1 4.06Å; L158-L181 HydrophobicContact CD1-CB 4.09Å; L158-L181 HydrophobicContact CD1-CD1 3.5Å; L158-L181 HydrophobicContact CD1-CG 4.44Å; L158-L181 HydrophobicContact CG-CD1 4.39Å; F177-L181 WeakPolarHBondContact O-CB 3.44Å; F177-L181 PolarHBondContact O-N 3.01Å; T178-L181 PolarHBondContact O-N 2.63Å; L181-V185 WeakPolarHBondContact O-CB 3.38Å; L181-V186 WeakPolarHBondContact O-CG2 3.38Å; L181-V186 PolarHBondContact O-N 3.49Å; L181-L205 HydrophobicContact CD1-CD1 3.78Å; L181-L205 HydrophobicContact CD2-CD1 3.8Å; L181-L205 HydrophobicContact CG-CD1 3.94Å
182	V	72.2	Confident	66.6	Low	3 Å²	3	40.5 Å²	40.5	2%	0.018	20%	0.2	C	C	.	.	I	π-helix	trans	-70.8	-64	-178.3	177	0	0	0	0	109	T178 A209 Y212 F213 Y246	T178-V182 HydrophobicContact CG2-CG2 4.24Å; T178-V182 VanDerWaalsContact O-CB 3.3Å; T178-V182 WeakPolarHBondContact O-CB 3.11Å; T178-V182 WeakPolarHBondContact O-CG2 3.27Å; T178-V182 PolarHBondContact O-N 3.44Å; V182-A209 HydrophobicContact CG2-CB 4.29Å; V182-Y212 HydrophobicContact CB-CD1 4.31Å; V182-Y212 HydrophobicContact CB-CG 4.43Å; V182-Y212 HydrophobicContact CG1-CD1 3.78Å; V182-Y212 HydrophobicContact CG1-CE1 4.27Å; V182-Y212 HydrophobicContact CG1-CG 4.3Å; V182-Y212 HydrophobicContact CG2-CG 4.21Å; V182-F213 HydrophobicContact CG1-CD2 4.24Å; V182-F213 HydrophobicContact CG1-CE1 4.02Å; V182-F213 HydrophobicContact CG1-CE2 3.41Å; V182-F213 VanDerWaalsContact CG1-CE2 3.41Å; V182-F213 HydrophobicContact CG1-CZ 3.26Å; V182-Y246 VanDerWaalsContact CA-OH 3.3Å; V182-Y246 WeakPolarHBondContact CA-OH 3.33Å; V182-Y246 VanDerWaalsContact CG1-OH 3.27Å; V182-Y246 WeakPolarHBondContact CG1-OH 3.31Å; V182-Y246 PolarHBondContact O-OH 2.91Å
183	K	71.2	Confident	65.8	Low	102 Å²	102	42.6 Å²	42.6	44%	0.443	22%	0.224	S	C	.	.	I	π-helix	trans	-73	-39.4	-169	-66.4	-171.9	169.2	171.6	0	114.3	T179 Y212 E216	T179-K183 HydrophobicContact CG2-CD 4.16Å; T179-K183 WeakPolarHBondContact O-CB 3.36Å; T179-K183 PolarHBondContact O-N 2.98Å; K183-Y212 WeakPolarHBondContact CE-OH 3.25Å; K183-Y212 PolarHBondContact NZ-OH 3.31Å; K183-Y212 VanDerWaalsContact NZ-OH 3.09Å; K183-E216 IonicContact NZ-OE1 3.57Å; K183-E216 PolarHBondContact NZ-OE1 2.84Å
184	E	66.9	Low	64.9	Low	66 Å²	66	45.9 Å²	45.9	31%	0.308	25%	0.248	S	C	.	.	I	π-helix	trans	-102.1	-49	-173.3	-68	-161.3	131.8	0	0	113.4	L137 R141 L180 V186 S187 L188	L137-E184 VanDerWaalsContact CD1-OE2 3.23Å; L137-E184 WeakPolarHBondContact CD1-OE2 3.3Å; R141-E184 IonicContact NH2-OE1 3.22Å; R141-E184 PolarHBondContact NH2-OE1 3.47Å; R141-E184 IonicContact NH2-OE2 2.66Å; L180-E184 WeakPolarHBondContact CD1-OE2 3.35Å; L180-E184 WeakPolarHBondContact O-CA 3.29Å; L180-E184 WeakPolarHBondContact O-CB 3.4Å; L180-E184 PolarHBondContact O-N 3.34Å; E184-V186 VanDerWaalsContact C-N 3.33Å; E184-V186 PolarHBondContact O-N 3.41Å; E184-S187 PolarHBondContact O-N 2.88Å; E184-S187 PolarHBondContact O-OG 3.2Å; E184-L188 PolarHBondContact O-N 2.96Å
185	V	64.2	Low	64.3	Low	1 Å²	1	41.2 Å²	41.2	1%	0.006	23%	0.229	C	C	.	.	I	π-helix	trans	-67.8	-35.2	-172.3	-178.8	0	0	0	0	111.8	L137 L154 L158 L180 L181 L188 L189	L137-V185 HydrophobicContact CD2-CG2 4.11Å; L154-V185 HydrophobicContact CD2-CB 4.41Å; L154-V185 HydrophobicContact CD2-CG1 4.12Å; L154-V185 HydrophobicContact CD2-CG2 3.43Å; L154-V185 VanDerWaalsContact CD2-CG2 3.43Å; L154-V185 HydrophobicContact CG-CG2 4.04Å; L158-V185 HydrophobicContact CD1-CG2 3.71Å; L180-V185 WeakPolarHBondContact O-CG2 3.34Å; L180-V185 PolarHBondContact O-N 3.29Å; L181-V185 WeakPolarHBondContact O-CB 3.38Å; V185-L188 WeakPolarHBondContact O-CB 3.2Å; V185-L188 PolarHBondContact O-N 2.89Å; V185-L189 HydrophobicContact CG1-CD1 3.79Å; V185-L189 HydrophobicContact CG1-CG 4.14Å; V185-L189 WeakPolarHBondContact O-CG 3.36Å; V185-L189 PolarHBondContact O-N 2.92Å
186	V	63.3	Low	63.7	Low	3 Å²	3	45.2 Å²	45.2	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-71.2	-35.5	-179.7	175.3	0	0	0	0	112.1	L181 E184 L188 L189 L190 L205 Y246	L181-V186 WeakPolarHBondContact O-CG2 3.38Å; L181-V186 PolarHBondContact O-N 3.49Å; E184-V186 VanDerWaalsContact C-N 3.33Å; E184-V186 PolarHBondContact O-N 3.41Å; V186-L188 PolarHBondContact O-N 3.38Å; V186-L189 PolarHBondContact O-N 2.84Å; V186-L189 VanDerWaalsContact O-N 3.15Å; V186-L190 HydrophobicContact CG1-CD1 3.76Å; V186-L190 HydrophobicContact CG1-CG 3.96Å; V186-L190 WeakPolarHBondContact O-CB 3.46Å; V186-L190 WeakPolarHBondContact O-CD1 3.46Å; V186-L190 VanDerWaalsContact O-CG 3.23Å; V186-L190 WeakPolarHBondContact O-CG 3.45Å; V186-L190 PolarHBondContact O-N 3.26Å; V186-L205 HydrophobicContact CG2-CD2 4.32Å; V186-Y246 HydrophobicContact CB-CE1 3.74Å; V186-Y246 HydrophobicContact CB-CE2 4.39Å; V186-Y246 WeakPolarHBondContact CB-OH 3.26Å; V186-Y246 HydrophobicContact CG1-CD1 4.07Å; V186-Y246 HydrophobicContact CG1-CD2 4.29Å; V186-Y246 HydrophobicContact CG1-CE1 3.58Å; V186-Y246 HydrophobicContact CG1-CE2 3.84Å; V186-Y246 HydrophobicContact CG1-CG 4.42Å; V186-Y246 VanDerWaalsContact CG1-CZ 3.45Å; V186-Y246 HydrophobicContact CG2-CD1 4.1Å; V186-Y246 HydrophobicContact CG2-CE1 3.15Å; V186-Y246 WeakPolarHBondContact CG2-OH 2.89Å
187	S	65.4	Low	63.4	Low	55 Å²	55	43.7 Å²	43.7	39%	0.385	25%	0.252	S	S	.	.	H	α-helix	trans	-57.7	-34.3	173.1	74.5	0	0	0	0	111.8	E184 Q191	E184-S187 PolarHBondContact O-N 2.88Å; E184-S187 PolarHBondContact O-OG 3.2Å; S187-Q191 WeakPolarHBondContact O-CG 3.29Å; S187-Q191 PolarHBondContact O-NE2 2.88Å
188	L	61.8	Low	63.4	Low	25 Å²	25	50.4 Å²	50.4	13%	0.131	28%	0.282	C	S	.	.	H	α-helix	trans	-78.9	-38	176.9	-63.2	166.7	0	0	0	112.2	L137 I140 E184 V185 V186 Q191 S192	L137-L188 HydrophobicContact CD2-CD1 3.51Å; I140-L188 HydrophobicContact CG2-CB 4.44Å; I140-L188 HydrophobicContact CG2-CD1 4.05Å; I140-L188 HydrophobicContact CG2-CD2 4.08Å; I140-L188 HydrophobicContact CG2-CG 4.42Å; E184-L188 PolarHBondContact O-N 2.96Å; V185-L188 WeakPolarHBondContact O-CB 3.2Å; V185-L188 PolarHBondContact O-N 2.89Å; V186-L188 PolarHBondContact O-N 3.38Å; L188-Q191 PolarHBondContact O-N 2.82Å; L188-S192 PolarHBondContact O-N 2.85Å; L188-S192 PolarHBondContact O-OG 3.33Å
189	L	60.2	Low	63.8	Low	1 Å²	1	54.2 Å²	54.2	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-72.1	-30.5	177.1	-71.7	170.4	0	0	0	113.5	A151 L155 V185 V186 Q191 S192 W249	A151-L189 HydrophobicContact CB-CD2 3.87Å; L155-L189 HydrophobicContact CD1-CD1 3.95Å; L155-L189 HydrophobicContact CD1-CD2 3.94Å; L155-L189 HydrophobicContact CD2-CD1 4Å; L155-L189 HydrophobicContact CG-CD1 4.3Å; V185-L189 HydrophobicContact CG1-CD1 3.79Å; V185-L189 HydrophobicContact CG1-CG 4.14Å; V185-L189 WeakPolarHBondContact O-CG 3.36Å; V185-L189 PolarHBondContact O-N 2.92Å; V186-L189 PolarHBondContact O-N 2.84Å; V186-L189 VanDerWaalsContact O-N 3.15Å; L189-Q191 PolarHBondContact O-N 2.99Å; L189-S192 PolarHBondContact O-N 3.32Å; L189-W249 HydrophobicContact CB-CZ2 4.21Å; L189-W249 PolarHBondContact O-NE1 3.06Å
190	L	59	Low	63.9	Low	82 Å²	82	54.9 Å²	54.9	43%	0.429	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-29.9	173	-77.8	163.6	0	0	0	111.7	V186 W249	V186-L190 HydrophobicContact CG1-CD1 3.76Å; V186-L190 HydrophobicContact CG1-CG 3.96Å; V186-L190 WeakPolarHBondContact O-CB 3.46Å; V186-L190 WeakPolarHBondContact O-CD1 3.46Å; V186-L190 VanDerWaalsContact O-CG 3.23Å; V186-L190 WeakPolarHBondContact O-CG 3.45Å; V186-L190 PolarHBondContact O-N 3.26Å; L190-W249 HydrophobicContact CD2-CB 3.54Å; L190-W249 HydrophobicContact CD2-CG 3.71Å
191	Q	62.8	Low	64.1	Low	154 Å²	154	58 Å²	58	72%	0.72	32%	0.319	S	S	*	.	H	α-helix	trans	-87.1	-21.6	179.5	-65.7	174	14.9	0	0	112.8	S187 L188 L189	S187-Q191 WeakPolarHBondContact O-CG 3.29Å; S187-Q191 PolarHBondContact O-NE2 2.88Å; L188-Q191 PolarHBondContact O-N 2.82Å; L189-Q191 PolarHBondContact O-N 2.99Å
192	S	54.2	Low	64.4	Low	18 Å²	18	57.9 Å²	57.9	13%	0.126	32%	0.319	C	S	.	.			trans	-100.4	100.6	-172.8	-50.2	0	0	0	0	110.8	L188 L189 S194	L188-S192 PolarHBondContact O-N 2.85Å; L188-S192 PolarHBondContact O-OG 3.33Å; L189-S192 PolarHBondContact O-N 3.32Å; S192-S194 PolarHBondContact O-N 3.31Å; S192-S194 VanDerWaalsContact O-N 3.07Å
193	S	50.7	Low	64.9	Low	126 Å²	126	57.9 Å²	57.9	88%	0.881	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-0.3	179.2	41.2	0	0	0	0	115.1
194	S	47	Very low	65.3	Low	77 Å²	77	55.6 Å²	55.6	54%	0.538	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	15.6	-162.9	50.6	0	0	0	0	116.8	A148 S192	A148-S194 WeakPolarHBondContact CB-OG 3.15Å; S192-S194 PolarHBondContact O-N 3.31Å; S192-S194 VanDerWaalsContact O-N 3.07Å
195	S	55.2	Low	65.8	Low	9 Å²	9	52.8 Å²	52.8	6%	0.063	30%	0.298	C	S	.	.			trans	-74.3	149.6	170	58.9	0	0	0	0	111.1	R253	S195-R253 VanDerWaalsContact O-CZ 3.23Å; S195-R253 PolarHBondContact O-NH1 3.42Å; S195-R253 PolarHBondContact O-NH2 2.91Å; S195-R253 PolarHBondContact OG-NH1 3.37Å
196	S	57	Low	66.7	Low	97 Å²	97	53 Å²	53	68%	0.678	30%	0.299	S	S	*	.			trans	-104	31.4	-175.2	73.8	0	0	0	0	114	K198	S196-K198 PolarHBondContact O-N 3.28Å
197	L	63.7	Low	67.6	Low	29 Å²	29	53.9 Å²	53.9	15%	0.152	30%	0.304	C	S	.	.			trans	-62.5	129	177.2	-71.9	156.2	0	0	0	111.1	L155 Q201 W249 R253	L155-L197 HydrophobicContact CD1-CD1 3.67Å; L155-L197 HydrophobicContact CD1-CD2 4.05Å; L155-L197 HydrophobicContact CD1-CG 4.1Å; L197-Q201 HydrophobicContact CD2-CB 3.91Å; L197-W249 HydrophobicContact CD1-CH2 3.98Å; L197-W249 HydrophobicContact CD1-CZ2 4.48Å; L197-R253 PolarHBondContact O-NH2 2.99Å
198	K	72.1	Confident	68.3	Low	151 Å²	151	53.5 Å²	53.5	66%	0.657	29%	0.294	S	S	*	.			trans	-73.2	150.6	171.5	-63.1	-177.8	178.9	-179.7	0	109.6	S196 P200 Q201 G202	S196-K198 PolarHBondContact O-N 3.28Å; K198-P200 HydrophobicContact CB-CG 4.26Å; K198-Q201 WeakPolarHBondContact O-CB 3.07Å; K198-Q201 PolarHBondContact O-N 2.78Å; K198-G202 PolarHBondContact O-N 3.45Å
199	E	76	Confident	69.2	Low	80 Å²	80	52.4 Å²	52.4	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-41.7	-51.9	178.6	-152.8	-178.5	169.4	0	0	114.3	Q201 G202 V203 C254 W256 Q285	E199-Q201 VanDerWaalsContact C-N 3.32Å; E199-Q201 PolarHBondContact O-N 3.37Å; E199-G202 WeakPolarHBondContact O-CA 3.42Å; E199-G202 PolarHBondContact O-N 3.31Å; E199-V203 PolarHBondContact O-N 3.04Å; E199-C254 HydrophobicContact CG-CB 4.38Å; E199-W256 HydrophobicContact CG-CZ2 4.28Å; E199-W256 PolarHBondContact OE1-NE1 2.82Å; E199-W256 VanDerWaalsContact OE1-NE1 3.09Å; E199-Q285 HydrophobicContact CG-CB 4.43Å; E199-Q285 VanDerWaalsContact CG-OE1 3.24Å; E199-Q285 PolarHBondContact O-OE1 3.06Å
200	P	77.8	Confident	70.4	Confident	59 Å²	59	52.3 Å²	52.3	38%	0.383	29%	0.288	S	S	.	.	H	α-helix	trans	-60.3	-37.1	179.9	19.1	-32.7	0	0	0	114.1	K198 G202 V203 D204 Q285	K198-P200 HydrophobicContact CB-CG 4.26Å; P200-G202 VanDerWaalsContact C-N 3.27Å; P200-G202 PolarHBondContact O-N 2.9Å; P200-V203 PolarHBondContact O-N 3.21Å; P200-D204 PolarHBondContact O-N 2.88Å; P200-Q285 VanDerWaalsContact N-OE1 3.13Å
201	Q	75	Confident	71.6	Confident	76 Å²	76	48.4 Å²	48.4	36%	0.355	27%	0.267	S	S	.	.	H	α-helix	trans	-68.9	-32.3	177.9	-65.1	176.3	-35.7	0	0	111.2	L197 K198 E199 L205	L197-Q201 HydrophobicContact CD2-CB 3.91Å; K198-Q201 WeakPolarHBondContact O-CB 3.07Å; K198-Q201 PolarHBondContact O-N 2.78Å; E199-Q201 VanDerWaalsContact C-N 3.32Å; E199-Q201 PolarHBondContact O-N 3.37Å; Q201-L205 PolarHBondContact O-N 2.92Å; Q201-L205 VanDerWaalsContact O-N 3.14Å
202	G	77	Confident	72.5	Confident	2 Å²	2	41.5 Å²	41.5	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-67.9	-38.9	173.6	0	0	0	0	0	112.4	K198 E199 P200 L205 L206	K198-G202 PolarHBondContact O-N 3.45Å; E199-G202 WeakPolarHBondContact O-CA 3.42Å; E199-G202 PolarHBondContact O-N 3.31Å; P200-G202 VanDerWaalsContact C-N 3.27Å; P200-G202 PolarHBondContact O-N 2.9Å; G202-L205 WeakPolarHBondContact O-CB 3.13Å; G202-L205 PolarHBondContact O-N 3.42Å; G202-L206 PolarHBondContact O-N 3.32Å
203	V	82.2	Confident	73.9	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-45	174.5	175.7	0	0	0	0	111.6	E199 P200 L205 L206 L207 L250 Q285 F288	E199-V203 PolarHBondContact O-N 3.04Å; P200-V203 PolarHBondContact O-N 3.21Å; V203-L205 PolarHBondContact O-N 2.89Å; V203-L206 WeakPolarHBondContact O-CA 3.4Å; V203-L206 WeakPolarHBondContact O-CB 3.49Å; V203-L206 PolarHBondContact O-N 3.23Å; V203-L207 HydrophobicContact CG1-CD1 4.33Å; V203-L207 HydrophobicContact CG1-CG 4.43Å; V203-L207 WeakPolarHBondContact O-CG 3.34Å; V203-L207 PolarHBondContact O-N 3.45Å; V203-L250 HydrophobicContact CG2-CD2 4.19Å; V203-Q285 HydrophobicContact CG2-CB 3.87Å; V203-Q285 HydrophobicContact CG2-CG 4.2Å; V203-F288 HydrophobicContact CG1-CD1 3.79Å; V203-F288 HydrophobicContact CG1-CE1 3.59Å
204	D	79.2	Confident	75.4	Confident	53 Å²	53	35.3 Å²	35.3	28%	0.283	19%	0.19	S	C	.	.	H	α-helix	trans	-61.1	-36.5	177.4	-70.5	-18.5	0	0	0	111.8	P200 L207 R208	P200-D204 PolarHBondContact O-N 2.88Å; D204-L207 PolarHBondContact O-N 3.27Å; D204-R208 VanDerWaalsContact O-CG 3.31Å; D204-R208 WeakPolarHBondContact O-CG 3.12Å; D204-R208 PolarHBondContact O-N 3.06Å; D204-R208 VanDerWaalsContact O-N 3.11Å
205	L	77.8	Confident	77.1	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.042	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-43.6	173.3	-161	88.3	0	0	0	111.7	L155 L181 V186 Q201 G202 V203 R208 A209 W249	L155-L205 HydrophobicContact CD2-CD1 3.86Å; L181-L205 HydrophobicContact CD1-CD1 3.78Å; L181-L205 HydrophobicContact CD2-CD1 3.8Å; L181-L205 HydrophobicContact CG-CD1 3.94Å; V186-L205 HydrophobicContact CG2-CD2 4.32Å; Q201-L205 PolarHBondContact O-N 2.92Å; Q201-L205 VanDerWaalsContact O-N 3.14Å; G202-L205 WeakPolarHBondContact O-CB 3.13Å; G202-L205 PolarHBondContact O-N 3.42Å; V203-L205 PolarHBondContact O-N 2.89Å; L205-R208 PolarHBondContact O-N 2.99Å; L205-A209 PolarHBondContact O-N 3.15Å; L205-W249 HydrophobicContact CD2-CH2 4.23Å; L205-W249 HydrophobicContact CD2-CZ3 3.99Å
206	L	83.2	Confident	78.4	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-61.9	-44.7	176	179.5	67.4	0	0	0	110.8	G202 V203 R208 A209 V210 F247 L250 C289 L293	G202-L206 PolarHBondContact O-N 3.32Å; V203-L206 WeakPolarHBondContact O-CA 3.4Å; V203-L206 WeakPolarHBondContact O-CB 3.49Å; V203-L206 PolarHBondContact O-N 3.23Å; L206-R208 VanDerWaalsContact C-N 3.32Å; L206-R208 PolarHBondContact O-N 2.82Å; L206-A209 PolarHBondContact O-N 3.15Å; L206-V210 HydrophobicContact CD1-CG2 4.2Å; L206-V210 HydrophobicContact CG-CG2 4.25Å; L206-V210 WeakPolarHBondContact O-CB 3.43Å; L206-V210 WeakPolarHBondContact O-CG2 3.43Å; L206-V210 PolarHBondContact O-N 3.28Å; L206-F247 HydrophobicContact CD1-CB 4.48Å; L206-F247 HydrophobicContact CD2-CD2 4.28Å; L206-L250 HydrophobicContact CB-CD2 4.27Å; L206-L250 HydrophobicContact CD2-CD2 4.11Å; L206-C289 HydrophobicContact CD2-CB 3.96Å; L206-L293 HydrophobicContact CD2-CD1 4.46Å
207	L	83.5	Confident	79.5	Confident	22 Å²	22	29.7 Å²	29.7	12%	0.115	14%	0.144	C	C	.	.	H	α-helix	trans	-57	-44.8	177.5	-72.8	175.7	0	0	0	112.2	V203 D204 V210 G211 F288 L292 L375	V203-L207 HydrophobicContact CG1-CD1 4.33Å; V203-L207 HydrophobicContact CG1-CG 4.43Å; V203-L207 WeakPolarHBondContact O-CG 3.34Å; V203-L207 PolarHBondContact O-N 3.45Å; D204-L207 PolarHBondContact O-N 3.27Å; L207-V210 PolarHBondContact O-N 3.36Å; L207-G211 PolarHBondContact O-N 3.03Å; L207-F288 HydrophobicContact CD1-CE1 4.23Å; L207-F288 HydrophobicContact CD1-CZ 4.33Å; L207-F288 HydrophobicContact CD2-CE1 4.08Å; L207-F288 HydrophobicContact CD2-CZ 3.95Å; L207-F288 HydrophobicContact CG-CE1 4.4Å; L207-L292 HydrophobicContact CD2-CD2 3.18Å; L207-L375 WeakPolarHBondContact O-CD1 3.23Å
208	R	78.1	Confident	80.1	Confident	48 Å²	48	30.5 Å²	30.5	18%	0.181	15%	0.148	C	C	.	.	H	α-helix	trans	-65.1	-42.9	177.5	-68.2	166.5	-164	161.9	14.1	111.9	E162 D204 L205 L206 G211 Y212	E162-R208 WeakPolarHBondContact OE2-CD 3.47Å; E162-R208 IonicContact OE2-CZ 2.66Å; E162-R208 IonicContact OE2-NE 2.72Å; E162-R208 IonicContact OE2-NH1 3.54Å; E162-R208 PolarHBondContact OE2-NH1 3.21Å; D204-R208 VanDerWaalsContact O-CG 3.31Å; D204-R208 WeakPolarHBondContact O-CG 3.12Å; D204-R208 PolarHBondContact O-N 3.06Å; D204-R208 VanDerWaalsContact O-N 3.11Å; L205-R208 PolarHBondContact O-N 2.99Å; L206-R208 VanDerWaalsContact C-N 3.32Å; L206-R208 PolarHBondContact O-N 2.82Å; R208-G211 PolarHBondContact O-N 2.86Å; R208-Y212 WeakPolarHBondContact O-CB 3.21Å; R208-Y212 PolarHBondContact O-N 2.99Å
209	A	82.2	Confident	80.2	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-62.3	-44	176	0	0	0	0	0	111.7	V182 L205 L206 Y212 F213 Y246	V182-A209 HydrophobicContact CG2-CB 4.29Å; L205-A209 PolarHBondContact O-N 3.15Å; L206-A209 PolarHBondContact O-N 3.15Å; A209-Y212 PolarHBondContact O-N 3.5Å; A209-F213 HydrophobicContact CB-CD2 4.41Å; A209-F213 HydrophobicContact CB-CE2 4.36Å; A209-F213 WeakPolarHBondContact O-CD2 3.3Å; A209-F213 PolarHBondContact O-N 3.34Å; A209-Y246 HydrophobicContact CB-CD1 3.48Å; A209-Y246 VanDerWaalsContact CB-CD1 3.48Å; A209-Y246 HydrophobicContact CB-CE1 3.44Å; A209-Y246 VanDerWaalsContact CB-CE1 3.44Å; A209-Y246 HydrophobicContact CB-CG 4.1Å
210	V	85.2	Confident	79.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.9	-47.7	175.6	170.8	0	0	0	0	110.5	L206 L207 Y212 F213 L214 I243 L293 L296 L375	L206-V210 HydrophobicContact CD1-CG2 4.2Å; L206-V210 HydrophobicContact CG-CG2 4.25Å; L206-V210 WeakPolarHBondContact O-CB 3.43Å; L206-V210 WeakPolarHBondContact O-CG2 3.43Å; L206-V210 PolarHBondContact O-N 3.28Å; L207-V210 PolarHBondContact O-N 3.36Å; V210-Y212 PolarHBondContact O-N 3.16Å; V210-F213 PolarHBondContact O-N 3.07Å; V210-L214 HydrophobicContact CG1-CD1 3.5Å; V210-L214 HydrophobicContact CG1-CG 4.26Å; V210-L214 WeakPolarHBondContact O-CB 3.28Å; V210-L214 VanDerWaalsContact O-CG 3.24Å; V210-L214 WeakPolarHBondContact O-CG 3.34Å; V210-L214 PolarHBondContact O-N 2.75Å; V210-I243 HydrophobicContact CG2-CG1 4.35Å; V210-I243 HydrophobicContact CG2-CG2 3.77Å; V210-L293 HydrophobicContact CG2-CD2 3.54Å; V210-L296 HydrophobicContact CG1-CD1 3.55Å; V210-L375 HydrophobicContact CG1-CD2 4.13Å
211	G	83.1	Confident	78.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-46	175.9	0	0	0	0	0	113.1	L207 R208 A215	L207-G211 PolarHBondContact O-N 3.03Å; R208-G211 PolarHBondContact O-N 2.86Å; G211-A215 VanDerWaalsContact O-CB 3.25Å; G211-A215 WeakPolarHBondContact O-CB 3.37Å; G211-A215 PolarHBondContact O-N 3.04Å
212	Y	83	Confident	77.2	Confident	9 Å²	9	30.5 Å²	30.5	4%	0.035	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-53.6	177.6	-180	-88.5	0	0	0	112.4	F173 F174 T178 T179 V182 K183 R208 A209 V210 L214 A215 E216	F173-Y212 WeakPolarHBondContact O-CD2 3.23Å; F174-Y212 HydrophobicContact CD1-CE2 4.18Å; T178-Y212 HydrophobicContact CG2-CD2 4.03Å; T178-Y212 HydrophobicContact CG2-CG 4.49Å; T179-Y212 HydrophobicContact CG2-CE2 4.42Å; T179-Y212 WeakPolarHBondContact OG1-CE2 3.45Å; V182-Y212 HydrophobicContact CB-CD1 4.31Å; V182-Y212 HydrophobicContact CB-CG 4.43Å; V182-Y212 HydrophobicContact CG1-CD1 3.78Å; V182-Y212 HydrophobicContact CG1-CE1 4.27Å; V182-Y212 HydrophobicContact CG1-CG 4.3Å; V182-Y212 HydrophobicContact CG2-CG 4.21Å; K183-Y212 WeakPolarHBondContact CE-OH 3.25Å; K183-Y212 PolarHBondContact NZ-OH 3.31Å; K183-Y212 VanDerWaalsContact NZ-OH 3.09Å; R208-Y212 WeakPolarHBondContact O-CB 3.21Å; R208-Y212 PolarHBondContact O-N 2.99Å; A209-Y212 PolarHBondContact O-N 3.5Å; V210-Y212 PolarHBondContact O-N 3.16Å; Y212-L214 PolarHBondContact O-N 3.27Å; Y212-A215 WeakPolarHBondContact O-CB 3.18Å; Y212-A215 PolarHBondContact O-N 3.13Å; Y212-E216 WeakPolarHBondContact CE1-OE2 3.1Å; Y212-E216 WeakPolarHBondContact O-CB 3.36Å; Y212-E216 PolarHBondContact O-N 3.5Å
213	F	82.5	Confident	75.1	Confident	13 Å²	13	37.3 Å²	37.3	6%	0.057	20%	0.2	C	C	.	.	H	α-helix	trans	-68.3	-36.2	-176.9	-72.2	-57.9	0	0	0	111.9	V182 A209 V210 E216 M217 S242 I243 Y246	V182-F213 HydrophobicContact CG1-CD2 4.24Å; V182-F213 HydrophobicContact CG1-CE1 4.02Å; V182-F213 HydrophobicContact CG1-CE2 3.41Å; V182-F213 VanDerWaalsContact CG1-CE2 3.41Å; V182-F213 HydrophobicContact CG1-CZ 3.26Å; A209-F213 HydrophobicContact CB-CD2 4.41Å; A209-F213 HydrophobicContact CB-CE2 4.36Å; A209-F213 WeakPolarHBondContact O-CD2 3.3Å; A209-F213 PolarHBondContact O-N 3.34Å; V210-F213 PolarHBondContact O-N 3.07Å; F213-E216 WeakPolarHBondContact CD1-OE2 2.83Å; F213-E216 PolarHBondContact O-N 3.18Å; F213-M217 WeakPolarHBondContact O-CB 2.64Å; F213-M217 WeakPolarHBondContact O-CE 3.43Å; F213-M217 VanDerWaalsContact O-CG 3.23Å; F213-M217 WeakPolarHBondContact O-CG 3.46Å; F213-M217 PolarHBondContact O-N 2.66Å; F213-S242 VanDerWaalsContact CZ-CB 3.43Å; F213-I243 HydrophobicContact CB-CD1 3.83Å; F213-I243 HydrophobicContact CB-CG1 3.82Å; F213-I243 HydrophobicContact CD2-CG1 3.79Å; F213-I243 HydrophobicContact CG-CG1 4.17Å; F213-Y246 HydrophobicContact CE2-CD2 4.35Å; F213-Y246 AromaticContact CE2-CE2 3.71Å; F213-Y246 HydrophobicContact CE2-CE2 3.71Å; F213-Y246 HydrophobicContact CZ-CE2 4.2Å
214	L	83.2	Confident	72.7	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-43.7	171.7	-77.4	169.6	0	0	0	111.5	V210 Y212 M217 L218 W240 L296 F300 F381	V210-L214 HydrophobicContact CG1-CD1 3.5Å; V210-L214 HydrophobicContact CG1-CG 4.26Å; V210-L214 WeakPolarHBondContact O-CB 3.28Å; V210-L214 VanDerWaalsContact O-CG 3.24Å; V210-L214 WeakPolarHBondContact O-CG 3.34Å; V210-L214 PolarHBondContact O-N 2.75Å; Y212-L214 PolarHBondContact O-N 3.27Å; L214-M217 HydrophobicContact CD2-CE 3.79Å; L214-M217 HydrophobicContact CG-CE 4.29Å; L214-M217 PolarHBondContact O-N 2.64Å; L214-L218 WeakPolarHBondContact O-CB 3.5Å; L214-L218 VanDerWaalsContact O-CG 3.28Å; L214-L218 WeakPolarHBondContact O-CG 3.4Å; L214-L218 PolarHBondContact O-N 3.28Å; L214-W240 HydrophobicContact CD2-CH2 3.65Å; L214-W240 HydrophobicContact CD2-CZ2 3.69Å; L214-L296 HydrophobicContact CD1-CB 4.38Å; L214-L296 HydrophobicContact CD1-CD1 3.9Å; L214-L296 HydrophobicContact CD1-CD2 4.26Å; L214-L296 HydrophobicContact CD1-CG 4.42Å; L214-F300 HydrophobicContact CD2-CD2 4.08Å; L214-F300 HydrophobicContact CD2-CG 4.5Å; L214-F381 HydrophobicContact CB-CE1 3.79Å; L214-F381 HydrophobicContact CB-CZ 4.13Å
215	A	82.3	Confident	70.5	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.9	-44.4	176.3	0	0	0	0	0	112	F173 F174 G211 Y212 L218 S219 F381	F173-A215 HydrophobicContact CB-CB 4.15Å; F173-A215 HydrophobicContact CG-CB 4.47Å; F174-A215 HydrophobicContact CE1-CB 4.36Å; F174-A215 HydrophobicContact CE2-CB 3.93Å; F174-A215 HydrophobicContact CZ-CB 3.67Å; G211-A215 VanDerWaalsContact O-CB 3.25Å; G211-A215 WeakPolarHBondContact O-CB 3.37Å; G211-A215 PolarHBondContact O-N 3.04Å; Y212-A215 WeakPolarHBondContact O-CB 3.18Å; Y212-A215 PolarHBondContact O-N 3.13Å; A215-L218 PolarHBondContact O-N 3.13Å; A215-S219 WeakPolarHBondContact O-CB 3.03Å; A215-S219 PolarHBondContact O-N 3.21Å; A215-S219 PolarHBondContact O-OG 2.79Å; A215-F381 HydrophobicContact CB-CE1 4.49Å; A215-F381 HydrophobicContact CB-CZ 4.17Å
216	E	81.9	Confident	68	Low	40 Å²	40	50.3 Å²	50.3	19%	0.187	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-46.7	177.4	-172.4	172.6	-146.5	0	0	110.9	F174 K183 Y212 F213 L218 S219 N220	F174-E216 HydrophobicContact CE1-CB 4.39Å; K183-E216 IonicContact NZ-OE1 3.57Å; K183-E216 PolarHBondContact NZ-OE1 2.84Å; Y212-E216 WeakPolarHBondContact CE1-OE2 3.1Å; Y212-E216 WeakPolarHBondContact O-CB 3.36Å; Y212-E216 PolarHBondContact O-N 3.5Å; F213-E216 WeakPolarHBondContact CD1-OE2 2.83Å; F213-E216 PolarHBondContact O-N 3.18Å; E216-L218 PolarHBondContact O-N 2.85Å; E216-S219 PolarHBondContact O-N 3.46Å; E216-N220 VanDerWaalsContact O-CG 3.31Å; E216-N220 PolarHBondContact O-N 3.2Å
217	M	81.2	Confident	65.2	Low	25 Å²	25	58.9 Å²	58.9	12%	0.123	33%	0.328	C	S	.	.	H	α-helix	trans	-63.4	-37.3	177.5	-72.9	-173.4	-62.4	0	0	113.2	F213 L214 W240 I243 F300	F213-M217 WeakPolarHBondContact O-CB 2.64Å; F213-M217 WeakPolarHBondContact O-CE 3.43Å; F213-M217 VanDerWaalsContact O-CG 3.23Å; F213-M217 WeakPolarHBondContact O-CG 3.46Å; F213-M217 PolarHBondContact O-N 2.66Å; L214-M217 HydrophobicContact CD2-CE 3.79Å; L214-M217 HydrophobicContact CG-CE 4.29Å; L214-M217 PolarHBondContact O-N 2.64Å; M217-W240 HydrophobicContact CE-CD2 4.05Å; M217-W240 HydrophobicContact CE-CG 4.34Å; M217-W240 HydrophobicContact CE-CZ2 3.92Å; M217-W240 HydrophobicContact SD-CD2 4.47Å; M217-W240 HydrophobicContact SD-CG 4.16Å; M217-I243 HydrophobicContact CE-CD1 4.27Å; M217-F300 HydrophobicContact CB-CE2 4.02Å; M217-F300 HydrophobicContact CB-CZ 3.85Å; M217-F300 HydrophobicContact CE-CZ 4.44Å; M217-F300 HydrophobicContact SD-CZ 4.24Å
218	L	75.8	Confident	62.5	Low	45 Å²	45	62.6 Å²	62.6	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-75.1	-30.8	177.4	-70.7	171.3	0	0	0	112.9	L214 A215 E216 F300 F381 I384	L214-L218 WeakPolarHBondContact O-CB 3.5Å; L214-L218 VanDerWaalsContact O-CG 3.28Å; L214-L218 WeakPolarHBondContact O-CG 3.4Å; L214-L218 PolarHBondContact O-N 3.28Å; A215-L218 PolarHBondContact O-N 3.13Å; E216-L218 PolarHBondContact O-N 2.85Å; L218-F300 HydrophobicContact CD2-CD2 4.13Å; L218-F300 HydrophobicContact CD2-CE2 3.76Å; L218-F300 HydrophobicContact CG-CE2 4.07Å; L218-F381 HydrophobicContact CD1-CD1 3.42Å; L218-F381 VanDerWaalsContact CD1-CD1 3.42Å; L218-F381 HydrophobicContact CD1-CE1 3.61Å; L218-I384 HydrophobicContact CD1-CD1 3.95Å; L218-I384 HydrophobicContact CD2-CD1 4.44Å
219	S	75	Confident	60	Low	48 Å²	48	65.9 Å²	65.9	34%	0.336	38%	0.381	S	S	.	.	H	α-helix	trans	-73.3	-42.7	178.2	-58.5	0	0	0	0	111.3	A215 E216 G221 K222	A215-S219 WeakPolarHBondContact O-CB 3.03Å; A215-S219 PolarHBondContact O-N 3.21Å; A215-S219 PolarHBondContact O-OG 2.79Å; E216-S219 PolarHBondContact O-N 3.46Å; S219-G221 PolarHBondContact O-N 3.03Å; S219-K222 PolarHBondContact O-N 3.32Å
220	N	64.6	Low	57.3	Low	85 Å²	85	71.2 Å²	71.2	46%	0.455	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-16	176.6	-68.1	-11.4	0	0	0	113.2	E216 K222	E216-N220 VanDerWaalsContact O-CG 3.31Å; E216-N220 PolarHBondContact O-N 3.2Å; N220-K222 VanDerWaalsContact C-N 3.34Å
221	G	52.5	Low	54.4	Low	51 Å²	51	73.9 Å²	73.9	53%	0.526	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-11.1	176.3	0	0	0	0	0	115	S219	S219-G221 PolarHBondContact O-N 3.03Å
222	K	47.2	Very low	51.7	Low	183 Å²	183	81.4 Å²	81.4	80%	0.796	49%	0.492	S	S	*	.	S	Bend	trans	-87.6	-16.8	-176	-75.9	-176.2	175.5	178.4	0	115	S219 N220	S219-K222 PolarHBondContact O-N 3.32Å; N220-K222 VanDerWaalsContact C-N 3.34Å
223	D	34.3	Very low	49	Very low	144 Å²	144	86.8 Å²	86.8	77%	0.77	53%	0.531	S	S	*	.	S	Bend	trans	-100.9	-2.7	-172.5	-91.6	-12	0	0	0	115.6	G225	D223-G225 PolarHBondContact O-N 2.9Å
224	N	31.9	Very low	46.5	Very low	120 Å²	120	95.8 Å²	95.8	64%	0.642	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	72	-175.9	-67.2	-6.5	0	0	0	112.2
225	G	32.4	Very low	43.9	Very low	78 Å²	78	99 Å²	99	80%	0.804	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-7.3	151.2	0	0	0	0	0	113	D223	D223-G225 PolarHBondContact O-N 2.9Å
226	D	25.5	Very low	41.6	Very low	139 Å²	139	105.9 Å²	105.9	74%	0.743	64%	0.643	S	S	*	*	S	Bend	trans	-116.6	136.8	175.8	-70.9	-42	0	0	0	109.7
227	E	24.1	Very low	40.1	Very low	184 Å²	184	109.7 Å²	109.7	86%	0.86	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-49.6	137.2	172.9	-75.5	-174.8	144.1	0	0	110.4
228	P	26.7	Very low	39.4	Very low	100 Å²	100	114.2 Å²	114.2	65%	0.649	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-65	130.9	177.8	28.1	-30.9	0	0	0	108	A230	P228-A230 PolarHBondContact O-N 3.23Å; P228-A230 VanDerWaalsContact O-N 3.11Å
229	P	24.7	Very low	39.4	Very low	118 Å²	118	112.5 Å²	112.5	77%	0.766	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-61.6	123.4	175.5	25.3	-31	0	0	0	107.8	G231	P229-G231 VanDerWaalsContact C-N 3.3Å; P229-G231 PolarHBondContact O-N 3.03Å
230	A	26	Very low	39.8	Very low	113 Å²	113	111.2 Å²	111.2	93%	0.934	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	91.6	174.1	0	0	0	0	0	109.2	P228	P228-A230 PolarHBondContact O-N 3.23Å; P228-A230 VanDerWaalsContact O-N 3.11Å
231	G	25.7	Very low	40.6	Very low	56 Å²	56	109.6 Å²	109.6	58%	0.577	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.8	-31.9	-173.1	0	0	0	0	0	118	P229	P229-G231 VanDerWaalsContact C-N 3.3Å; P229-G231 PolarHBondContact O-N 3.03Å
232	N	25.4	Very low	42	Very low	157 Å²	157	107.8 Å²	107.8	84%	0.84	64%	0.639	S	S	*	*			trans	-129.2	36.8	-171.9	-78.8	-10.9	0	0	0	115.2	Q234	N232-Q234 PolarHBondContact O-N 3.1Å; N232-Q234 VanDerWaalsContact O-N 3.1Å
233	S	26.1	Very low	43.8	Very low	122 Å²	122	99 Å²	99	85%	0.853	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	26.7	-178.9	40.2	0	0	0	0	115.5
234	Q	30.3	Very low	46.2	Very low	203 Å²	203	93.7 Å²	93.7	95%	0.949	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	3	178.3	-82.3	-176.1	-12.7	0	0	115.2	N232	N232-Q234 PolarHBondContact O-N 3.1Å; N232-Q234 VanDerWaalsContact O-N 3.1Å
235	G	29.2	Very low	48.6	Very low	68 Å²	68	92.3 Å²	92.3	70%	0.701	56%	0.558	S	S	*	*	S	Bend	trans	-120.6	-10.1	-168.9	0	0	0	0	0	118.3
236	L	32.8	Very low	50.9	Low	145 Å²	145	89.3 Å²	89.3	76%	0.759	52%	0.523	S	S	*	.			trans	-109	95.3	179.9	-118.9	80.3	0	0	0	109.1	D238	L236-D238 PolarHBondContact O-N 3.21Å
237	E	50.2	Low	53.7	Low	119 Å²	119	82.8 Å²	82.8	56%	0.556	49%	0.488	S	S	*	.			trans	-56.1	125.7	157.8	-69.4	-174	138.5	0	0	107.7	G239 R245	E237-G239 PolarHBondContact O-N 3.34Å; E237-R245 IonicContact OE1-CZ 3.99Å; E237-R245 IonicContact OE1-NE 2.75Å; E237-R245 IonicContact OE1-NH1 3.34Å; E237-R245 PolarHBondContact OE1-NH1 3.19Å; E237-R245 IonicContact OE1-NH2 3.79Å; E237-R245 PolarHBondContact OE1-NH2 2.97Å; E237-R245 IonicContact OE2-CZ 3.89Å; E237-R245 IonicContact OE2-NH1 3.9Å; E237-R245 PolarHBondContact OE2-NH1 3.48Å; E237-R245 IonicContact OE2-NH2 3.44Å; E237-R245 PolarHBondContact OE2-NH2 3.06Å
238	D	67.6	Low	56.5	Low	120 Å²	120	79.9 Å²	79.9	64%	0.642	47%	0.472	S	S	*	.			trans	-49.3	126.4	176.6	-92.1	-31.1	0	0	0	108.7	L236 W240 T241 S242	L236-D238 PolarHBondContact O-N 3.21Å; D238-W240 CarbonylContact O-C 3.59Å; D238-W240 PolarHBondContact O-N 3.46Å; D238-T241 HydrophobicContact CB-CG2 3.97Å; D238-T241 WeakPolarHBondContact O-CA 3.04Å; D238-T241 WeakPolarHBondContact O-CB 3.3Å; D238-T241 PolarHBondContact O-N 2.92Å; D238-T241 PolarHBondContact O-OG1 3.44Å; D238-S242 PolarHBondContact O-N 3.33Å
239	G	75.6	Confident	59.1	Low	10 Å²	10	76.5 Å²	76.5	10%	0.103	45%	0.447	C	S	.	.	H	α-helix	trans	-51.9	-28.5	-174.7	0	0	0	0	0	113.5	E237 S242 I243	E237-G239 PolarHBondContact O-N 3.34Å; G239-S242 WeakPolarHBondContact O-CB 3.47Å; G239-S242 PolarHBondContact O-N 2.9Å; G239-I243 WeakPolarHBondContact O-CG1 3.2Å; G239-I243 PolarHBondContact O-N 3.39Å
240	W	83.1	Confident	61.7	Low	21 Å²	21	71 Å²	71	8%	0.08	41%	0.41	C	S	.	.	H	α-helix	trans	-65.1	-38.9	170.6	-70.8	115.9	0	0	0	114.9	L214 M217 D238 S242 I243 L244 F265 L296 Y297 F300	L214-W240 HydrophobicContact CD2-CH2 3.65Å; L214-W240 HydrophobicContact CD2-CZ2 3.69Å; M217-W240 HydrophobicContact CE-CD2 4.05Å; M217-W240 HydrophobicContact CE-CG 4.34Å; M217-W240 HydrophobicContact CE-CZ2 3.92Å; M217-W240 HydrophobicContact SD-CD2 4.47Å; M217-W240 HydrophobicContact SD-CG 4.16Å; D238-W240 CarbonylContact O-C 3.59Å; D238-W240 PolarHBondContact O-N 3.46Å; W240-S242 VanDerWaalsContact C-N 3.29Å; W240-I243 HydrophobicContact CD2-CD1 4.4Å; W240-I243 HydrophobicContact CE3-CD1 3.73Å; W240-I243 HydrophobicContact CZ3-CD1 3.87Å; W240-I243 PolarHBondContact O-N 3.11Å; W240-L244 WeakPolarHBondContact O-CG 3.35Å; W240-L244 PolarHBondContact O-N 3.4Å; W240-F265 HydrophobicContact CB-CE2 3.94Å; W240-F265 HydrophobicContact CD2-CE2 4.16Å; W240-F265 HydrophobicContact CD2-CZ 4.42Å; W240-F265 HydrophobicContact CE3-CE1 4.31Å; W240-F265 AromaticContact CE3-CE2 3.61Å; W240-F265 HydrophobicContact CE3-CE2 3.61Å; W240-F265 AromaticContact CE3-CZ 3.46Å; W240-F265 HydrophobicContact CE3-CZ 3.46Å; W240-F265 VanDerWaalsContact CE3-CZ 3.46Å; W240-F265 HydrophobicContact CG-CE2 4.33Å; W240-F265 HydrophobicContact CZ3-CE1 4.4Å; W240-F265 HydrophobicContact CZ3-CE2 4.46Å; W240-F265 AromaticContact CZ3-CZ 3.91Å; W240-F265 HydrophobicContact CZ3-CZ 3.91Å; W240-L296 HydrophobicContact CH2-CB 4.32Å; W240-Y297 AromaticContact CD2-CD2 3.77Å; W240-Y297 HydrophobicContact CD2-CD2 3.77Å; W240-Y297 HydrophobicContact CD2-CE2 4.41Å; W240-Y297 AromaticContact CE2-CD2 3.89Å; W240-Y297 AromaticContact CE3-CD2 3.96Å; W240-Y297 HydrophobicContact CE3-CD2 3.96Å; W240-Y297 HydrophobicContact CG-CD2 4.24Å; W240-Y297 HydrophobicContact CG-CE2 4.43Å; W240-Y297 HydrophobicContact CH2-CD2 4.37Å; W240-Y297 HydrophobicContact CZ2-CD2 4.22Å; W240-Y297 HydrophobicContact CZ3-CD2 4.24Å; W240-F300 AromaticContact CE2-CD1 3.87Å; W240-F300 HydrophobicContact CH2-CB 4.38Å; W240-F300 HydrophobicContact CZ2-CB 3.64Å; W240-F300 AromaticContact CZ2-CD1 3.7Å; W240-F300 HydrophobicContact CZ2-CD1 3.7Å; W240-F300 HydrophobicContact CZ2-CD2 4.38Å; W240-F300 HydrophobicContact CZ2-CE1 4.42Å; W240-F300 AromaticContact CZ2-CG 3.67Å; W240-F300 HydrophobicContact CZ2-CG 3.67Å; W240-F300 AromaticContact NE1-CD1 3.42Å; W240-F300 AromaticContact NE1-CE1 3.44Å
241	T	82.5	Confident	64.4	Low	51 Å²	51	65.6 Å²	65.6	31%	0.313	37%	0.366	S	S	.	.	H	α-helix	trans	-64.4	-38.6	173.9	65.6	0	0	0	0	110.8	D238 L244 R245	D238-T241 HydrophobicContact CB-CG2 3.97Å; D238-T241 WeakPolarHBondContact O-CA 3.04Å; D238-T241 WeakPolarHBondContact O-CB 3.3Å; D238-T241 PolarHBondContact O-N 2.92Å; D238-T241 PolarHBondContact O-OG1 3.44Å; T241-L244 PolarHBondContact O-N 3.03Å; T241-R245 WeakPolarHBondContact O-CG 3.38Å; T241-R245 PolarHBondContact O-N 3.39Å; T241-R245 PolarHBondContact OG1-NH2 2.85Å
242	S	81.9	Confident	67	Low	12 Å²	12	68 Å²	68	8%	0.084	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-51.9	172.4	-61.1	0	0	0	0	110.3	F213 D238 G239 W240 L244 R245 Y246	F213-S242 VanDerWaalsContact CZ-CB 3.43Å; D238-S242 PolarHBondContact O-N 3.33Å; G239-S242 WeakPolarHBondContact O-CB 3.47Å; G239-S242 PolarHBondContact O-N 2.9Å; W240-S242 VanDerWaalsContact C-N 3.29Å; S242-L244 VanDerWaalsContact C-N 3.3Å; S242-L244 PolarHBondContact O-N 3.02Å; S242-R245 WeakPolarHBondContact O-CB 3.38Å; S242-R245 PolarHBondContact O-N 3.41Å; S242-R245 PolarHBondContact OG-NH1 3.1Å; S242-Y246 WeakPolarHBondContact O-CD2 2.99Å; S242-Y246 PolarHBondContact O-N 2.72Å
243	I	85	Confident	69.5	Low	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-54.4	-44.6	176	-68.3	166	0	0	0	112.1	V210 F213 M217 G239 W240 R245 Y246 F247 L293	V210-I243 HydrophobicContact CG2-CG1 4.35Å; V210-I243 HydrophobicContact CG2-CG2 3.77Å; F213-I243 HydrophobicContact CB-CD1 3.83Å; F213-I243 HydrophobicContact CB-CG1 3.82Å; F213-I243 HydrophobicContact CD2-CG1 3.79Å; F213-I243 HydrophobicContact CG-CG1 4.17Å; M217-I243 HydrophobicContact CE-CD1 4.27Å; G239-I243 WeakPolarHBondContact O-CG1 3.2Å; G239-I243 PolarHBondContact O-N 3.39Å; W240-I243 HydrophobicContact CD2-CD1 4.4Å; W240-I243 HydrophobicContact CE3-CD1 3.73Å; W240-I243 HydrophobicContact CZ3-CD1 3.87Å; W240-I243 PolarHBondContact O-N 3.11Å; I243-R245 VanDerWaalsContact C-N 3.34Å; I243-R245 PolarHBondContact O-N 3.48Å; I243-Y246 WeakPolarHBondContact O-CB 3.31Å; I243-Y246 PolarHBondContact O-N 3.48Å; I243-Y246 VanDerWaalsContact O-N 3.15Å; I243-F247 PolarHBondContact O-N 2.94Å; I243-L293 HydrophobicContact CG2-CD2 3.31Å
244	L	84.5	Confident	71.9	Confident	31 Å²	31	59.6 Å²	59.6	16%	0.162	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-34.6	178.5	-75.4	175.9	0	0	0	113	W240 T241 S242 Y246 F247 K248 F262 F265	W240-L244 WeakPolarHBondContact O-CG 3.35Å; W240-L244 PolarHBondContact O-N 3.4Å; T241-L244 PolarHBondContact O-N 3.03Å; S242-L244 VanDerWaalsContact C-N 3.3Å; S242-L244 PolarHBondContact O-N 3.02Å; L244-Y246 VanDerWaalsContact C-N 3.28Å; L244-Y246 PolarHBondContact O-N 3.2Å; L244-F247 PolarHBondContact O-N 3.43Å; L244-K248 WeakPolarHBondContact O-CB 3.24Å; L244-K248 PolarHBondContact O-N 3.37Å; L244-F262 HydrophobicContact CD2-CD1 4.11Å; L244-F262 HydrophobicContact CD2-CE1 3.32Å; L244-F262 HydrophobicContact CD2-CZ 3.89Å; L244-F265 HydrophobicContact CD1-CD2 3.69Å; L244-F265 HydrophobicContact CD1-CE2 3.51Å; L244-F265 HydrophobicContact CD1-CZ 4.33Å; L244-F265 HydrophobicContact CD2-CD2 4.24Å; L244-F265 HydrophobicContact CD2-CE1 4.16Å; L244-F265 HydrophobicContact CD2-CE2 3.69Å; L244-F265 HydrophobicContact CD2-CZ 3.63Å; L244-F265 HydrophobicContact CG-CD2 4.08Å; L244-F265 HydrophobicContact CG-CE2 3.41Å; L244-F265 VanDerWaalsContact CG-CE2 3.41Å; L244-F265 HydrophobicContact CG-CZ 3.79Å
245	R	82	Confident	74.2	Confident	91 Å²	91	55 Å²	55	34%	0.343	30%	0.297	S	S	.	.	H	α-helix	trans	-63.3	-37	173.9	-71.9	-173.9	-149	95.6	4.5	111.6	E237 T241 S242 I243 K248 W249	E237-R245 IonicContact OE1-CZ 3.99Å; E237-R245 IonicContact OE1-NE 2.75Å; E237-R245 IonicContact OE1-NH1 3.34Å; E237-R245 PolarHBondContact OE1-NH1 3.19Å; E237-R245 IonicContact OE1-NH2 3.79Å; E237-R245 PolarHBondContact OE1-NH2 2.97Å; E237-R245 IonicContact OE2-CZ 3.89Å; E237-R245 IonicContact OE2-NH1 3.9Å; E237-R245 PolarHBondContact OE2-NH1 3.48Å; E237-R245 IonicContact OE2-NH2 3.44Å; E237-R245 PolarHBondContact OE2-NH2 3.06Å; T241-R245 WeakPolarHBondContact O-CG 3.38Å; T241-R245 PolarHBondContact O-N 3.39Å; T241-R245 PolarHBondContact OG1-NH2 2.85Å; S242-R245 WeakPolarHBondContact O-CB 3.38Å; S242-R245 PolarHBondContact O-N 3.41Å; S242-R245 PolarHBondContact OG-NH1 3.1Å; I243-R245 VanDerWaalsContact C-N 3.34Å; I243-R245 PolarHBondContact O-N 3.48Å; R245-K248 PolarHBondContact O-N 2.94Å; R245-W249 WeakPolarHBondContact O-CB 3.48Å; R245-W249 PolarHBondContact O-N 3.37Å
246	Y	80.2	Confident	76.7	Confident	16 Å²	16	52.5 Å²	52.5	6%	0.063	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-45.6	176.2	-78.5	-118.3	0	0	0	111	V182 V186 A209 F213 S242 I243 L244 K248 W249 L250	V182-Y246 VanDerWaalsContact CA-OH 3.3Å; V182-Y246 WeakPolarHBondContact CA-OH 3.33Å; V182-Y246 VanDerWaalsContact CG1-OH 3.27Å; V182-Y246 WeakPolarHBondContact CG1-OH 3.31Å; V182-Y246 PolarHBondContact O-OH 2.91Å; V186-Y246 HydrophobicContact CB-CE1 3.74Å; V186-Y246 HydrophobicContact CB-CE2 4.39Å; V186-Y246 WeakPolarHBondContact CB-OH 3.26Å; V186-Y246 HydrophobicContact CG1-CD1 4.07Å; V186-Y246 HydrophobicContact CG1-CD2 4.29Å; V186-Y246 HydrophobicContact CG1-CE1 3.58Å; V186-Y246 HydrophobicContact CG1-CE2 3.84Å; V186-Y246 HydrophobicContact CG1-CG 4.42Å; V186-Y246 VanDerWaalsContact CG1-CZ 3.45Å; V186-Y246 HydrophobicContact CG2-CD1 4.1Å; V186-Y246 HydrophobicContact CG2-CE1 3.15Å; V186-Y246 WeakPolarHBondContact CG2-OH 2.89Å; A209-Y246 HydrophobicContact CB-CD1 3.48Å; A209-Y246 VanDerWaalsContact CB-CD1 3.48Å; A209-Y246 HydrophobicContact CB-CE1 3.44Å; A209-Y246 VanDerWaalsContact CB-CE1 3.44Å; A209-Y246 HydrophobicContact CB-CG 4.1Å; F213-Y246 HydrophobicContact CE2-CD2 4.35Å; F213-Y246 AromaticContact CE2-CE2 3.71Å; F213-Y246 HydrophobicContact CE2-CE2 3.71Å; F213-Y246 HydrophobicContact CZ-CE2 4.2Å; S242-Y246 WeakPolarHBondContact O-CD2 2.99Å; S242-Y246 PolarHBondContact O-N 2.72Å; I243-Y246 WeakPolarHBondContact O-CB 3.31Å; I243-Y246 PolarHBondContact O-N 3.48Å; I243-Y246 VanDerWaalsContact O-N 3.15Å; L244-Y246 VanDerWaalsContact C-N 3.28Å; L244-Y246 PolarHBondContact O-N 3.2Å; Y246-K248 VanDerWaalsContact C-N 3.34Å; Y246-K248 PolarHBondContact O-N 2.8Å; Y246-W249 PolarHBondContact O-N 2.81Å; Y246-L250 PolarHBondContact O-N 3.36Å
247	F	84.5	Confident	78.7	Confident	2 Å²	2	54 Å²	54	1%	0.009	27%	0.27	C	S	.	.	H	α-helix	trans	-58.1	-49	175.3	178.4	-91.3	0	0	0	110.8	L206 I243 L244 W249 L250 A251 W256 F262 C289 I290 L293	L206-F247 HydrophobicContact CD1-CB 4.48Å; L206-F247 HydrophobicContact CD2-CD2 4.28Å; I243-F247 PolarHBondContact O-N 2.94Å; L244-F247 PolarHBondContact O-N 3.43Å; F247-W249 VanDerWaalsContact C-N 3.3Å; F247-W249 PolarHBondContact O-N 3.22Å; F247-L250 PolarHBondContact O-N 3.03Å; F247-L250 VanDerWaalsContact O-N 3.16Å; F247-A251 HydrophobicContact CD1-CB 4.33Å; F247-A251 HydrophobicContact CE1-CB 3.96Å; F247-A251 HydrophobicContact CZ-CB 4.27Å; F247-A251 VanDerWaalsContact O-CB 3.23Å; F247-A251 WeakPolarHBondContact O-CB 2.96Å; F247-A251 PolarHBondContact O-N 3.34Å; F247-W256 HydrophobicContact CD2-CZ3 4.3Å; F247-W256 HydrophobicContact CE2-CE3 4.06Å; F247-W256 AromaticContact CE2-CZ3 3.69Å; F247-W256 HydrophobicContact CE2-CZ3 3.69Å; F247-W256 HydrophobicContact CZ-CE3 4.09Å; F247-W256 HydrophobicContact CZ-CZ3 4.21Å; F247-F262 AromaticContact CD1-CD1 3.5Å; F247-F262 HydrophobicContact CD1-CD1 3.5Å; F247-F262 VanDerWaalsContact CD1-CD1 3.5Å; F247-F262 AromaticContact CD1-CE1 3.98Å; F247-F262 HydrophobicContact CD1-CE1 3.98Å; F247-F262 HydrophobicContact CE1-CB 4.07Å; F247-F262 AromaticContact CE1-CD1 3.37Å; F247-F262 HydrophobicContact CE1-CD1 3.37Å; F247-F262 HydrophobicContact CE1-CE1 4.17Å; F247-F262 HydrophobicContact CE1-CG 4.09Å; F247-F262 HydrophobicContact CG-CD1 4.24Å; F247-F262 HydrophobicContact CG-CE1 4.3Å; F247-F262 HydrophobicContact CZ-CD1 4Å; F247-C289 HydrophobicContact CD2-CB 4.18Å; F247-C289 HydrophobicContact CE2-CB 3.9Å; F247-I290 HydrophobicContact CE2-CG1 3.83Å; F247-I290 HydrophobicContact CZ-CD1 4.28Å; F247-I290 HydrophobicContact CZ-CG1 3.67Å; F247-L293 HydrophobicContact CB-CD1 3.79Å; F247-L293 HydrophobicContact CD2-CD1 3.47Å; F247-L293 VanDerWaalsContact CD2-CD1 3.47Å; F247-L293 HydrophobicContact CE2-CD1 4.3Å; F247-L293 HydrophobicContact CG-CD1 3.79Å
248	K	82.5	Confident	79.7	Confident	123 Å²	123	48.6 Å²	48.6	54%	0.535	25%	0.245	S	C	.	.	H	α-helix	trans	-60.7	-39.4	-179.9	-172.8	173.3	-175.4	173.4	0	112.4	L244 R245 Y246 N252	L244-K248 WeakPolarHBondContact O-CB 3.24Å; L244-K248 PolarHBondContact O-N 3.37Å; R245-K248 PolarHBondContact O-N 2.94Å; Y246-K248 VanDerWaalsContact C-N 3.34Å; Y246-K248 PolarHBondContact O-N 2.8Å; K248-N252 WeakPolarHBondContact O-CB 3.04Å; K248-N252 VanDerWaalsContact O-CG 3.23Å; K248-N252 PolarHBondContact O-N 2.81Å; K248-N252 PolarHBondContact O-ND2 2.84Å
249	W	80.6	Confident	79.9	Confident	29 Å²	29	43.6 Å²	43.6	11%	0.11	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-48.8	174	171.2	79.8	0	0	0	112	L189 L190 L197 L205 R245 Y246 F247 R253	L189-W249 HydrophobicContact CB-CZ2 4.21Å; L189-W249 PolarHBondContact O-NE1 3.06Å; L190-W249 HydrophobicContact CD2-CB 3.54Å; L190-W249 HydrophobicContact CD2-CG 3.71Å; L197-W249 HydrophobicContact CD1-CH2 3.98Å; L197-W249 HydrophobicContact CD1-CZ2 4.48Å; L205-W249 HydrophobicContact CD2-CH2 4.23Å; L205-W249 HydrophobicContact CD2-CZ3 3.99Å; R245-W249 WeakPolarHBondContact O-CB 3.48Å; R245-W249 PolarHBondContact O-N 3.37Å; Y246-W249 PolarHBondContact O-N 2.81Å; F247-W249 VanDerWaalsContact C-N 3.3Å; F247-W249 PolarHBondContact O-N 3.22Å; W249-R253 VanDerWaalsContact O-CB 3.24Å; W249-R253 WeakPolarHBondContact O-CB 3.4Å; W249-R253 PolarHBondContact O-N 3.03Å; W249-R253 VanDerWaalsContact O-N 3.1Å
250	L	81	Confident	79.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-45.8	178.5	-176.8	62.9	0	0	0	111.1	V203 L206 Y246 F247 R253 C254 W256	V203-L250 HydrophobicContact CG2-CD2 4.19Å; L206-L250 HydrophobicContact CB-CD2 4.27Å; L206-L250 HydrophobicContact CD2-CD2 4.11Å; Y246-L250 PolarHBondContact O-N 3.36Å; F247-L250 PolarHBondContact O-N 3.03Å; F247-L250 VanDerWaalsContact O-N 3.16Å; L250-R253 WeakPolarHBondContact O-CB 3.1Å; L250-R253 PolarHBondContact O-N 3.34Å; L250-C254 WeakPolarHBondContact O-CB 3.31Å; L250-C254 PolarHBondContact O-N 3.12Å; L250-C254 PolarHBondContact O-SG 3.13Å; L250-C254 VanDerWaalsContact O-SG 3.41Å; L250-W256 HydrophobicContact CD2-CH2 3.61Å; L250-W256 HydrophobicContact CD2-CZ2 4.42Å; L250-W256 HydrophobicContact CD2-CZ3 4.08Å; L250-W256 HydrophobicContact CG-CH2 3.9Å; L250-W256 HydrophobicContact CG-CZ2 4.42Å; L250-W256 HydrophobicContact CG-CZ3 4.22Å
251	A	82.2	Confident	79.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-44.1	-177.5	0	0	0	0	0	112.1	F247 R253 C254 S255 W256 A259	F247-A251 HydrophobicContact CD1-CB 4.33Å; F247-A251 HydrophobicContact CE1-CB 3.96Å; F247-A251 HydrophobicContact CZ-CB 4.27Å; F247-A251 VanDerWaalsContact O-CB 3.23Å; F247-A251 WeakPolarHBondContact O-CB 2.96Å; F247-A251 PolarHBondContact O-N 3.34Å; A251-R253 VanDerWaalsContact C-N 3.29Å; A251-R253 PolarHBondContact O-N 3.37Å; A251-C254 PolarHBondContact O-N 2.96Å; A251-S255 PolarHBondContact O-N 3.32Å; A251-W256 HydrophobicContact CB-CB 4.06Å; A251-W256 HydrophobicContact CB-CD2 4.27Å; A251-W256 HydrophobicContact CB-CE3 3.65Å; A251-W256 HydrophobicContact CB-CG 4.48Å; A251-W256 HydrophobicContact CB-CZ3 4.45Å; A251-W256 PolarHBondContact O-N 3.31Å; A251-A259 HydrophobicContact CB-CB 3.56Å
252	N	80.8	Confident	79.3	Confident	106 Å²	106	47.4 Å²	47.4	57%	0.567	25%	0.252	S	S	*	.	H	α-helix	trans	-62.6	-37.9	174.7	-76.8	-13.8	0	0	0	112.2	K248 S255	K248-N252 WeakPolarHBondContact O-CB 3.04Å; K248-N252 VanDerWaalsContact O-CG 3.23Å; K248-N252 PolarHBondContact O-N 2.81Å; K248-N252 PolarHBondContact O-ND2 2.84Å; N252-S255 PolarHBondContact O-N 3.01Å
253	R	76.2	Confident	78.9	Confident	76 Å²	76	51.4 Å²	51.4	29%	0.287	28%	0.276	S	S	.	.	H	α-helix	trans	-71.6	-38.1	-178.7	-178.9	-175.9	169.5	85.7	18.4	112.2	S195 L197 W249 L250 A251 S255	S195-R253 VanDerWaalsContact O-CZ 3.23Å; S195-R253 PolarHBondContact O-NH1 3.42Å; S195-R253 PolarHBondContact O-NH2 2.91Å; S195-R253 PolarHBondContact OG-NH1 3.37Å; L197-R253 PolarHBondContact O-NH2 2.99Å; W249-R253 VanDerWaalsContact O-CB 3.24Å; W249-R253 WeakPolarHBondContact O-CB 3.4Å; W249-R253 PolarHBondContact O-N 3.03Å; W249-R253 VanDerWaalsContact O-N 3.1Å; L250-R253 WeakPolarHBondContact O-CB 3.1Å; L250-R253 PolarHBondContact O-N 3.34Å; A251-R253 VanDerWaalsContact C-N 3.29Å; A251-R253 PolarHBondContact O-N 3.37Å; R253-S255 VanDerWaalsContact C-N 3.3Å
254	C	77.3	Confident	78.7	Confident	27 Å²	27	53.2 Å²	53.2	18%	0.182	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	5.4	178.8	-62.5	0	0	0	0	112.9	E199 L250 A251 W256	E199-C254 HydrophobicContact CG-CB 4.38Å; L250-C254 WeakPolarHBondContact O-CB 3.31Å; L250-C254 PolarHBondContact O-N 3.12Å; L250-C254 PolarHBondContact O-SG 3.13Å; L250-C254 VanDerWaalsContact O-SG 3.41Å; A251-C254 PolarHBondContact O-N 2.96Å; C254-W256 HydrophobicContact CB-CD2 4.19Å; C254-W256 HydrophobicContact CB-CG 4.08Å; C254-W256 HydrophobicContact CB-CZ2 4.31Å; C254-W256 VanDerWaalsContact CB-NE1 3.27Å; C254-W256 PolarHBondContact O-N 3.47Å
255	S	79.3	Confident	78.4	Confident	106 Å²	106	52.2 Å²	52.2	74%	0.741	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	39.6	-178.2	52.7	0	0	0	0	113.5	A251 N252 R253	A251-S255 PolarHBondContact O-N 3.32Å; N252-S255 PolarHBondContact O-N 3.01Å; R253-S255 VanDerWaalsContact C-N 3.3Å
256	W	81.4	Confident	78	Confident	16 Å²	16	51.6 Å²	51.6	6%	0.061	29%	0.293	C	S	.	.			trans	-69.5	127.8	179	-72.7	-6	0	0	0	110.8	E199 F247 L250 A251 C254 T258 A259 Q285 E286 C289	E199-W256 HydrophobicContact CG-CZ2 4.28Å; E199-W256 PolarHBondContact OE1-NE1 2.82Å; E199-W256 VanDerWaalsContact OE1-NE1 3.09Å; F247-W256 HydrophobicContact CD2-CZ3 4.3Å; F247-W256 HydrophobicContact CE2-CE3 4.06Å; F247-W256 AromaticContact CE2-CZ3 3.69Å; F247-W256 HydrophobicContact CE2-CZ3 3.69Å; F247-W256 HydrophobicContact CZ-CE3 4.09Å; F247-W256 HydrophobicContact CZ-CZ3 4.21Å; L250-W256 HydrophobicContact CD2-CH2 3.61Å; L250-W256 HydrophobicContact CD2-CZ2 4.42Å; L250-W256 HydrophobicContact CD2-CZ3 4.08Å; L250-W256 HydrophobicContact CG-CH2 3.9Å; L250-W256 HydrophobicContact CG-CZ2 4.42Å; L250-W256 HydrophobicContact CG-CZ3 4.22Å; A251-W256 HydrophobicContact CB-CB 4.06Å; A251-W256 HydrophobicContact CB-CD2 4.27Å; A251-W256 HydrophobicContact CB-CE3 3.65Å; A251-W256 HydrophobicContact CB-CG 4.48Å; A251-W256 HydrophobicContact CB-CZ3 4.45Å; A251-W256 PolarHBondContact O-N 3.31Å; C254-W256 HydrophobicContact CB-CD2 4.19Å; C254-W256 HydrophobicContact CB-CG 4.08Å; C254-W256 HydrophobicContact CB-CZ2 4.31Å; C254-W256 VanDerWaalsContact CB-NE1 3.27Å; C254-W256 PolarHBondContact O-N 3.47Å; W256-T258 VanDerWaalsContact C-N 3.26Å; W256-T258 PolarHBondContact O-N 3.3Å; W256-A259 WeakPolarHBondContact O-CB 3.5Å; W256-A259 PolarHBondContact O-N 3.23Å; W256-Q285 HydrophobicContact CZ2-CB 4.17Å; W256-E286 VanDerWaalsContact CB-CD 3.47Å; W256-E286 HydrophobicContact CB-CG 4.06Å; W256-E286 WeakPolarHBondContact CB-OE1 3.21Å; W256-E286 HydrophobicContact CD2-CB 3.69Å; W256-E286 HydrophobicContact CD2-CG 3.73Å; W256-E286 HydrophobicContact CE3-CB 4.05Å; W256-E286 HydrophobicContact CE3-CG 3.89Å; W256-E286 HydrophobicContact CG-CB 4Å; W256-E286 HydrophobicContact CG-CG 3.82Å; W256-E286 HydrophobicContact CZ2-CB 4.2Å; W256-E286 HydrophobicContact CZ3-CB 4.48Å; W256-C289 HydrophobicContact CH2-CB 4.11Å; W256-C289 HydrophobicContact CZ3-CB 4.03Å
257	E	74	Confident	77.5	Confident	176 Å²	176	52.4 Å²	52.4	82%	0.822	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-66.2	-31.9	-177	-65.1	-174.4	170.3	0	0	111.5	A259 E286	E257-A259 PolarHBondContact O-N 3.27Å; E257-E286 PolarHBondContact N-OE1 3.29Å
258	T	72.1	Confident	76.7	Confident	6 Å²	6	52.6 Å²	52.6	4%	0.037	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-70.7	-12.8	177.9	61.9	0	0	0	0	113.5	W256 A260 V261 F262 L280 E286 I290	W256-T258 VanDerWaalsContact C-N 3.26Å; W256-T258 PolarHBondContact O-N 3.3Å; T258-A260 PolarHBondContact O-N 2.67Å; T258-A260 VanDerWaalsContact O-N 3.17Å; T258-V261 PolarHBondContact O-N 3.14Å; T258-F262 WeakPolarHBondContact O-CB 3.43Å; T258-F262 PolarHBondContact O-N 2.68Å; T258-L280 HydrophobicContact CG2-CD1 3.67Å; T258-E286 WeakPolarHBondContact CB-OE1 3.43Å; T258-E286 HydrophobicContact CG2-CG 4.39Å; T258-E286 WeakPolarHBondContact CG2-OE1 3.44Å; T258-E286 PolarHBondContact N-OE1 2.71Å; T258-E286 WeakPolarHBondContact OG1-CG 3.39Å; T258-E286 PolarHBondContact OG1-OE1 3.23Å; T258-I290 HydrophobicContact CG2-CD1 3.76Å; T258-I290 VanDerWaalsContact OG1-CD1 3.29Å; T258-I290 WeakPolarHBondContact OG1-CD1 3.31Å
259	A	71.8	Confident	76	Confident	15 Å²	15	52.3 Å²	52.3	12%	0.124	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-56.9	-33.7	178.6	0	0	0	0	0	112.4	A251 W256 E257	A251-A259 HydrophobicContact CB-CB 3.56Å; W256-A259 WeakPolarHBondContact O-CB 3.5Å; W256-A259 PolarHBondContact O-N 3.23Å; E257-A259 PolarHBondContact O-N 3.27Å
260	A	74	Confident	75.6	Confident	86 Å²	86	54.7 Å²	54.7	71%	0.711	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-73.5	-31	178.4	0	0	0	0	0	112.5	T258	T258-A260 PolarHBondContact O-N 2.67Å; T258-A260 VanDerWaalsContact O-N 3.17Å
261	V	76	Confident	75	Confident	68 Å²	68	59.2 Å²	59.2	41%	0.412	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-44.4	-175.5	-169.9	0	0	0	0	110.6	T258 T263 C267 F273	T258-V261 PolarHBondContact O-N 3.14Å; V261-T263 VanDerWaalsContact C-N 3.28Å; V261-T263 PolarHBondContact O-N 3.16Å; V261-C267 PolarHBondContact O-SG 3.15Å; V261-F273 HydrophobicContact CG1-CD2 3.78Å; V261-F273 HydrophobicContact CG1-CE2 4.41Å
262	F	78.3	Confident	74.7	Confident	8 Å²	8	63.7 Å²	63.7	4%	0.035	37%	0.373	C	S	.	.			trans	-81.2	74.9	-179.3	-166.2	-104.6	0	0	0	111.2	L244 F247 T258 F265 F273 L293 L294	L244-F262 HydrophobicContact CD2-CD1 4.11Å; L244-F262 HydrophobicContact CD2-CE1 3.32Å; L244-F262 HydrophobicContact CD2-CZ 3.89Å; F247-F262 AromaticContact CD1-CD1 3.5Å; F247-F262 HydrophobicContact CD1-CD1 3.5Å; F247-F262 VanDerWaalsContact CD1-CD1 3.5Å; F247-F262 AromaticContact CD1-CE1 3.98Å; F247-F262 HydrophobicContact CD1-CE1 3.98Å; F247-F262 HydrophobicContact CE1-CB 4.07Å; F247-F262 AromaticContact CE1-CD1 3.37Å; F247-F262 HydrophobicContact CE1-CD1 3.37Å; F247-F262 HydrophobicContact CE1-CE1 4.17Å; F247-F262 HydrophobicContact CE1-CG 4.09Å; F247-F262 HydrophobicContact CG-CD1 4.24Å; F247-F262 HydrophobicContact CG-CE1 4.3Å; F247-F262 HydrophobicContact CZ-CD1 4Å; T258-F262 WeakPolarHBondContact O-CB 3.43Å; T258-F262 PolarHBondContact O-N 2.68Å; F262-F265 HydrophobicContact CE2-CD1 4.44Å; F262-F265 AromaticContact CZ-CD1 3.87Å; F262-F265 HydrophobicContact CZ-CD1 3.87Å; F262-F265 AromaticContact CZ-CE1 3.85Å; F262-F265 HydrophobicContact CZ-CE1 3.85Å; F262-F273 HydrophobicContact CB-CE2 4.29Å; F262-F273 AromaticContact CD2-CE2 3.78Å; F262-F273 HydrophobicContact CD2-CE2 3.78Å; F262-F273 AromaticContact CD2-CZ 3.57Å; F262-F273 HydrophobicContact CD2-CZ 3.57Å; F262-F273 HydrophobicContact CE2-CZ 4.12Å; F262-L293 HydrophobicContact CE1-CD1 4.32Å; F262-L294 HydrophobicContact CE2-CD1 4.4Å; F262-L294 HydrophobicContact CE2-CD2 3.91Å; F262-L294 HydrophobicContact CE2-CG 4.1Å; F262-L294 HydrophobicContact CZ-CD2 4.45Å
263	T	73.4	Confident	74.7	Confident	96 Å²	96	58.9 Å²	58.9	59%	0.589	35%	0.346	S	S	*	.	S	Bend	trans	-94	-23.8	176.6	56.3	0	0	0	0	112.5	V261	V261-T263 VanDerWaalsContact C-N 3.28Å; V261-T263 PolarHBondContact O-N 3.16Å
264	S	81.2	Confident	74.6	Confident	39 Å²	39	56.4 Å²	56.4	27%	0.273	34%	0.337	S	S	.	.	S	Bend	trans	-155.3	159.5	179	68.4	0	0	0	0	110.9	S266 C267	S264-S266 PolarHBondContact O-N 2.99Å; S264-C267 WeakPolarHBondContact O-CB 3.15Å; S264-C267 PolarHBondContact O-N 2.63Å
265	F	77.7	Confident	74.5	Confident	10 Å²	10	57.3 Å²	57.3	4%	0.044	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-62.1	-23.9	173.5	-65.6	-71.9	0	0	0	113	W240 L244 F262 C267 S268 L293 L294 Y297	W240-F265 HydrophobicContact CB-CE2 3.94Å; W240-F265 HydrophobicContact CD2-CE2 4.16Å; W240-F265 HydrophobicContact CD2-CZ 4.42Å; W240-F265 HydrophobicContact CE3-CE1 4.31Å; W240-F265 AromaticContact CE3-CE2 3.61Å; W240-F265 HydrophobicContact CE3-CE2 3.61Å; W240-F265 AromaticContact CE3-CZ 3.46Å; W240-F265 HydrophobicContact CE3-CZ 3.46Å; W240-F265 VanDerWaalsContact CE3-CZ 3.46Å; W240-F265 HydrophobicContact CG-CE2 4.33Å; W240-F265 HydrophobicContact CZ3-CE1 4.4Å; W240-F265 HydrophobicContact CZ3-CE2 4.46Å; W240-F265 AromaticContact CZ3-CZ 3.91Å; W240-F265 HydrophobicContact CZ3-CZ 3.91Å; L244-F265 HydrophobicContact CD1-CD2 3.69Å; L244-F265 HydrophobicContact CD1-CE2 3.51Å; L244-F265 HydrophobicContact CD1-CZ 4.33Å; L244-F265 HydrophobicContact CD2-CD2 4.24Å; L244-F265 HydrophobicContact CD2-CE1 4.16Å; L244-F265 HydrophobicContact CD2-CE2 3.69Å; L244-F265 HydrophobicContact CD2-CZ 3.63Å; L244-F265 HydrophobicContact CG-CD2 4.08Å; L244-F265 HydrophobicContact CG-CE2 3.41Å; L244-F265 VanDerWaalsContact CG-CE2 3.41Å; L244-F265 HydrophobicContact CG-CZ 3.79Å; F262-F265 HydrophobicContact CE2-CD1 4.44Å; F262-F265 AromaticContact CZ-CD1 3.87Å; F262-F265 HydrophobicContact CZ-CD1 3.87Å; F262-F265 AromaticContact CZ-CE1 3.85Å; F262-F265 HydrophobicContact CZ-CE1 3.85Å; F265-C267 PolarHBondContact O-N 3.1Å; F265-S268 WeakPolarHBondContact O-CB 3.25Å; F265-S268 PolarHBondContact O-N 3.34Å; F265-S268 PolarHBondContact O-OG 3.44Å; F265-L293 HydrophobicContact CE1-CB 4.13Å; F265-L294 HydrophobicContact CD1-CD2 4.14Å; F265-Y297 HydrophobicContact CB-CD1 3.76Å; F265-Y297 HydrophobicContact CB-CD2 3.96Å; F265-Y297 HydrophobicContact CB-CE1 3.6Å; F265-Y297 HydrophobicContact CB-CE2 3.8Å; F265-Y297 HydrophobicContact CB-CG 3.94Å; F265-Y297 HydrophobicContact CD1-CD1 4.05Å; F265-Y297 AromaticContact CD1-CD2 3.81Å; F265-Y297 HydrophobicContact CD1-CD2 3.81Å; F265-Y297 HydrophobicContact CD1-CE2 4.48Å; F265-Y297 AromaticContact CD1-CG 3.56Å; F265-Y297 HydrophobicContact CD1-CG 3.56Å; F265-Y297 AromaticContact CD2-CD2 3.53Å; F265-Y297 HydrophobicContact CD2-CD2 3.53Å; F265-Y297 AromaticContact CD2-CE2 3.64Å; F265-Y297 HydrophobicContact CD2-CE2 3.64Å; F265-Y297 HydrophobicContact CD2-CG 4.15Å; F265-Y297 HydrophobicContact CE1-CD2 4.17Å; F265-Y297 HydrophobicContact CE1-CG 4.06Å; F265-Y297 AromaticContact CE2-CD2 3.93Å; F265-Y297 HydrophobicContact CE2-CD2 3.93Å; F265-Y297 HydrophobicContact CE2-CE2 4.37Å; F265-Y297 AromaticContact CG-CD1 3.98Å; F265-Y297 HydrophobicContact CG-CD1 3.98Å; F265-Y297 AromaticContact CG-CD2 3.48Å; F265-Y297 HydrophobicContact CG-CD2 3.48Å; F265-Y297 VanDerWaalsContact CG-CD2 3.48Å; F265-Y297 HydrophobicContact CG-CE1 4.2Å; F265-Y297 AromaticContact CG-CE2 3.72Å; F265-Y297 HydrophobicContact CG-CE2 3.72Å; F265-Y297 AromaticContact CG-CG 3.62Å; F265-Y297 HydrophobicContact CG-CG 3.62Å; F265-Y297 HydrophobicContact CZ-CD2 4.25Å
266	S	73.9	Confident	74.3	Confident	77 Å²	77	54.1 Å²	54.1	54%	0.538	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-62.8	-25.8	176.7	-54.5	0	0	0	0	113.6	S264 S268 K269	S264-S266 PolarHBondContact O-N 2.99Å; S266-S268 PolarHBondContact O-N 2.79Å; S266-S268 VanDerWaalsContact O-N 3.14Å; S266-K269 PolarHBondContact O-N 3Å; S266-K269 VanDerWaalsContact O-N 3.15Å
267	C	69.2	Low	74.1	Confident	33 Å²	33	53.4 Å²	53.4	22%	0.223	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-60.8	-21.9	177.7	-62.5	0	0	0	0	112.7	V261 S264 F265 K269 D270 F273	V261-C267 PolarHBondContact O-SG 3.15Å; S264-C267 WeakPolarHBondContact O-CB 3.15Å; S264-C267 PolarHBondContact O-N 2.63Å; F265-C267 PolarHBondContact O-N 3.1Å; C267-K269 PolarHBondContact O-N 3.43Å; C267-D270 PolarHBondContact O-N 3.21Å; C267-F273 HydrophobicContact CB-CD2 4.33Å; C267-F273 VanDerWaalsContact O-CB 3.32Å; C267-F273 WeakPolarHBondContact O-CB 3.24Å; C267-F273 WeakPolarHBondContact O-CG 3.46Å
268	S	68.3	Low	74.1	Confident	6 Å²	6	50 Å²	50	4%	0.042	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-69.6	-11	177.4	66.8	0	0	0	0	115.2	F265 S266 D270 W274	F265-S268 WeakPolarHBondContact O-CB 3.25Å; F265-S268 PolarHBondContact O-N 3.34Å; F265-S268 PolarHBondContact O-OG 3.44Å; S266-S268 PolarHBondContact O-N 2.79Å; S266-S268 VanDerWaalsContact O-N 3.14Å; S268-D270 VanDerWaalsContact C-N 3.29Å; S268-W274 PolarHBondContact O-NE1 3.14Å
269	K	68.1	Low	74.3	Confident	117 Å²	117	57.8 Å²	57.8	51%	0.509	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-78.9	-14.4	175.2	-60.8	-173.1	-179.9	-173.1	0	112.4	S266 C267 E347	S266-K269 PolarHBondContact O-N 3Å; S266-K269 VanDerWaalsContact O-N 3.15Å; C267-K269 PolarHBondContact O-N 3.43Å; K269-E347 IonicContact NZ-OE1 3.74Å
270	D	71.2	Confident	74.4	Confident	79 Å²	79	58.6 Å²	58.6	42%	0.422	34%	0.344	S	S	.	.	S	Bend	trans	-88.3	125.2	179.7	-166.3	-34.3	0	0	0	110.8	C267 S268 T272 F273	C267-D270 PolarHBondContact O-N 3.21Å; S268-D270 VanDerWaalsContact C-N 3.29Å; D270-T272 PolarHBondContact O-N 2.93Å; D270-T272 WeakPolarHBondContact OD1-CB 3.44Å; D270-T272 WeakPolarHBondContact OD1-CG2 3.43Å; D270-T272 PolarHBondContact OD1-N 3.49Å; D270-T272 PolarHBondContact OD1-OG1 3.33Å; D270-T272 PolarHBondContact OD2-OG1 3.29Å; D270-F273 HydrophobicContact CB-CB 4.42Å; D270-F273 WeakPolarHBondContact O-CB 3.33Å; D270-F273 PolarHBondContact O-N 3.4Å; D270-F273 VanDerWaalsContact O-N 3.16Å
271	P	68.5	Low	73.9	Confident	97 Å²	97	58.4 Å²	58.4	63%	0.63	34%	0.335	S	S	*	.	H	α-helix	trans	-61	-26.6	176.6	23.7	-33.3	0	0	0	113.4	F273 W274 A275	P271-F273 VanDerWaalsContact C-N 3.28Å; P271-F273 PolarHBondContact O-N 3.22Å; P271-W274 PolarHBondContact O-N 3.21Å; P271-A275 PolarHBondContact O-N 3.46Å
272	T	75.3	Confident	73.2	Confident	94 Å²	94	59.7 Å²	59.7	58%	0.577	35%	0.347	S	S	*	.	H	α-helix	trans	-68.3	-29	178.1	63.6	0	0	0	0	112.5	D270 A275 S276	D270-T272 PolarHBondContact O-N 2.93Å; D270-T272 WeakPolarHBondContact OD1-CB 3.44Å; D270-T272 WeakPolarHBondContact OD1-CG2 3.43Å; D270-T272 PolarHBondContact OD1-N 3.49Å; D270-T272 PolarHBondContact OD1-OG1 3.33Å; D270-T272 PolarHBondContact OD2-OG1 3.29Å; T272-A275 PolarHBondContact O-N 3.18Å; T272-S276 PolarHBondContact O-N 2.69Å; T272-S276 VanDerWaalsContact O-N 3.13Å
273	F	81.1	Confident	72.3	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.018	37%	0.37	C	S	.	.	H	α-helix	trans	-64.2	-47.5	175.3	171.3	-100.5	0	0	0	111.2	V261 F262 C267 D270 P271 A275 S276 I277 I290 L294	V261-F273 HydrophobicContact CG1-CD2 3.78Å; V261-F273 HydrophobicContact CG1-CE2 4.41Å; F262-F273 HydrophobicContact CB-CE2 4.29Å; F262-F273 AromaticContact CD2-CE2 3.78Å; F262-F273 HydrophobicContact CD2-CE2 3.78Å; F262-F273 AromaticContact CD2-CZ 3.57Å; F262-F273 HydrophobicContact CD2-CZ 3.57Å; F262-F273 HydrophobicContact CE2-CZ 4.12Å; C267-F273 HydrophobicContact CB-CD2 4.33Å; C267-F273 VanDerWaalsContact O-CB 3.32Å; C267-F273 WeakPolarHBondContact O-CB 3.24Å; C267-F273 WeakPolarHBondContact O-CG 3.46Å; D270-F273 HydrophobicContact CB-CB 4.42Å; D270-F273 WeakPolarHBondContact O-CB 3.33Å; D270-F273 PolarHBondContact O-N 3.4Å; D270-F273 VanDerWaalsContact O-N 3.16Å; P271-F273 VanDerWaalsContact C-N 3.28Å; P271-F273 PolarHBondContact O-N 3.22Å; F273-A275 VanDerWaalsContact C-N 3.34Å; F273-A275 PolarHBondContact O-N 3.33Å; F273-S276 WeakPolarHBondContact O-CB 3.23Å; F273-S276 PolarHBondContact O-N 2.94Å; F273-S276 VanDerWaalsContact O-N 3.15Å; F273-S276 PolarHBondContact O-OG 3.22Å; F273-I277 HydrophobicContact CD1-CD1 3.82Å; F273-I277 HydrophobicContact CD2-CD1 4.44Å; F273-I277 HydrophobicContact CE1-CD1 3.28Å; F273-I277 HydrophobicContact CE2-CD1 3.96Å; F273-I277 HydrophobicContact CG-CD1 4.39Å; F273-I277 HydrophobicContact CZ-CD1 3.38Å; F273-I277 HydrophobicContact CZ-CG1 4.39Å; F273-I277 PolarHBondContact O-N 3.24Å; F273-I290 HydrophobicContact CZ-CG2 3.99Å; F273-L294 HydrophobicContact CE1-CD1 3.53Å; F273-L294 HydrophobicContact CZ-CD1 3.85Å
274	W	75.3	Confident	72.5	Confident	25 Å²	25	59.1 Å²	59.1	10%	0.095	36%	0.356	C	S	.	.	H	α-helix	trans	-63.8	-39.9	177.8	-66.4	106.2	0	0	0	112.5	S268 P271 S276 I277 E278 L294 T354 D357 A358 I361	S268-W274 PolarHBondContact O-NE1 3.14Å; P271-W274 PolarHBondContact O-N 3.21Å; W274-S276 PolarHBondContact O-N 3.18Å; W274-I277 HydrophobicContact CE3-CD1 4.14Å; W274-I277 HydrophobicContact CZ3-CD1 4.34Å; W274-I277 PolarHBondContact O-N 2.84Å; W274-I277 VanDerWaalsContact O-N 3.09Å; W274-E278 WeakPolarHBondContact O-CG 3.39Å; W274-E278 PolarHBondContact O-N 2.9Å; W274-L294 HydrophobicContact CH2-CB 4.44Å; W274-L294 HydrophobicContact CH2-CD1 3.6Å; W274-L294 HydrophobicContact CZ2-CD1 4.23Å; W274-L294 HydrophobicContact CZ3-CD1 4.06Å; W274-T354 HydrophobicContact CH2-CG2 4.45Å; W274-T354 HydrophobicContact CZ2-CG2 3.97Å; W274-D357 HydrophobicContact CD2-CB 3.93Å; W274-D357 HydrophobicContact CE3-CB 3.94Å; W274-D357 HydrophobicContact CH2-CB 3.9Å; W274-D357 HydrophobicContact CZ2-CB 3.89Å; W274-D357 HydrophobicContact CZ3-CB 3.94Å; W274-A358 HydrophobicContact CH2-CB 3.87Å; W274-A358 HydrophobicContact CZ3-CB 4.33Å; W274-I361 HydrophobicContact CE3-CD1 3.65Å; W274-I361 HydrophobicContact CZ3-CD1 3.51Å
275	A	73.4	Confident	72.6	Confident	45 Å²	45	59.5 Å²	59.5	37%	0.372	35%	0.353	S	S	.	.	H	α-helix	trans	-58.9	-37.4	174.7	0	0	0	0	0	112.2	P271 T272 F273 Q279	P271-A275 PolarHBondContact O-N 3.46Å; T272-A275 PolarHBondContact O-N 3.18Å; F273-A275 VanDerWaalsContact C-N 3.34Å; F273-A275 PolarHBondContact O-N 3.33Å; A275-Q279 WeakPolarHBondContact O-CG 3.5Å; A275-Q279 PolarHBondContact O-N 3.27Å
276	S	77	Confident	72.9	Confident	39 Å²	39	59.8 Å²	59.8	27%	0.273	36%	0.355	S	S	.	.	H	α-helix	trans	-66.2	-37.3	175.7	77.3	0	0	0	0	112.6	T272 F273 W274	T272-S276 PolarHBondContact O-N 2.69Å; T272-S276 VanDerWaalsContact O-N 3.13Å; F273-S276 WeakPolarHBondContact O-CB 3.23Å; F273-S276 PolarHBondContact O-N 2.94Å; F273-S276 VanDerWaalsContact O-N 3.15Å; F273-S276 PolarHBondContact O-OG 3.22Å; W274-S276 PolarHBondContact O-N 3.18Å
277	I	76.3	Confident	73.3	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-76	-35.2	179.5	-54.7	161.8	0	0	0	111.6	F273 W274 Q279 L280 A287 I290 I361	F273-I277 HydrophobicContact CD1-CD1 3.82Å; F273-I277 HydrophobicContact CD2-CD1 4.44Å; F273-I277 HydrophobicContact CE1-CD1 3.28Å; F273-I277 HydrophobicContact CE2-CD1 3.96Å; F273-I277 HydrophobicContact CG-CD1 4.39Å; F273-I277 HydrophobicContact CZ-CD1 3.38Å; F273-I277 HydrophobicContact CZ-CG1 4.39Å; F273-I277 PolarHBondContact O-N 3.24Å; W274-I277 HydrophobicContact CE3-CD1 4.14Å; W274-I277 HydrophobicContact CZ3-CD1 4.34Å; W274-I277 PolarHBondContact O-N 2.84Å; W274-I277 VanDerWaalsContact O-N 3.09Å; I277-Q279 PolarHBondContact O-N 3.38Å; I277-L280 HydrophobicContact CG2-CD1 4.36Å; I277-L280 WeakPolarHBondContact O-CB 3.4Å; I277-L280 PolarHBondContact O-N 3.12Å; I277-L280 VanDerWaalsContact O-N 3.08Å; I277-A287 HydrophobicContact CG2-CB 4.49Å; I277-I290 HydrophobicContact CD1-CG2 3.59Å; I277-I290 HydrophobicContact CG1-CG2 4.42Å; I277-I361 HydrophobicContact CB-CD1 4.11Å; I277-I361 HydrophobicContact CD1-CD1 4.49Å; I277-I361 HydrophobicContact CG2-CD1 3.61Å; I277-I361 HydrophobicContact CG2-CG1 4.42Å; I277-I361 HydrophobicContact CG2-CG2 4.23Å
278	E	74	Confident	74.1	Confident	105 Å²	105	55.5 Å²	55.5	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-65.1	-24.7	178.6	-76	-172	157.6	0	0	113.5	W274 L280	W274-E278 WeakPolarHBondContact O-CG 3.39Å; W274-E278 PolarHBondContact O-N 2.9Å; E278-L280 VanDerWaalsContact C-N 3.3Å
279	Q	76.6	Confident	75	Confident	168 Å²	168	55.3 Å²	55.3	79%	0.785	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-17.1	174.5	-70.5	176.2	11	0	0	113.4	A275 I277	A275-Q279 WeakPolarHBondContact O-CG 3.5Å; A275-Q279 PolarHBondContact O-N 3.27Å; I277-Q279 PolarHBondContact O-N 3.38Å
280	L	74.3	Confident	75.9	Confident	33 Å²	33	49.7 Å²	49.7	17%	0.173	30%	0.298	C	S	.	.	S	Bend	trans	-70.1	145.7	177	-83.2	128.8	0	0	0	111.9	T258 I277 E278 E286 A287	T258-L280 HydrophobicContact CG2-CD1 3.67Å; I277-L280 HydrophobicContact CG2-CD1 4.36Å; I277-L280 WeakPolarHBondContact O-CB 3.4Å; I277-L280 PolarHBondContact O-N 3.12Å; I277-L280 VanDerWaalsContact O-N 3.08Å; E278-L280 VanDerWaalsContact C-N 3.3Å; L280-E286 HydrophobicContact CD2-CB 4.37Å; L280-E286 HydrophobicContact CD2-CG 4.21Å; L280-E286 VanDerWaalsContact CD2-OE2 3.32Å; L280-E286 WeakPolarHBondContact CD2-OE2 3.42Å; L280-A287 HydrophobicContact CB-CB 4.49Å
281	P	63.8	Low	76.5	Confident	81 Å²	81	46 Å²	46	53%	0.526	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-60.2	143	-179.6	-15.7	24.2	0	0	0	112.5	G283 C284	P281-G283 PolarHBondContact O-N 3.06Å; P281-C284 VanDerWaalsContact CD-SG 3.59Å; P281-C284 VanDerWaalsContact CG-SG 3.57Å; P281-C284 PolarHBondContact O-N 3.2Å
282	S	59.9	Low	77.4	Confident	95 Å²	95	41.3 Å²	41.3	66%	0.664	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	124.4	174.3	57.4	0	0	0	0	110.7
283	G	60.8	Low	78.1	Confident	51 Å²	51	36.9 Å²	36.9	53%	0.526	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.1	2.2	178.9	0	0	0	0	0	115.2	P281 Q285	P281-G283 PolarHBondContact O-N 3.06Å; G283-Q285 PolarHBondContact O-N 3.27Å
284	C	77.5	Confident	78.3	Confident	42 Å²	42	36.7 Å²	36.7	28%	0.284	22%	0.22	S	C	.	.			trans	-63.1	133.8	170.9	-77.9	0	0	0	0	111	P281 E286 A287 F288	P281-C284 VanDerWaalsContact CD-SG 3.59Å; P281-C284 VanDerWaalsContact CG-SG 3.57Å; P281-C284 PolarHBondContact O-N 3.2Å; C284-E286 PolarHBondContact O-N 3.38Å; C284-A287 HydrophobicContact CB-CB 4.45Å; C284-A287 PolarHBondContact O-N 3.43Å; C284-A287 VanDerWaalsContact O-N 3.15Å; C284-F288 PolarHBondContact O-N 2.99Å; C284-F288 VanDerWaalsContact O-N 3.08Å
285	Q	82.7	Confident	78.7	Confident	46 Å²	46	35.5 Å²	35.5	22%	0.215	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-30.4	178	-70.5	-164.3	-6.7	0	0	112.3	E199 P200 V203 W256 G283 F288 C289	E199-Q285 HydrophobicContact CG-CB 4.43Å; E199-Q285 VanDerWaalsContact CG-OE1 3.24Å; E199-Q285 PolarHBondContact O-OE1 3.06Å; P200-Q285 VanDerWaalsContact N-OE1 3.13Å; V203-Q285 HydrophobicContact CG2-CB 3.87Å; V203-Q285 HydrophobicContact CG2-CG 4.2Å; W256-Q285 HydrophobicContact CZ2-CB 4.17Å; G283-Q285 PolarHBondContact O-N 3.27Å; Q285-F288 WeakPolarHBondContact O-CB 3.19Å; Q285-F288 PolarHBondContact O-N 3.31Å; Q285-C289 WeakPolarHBondContact O-CB 3.01Å; Q285-C289 PolarHBondContact O-N 3.43Å; Q285-C289 PolarHBondContact O-SG 2.81Å
286	E	84.4	Confident	79.3	Confident	17 Å²	17	33.3 Å²	33.3	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-57.6	-53.8	171.3	-176.5	172.1	-174.8	0	0	112.2	W256 E257 T258 L280 C284 F288 C289 I290	W256-E286 VanDerWaalsContact CB-CD 3.47Å; W256-E286 HydrophobicContact CB-CG 4.06Å; W256-E286 WeakPolarHBondContact CB-OE1 3.21Å; W256-E286 HydrophobicContact CD2-CB 3.69Å; W256-E286 HydrophobicContact CD2-CG 3.73Å; W256-E286 HydrophobicContact CE3-CB 4.05Å; W256-E286 HydrophobicContact CE3-CG 3.89Å; W256-E286 HydrophobicContact CG-CB 4Å; W256-E286 HydrophobicContact CG-CG 3.82Å; W256-E286 HydrophobicContact CZ2-CB 4.2Å; W256-E286 HydrophobicContact CZ3-CB 4.48Å; E257-E286 PolarHBondContact N-OE1 3.29Å; T258-E286 WeakPolarHBondContact CB-OE1 3.43Å; T258-E286 HydrophobicContact CG2-CG 4.39Å; T258-E286 WeakPolarHBondContact CG2-OE1 3.44Å; T258-E286 PolarHBondContact N-OE1 2.71Å; T258-E286 WeakPolarHBondContact OG1-CG 3.39Å; T258-E286 PolarHBondContact OG1-OE1 3.23Å; L280-E286 HydrophobicContact CD2-CB 4.37Å; L280-E286 HydrophobicContact CD2-CG 4.21Å; L280-E286 VanDerWaalsContact CD2-OE2 3.32Å; L280-E286 WeakPolarHBondContact CD2-OE2 3.42Å; C284-E286 PolarHBondContact O-N 3.38Å; E286-F288 VanDerWaalsContact C-N 3.3Å; E286-F288 PolarHBondContact O-N 3.03Å; E286-C289 PolarHBondContact O-N 3.5Å; E286-I290 HydrophobicContact CG-CD1 4.05Å; E286-I290 WeakPolarHBondContact O-CG1 3.49Å; E286-I290 PolarHBondContact O-N 2.95Å
287	A	82.2	Confident	79.8	Confident	8 Å²	8	33.7 Å²	33.7	7%	0.066	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-37.5	179	0	0	0	0	0	111.8	I277 L280 C284 G291 I361	I277-A287 HydrophobicContact CG2-CB 4.49Å; L280-A287 HydrophobicContact CB-CB 4.49Å; C284-A287 HydrophobicContact CB-CB 4.45Å; C284-A287 PolarHBondContact O-N 3.43Å; C284-A287 VanDerWaalsContact O-N 3.15Å; A287-G291 PolarHBondContact O-N 3.44Å; A287-I361 HydrophobicContact CB-CG2 4.04Å
288	F	86.5	Confident	79.8	Confident	12 Å²	12	33.6 Å²	33.6	5%	0.053	19%	0.193	C	C	.	.	H	α-helix	trans	-59.1	-53.5	172.5	167.7	-109.8	0	0	0	111.8	V203 L207 C284 Q285 E286 I290 G291 L292 L362 S368 K371	V203-F288 HydrophobicContact CG1-CD1 3.79Å; V203-F288 HydrophobicContact CG1-CE1 3.59Å; L207-F288 HydrophobicContact CD1-CE1 4.23Å; L207-F288 HydrophobicContact CD1-CZ 4.33Å; L207-F288 HydrophobicContact CD2-CE1 4.08Å; L207-F288 HydrophobicContact CD2-CZ 3.95Å; L207-F288 HydrophobicContact CG-CE1 4.4Å; C284-F288 PolarHBondContact O-N 2.99Å; C284-F288 VanDerWaalsContact O-N 3.08Å; Q285-F288 WeakPolarHBondContact O-CB 3.19Å; Q285-F288 PolarHBondContact O-N 3.31Å; E286-F288 VanDerWaalsContact C-N 3.3Å; E286-F288 PolarHBondContact O-N 3.03Å; F288-I290 VanDerWaalsContact C-N 3.34Å; F288-I290 PolarHBondContact O-N 2.91Å; F288-G291 PolarHBondContact O-N 3.41Å; F288-L292 HydrophobicContact CE1-CD2 4.4Å; F288-L292 HydrophobicContact CE2-CB 4.45Å; F288-L292 HydrophobicContact CZ-CD2 4.12Å; F288-L292 WeakPolarHBondContact O-CB 3.47Å; F288-L292 PolarHBondContact O-N 2.87Å; F288-L362 HydrophobicContact CD2-CD2 3.5Å; F288-L362 VanDerWaalsContact CD2-CD2 3.5Å; F288-L362 HydrophobicContact CE2-CD2 4.02Å; F288-L362 HydrophobicContact CG-CD2 4.46Å; F288-S368 VanDerWaalsContact CD2-CB 3.45Å; F288-S368 WeakPolarHBondContact CD2-OG 3.22Å; F288-S368 VanDerWaalsContact CE2-O 3.31Å; F288-S368 WeakPolarHBondContact CE2-O 3.07Å; F288-K371 HydrophobicContact CE2-CB 4.27Å; F288-K371 HydrophobicContact CZ-CB 3.95Å; F288-K371 HydrophobicContact CZ-CD 4.3Å
289	C	86.2	Confident	80	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.007	17%	0.169	C	C	.	.	H	α-helix	trans	-61.1	-42.6	-177.7	-72.7	0	0	0	0	111.8	L206 F247 W256 Q285 E286 L293	L206-C289 HydrophobicContact CD2-CB 3.96Å; F247-C289 HydrophobicContact CD2-CB 4.18Å; F247-C289 HydrophobicContact CE2-CB 3.9Å; W256-C289 HydrophobicContact CH2-CB 4.11Å; W256-C289 HydrophobicContact CZ3-CB 4.03Å; Q285-C289 WeakPolarHBondContact O-CB 3.01Å; Q285-C289 PolarHBondContact O-N 3.43Å; Q285-C289 PolarHBondContact O-SG 2.81Å; E286-C289 PolarHBondContact O-N 3.5Å; C289-L293 VanDerWaalsContact O-CB 3.31Å; C289-L293 WeakPolarHBondContact O-CB 3.41Å; C289-L293 WeakPolarHBondContact O-CG 3.42Å; C289-L293 PolarHBondContact O-N 2.99Å
290	I	86.5	Confident	80.2	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.6	-48.8	178.7	-63.6	165.9	0	0	0	110.9	F247 T258 F273 I277 E286 F288 L292 L293 L294	F247-I290 HydrophobicContact CE2-CG1 3.83Å; F247-I290 HydrophobicContact CZ-CD1 4.28Å; F247-I290 HydrophobicContact CZ-CG1 3.67Å; T258-I290 HydrophobicContact CG2-CD1 3.76Å; T258-I290 VanDerWaalsContact OG1-CD1 3.29Å; T258-I290 WeakPolarHBondContact OG1-CD1 3.31Å; F273-I290 HydrophobicContact CZ-CG2 3.99Å; I277-I290 HydrophobicContact CD1-CG2 3.59Å; I277-I290 HydrophobicContact CG1-CG2 4.42Å; E286-I290 HydrophobicContact CG-CD1 4.05Å; E286-I290 WeakPolarHBondContact O-CG1 3.49Å; E286-I290 PolarHBondContact O-N 2.95Å; F288-I290 VanDerWaalsContact C-N 3.34Å; F288-I290 PolarHBondContact O-N 2.91Å; I290-L292 VanDerWaalsContact C-N 3.3Å; I290-L292 PolarHBondContact O-N 3.5Å; I290-L293 PolarHBondContact O-N 3.2Å; I290-L294 HydrophobicContact CG2-CD1 3.57Å; I290-L294 HydrophobicContact CG2-CG 4.34Å; I290-L294 WeakPolarHBondContact O-CB 3.32Å; I290-L294 WeakPolarHBondContact O-CG 3.28Å; I290-L294 PolarHBondContact O-N 3.42Å
291	G	84.6	Confident	80.3	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.3	-42.2	177.6	0	0	0	0	0	111.8	A287 F288 S295 A358	A287-G291 PolarHBondContact O-N 3.44Å; F288-G291 PolarHBondContact O-N 3.41Å; G291-S295 VanDerWaalsContact O-CB 3.25Å; G291-S295 WeakPolarHBondContact O-CB 3.43Å; G291-S295 PolarHBondContact O-N 2.85Å; G291-S295 PolarHBondContact O-OG 3.45Å; G291-A358 WeakPolarHBondContact O-CB 3.47Å
292	L	88.1	Confident	80.6	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.4	-51.2	176.4	179.5	78.3	0	0	0	111.6	L207 F288 I290 L294 S295 L296 M372	L207-L292 HydrophobicContact CD2-CD2 3.18Å; F288-L292 HydrophobicContact CE1-CD2 4.4Å; F288-L292 HydrophobicContact CE2-CB 4.45Å; F288-L292 HydrophobicContact CZ-CD2 4.12Å; F288-L292 WeakPolarHBondContact O-CB 3.47Å; F288-L292 PolarHBondContact O-N 2.87Å; I290-L292 VanDerWaalsContact C-N 3.3Å; I290-L292 PolarHBondContact O-N 3.5Å; L292-L294 VanDerWaalsContact C-N 3.34Å; L292-L294 PolarHBondContact O-N 3.32Å; L292-S295 WeakPolarHBondContact CA-OG 3.39Å; L292-S295 PolarHBondContact O-N 3.4Å; L292-S295 PolarHBondContact O-OG 3.14Å; L292-L296 HydrophobicContact CD1-CD1 3.76Å; L292-L296 HydrophobicContact CD1-CG 4.29Å; L292-L296 HydrophobicContact CD2-CD1 4.39Å; L292-L296 HydrophobicContact CG-CD1 3.72Å; L292-L296 HydrophobicContact CG-CG 4.45Å; L292-L296 VanDerWaalsContact O-CB 3.31Å; L292-L296 WeakPolarHBondContact O-CB 3.16Å; L292-L296 WeakPolarHBondContact O-CG 3.23Å; L292-L296 PolarHBondContact O-N 3.43Å; L292-M372 HydrophobicContact CD1-CB 3.77Å; L292-M372 HydrophobicContact CD1-CE 3.6Å; L292-M372 HydrophobicContact CD1-CG 3.81Å
293	L	88.2	Confident	81	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.5	-41.7	-177.1	-73.2	178.7	0	0	0	111.8	L206 V210 I243 F247 F262 F265 C289 I290 Y297	L206-L293 HydrophobicContact CD2-CD1 4.46Å; V210-L293 HydrophobicContact CG2-CD2 3.54Å; I243-L293 HydrophobicContact CG2-CD2 3.31Å; F247-L293 HydrophobicContact CB-CD1 3.79Å; F247-L293 HydrophobicContact CD2-CD1 3.47Å; F247-L293 VanDerWaalsContact CD2-CD1 3.47Å; F247-L293 HydrophobicContact CE2-CD1 4.3Å; F247-L293 HydrophobicContact CG-CD1 3.79Å; F262-L293 HydrophobicContact CE1-CD1 4.32Å; F265-L293 HydrophobicContact CE1-CB 4.13Å; C289-L293 VanDerWaalsContact O-CB 3.31Å; C289-L293 WeakPolarHBondContact O-CB 3.41Å; C289-L293 WeakPolarHBondContact O-CG 3.42Å; C289-L293 PolarHBondContact O-N 2.99Å; I290-L293 PolarHBondContact O-N 3.2Å; L293-Y297 WeakPolarHBondContact O-CB 3.07Å; L293-Y297 PolarHBondContact O-N 3.3Å
294	L	86.2	Confident	81.4	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-70.3	-43.1	179.4	-75	170.9	0	0	0	113	F262 F265 F273 W274 I290 L292 Y297 A298 T354 A358	F262-L294 HydrophobicContact CE2-CD1 4.4Å; F262-L294 HydrophobicContact CE2-CD2 3.91Å; F262-L294 HydrophobicContact CE2-CG 4.1Å; F262-L294 HydrophobicContact CZ-CD2 4.45Å; F265-L294 HydrophobicContact CD1-CD2 4.14Å; F273-L294 HydrophobicContact CE1-CD1 3.53Å; F273-L294 HydrophobicContact CZ-CD1 3.85Å; W274-L294 HydrophobicContact CH2-CB 4.44Å; W274-L294 HydrophobicContact CH2-CD1 3.6Å; W274-L294 HydrophobicContact CZ2-CD1 4.23Å; W274-L294 HydrophobicContact CZ3-CD1 4.06Å; I290-L294 HydrophobicContact CG2-CD1 3.57Å; I290-L294 HydrophobicContact CG2-CG 4.34Å; I290-L294 WeakPolarHBondContact O-CB 3.32Å; I290-L294 WeakPolarHBondContact O-CG 3.28Å; I290-L294 PolarHBondContact O-N 3.42Å; L292-L294 VanDerWaalsContact C-N 3.34Å; L292-L294 PolarHBondContact O-N 3.32Å; L294-Y297 PolarHBondContact O-N 2.94Å; L294-A298 VanDerWaalsContact O-CB 3.23Å; L294-A298 WeakPolarHBondContact O-CB 3.31Å; L294-A298 PolarHBondContact O-N 3.46Å; L294-T354 HydrophobicContact CB-CG2 4.47Å; L294-T354 HydrophobicContact CD2-CG2 4.27Å; L294-A358 HydrophobicContact CB-CB 3.82Å
295	S	84	Confident	80.5	Confident	0 Å²	0	21 Å²	21	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64	-42.5	176.3	54	0	0	0	0	111.3	G291 L292 A299 M372	G291-S295 VanDerWaalsContact O-CB 3.25Å; G291-S295 WeakPolarHBondContact O-CB 3.43Å; G291-S295 PolarHBondContact O-N 2.85Å; G291-S295 PolarHBondContact O-OG 3.45Å; L292-S295 WeakPolarHBondContact CA-OG 3.39Å; L292-S295 PolarHBondContact O-N 3.4Å; L292-S295 PolarHBondContact O-OG 3.14Å; S295-A299 WeakPolarHBondContact O-CB 3.2Å; S295-A299 PolarHBondContact O-N 2.88Å; S295-M372 WeakPolarHBondContact OG-CE 3.49Å
296	L	86.1	Confident	79	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-67.3	-41.1	175.9	-69.4	172.8	0	0	0	112.1	V210 L214 W240 L292 F300 L375 L376 I384 I388	V210-L296 HydrophobicContact CG1-CD1 3.55Å; L214-L296 HydrophobicContact CD1-CB 4.38Å; L214-L296 HydrophobicContact CD1-CD1 3.9Å; L214-L296 HydrophobicContact CD1-CD2 4.26Å; L214-L296 HydrophobicContact CD1-CG 4.42Å; W240-L296 HydrophobicContact CH2-CB 4.32Å; L292-L296 HydrophobicContact CD1-CD1 3.76Å; L292-L296 HydrophobicContact CD1-CG 4.29Å; L292-L296 HydrophobicContact CD2-CD1 4.39Å; L292-L296 HydrophobicContact CG-CD1 3.72Å; L292-L296 HydrophobicContact CG-CG 4.45Å; L292-L296 VanDerWaalsContact O-CB 3.31Å; L292-L296 WeakPolarHBondContact O-CB 3.16Å; L292-L296 WeakPolarHBondContact O-CG 3.23Å; L292-L296 PolarHBondContact O-N 3.43Å; L296-F300 WeakPolarHBondContact O-CB 3.43Å; L296-F300 PolarHBondContact O-N 2.85Å; L296-L375 HydrophobicContact CD1-CD2 4.02Å; L296-L376 HydrophobicContact CD2-CD1 4.14Å; L296-L376 HydrophobicContact CD2-CD2 3.78Å; L296-L376 HydrophobicContact CD2-CG 4.29Å; L296-I384 HydrophobicContact CD2-CG2 4.08Å; L296-I388 HydrophobicContact CD2-CD1 3.91Å
297	Y	86.4	Confident	77.3	Confident	46 Å²	46	20.7 Å²	20.7	18%	0.18	10%	0.095	C	C	.	.	H	α-helix	trans	-61	-52.4	175.5	176.1	-95.9	0	0	0	111.1	W240 F265 L293 L294 A299 F300 H301 L351	W240-Y297 AromaticContact CD2-CD2 3.77Å; W240-Y297 HydrophobicContact CD2-CD2 3.77Å; W240-Y297 HydrophobicContact CD2-CE2 4.41Å; W240-Y297 AromaticContact CE2-CD2 3.89Å; W240-Y297 AromaticContact CE3-CD2 3.96Å; W240-Y297 HydrophobicContact CE3-CD2 3.96Å; W240-Y297 HydrophobicContact CG-CD2 4.24Å; W240-Y297 HydrophobicContact CG-CE2 4.43Å; W240-Y297 HydrophobicContact CH2-CD2 4.37Å; W240-Y297 HydrophobicContact CZ2-CD2 4.22Å; W240-Y297 HydrophobicContact CZ3-CD2 4.24Å; F265-Y297 HydrophobicContact CB-CD1 3.76Å; F265-Y297 HydrophobicContact CB-CD2 3.96Å; F265-Y297 HydrophobicContact CB-CE1 3.6Å; F265-Y297 HydrophobicContact CB-CE2 3.8Å; F265-Y297 HydrophobicContact CB-CG 3.94Å; F265-Y297 HydrophobicContact CD1-CD1 4.05Å; F265-Y297 AromaticContact CD1-CD2 3.81Å; F265-Y297 HydrophobicContact CD1-CD2 3.81Å; F265-Y297 HydrophobicContact CD1-CE2 4.48Å; F265-Y297 AromaticContact CD1-CG 3.56Å; F265-Y297 HydrophobicContact CD1-CG 3.56Å; F265-Y297 AromaticContact CD2-CD2 3.53Å; F265-Y297 HydrophobicContact CD2-CD2 3.53Å; F265-Y297 AromaticContact CD2-CE2 3.64Å; F265-Y297 HydrophobicContact CD2-CE2 3.64Å; F265-Y297 HydrophobicContact CD2-CG 4.15Å; F265-Y297 HydrophobicContact CE1-CD2 4.17Å; F265-Y297 HydrophobicContact CE1-CG 4.06Å; F265-Y297 AromaticContact CE2-CD2 3.93Å; F265-Y297 HydrophobicContact CE2-CD2 3.93Å; F265-Y297 HydrophobicContact CE2-CE2 4.37Å; F265-Y297 AromaticContact CG-CD1 3.98Å; F265-Y297 HydrophobicContact CG-CD1 3.98Å; F265-Y297 AromaticContact CG-CD2 3.48Å; F265-Y297 HydrophobicContact CG-CD2 3.48Å; F265-Y297 VanDerWaalsContact CG-CD2 3.48Å; F265-Y297 HydrophobicContact CG-CE1 4.2Å; F265-Y297 AromaticContact CG-CE2 3.72Å; F265-Y297 HydrophobicContact CG-CE2 3.72Å; F265-Y297 AromaticContact CG-CG 3.62Å; F265-Y297 HydrophobicContact CG-CG 3.62Å; F265-Y297 HydrophobicContact CZ-CD2 4.25Å; L293-Y297 WeakPolarHBondContact O-CB 3.07Å; L293-Y297 PolarHBondContact O-N 3.3Å; L294-Y297 PolarHBondContact O-N 2.94Å; Y297-A299 PolarHBondContact O-N 3.41Å; Y297-F300 PolarHBondContact O-N 3.42Å; Y297-H301 AromaticContact CD2-CD2 3.62Å; Y297-H301 AromaticContact CD2-NE2 3.81Å; Y297-H301 AromaticContact CE1-CD2 3.8Å; Y297-H301 AromaticContact CE2-CD2 3.25Å; Y297-H301 WeakPolarHBondContact CE2-CD2 3.4Å; Y297-H301 AromaticContact CE2-NE2 3.07Å; Y297-H301 WeakPolarHBondContact CE2-NE2 3.45Å; Y297-H301 AromaticContact CZ-CD2 3.33Å; Y297-H301 AromaticContact CZ-NE2 3.34Å; Y297-H301 VanDerWaalsContact CZ-NE2 3.34Å; Y297-H301 PolarHBondContact O-CD2 3.33Å; Y297-H301 VanDerWaalsContact O-CD2 3.32Å; Y297-H301 PolarHBondContact O-N 2.98Å; Y297-H301 PolarHBondContact OH-NE2 2.92Å; Y297-L351 HydrophobicContact CE1-CD2 4.36Å
298	A	77.7	Confident	75.5	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.3	-47.3	178.3	0	0	0	0	0	111.2	L294 F300 H301 L302 L351 T354 C355	L294-A298 VanDerWaalsContact O-CB 3.23Å; L294-A298 WeakPolarHBondContact O-CB 3.31Å; L294-A298 PolarHBondContact O-N 3.46Å; A298-F300 VanDerWaalsContact C-N 3.35Å; A298-F300 PolarHBondContact O-N 2.86Å; A298-H301 PolarHBondContact O-N 2.94Å; A298-L302 VanDerWaalsContact O-CB 3.23Å; A298-L302 WeakPolarHBondContact O-CB 3.04Å; A298-L302 WeakPolarHBondContact O-CD1 3.39Å; A298-L302 WeakPolarHBondContact O-CG 3.37Å; A298-L302 PolarHBondContact O-N 3.4Å; A298-L351 WeakPolarHBondContact CB-O 3.29Å; A298-T354 HydrophobicContact CB-CG2 4.19Å; A298-C355 HydrophobicContact CB-CB 3.71Å
299	A	77.5	Confident	73.7	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.1	-37.7	178.9	0	0	0	0	0	112.4	S295 Y297 C303 I384 V387 I388	S295-A299 WeakPolarHBondContact O-CB 3.2Å; S295-A299 PolarHBondContact O-N 2.88Å; Y297-A299 PolarHBondContact O-N 3.41Å; A299-C303 VanDerWaalsContact O-CB 3.31Å; A299-C303 WeakPolarHBondContact O-CB 3.4Å; A299-C303 PolarHBondContact O-N 3.26Å; A299-C303 PolarHBondContact O-SG 3Å; A299-I384 HydrophobicContact CB-CG2 3.88Å; A299-V387 HydrophobicContact CB-CB 4.4Å; A299-V387 HydrophobicContact CB-CG1 4.06Å; A299-I388 HydrophobicContact CB-CD1 4.02Å; A299-I388 HydrophobicContact CB-CG1 3.77Å
300	F	80.6	Confident	71.9	Confident	5 Å²	5	22.9 Å²	22.9	2%	0.022	11%	0.108	C	C	.	.	H	α-helix	trans	-66.7	-45.7	175.7	177	-94	0	0	0	112.1	L214 M217 L218 W240 L296 Y297 A298 C303 R304 I384	L214-F300 HydrophobicContact CD2-CD2 4.08Å; L214-F300 HydrophobicContact CD2-CG 4.5Å; M217-F300 HydrophobicContact CB-CE2 4.02Å; M217-F300 HydrophobicContact CB-CZ 3.85Å; M217-F300 HydrophobicContact CE-CZ 4.44Å; M217-F300 HydrophobicContact SD-CZ 4.24Å; L218-F300 HydrophobicContact CD2-CD2 4.13Å; L218-F300 HydrophobicContact CD2-CE2 3.76Å; L218-F300 HydrophobicContact CG-CE2 4.07Å; W240-F300 AromaticContact CE2-CD1 3.87Å; W240-F300 HydrophobicContact CH2-CB 4.38Å; W240-F300 HydrophobicContact CZ2-CB 3.64Å; W240-F300 AromaticContact CZ2-CD1 3.7Å; W240-F300 HydrophobicContact CZ2-CD1 3.7Å; W240-F300 HydrophobicContact CZ2-CD2 4.38Å; W240-F300 HydrophobicContact CZ2-CE1 4.42Å; W240-F300 AromaticContact CZ2-CG 3.67Å; W240-F300 HydrophobicContact CZ2-CG 3.67Å; W240-F300 AromaticContact NE1-CD1 3.42Å; W240-F300 AromaticContact NE1-CE1 3.44Å; L296-F300 WeakPolarHBondContact O-CB 3.43Å; L296-F300 PolarHBondContact O-N 2.85Å; Y297-F300 PolarHBondContact O-N 3.42Å; A298-F300 VanDerWaalsContact C-N 3.35Å; A298-F300 PolarHBondContact O-N 2.86Å; F300-C303 PolarHBondContact O-N 3.03Å; F300-R304 HydrophobicContact CD1-CG 4.47Å; F300-R304 HydrophobicContact CE1-CG 4.13Å; F300-R304 HydrophobicContact CZ-CG 4.25Å; F300-R304 PolarHBondContact O-N 3.42Å; F300-I384 HydrophobicContact CB-CD1 4.38Å; F300-I384 HydrophobicContact CD2-CD1 4.02Å
301	H	75.9	Confident	70	Confident	47 Å²	47	23.9 Å²	23.9	22%	0.218	12%	0.115	C	C	.	.	H	α-helix	trans	-66.1	-41.2	176.7	-85.5	-81.2	0	0	0	111.7	Y297 A298 C303 R304 Q305 L351	Y297-H301 AromaticContact CD2-CD2 3.62Å; Y297-H301 AromaticContact CD2-NE2 3.81Å; Y297-H301 AromaticContact CE1-CD2 3.8Å; Y297-H301 AromaticContact CE2-CD2 3.25Å; Y297-H301 WeakPolarHBondContact CE2-CD2 3.4Å; Y297-H301 AromaticContact CE2-NE2 3.07Å; Y297-H301 WeakPolarHBondContact CE2-NE2 3.45Å; Y297-H301 AromaticContact CZ-CD2 3.33Å; Y297-H301 AromaticContact CZ-NE2 3.34Å; Y297-H301 VanDerWaalsContact CZ-NE2 3.34Å; Y297-H301 PolarHBondContact O-CD2 3.33Å; Y297-H301 VanDerWaalsContact O-CD2 3.32Å; Y297-H301 PolarHBondContact O-N 2.98Å; Y297-H301 PolarHBondContact OH-NE2 2.92Å; A298-H301 PolarHBondContact O-N 2.94Å; H301-C303 VanDerWaalsContact C-N 3.35Å; H301-C303 PolarHBondContact O-N 3.21Å; H301-R304 PolarHBondContact O-N 3Å; H301-Q305 WeakPolarHBondContact O-CB 3.23Å; H301-Q305 WeakPolarHBondContact O-CG 3.35Å; H301-Q305 PolarHBondContact O-N 3.36Å; H301-L351 HydrophobicContact CB-CD1 3.96Å; H301-L351 HydrophobicContact CB-CD2 4.27Å
302	L	70.5	Confident	68.5	Low	4 Å²	4	23.9 Å²	23.9	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-55.6	-49.8	168.6	-74.2	168.3	0	0	0	109.7	A298 R304 Q305 L306 L351 F352 C355 V387	A298-L302 VanDerWaalsContact O-CB 3.23Å; A298-L302 WeakPolarHBondContact O-CB 3.04Å; A298-L302 WeakPolarHBondContact O-CD1 3.39Å; A298-L302 WeakPolarHBondContact O-CG 3.37Å; A298-L302 PolarHBondContact O-N 3.4Å; L302-R304 VanDerWaalsContact C-N 3.26Å; L302-R304 PolarHBondContact O-N 2.66Å; L302-Q305 PolarHBondContact O-N 3.08Å; L302-L306 HydrophobicContact CB-CD1 3.76Å; L302-L306 HydrophobicContact CD2-CD1 4.16Å; L302-L306 WeakPolarHBondContact O-CA 3.17Å; L302-L306 WeakPolarHBondContact O-CB 3.31Å; L302-L306 VanDerWaalsContact O-CD1 3.31Å; L302-L306 WeakPolarHBondContact O-CD1 3.14Å; L302-L306 WeakPolarHBondContact O-CG 3.38Å; L302-L306 PolarHBondContact O-N 2.85Å; L302-L351 HydrophobicContact CD2-CB 4.03Å; L302-L351 HydrophobicContact CG-CB 4.06Å; L302-F352 HydrophobicContact CD1-CD2 4.21Å; L302-C355 HydrophobicContact CD1-CB 4.44Å; L302-V387 HydrophobicContact CB-CG1 4.46Å; L302-V387 HydrophobicContact CD1-CG1 4.03Å
303	C	69.2	Low	66.8	Low	24 Å²	24	24.1 Å²	24.1	16%	0.162	12%	0.116	C	C	.	.	H	α-helix	trans	-65.2	-20.6	178.9	-71.7	0	0	0	0	115.4	A299 F300 H301 L306 K383 I384	A299-C303 VanDerWaalsContact O-CB 3.31Å; A299-C303 WeakPolarHBondContact O-CB 3.4Å; A299-C303 PolarHBondContact O-N 3.26Å; A299-C303 PolarHBondContact O-SG 3Å; F300-C303 PolarHBondContact O-N 3.03Å; H301-C303 VanDerWaalsContact C-N 3.35Å; H301-C303 PolarHBondContact O-N 3.21Å; C303-L306 CarbonylContact C-O 3.58Å; C303-L306 VanDerWaalsContact O-O 3.08Å; C303-K383 VanDerWaalsContact SG-C 3.55Å; C303-I384 HydrophobicContact CB-CG1 4.39Å
304	R	67.7	Low	64.9	Low	165 Å²	165	24.9 Å²	24.9	62%	0.623	12%	0.12	S	C	*	.	H	α-helix	trans	-89	-35.9	176.3	-77	-170.6	71.2	134.9	2.4	112.5	F300 H301 L302	F300-R304 HydrophobicContact CD1-CG 4.47Å; F300-R304 HydrophobicContact CE1-CG 4.13Å; F300-R304 HydrophobicContact CZ-CG 4.25Å; F300-R304 PolarHBondContact O-N 3.42Å; H301-R304 PolarHBondContact O-N 3Å; L302-R304 VanDerWaalsContact C-N 3.26Å; L302-R304 PolarHBondContact O-N 2.66Å
305	Q	60.2	Low	62.9	Low	66 Å²	66	25.8 Å²	25.8	31%	0.308	13%	0.126	S	C	.	.	H	α-helix	trans	-80.9	-47.9	178.7	-70.9	-170.9	-14.3	0	0	110.2	H301 L302 P307 F339	H301-Q305 WeakPolarHBondContact O-CB 3.23Å; H301-Q305 WeakPolarHBondContact O-CG 3.35Å; H301-Q305 PolarHBondContact O-N 3.36Å; L302-Q305 PolarHBondContact O-N 3.08Å; Q305-P307 WeakPolarHBondContact O-CD 3.46Å; Q305-F339 HydrophobicContact CB-CE2 4.09Å; Q305-F339 WeakPolarHBondContact O-CD2 3.22Å; Q305-F339 WeakPolarHBondContact O-CE2 3.4Å
306	L	50.6	Low	61.1	Low	27 Å²	27	26.9 Å²	26.9	14%	0.141	13%	0.133	C	C	.	.	S	Bend	trans	-63.7	122.3	169.3	-59	163.4	0	0	0	106.4	L302 C303 V311 F339	L302-L306 HydrophobicContact CB-CD1 3.76Å; L302-L306 HydrophobicContact CD2-CD1 4.16Å; L302-L306 WeakPolarHBondContact O-CA 3.17Å; L302-L306 WeakPolarHBondContact O-CB 3.31Å; L302-L306 VanDerWaalsContact O-CD1 3.31Å; L302-L306 WeakPolarHBondContact O-CD1 3.14Å; L302-L306 WeakPolarHBondContact O-CG 3.38Å; L302-L306 PolarHBondContact O-N 2.85Å; C303-L306 CarbonylContact C-O 3.58Å; C303-L306 VanDerWaalsContact O-O 3.08Å; L306-V311 HydrophobicContact CD1-CG2 4.19Å; L306-V311 HydrophobicContact CD2-CG2 3.55Å; L306-F339 HydrophobicContact CD2-CE1 3.69Å; L306-F339 HydrophobicContact CD2-CZ 3.68Å; L306-F339 HydrophobicContact CG-CZ 4.31Å
307	P	48.4	Very low	59.3	Low	30 Å²	30	28.5 Å²	28.5	20%	0.195	14%	0.143	C	C	.	.			trans	-54.9	170.9	159	-10.9	24.5	0	0	0	106.8	Q305 V309 F339	Q305-P307 WeakPolarHBondContact O-CD 3.46Å; P307-V309 HydrophobicContact CB-CG2 4.42Å; P307-V309 PolarHBondContact O-N 3.21Å; P307-F339 HydrophobicContact CG-CB 3.8Å; P307-F339 HydrophobicContact CG-CD1 4.2Å; P307-F339 HydrophobicContact CG-CG 4Å
308	T	44.9	Very low	57.4	Low	43 Å²	43	28.4 Å²	28.4	26%	0.264	15%	0.147	S	C	.	.	S	Bend	trans	-52.6	86.4	156.3	26.5	0	0	0	0	109.5	S332 H333 K383	T308-S332 WeakPolarHBondContact CA-OG 3.16Å; T308-S332 WeakPolarHBondContact CB-OG 3.34Å; T308-S332 WeakPolarHBondContact CG2-OG 3.2Å; T308-S332 CarbonylContact O-C 3.41Å; T308-S332 WeakPolarHBondContact O-CA 3.44Å; T308-S332 VanDerWaalsContact O-O 3.07Å; T308-S332 PolarHBondContact O-OG 2.97Å; T308-H333 CarbonylContact O-C 3.45Å; T308-H333 WeakPolarHBondContact O-CA 2.95Å; T308-H333 PolarHBondContact O-N 3.37Å; T308-H333 PolarHBondContact OG1-O 2.96Å; T308-K383 HydrophobicContact CG2-CD 4.13Å
309	V	49.3	Very low	56	Low	16 Å²	16	29.1 Å²	29.1	10%	0.097	15%	0.151	C	C	.	.			trans	-164.7	143.4	169	-163.8	0	0	0	0	115	P307 V311 Y331 S332 L336 L471	P307-V309 HydrophobicContact CB-CG2 4.42Å; P307-V309 PolarHBondContact O-N 3.21Å; V309-V311 PolarHBondContact O-N 3.42Å; V309-Y331 CarbonylContact C-O 2.65Å; V309-Y331 VanDerWaalsContact CA-C 3.48Å; V309-Y331 PolarHBondContact N-O 3.41Å; V309-S332 VanDerWaalsContact CA-C 3.45Å; V309-S332 WeakPolarHBondContact CA-O 3.19Å; V309-S332 VanDerWaalsContact CB-O 3.22Å; V309-S332 WeakPolarHBondContact CB-O 3.48Å; V309-S332 WeakPolarHBondContact CG1-O 3.43Å; V309-S332 WeakPolarHBondContact CG2-O 3.25Å; V309-S332 PolarHBondContact N-OG 2.89Å; V309-L336 HydrophobicContact CB-CD1 4.32Å; V309-L336 HydrophobicContact CG1-CD1 4.36Å; V309-L336 HydrophobicContact CG2-CB 4.5Å; V309-L336 HydrophobicContact CG2-CD1 4.2Å; V309-L471 HydrophobicContact CG1-CD1 3.78Å
310	V	46.7	Very low	54.3	Low	7 Å²	7	31.7 Å²	31.7	4%	0.042	17%	0.169	C	C	.	.			trans	-45.7	111.9	176.1	-177.6	0	0	0	0	115	V312 F329 A330 Y331 L420 L472	V310-V312 HydrophobicContact CG1-CG2 3.84Å; V310-F329 HydrophobicContact CG1-CD1 3.71Å; V310-F329 HydrophobicContact CG1-CE1 4.47Å; V310-A330 VanDerWaalsContact CA-C 3.48Å; V310-A330 WeakPolarHBondContact CA-O 3.13Å; V310-A330 WeakPolarHBondContact CB-O 3.16Å; V310-A330 WeakPolarHBondContact CG1-O 3.37Å; V310-A330 WeakPolarHBondContact CG2-O 3.47Å; V310-Y331 HydrophobicContact CG2-CD1 4.11Å; V310-Y331 HydrophobicContact CG2-CG 4.16Å; V310-Y331 VanDerWaalsContact N-C 3.3Å; V310-L420 HydrophobicContact CG1-CD2 4.29Å; V310-L420 HydrophobicContact CG2-CD1 4.12Å; V310-L420 HydrophobicContact CG2-CD2 3.53Å; V310-L472 HydrophobicContact CG1-CB 4.25Å
311	V	47.8	Very low	52.7	Low	22 Å²	22	37.3 Å²	37.3	13%	0.133	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	116.6	159.1	178.8	0	0	0	0	107.8	L306 V309 I313 F329 A330 F469	L306-V311 HydrophobicContact CD1-CG2 4.19Å; L306-V311 HydrophobicContact CD2-CG2 3.55Å; V309-V311 PolarHBondContact O-N 3.42Å; V311-I313 HydrophobicContact CG1-CD1 4.41Å; V311-I313 HydrophobicContact CG1-CG1 3.92Å; V311-F329 WeakPolarHBondContact O-CA 3.34Å; V311-A330 PolarHBondContact O-N 3.17Å; V311-A330 VanDerWaalsContact O-N 3.13Å; V311-F469 HydrophobicContact CG1-CD1 3.28Å; V311-F469 HydrophobicContact CG1-CE1 3.68Å; V311-F469 HydrophobicContact CG1-CG 4.3Å; V311-F469 HydrophobicContact CG2-CD1 4.49Å
312	V	52.6	Low	51.1	Low	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	120	164.3	-169.9	0	0	0	0	107.6	V310 L314 F329 Q468 V470 L472 Y480	V310-V312 HydrophobicContact CG1-CG2 3.84Å; V312-L314 HydrophobicContact CB-CD1 4.26Å; V312-L314 HydrophobicContact CG1-CD1 3.7Å; V312-L314 HydrophobicContact CG1-CG 4.38Å; V312-L314 PolarHBondContact O-N 3.26Å; V312-F329 HydrophobicContact CB-CD1 4.43Å; V312-F329 HydrophobicContact CB-CE1 4.38Å; V312-F329 HydrophobicContact CG1-CD1 4.34Å; V312-F329 HydrophobicContact CG1-CE1 4.03Å; V312-F329 HydrophobicContact CG2-CD1 3.65Å; V312-F329 HydrophobicContact CG2-CE1 3.53Å; V312-Q468 VanDerWaalsContact O-O 3.12Å; V312-V470 VanDerWaalsContact CB-O 3.3Å; V312-V470 WeakPolarHBondContact CB-O 3.14Å; V312-V470 WeakPolarHBondContact CG2-O 3Å; V312-V470 PolarHBondContact N-O 3.34Å; V312-V470 VanDerWaalsContact N-O 3.16Å; V312-V470 PolarHBondContact O-N 2.92Å; V312-L472 HydrophobicContact CG2-CB 3.65Å; V312-L472 HydrophobicContact CG2-CD1 3.69Å; V312-L472 HydrophobicContact CG2-CG 4.17Å; V312-Y480 HydrophobicContact CG1-CD2 3.42Å; V312-Y480 VanDerWaalsContact CG1-CD2 3.42Å; V312-Y480 HydrophobicContact CG1-CE2 3.24Å; V312-Y480 HydrophobicContact CG1-CG 4.42Å
313	I	52.2	Low	49.8	Very low	4 Å²	4	47.9 Å²	47.9	2%	0.021	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	100	169.5	-70.5	167.2	0	0	0	105.7	V311 P327 S328 F352 L394 W467	V311-I313 HydrophobicContact CG1-CD1 4.41Å; V311-I313 HydrophobicContact CG1-CG1 3.92Å; I313-P327 VanDerWaalsContact O-CA 3.28Å; I313-P327 WeakPolarHBondContact O-CA 3.33Å; I313-S328 PolarHBondContact N-O 2.5Å; I313-F352 HydrophobicContact CD1-CD1 4.31Å; I313-F352 HydrophobicContact CD1-CD2 4.41Å; I313-F352 HydrophobicContact CD1-CE1 3.48Å; I313-F352 VanDerWaalsContact CD1-CE1 3.48Å; I313-F352 HydrophobicContact CD1-CE2 3.62Å; I313-F352 HydrophobicContact CD1-CZ 3.11Å; I313-L394 HydrophobicContact CB-CD2 4.26Å; I313-L394 HydrophobicContact CD1-CD1 3.4Å; I313-L394 HydrophobicContact CD1-CD2 4.42Å; I313-L394 HydrophobicContact CD1-CG 4.43Å; I313-L394 HydrophobicContact CG2-CD1 4.47Å; I313-L394 HydrophobicContact CG2-CD2 3.87Å; I313-W467 HydrophobicContact CG2-CB 4.47Å; I313-W467 HydrophobicContact CG2-CD2 3.93Å; I313-W467 HydrophobicContact CG2-CE3 3.02Å; I313-W467 HydrophobicContact CG2-CZ3 3.4Å; I313-W467 VanDerWaalsContact CG2-CZ3 3.4Å
314	L	47.9	Very low	48.5	Very low	16 Å²	16	50.6 Å²	50.6	8%	0.084	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.5	170.3	-87.4	95.8	0	0	0	108.4	V312 Q468 V470 Y480 R483	V312-L314 HydrophobicContact CB-CD1 4.26Å; V312-L314 HydrophobicContact CG1-CD1 3.7Å; V312-L314 HydrophobicContact CG1-CG 4.38Å; V312-L314 PolarHBondContact O-N 3.26Å; L314-Q468 PolarHBondContact N-O 3.15Å; L314-Q468 PolarHBondContact O-N 3.25Å; L314-V470 HydrophobicContact CD1-CB 3.66Å; L314-V470 HydrophobicContact CD1-CG1 4.36Å; L314-V470 HydrophobicContact CD1-CG2 3.72Å; L314-Y480 HydrophobicContact CD1-CD2 4.2Å; L314-Y480 HydrophobicContact CG-CD2 4.25Å; L314-R483 VanDerWaalsContact CD2-NH1 3.35Å
315	P	45.8	Very low	47.2	Very low	20 Å²	20	44 Å²	44	13%	0.13	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-66	149.4	169	25.5	-31.1	0	0	0	110.4	C325 W467	P315-C325 HydrophobicContact CB-CB 3.36Å; P315-C325 VanDerWaalsContact CB-SG 3.57Å; P315-C325 HydrophobicContact CG-CB 4.05Å; P315-W467 HydrophobicContact CB-CZ3 4.43Å
316	P	45.3	Very low	46.6	Very low	23 Å²	23	41.5 Å²	41.5	15%	0.149	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-58.7	146.1	167.7	26.6	-33	0	0	0	109.7	V318 F464 D465	P316-V318 VanDerWaalsContact C-N 3.25Å; P316-V318 PolarHBondContact O-N 2.81Å; P316-F464 VanDerWaalsContact CB-O 3.32Å; P316-F464 WeakPolarHBondContact CB-O 3.36Å; P316-D465 WeakPolarHBondContact CB-O 3.34Å
317	V	48.3	Very low	46.3	Very low	34 Å²	34	40.2 Å²	40.2	21%	0.206	23%	0.229	C	C	.	.	S	Bend	trans	-74.1	79.1	-174.8	-180	0	0	0	0	110.2	I519 W520	V317-I519 HydrophobicContact CB-CG2 3.95Å; V317-I519 HydrophobicContact CG1-CG2 4.07Å; V317-I519 WeakPolarHBondContact CG1-O 3.23Å; V317-I519 HydrophobicContact CG2-CG2 3.56Å; V317-W520 HydrophobicContact CG1-CD2 4.14Å; V317-W520 HydrophobicContact CG1-CE3 3.36Å; V317-W520 HydrophobicContact CG1-CH2 4.48Å; V317-W520 HydrophobicContact CG1-CZ3 3.57Å; V317-W520 HydrophobicContact CG2-CH2 4.44Å; V317-W520 HydrophobicContact CG2-CZ3 4.25Å
318	V	46.6	Very low	46.1	Very low	43 Å²	43	39 Å²	39	26%	0.261	22%	0.221	S	C	.	.			trans	-138.9	95.7	166.8	-168.7	0	0	0	0	109.8	P316 C320 T522	P316-V318 VanDerWaalsContact C-N 3.25Å; P316-V318 PolarHBondContact O-N 2.81Å; V318-C320 PolarHBondContact O-N 2.8Å; V318-T522 HydrophobicContact CG1-CG2 4.37Å
319	C	47.5	Very low	46.3	Very low	15 Å²	15	37 Å²	37	10%	0.101	21%	0.209	C	C	.	.			trans	-96.5	84.2	171.7	-76.7	0	0	0	0	109.9	A490 L523	C319-A490 HydrophobicContact CB-CB 4.15Å; C319-L523 HydrophobicContact CB-CD1 3.84Å
320	C	43.3	Very low	46	Very low	55 Å²	55	36.9 Å²	36.9	37%	0.372	21%	0.209	S	C	.	.			trans	-105.7	163.9	162.9	-79.3	0	0	0	0	110.4	V318 D322 K491	V318-C320 PolarHBondContact O-N 2.8Å; C320-D322 PolarHBondContact O-N 3.25Å; C320-D322 VanDerWaalsContact O-N 3.16Å; C320-K491 PolarHBondContact O-NZ 2.87Å
321	E	46	Very low	45.6	Very low	123 Å²	123	39.1 Å²	39.1	58%	0.575	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-36.4	-176.2	-74.1	179.7	158.2	0	0	112.8	K491 W526	E321-K491 PolarHBondContact O-NZ 3.32Å; E321-W526 HydrophobicContact CG-CZ2 3.91Å
322	D	43.1	Very low	45.2	Very low	155 Å²	155	39.8 Å²	39.8	83%	0.829	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-7.4	-165.8	-65.3	-36.5	0	0	0	116.9	C320	C320-D322 PolarHBondContact O-N 3.25Å; C320-D322 VanDerWaalsContact O-N 3.16Å
323	E	43.3	Very low	44.2	Very low	118 Å²	118	46.5 Å²	46.5	55%	0.551	25%	0.254	S	S	*	.			trans	-95.9	133.5	-173.6	-69	-98.7	154.1	0	0	112.1	C325 K491	E323-C325 PolarHBondContact O-N 3.17Å; E323-K491 PolarHBondContact O-NZ 2.93Å
324	S	41.9	Very low	43.4	Very low	81 Å²	81	50.9 Å²	50.9	57%	0.566	28%	0.278	S	S	*	.			trans	-96.2	82.2	-178.1	42.7	0	0	0	0	110.5
325	C	40.2	Very low	42.8	Very low	26 Å²	26	57.9 Å²	57.9	18%	0.176	31%	0.31	C	S	.	.			trans	-102.9	104	177.4	-90.9	0	0	0	0	109.3	P315 E323	P315-C325 HydrophobicContact CB-CB 3.36Å; P315-C325 VanDerWaalsContact CB-SG 3.57Å; P315-C325 HydrophobicContact CG-CB 4.05Å; E323-C325 PolarHBondContact O-N 3.17Å
326	F	46.1	Very low	42.4	Very low	13 Å²	13	58.6 Å²	58.6	6%	0.057	31%	0.313	C	S	.	.			trans	-113	118.9	-178.3	-51.8	-59.1	0	0	0	110.3	L394 M430 V431 F435	F326-L394 VanDerWaalsContact O-CD2 3.23Å; F326-L394 WeakPolarHBondContact O-CD2 2.97Å; F326-M430 VanDerWaalsContact CD1-C 3.42Å; F326-M430 HydrophobicContact CD1-CB 4.42Å; F326-M430 WeakPolarHBondContact CD1-O 3.48Å; F326-M430 WeakPolarHBondContact CE1-O 3.32Å; F326-V431 HydrophobicContact CB-CB 4.42Å; F326-V431 HydrophobicContact CB-CG2 3.45Å; F326-V431 VanDerWaalsContact CB-CG2 3.45Å; F326-V431 HydrophobicContact CD1-CB 4.39Å; F326-V431 HydrophobicContact CD1-CG2 4.26Å; F326-V431 HydrophobicContact CD2-CB 4.49Å; F326-V431 HydrophobicContact CD2-CG2 4.2Å; F326-V431 HydrophobicContact CG-CB 4.19Å; F326-V431 HydrophobicContact CG-CG2 3.73Å; F326-V431 WeakPolarHBondContact CZ-O 3.4Å; F326-F435 HydrophobicContact CE1-CZ 4.39Å
327	P	45.6	Very low	42.1	Very low	1 Å²	1	63.4 Å²	63.4	1%	0.006	34%	0.337	C	S	.	.			trans	-75.3	133.5	171.8	34.4	-34.9	0	0	0	109.3	I313 G427 M430 Y480	I313-P327 VanDerWaalsContact O-CA 3.28Å; I313-P327 WeakPolarHBondContact O-CA 3.33Å; P327-G427 WeakPolarHBondContact O-CA 3.21Å; P327-M430 HydrophobicContact CG-CE 3.83Å; P327-M430 HydrophobicContact CG-SD 3.56Å; P327-M430 VanDerWaalsContact CG-SD 3.56Å; P327-Y480 HydrophobicContact CB-CE2 3.85Å; P327-Y480 WeakPolarHBondContact CB-OH 3.47Å; P327-Y480 WeakPolarHBondContact CG-OH 3.32Å
328	S	44.5	Very low	41.9	Very low	4 Å²	4	67.9 Å²	67.9	3%	0.028	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	151.2	175.9	66.3	0	0	0	0	110.6	I313 L394	I313-S328 PolarHBondContact N-O 2.5Å; S328-L394 WeakPolarHBondContact OG-CD1 3.49Å; S328-L394 WeakPolarHBondContact OG-CD2 3.32Å; S328-L394 WeakPolarHBondContact OG-CG 3.41Å
329	F	47.5	Very low	41.7	Very low	1 Å²	1	67.1 Å²	67.1	0%	0.004	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.8	-174	-74.7	-78	0	0	0	109.1	V310 V311 V312 S390 L423 Q424 L472 Y480	V310-F329 HydrophobicContact CG1-CD1 3.71Å; V310-F329 HydrophobicContact CG1-CE1 4.47Å; V311-F329 WeakPolarHBondContact O-CA 3.34Å; V312-F329 HydrophobicContact CB-CD1 4.43Å; V312-F329 HydrophobicContact CB-CE1 4.38Å; V312-F329 HydrophobicContact CG1-CD1 4.34Å; V312-F329 HydrophobicContact CG1-CE1 4.03Å; V312-F329 HydrophobicContact CG2-CD1 3.65Å; V312-F329 HydrophobicContact CG2-CE1 3.53Å; F329-S390 PolarHBondContact O-OG 3.47Å; F329-L423 HydrophobicContact CD2-CB 4.39Å; F329-L423 WeakPolarHBondContact CD2-O 3.49Å; F329-L423 HydrophobicContact CE1-CB 4.39Å; F329-L423 HydrophobicContact CE2-CB 3.69Å; F329-L423 WeakPolarHBondContact CE2-O 3.34Å; F329-L423 HydrophobicContact CZ-CB 3.64Å; F329-L423 HydrophobicContact CZ-CD1 4.3Å; F329-L423 HydrophobicContact CZ-CG 4.38Å; F329-Q424 VanDerWaalsContact O-CD 3.31Å; F329-Q424 PolarHBondContact O-NE2 3.07Å; F329-Q424 PolarHBondContact O-OE1 3.43Å; F329-L472 HydrophobicContact CE1-CD1 4.23Å; F329-L472 HydrophobicContact CE1-CD2 3.86Å; F329-Y480 HydrophobicContact CE1-CD1 4.24Å; F329-Y480 HydrophobicContact CE1-CE1 4.03Å; F329-Y480 HydrophobicContact CE1-CE2 4.34Å; F329-Y480 AromaticContact CE1-CZ 4Å; F329-Y480 HydrophobicContact CE2-CD1 4.29Å; F329-Y480 AromaticContact CE2-CE1 3.37Å; F329-Y480 HydrophobicContact CE2-CE1 3.37Å; F329-Y480 HydrophobicContact CE2-CE2 4.34Å; F329-Y480 AromaticContact CE2-CZ 3.33Å; F329-Y480 WeakPolarHBondContact CE2-OH 3.48Å; F329-Y480 AromaticContact CZ-CD1 3.46Å; F329-Y480 HydrophobicContact CZ-CD1 3.46Å; F329-Y480 VanDerWaalsContact CZ-CD1 3.46Å; F329-Y480 HydrophobicContact CZ-CD2 4.35Å; F329-Y480 AromaticContact CZ-CE1 2.96Å; F329-Y480 HydrophobicContact CZ-CE1 2.96Å; F329-Y480 AromaticContact CZ-CE2 3.89Å; F329-Y480 HydrophobicContact CZ-CE2 3.89Å; F329-Y480 HydrophobicContact CZ-CG 4.13Å; F329-Y480 AromaticContact CZ-CZ 3.13Å; F329-Y480 WeakPolarHBondContact CZ-OH 3.19Å
330	A	43.1	Very low	41.6	Very low	13 Å²	13	70.3 Å²	70.3	11%	0.107	36%	0.364	C	S	.	.			trans	-105.5	-176.8	159.5	0	0	0	0	0	109.3	V310 V311	V310-A330 VanDerWaalsContact CA-C 3.48Å; V310-A330 WeakPolarHBondContact CA-O 3.13Å; V310-A330 WeakPolarHBondContact CB-O 3.16Å; V310-A330 WeakPolarHBondContact CG1-O 3.37Å; V310-A330 WeakPolarHBondContact CG2-O 3.47Å; V311-A330 PolarHBondContact O-N 3.17Å; V311-A330 VanDerWaalsContact O-N 3.13Å
331	Y	39.7	Very low	41.9	Very low	54 Å²	54	71.9 Å²	71.9	21%	0.212	38%	0.381	C	S	.	.			trans	-129.5	162.8	178	-96.3	-98	0	0	0	115.2	V309 V310 L420 H421 Q424	V309-Y331 CarbonylContact C-O 2.65Å; V309-Y331 VanDerWaalsContact CA-C 3.48Å; V309-Y331 PolarHBondContact N-O 3.41Å; V310-Y331 HydrophobicContact CG2-CD1 4.11Å; V310-Y331 HydrophobicContact CG2-CG 4.16Å; V310-Y331 VanDerWaalsContact N-C 3.3Å; Y331-L420 HydrophobicContact CD1-CD2 3.76Å; Y331-L420 HydrophobicContact CD2-CD2 4.05Å; Y331-L420 HydrophobicContact CE1-CB 3.54Å; Y331-L420 HydrophobicContact CE1-CD1 4.29Å; Y331-L420 HydrophobicContact CE1-CD2 3.21Å; Y331-L420 HydrophobicContact CE1-CG 3.78Å; Y331-L420 HydrophobicContact CE2-CD2 3.5Å; Y331-L420 VanDerWaalsContact CE2-CD2 3.5Å; Y331-L420 HydrophobicContact CG-CD2 4.19Å; Y331-L420 WeakPolarHBondContact OH-CA 3.49Å; Y331-L420 WeakPolarHBondContact OH-CB 3.01Å; Y331-L420 PolarHBondContact OH-O 2.98Å; Y331-H421 WeakPolarHBondContact OH-CA 3.38Å; Y331-H421 PolarHBondContact OH-N 2.94Å; Y331-Q424 HydrophobicContact CE2-CB 4.28Å
332	S	38.9	Very low	41.8	Very low	36 Å²	36	72.5 Å²	72.5	25%	0.252	38%	0.384	S	S	.	.			trans	143.3	-174.5	133.3	50.5	0	0	0	0	116.5	T308 V309	T308-S332 WeakPolarHBondContact CA-OG 3.16Å; T308-S332 WeakPolarHBondContact CB-OG 3.34Å; T308-S332 WeakPolarHBondContact CG2-OG 3.2Å; T308-S332 CarbonylContact O-C 3.41Å; T308-S332 WeakPolarHBondContact O-CA 3.44Å; T308-S332 VanDerWaalsContact O-O 3.07Å; T308-S332 PolarHBondContact O-OG 2.97Å; V309-S332 VanDerWaalsContact CA-C 3.45Å; V309-S332 WeakPolarHBondContact CA-O 3.19Å; V309-S332 VanDerWaalsContact CB-O 3.22Å; V309-S332 WeakPolarHBondContact CB-O 3.48Å; V309-S332 WeakPolarHBondContact CG1-O 3.43Å; V309-S332 WeakPolarHBondContact CG2-O 3.25Å; V309-S332 PolarHBondContact N-OG 2.89Å
333	H	31	Very low	42.1	Very low	141 Å²	141	67.9 Å²	67.9	65%	0.653	36%	0.359	S	S	*	.			trans	-123.5	154.3	-174.5	-146.9	51.4	0	0	0	115.9	T308	T308-H333 CarbonylContact O-C 3.45Å; T308-H333 WeakPolarHBondContact O-CA 2.95Å; T308-H333 PolarHBondContact O-N 3.37Å; T308-H333 PolarHBondContact OG1-O 2.96Å
334	D	35.1	Very low	42.4	Very low	97 Å²	97	69 Å²	69	52%	0.519	37%	0.369	S	S	.	.	S	Bend	trans	72.2	132.7	167.6	-64.7	-30.1	0	0	0	123.2
335	H	36.4	Very low	43.2	Very low	162 Å²	162	69.8 Å²	69.8	75%	0.75	37%	0.366	S	S	*	.			trans	91.6	16.8	-175.6	-54.4	101	0	0	0	118.8	N337 H338	H335-N337 PolarHBondContact O-N 3.03Å; H335-H338 PolarHBondContact O-N 3.29Å
336	L	36.2	Very low	44.3	Very low	36 Å²	36	73.1 Å²	73.1	19%	0.188	39%	0.389	C	S	.	.	H	α-helix	trans	-56	-36.5	-177.6	-176.2	64.8	0	0	0	117.6	V309 H338 F339 L340 L471	V309-L336 HydrophobicContact CB-CD1 4.32Å; V309-L336 HydrophobicContact CG1-CD1 4.36Å; V309-L336 HydrophobicContact CG2-CB 4.5Å; V309-L336 HydrophobicContact CG2-CD1 4.2Å; L336-H338 VanDerWaalsContact C-N 3.27Å; L336-H338 PolarHBondContact O-N 2.88Å; L336-F339 PolarHBondContact O-N 2.69Å; L336-L340 HydrophobicContact CD1-CD1 4.49Å; L336-L340 HydrophobicContact CD1-CG 4.44Å; L336-L340 HydrophobicContact CG-CD1 4.3Å; L336-L340 PolarHBondContact O-N 3.28Å; L336-L340 VanDerWaalsContact O-N 3.1Å; L336-L471 HydrophobicContact CD1-CD1 3.3Å; L336-L471 HydrophobicContact CD1-CD2 3.7Å; L336-L471 HydrophobicContact CD1-CG 3.99Å; L336-L471 HydrophobicContact CD2-CD1 3.73Å; L336-L471 HydrophobicContact CD2-CD2 3.06Å; L336-L471 HydrophobicContact CD2-CG 3.84Å; L336-L471 HydrophobicContact CG-CD1 4.01Å; L336-L471 HydrophobicContact CG-CD2 3.51Å; L336-L471 HydrophobicContact CG-CG 4.29Å
337	N	38.8	Very low	45.3	Very low	124 Å²	124	77.2 Å²	77.2	66%	0.663	41%	0.408	S	S	*	.	H	α-helix	trans	-69.6	-25.5	-175.7	-71.6	-23.8	0	0	0	112.8	H335	H335-N337 PolarHBondContact O-N 3.03Å
338	H	44.8	Very low	46.3	Very low	127 Å²	127	77.6 Å²	77.6	59%	0.588	41%	0.412	S	S	*	.	H	α-helix	trans	-80	-33.2	175.5	-164	-45.4	0	0	0	111.6	H335 L336 Q342	H335-H338 PolarHBondContact O-N 3.29Å; L336-H338 VanDerWaalsContact C-N 3.27Å; L336-H338 PolarHBondContact O-N 2.88Å; H338-Q342 PolarHBondContact CE1-NE2 3.4Å; H338-Q342 VanDerWaalsContact CE1-NE2 3.33Å
339	F	43.5	Very low	47.2	Very low	28 Å²	28	81.4 Å²	81.4	12%	0.123	43%	0.428	C	S	.	.	H	α-helix	trans	-72.6	-43.1	-179.7	175.7	-116.2	0	0	0	112.5	Q305 L306 P307 L336 A341 Q342 L343	Q305-F339 HydrophobicContact CB-CE2 4.09Å; Q305-F339 WeakPolarHBondContact O-CD2 3.22Å; Q305-F339 WeakPolarHBondContact O-CE2 3.4Å; L306-F339 HydrophobicContact CD2-CE1 3.69Å; L306-F339 HydrophobicContact CD2-CZ 3.68Å; L306-F339 HydrophobicContact CG-CZ 4.31Å; P307-F339 HydrophobicContact CG-CB 3.8Å; P307-F339 HydrophobicContact CG-CD1 4.2Å; P307-F339 HydrophobicContact CG-CG 4Å; L336-F339 PolarHBondContact O-N 2.69Å; F339-A341 PolarHBondContact O-N 3.26Å; F339-Q342 PolarHBondContact O-N 2.8Å; F339-L343 HydrophobicContact CD1-CD1 3.66Å; F339-L343 HydrophobicContact CD1-CG 4.37Å; F339-L343 HydrophobicContact CD2-CG 4.47Å; F339-L343 HydrophobicContact CE1-CD1 3.25Å; F339-L343 HydrophobicContact CE1-CD2 4.3Å; F339-L343 HydrophobicContact CE1-CG 3.88Å; F339-L343 HydrophobicContact CE2-CD1 4.24Å; F339-L343 HydrophobicContact CE2-CD2 4.29Å; F339-L343 HydrophobicContact CE2-CG 3.95Å; F339-L343 HydrophobicContact CG-CD1 4.34Å; F339-L343 HydrophobicContact CZ-CD1 3.58Å; F339-L343 HydrophobicContact CZ-CD2 3.78Å; F339-L343 HydrophobicContact CZ-CG 3.65Å; F339-L343 PolarHBondContact O-N 3.05Å; F339-L343 VanDerWaalsContact O-N 3.1Å
340	L	43.8	Very low	48.2	Very low	82 Å²	82	83.3 Å²	83.3	43%	0.429	44%	0.44	S	S	.	.	H	α-helix	trans	-61.5	-29.5	175.5	-70.6	175.8	0	0	0	112.9	L336 Q342 L343 L471	L336-L340 HydrophobicContact CD1-CD1 4.49Å; L336-L340 HydrophobicContact CD1-CG 4.44Å; L336-L340 HydrophobicContact CG-CD1 4.3Å; L336-L340 PolarHBondContact O-N 3.28Å; L336-L340 VanDerWaalsContact O-N 3.1Å; L340-Q342 VanDerWaalsContact C-N 3.29Å; L340-L343 HydrophobicContact CD2-CD1 3.93Å; L340-L471 HydrophobicContact CD1-CD2 3.8Å
341	A	49.6	Very low	49.5	Very low	88 Å²	88	83.2 Å²	83.2	73%	0.727	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-13.6	175.4	0	0	0	0	0	113.7	F339	F339-A341 PolarHBondContact O-N 3.26Å
342	Q	44.9	Very low	50.9	Low	135 Å²	135	82.1 Å²	82.1	63%	0.631	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-7	179.2	-72.5	-171.8	-23.8	0	0	113.7	H338 F339 L340 D344	H338-Q342 PolarHBondContact CE1-NE2 3.4Å; H338-Q342 VanDerWaalsContact CE1-NE2 3.33Å; F339-Q342 PolarHBondContact O-N 2.8Å; L340-Q342 VanDerWaalsContact C-N 3.29Å; Q342-D344 VanDerWaalsContact C-N 3.28Å; Q342-D344 PolarHBondContact O-N 3.47Å
343	L	50	Low	52.3	Low	58 Å²	58	88.4 Å²	88.4	30%	0.304	45%	0.452	S	S	.	.			trans	-74.2	79.8	176.6	-91.9	161.2	0	0	0	110.2	F339 L340 D345 A348	F339-L343 HydrophobicContact CD1-CD1 3.66Å; F339-L343 HydrophobicContact CD1-CG 4.37Å; F339-L343 HydrophobicContact CD2-CG 4.47Å; F339-L343 HydrophobicContact CE1-CD1 3.25Å; F339-L343 HydrophobicContact CE1-CD2 4.3Å; F339-L343 HydrophobicContact CE1-CG 3.88Å; F339-L343 HydrophobicContact CE2-CD1 4.24Å; F339-L343 HydrophobicContact CE2-CD2 4.29Å; F339-L343 HydrophobicContact CE2-CG 3.95Å; F339-L343 HydrophobicContact CG-CD1 4.34Å; F339-L343 HydrophobicContact CZ-CD1 3.58Å; F339-L343 HydrophobicContact CZ-CD2 3.78Å; F339-L343 HydrophobicContact CZ-CG 3.65Å; F339-L343 PolarHBondContact O-N 3.05Å; F339-L343 VanDerWaalsContact O-N 3.1Å; L340-L343 HydrophobicContact CD2-CD1 3.93Å; L343-D345 PolarHBondContact O-N 2.95Å; L343-D345 VanDerWaalsContact O-N 3.13Å; L343-A348 HydrophobicContact CD2-CB 3.66Å
344	D	48.5	Very low	54.3	Low	143 Å²	143	82 Å²	82	77%	0.765	42%	0.423	S	S	*	.			trans	-65.2	110.9	154.5	-82.8	-28.3	0	0	0	107	Q342 C346 E347	Q342-D344 VanDerWaalsContact C-N 3.28Å; Q342-D344 PolarHBondContact O-N 3.47Å; D344-C346 PolarHBondContact O-N 2.71Å; D344-E347 PolarHBondContact O-N 2.98Å
345	D	58	Low	56.2	Low	96 Å²	96	77.4 Å²	77.4	51%	0.513	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-3	-168.3	-151.2	16.9	0	0	0	115.1	L343 K349	L343-D345 PolarHBondContact O-N 2.95Å; L343-D345 VanDerWaalsContact O-N 3.13Å; D345-K349 VanDerWaalsContact CG-CE 3.48Å; D345-K349 WeakPolarHBondContact O-CB 3.1Å; D345-K349 WeakPolarHBondContact O-CD 3.32Å; D345-K349 WeakPolarHBondContact O-CG 3.1Å; D345-K349 WeakPolarHBondContact OD1-CE 3.36Å; D345-K349 IonicContact OD1-NZ 2.63Å; D345-K349 PolarHBondContact OD1-NZ 3.28Å; D345-K349 IonicContact OD2-NZ 3.7Å; D345-K349 PolarHBondContact OD2-NZ 2.72Å
346	C	63.9	Low	57.6	Low	96 Å²	96	70.7 Å²	70.7	65%	0.649	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-45	-178.3	-163	0	0	0	0	113.2	D344 T350	D344-C346 PolarHBondContact O-N 2.71Å; C346-T350 VanDerWaalsContact O-CG2 3.25Å; C346-T350 WeakPolarHBondContact O-CG2 3.13Å; C346-T350 PolarHBondContact O-N 3.27Å; C346-T350 VanDerWaalsContact O-N 3.08Å; C346-T350 PolarHBondContact O-OG1 2.73Å
347	E	67.8	Low	59.2	Low	99 Å²	99	70.9 Å²	70.9	46%	0.463	37%	0.37	S	S	.	.	H	α-helix	trans	-76.1	-46.8	-168.5	-167.4	169.3	-144.5	0	0	112.4	K269 D344 K349 T350 L351	K269-E347 IonicContact NZ-OE1 3.74Å; D344-E347 PolarHBondContact O-N 2.98Å; E347-K349 VanDerWaalsContact C-N 3.34Å; E347-K349 PolarHBondContact O-N 2.88Å; E347-T350 PolarHBondContact O-N 2.63Å; E347-T350 VanDerWaalsContact O-N 3.14Å; E347-T350 PolarHBondContact O-OG1 3.16Å; E347-L351 HydrophobicContact CG-CD1 4.49Å; E347-L351 PolarHBondContact O-N 3.49Å
348	A	65.5	Low	61.1	Low	10 Å²	10	65 Å²	65	8%	0.083	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-39.3	176.9	0	0	0	0	0	112.2	L343 T350 L351 F352	L343-A348 HydrophobicContact CD2-CB 3.66Å; A348-T350 VanDerWaalsContact C-N 3.33Å; A348-T350 PolarHBondContact O-N 3.18Å; A348-L351 PolarHBondContact O-N 3.48Å; A348-F352 WeakPolarHBondContact O-CB 3.47Å; A348-F352 PolarHBondContact O-N 3.16Å
349	K	64	Low	62.5	Low	83 Å²	83	58.9 Å²	58.9	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-43.1	173	-77	-171.8	-172.7	160.9	0	111.7	D345 E347 F352 R353 F469	D345-K349 VanDerWaalsContact CG-CE 3.48Å; D345-K349 WeakPolarHBondContact O-CB 3.1Å; D345-K349 WeakPolarHBondContact O-CD 3.32Å; D345-K349 WeakPolarHBondContact O-CG 3.1Å; D345-K349 WeakPolarHBondContact OD1-CE 3.36Å; D345-K349 IonicContact OD1-NZ 2.63Å; D345-K349 PolarHBondContact OD1-NZ 3.28Å; D345-K349 IonicContact OD2-NZ 3.7Å; D345-K349 PolarHBondContact OD2-NZ 2.72Å; E347-K349 VanDerWaalsContact C-N 3.34Å; E347-K349 PolarHBondContact O-N 2.88Å; K349-F352 PolarHBondContact O-N 3.13Å; K349-R353 WeakPolarHBondContact O-CB 3.13Å; K349-R353 PolarHBondContact O-N 3.42Å; K349-F469 HydrophobicContact CG-CD2 4.2Å; K349-F469 HydrophobicContact CG-CE2 3.75Å
350	T	67.8	Low	63.8	Low	42 Å²	42	64.3 Å²	64.3	26%	0.258	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-44.3	176.6	59.4	0	0	0	0	111.9	C346 E347 A348 F352 R353 T354	C346-T350 VanDerWaalsContact O-CG2 3.25Å; C346-T350 WeakPolarHBondContact O-CG2 3.13Å; C346-T350 PolarHBondContact O-N 3.27Å; C346-T350 VanDerWaalsContact O-N 3.08Å; C346-T350 PolarHBondContact O-OG1 2.73Å; E347-T350 PolarHBondContact O-N 2.63Å; E347-T350 VanDerWaalsContact O-N 3.14Å; E347-T350 PolarHBondContact O-OG1 3.16Å; A348-T350 VanDerWaalsContact C-N 3.33Å; A348-T350 PolarHBondContact O-N 3.18Å; T350-F352 VanDerWaalsContact C-N 3.34Å; T350-F352 PolarHBondContact O-N 3.01Å; T350-R353 PolarHBondContact O-N 2.82Å; T350-T354 WeakPolarHBondContact O-CB 3.45Å; T350-T354 PolarHBondContact O-N 2.88Å; T350-T354 PolarHBondContact O-OG1 2.94Å
351	L	71.8	Confident	65.3	Low	11 Å²	11	60.9 Å²	60.9	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-41.2	177.2	-71	171.6	0	0	0	111.9	Y297 A298 H301 L302 E347 A348 T354 C355	Y297-L351 HydrophobicContact CE1-CD2 4.36Å; A298-L351 WeakPolarHBondContact CB-O 3.29Å; H301-L351 HydrophobicContact CB-CD1 3.96Å; H301-L351 HydrophobicContact CB-CD2 4.27Å; L302-L351 HydrophobicContact CD2-CB 4.03Å; L302-L351 HydrophobicContact CG-CB 4.06Å; E347-L351 HydrophobicContact CG-CD1 4.49Å; E347-L351 PolarHBondContact O-N 3.49Å; A348-L351 PolarHBondContact O-N 3.48Å; L351-T354 PolarHBondContact O-N 3.21Å; L351-C355 WeakPolarHBondContact O-CB 3.42Å; L351-C355 PolarHBondContact O-N 2.87Å
352	F	69.2	Low	66.5	Low	30 Å²	30	56.8 Å²	56.8	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-63	-47.9	177.1	-162.3	-92.3	0	0	0	111.6	L302 I313 A348 K349 T350 T354 C355 T356 C391 L394 F469	L302-F352 HydrophobicContact CD1-CD2 4.21Å; I313-F352 HydrophobicContact CD1-CD1 4.31Å; I313-F352 HydrophobicContact CD1-CD2 4.41Å; I313-F352 HydrophobicContact CD1-CE1 3.48Å; I313-F352 VanDerWaalsContact CD1-CE1 3.48Å; I313-F352 HydrophobicContact CD1-CE2 3.62Å; I313-F352 HydrophobicContact CD1-CZ 3.11Å; A348-F352 WeakPolarHBondContact O-CB 3.47Å; A348-F352 PolarHBondContact O-N 3.16Å; K349-F352 PolarHBondContact O-N 3.13Å; T350-F352 VanDerWaalsContact C-N 3.34Å; T350-F352 PolarHBondContact O-N 3.01Å; F352-T354 PolarHBondContact O-N 2.71Å; F352-C355 WeakPolarHBondContact O-CA 3.49Å; F352-C355 WeakPolarHBondContact O-CB 3.3Å; F352-C355 PolarHBondContact O-N 3.35Å; F352-C355 VanDerWaalsContact O-N 3.08Å; F352-T356 HydrophobicContact CD1-CG2 3.95Å; F352-T356 HydrophobicContact CE1-CG2 3.47Å; F352-T356 VanDerWaalsContact CE1-CG2 3.47Å; F352-T356 HydrophobicContact CZ-CG2 4.07Å; F352-T356 PolarHBondContact O-N 3.2Å; F352-T356 PolarHBondContact O-OG1 2.92Å; F352-C391 WeakPolarHBondContact CE2-SG 3.43Å; F352-C391 WeakPolarHBondContact CZ-SG 3.42Å; F352-L394 HydrophobicContact CE1-CD1 3.39Å; F352-L394 HydrophobicContact CZ-CD1 3.23Å; F352-F469 HydrophobicContact CB-CE1 4.38Å; F352-F469 HydrophobicContact CB-CZ 3.78Å; F352-F469 HydrophobicContact CD1-CZ 4.15Å; F352-F469 HydrophobicContact CD2-CE1 4.1Å; F352-F469 HydrophobicContact CD2-CZ 4.16Å; F352-F469 HydrophobicContact CG-CE1 4.15Å; F352-F469 AromaticContact CG-CZ 3.73Å; F352-F469 HydrophobicContact CG-CZ 3.73Å
353	R	68	Low	67.6	Low	169 Å²	169	50.9 Å²	50.9	64%	0.638	25%	0.251	S	S	*	.	H	α-helix	trans	-59.4	-45.7	175.7	-176.9	174.6	-179.8	166.8	3.6	111.9	K349 T350 C355 T356 D357	K349-R353 WeakPolarHBondContact O-CB 3.13Å; K349-R353 PolarHBondContact O-N 3.42Å; T350-R353 PolarHBondContact O-N 2.82Å; R353-C355 VanDerWaalsContact C-N 3.27Å; R353-C355 PolarHBondContact O-N 3.2Å; R353-T356 WeakPolarHBondContact CA-OG1 3.43Å; R353-T356 PolarHBondContact O-N 2.95Å; R353-T356 PolarHBondContact O-OG1 3.48Å; R353-D357 WeakPolarHBondContact CG-OD2 3.43Å; R353-D357 IonicContact NE-OD2 2.66Å; R353-D357 WeakPolarHBondContact O-CB 3.49Å; R353-D357 VanDerWaalsContact O-CG 3.26Å; R353-D357 PolarHBondContact O-N 2.98Å
354	T	72.6	Confident	68.6	Low	7 Å²	7	52.8 Å²	52.8	4%	0.043	26%	0.257	C	S	.	.	H	α-helix	trans	-57.8	-40.8	173.7	-65.1	0	0	0	0	111.3	W274 L294 A298 T350 L351 F352 A358	W274-T354 HydrophobicContact CH2-CG2 4.45Å; W274-T354 HydrophobicContact CZ2-CG2 3.97Å; L294-T354 HydrophobicContact CB-CG2 4.47Å; L294-T354 HydrophobicContact CD2-CG2 4.27Å; A298-T354 HydrophobicContact CB-CG2 4.19Å; T350-T354 WeakPolarHBondContact O-CB 3.45Å; T350-T354 PolarHBondContact O-N 2.88Å; T350-T354 PolarHBondContact O-OG1 2.94Å; L351-T354 PolarHBondContact O-N 3.21Å; F352-T354 PolarHBondContact O-N 2.71Å; T354-A358 WeakPolarHBondContact O-CB 3.45Å; T354-A358 PolarHBondContact O-N 2.85Å
355	C	74.3	Confident	69.5	Low	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-47.4	177	-161.8	0	0	0	0	111.4	A298 L302 L351 F352 R353 A358 I359	A298-C355 HydrophobicContact CB-CB 3.71Å; L302-C355 HydrophobicContact CD1-CB 4.44Å; L351-C355 WeakPolarHBondContact O-CB 3.42Å; L351-C355 PolarHBondContact O-N 2.87Å; F352-C355 WeakPolarHBondContact O-CA 3.49Å; F352-C355 WeakPolarHBondContact O-CB 3.3Å; F352-C355 PolarHBondContact O-N 3.35Å; F352-C355 VanDerWaalsContact O-N 3.08Å; R353-C355 VanDerWaalsContact C-N 3.27Å; R353-C355 PolarHBondContact O-N 3.2Å; C355-A358 PolarHBondContact O-N 3.34Å; C355-I359 WeakPolarHBondContact O-CB 3.45Å; C355-I359 WeakPolarHBondContact O-CD1 2.92Å; C355-I359 WeakPolarHBondContact O-CG1 3.49Å; C355-I359 PolarHBondContact O-N 3.29Å
356	T	66.5	Low	70.1	Confident	21 Å²	21	47.8 Å²	47.8	13%	0.129	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-41.8	179.6	51.9	0	0	0	0	112.4	F352 R353 I359 R360 C391	F352-T356 HydrophobicContact CD1-CG2 3.95Å; F352-T356 HydrophobicContact CE1-CG2 3.47Å; F352-T356 VanDerWaalsContact CE1-CG2 3.47Å; F352-T356 HydrophobicContact CZ-CG2 4.07Å; F352-T356 PolarHBondContact O-N 3.2Å; F352-T356 PolarHBondContact O-OG1 2.92Å; R353-T356 WeakPolarHBondContact CA-OG1 3.43Å; R353-T356 PolarHBondContact O-N 2.95Å; R353-T356 PolarHBondContact O-OG1 3.48Å; T356-I359 PolarHBondContact O-N 3.21Å; T356-R360 WeakPolarHBondContact O-CB 3.43Å; T356-R360 PolarHBondContact O-N 3.35Å; T356-C391 HydrophobicContact CG2-CB 4.26Å
357	D	69.7	Low	70.7	Confident	39 Å²	39	49.4 Å²	49.4	21%	0.209	23%	0.23	C	C	.	.	H	α-helix	trans	-66.8	-40.3	178.5	-69.3	-22	0	0	0	110.6	W274 R353 R360 I361	W274-D357 HydrophobicContact CD2-CB 3.93Å; W274-D357 HydrophobicContact CE3-CB 3.94Å; W274-D357 HydrophobicContact CH2-CB 3.9Å; W274-D357 HydrophobicContact CZ2-CB 3.89Å; W274-D357 HydrophobicContact CZ3-CB 3.94Å; R353-D357 WeakPolarHBondContact CG-OD2 3.43Å; R353-D357 IonicContact NE-OD2 2.66Å; R353-D357 WeakPolarHBondContact O-CB 3.49Å; R353-D357 VanDerWaalsContact O-CG 3.26Å; R353-D357 PolarHBondContact O-N 2.98Å; D357-R360 WeakPolarHBondContact O-CB 3.25Å; D357-R360 PolarHBondContact O-N 3.03Å; D357-I361 PolarHBondContact O-N 2.66Å
358	A	78.3	Confident	71.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-46.3	173.3	0	0	0	0	0	112.5	W274 G291 L294 T354 C355 R360 I361 L362	W274-A358 HydrophobicContact CH2-CB 3.87Å; W274-A358 HydrophobicContact CZ3-CB 4.33Å; G291-A358 WeakPolarHBondContact O-CB 3.47Å; L294-A358 HydrophobicContact CB-CB 3.82Å; T354-A358 WeakPolarHBondContact O-CB 3.45Å; T354-A358 PolarHBondContact O-N 2.85Å; C355-A358 PolarHBondContact O-N 3.34Å; A358-R360 VanDerWaalsContact C-N 3.32Å; A358-R360 PolarHBondContact O-N 3.11Å; A358-I361 PolarHBondContact O-N 3.35Å; A358-L362 PolarHBondContact O-N 3.14Å
359	I	74	Confident	71.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.3	-37.3	178.7	-69.2	166.2	0	0	0	110.3	C355 T356 I361 L362 T363 I388 C391 C392 L395	C355-I359 WeakPolarHBondContact O-CB 3.45Å; C355-I359 WeakPolarHBondContact O-CD1 2.92Å; C355-I359 WeakPolarHBondContact O-CG1 3.49Å; C355-I359 PolarHBondContact O-N 3.29Å; T356-I359 PolarHBondContact O-N 3.21Å; I359-I361 VanDerWaalsContact C-N 3.25Å; I359-I361 PolarHBondContact O-N 3.27Å; I359-L362 WeakPolarHBondContact O-CB 3.2Å; I359-L362 PolarHBondContact O-N 3.29Å; I359-L362 VanDerWaalsContact O-N 3.07Å; I359-T363 HydrophobicContact CG2-CG2 3.81Å; I359-T363 WeakPolarHBondContact O-CG2 3.39Å; I359-T363 PolarHBondContact O-N 3.15Å; I359-T363 PolarHBondContact O-OG1 3.07Å; I359-I388 HydrophobicContact CD1-CG2 4.09Å; I359-C391 HydrophobicContact CD1-CB 3.3Å; I359-C392 WeakPolarHBondContact CG2-SG 3.36Å; I359-L395 HydrophobicContact CB-CD1 3.91Å; I359-L395 HydrophobicContact CG2-CD1 3.51Å
360	R	70.7	Confident	72.3	Confident	141 Å²	141	44.6 Å²	44.6	53%	0.532	21%	0.213	S	C	.	.	H	α-helix	trans	-56.1	-41.4	175.3	-169.6	-177.1	-173.5	122.2	2.1	111.5	T356 D357 A358 T363 L395	T356-R360 WeakPolarHBondContact O-CB 3.43Å; T356-R360 PolarHBondContact O-N 3.35Å; D357-R360 WeakPolarHBondContact O-CB 3.25Å; D357-R360 PolarHBondContact O-N 3.03Å; A358-R360 VanDerWaalsContact C-N 3.32Å; A358-R360 PolarHBondContact O-N 3.11Å; R360-T363 PolarHBondContact O-N 3.23Å; R360-T363 PolarHBondContact O-OG1 3.49Å; R360-L395 HydrophobicContact CB-CD1 4.34Å; R360-L395 HydrophobicContact CB-CD2 4.45Å
361	I	75.9	Confident	72.9	Confident	11 Å²	11	45.6 Å²	45.6	6%	0.056	21%	0.214	C	C	.	.	H	α-helix	trans	-65.5	-44.5	175.9	-65.4	161	0	0	0	111.2	W274 I277 A287 D357 A358 I359 T363 K364	W274-I361 HydrophobicContact CE3-CD1 3.65Å; W274-I361 HydrophobicContact CZ3-CD1 3.51Å; I277-I361 HydrophobicContact CB-CD1 4.11Å; I277-I361 HydrophobicContact CD1-CD1 4.49Å; I277-I361 HydrophobicContact CG2-CD1 3.61Å; I277-I361 HydrophobicContact CG2-CG1 4.42Å; I277-I361 HydrophobicContact CG2-CG2 4.23Å; A287-I361 HydrophobicContact CB-CG2 4.04Å; D357-I361 PolarHBondContact O-N 2.66Å; A358-I361 PolarHBondContact O-N 3.35Å; I359-I361 VanDerWaalsContact C-N 3.25Å; I359-I361 PolarHBondContact O-N 3.27Å; I361-T363 VanDerWaalsContact C-N 3.32Å; I361-T363 PolarHBondContact O-N 2.92Å; I361-K364 WeakPolarHBondContact O-CB 3.21Å; I361-K364 WeakPolarHBondContact O-CG 3.31Å; I361-K364 PolarHBondContact O-N 3Å
362	L	74.9	Confident	73.4	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-37.7	178.7	-70.6	164.2	0	0	0	112.6	F288 A358 I359 K364 S365 L369 M372	F288-L362 HydrophobicContact CD2-CD2 3.5Å; F288-L362 VanDerWaalsContact CD2-CD2 3.5Å; F288-L362 HydrophobicContact CE2-CD2 4.02Å; F288-L362 HydrophobicContact CG-CD2 4.46Å; A358-L362 PolarHBondContact O-N 3.14Å; I359-L362 WeakPolarHBondContact O-CB 3.2Å; I359-L362 PolarHBondContact O-N 3.29Å; I359-L362 VanDerWaalsContact O-N 3.07Å; L362-K364 PolarHBondContact O-N 3.45Å; L362-K364 VanDerWaalsContact O-N 3.12Å; L362-S365 PolarHBondContact O-N 3.28Å; L362-L369 HydrophobicContact CB-CD2 4.17Å; L362-L369 HydrophobicContact CB-CG 4.43Å; L362-M372 HydrophobicContact CD1-CE 3.11Å; L362-M372 HydrophobicContact CD1-SD 4.28Å; L362-M372 HydrophobicContact CG-CE 4.49Å
363	T	67.8	Low	74	Confident	12 Å²	12	44 Å²	44	7%	0.074	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-5.2	178.7	68.3	0	0	0	0	113.8	I359 R360 I361 S365 L369 R397	I359-T363 HydrophobicContact CG2-CG2 3.81Å; I359-T363 WeakPolarHBondContact O-CG2 3.39Å; I359-T363 PolarHBondContact O-N 3.15Å; I359-T363 PolarHBondContact O-OG1 3.07Å; R360-T363 PolarHBondContact O-N 3.23Å; R360-T363 PolarHBondContact O-OG1 3.49Å; I361-T363 VanDerWaalsContact C-N 3.32Å; I361-T363 PolarHBondContact O-N 2.92Å; T363-S365 PolarHBondContact O-N 3.34Å; T363-L369 HydrophobicContact CG2-CD1 3.66Å; T363-L369 HydrophobicContact CG2-CD2 4.22Å; T363-L369 HydrophobicContact CG2-CG 4.36Å; T363-R397 HydrophobicContact CG2-CG 4.16Å
364	K	70.6	Confident	74.6	Confident	97 Å²	97	40.1 Å²	40.1	42%	0.422	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.5	170.6	-65.8	-177.7	178.6	178.3	0	112.3	I361 L362	I361-K364 WeakPolarHBondContact O-CB 3.21Å; I361-K364 WeakPolarHBondContact O-CG 3.31Å; I361-K364 PolarHBondContact O-N 3Å; L362-K364 PolarHBondContact O-N 3.45Å; L362-K364 VanDerWaalsContact O-N 3.12Å
365	S	69.2	Low	75	Confident	28 Å²	28	40.7 Å²	40.7	20%	0.196	20%	0.201	C	C	.	.	S	Bend	trans	-141.3	120.6	177	60.5	0	0	0	0	111.1	L362 T363 E367 S368	L362-S365 PolarHBondContact O-N 3.28Å; T363-S365 PolarHBondContact O-N 3.34Å; S365-E367 VanDerWaalsContact C-N 3.25Å; S365-E367 PolarHBondContact O-N 3.35Å; S365-S368 WeakPolarHBondContact O-CB 3.43Å; S365-S368 PolarHBondContact O-N 3.27Å; S365-S368 VanDerWaalsContact O-N 3.12Å; S365-S368 WeakPolarHBondContact OG-CB 3.32Å; S365-S368 PolarHBondContact OG-OG 2.88Å
366	D	68.8	Low	75.3	Confident	106 Å²	106	40.7 Å²	40.7	57%	0.567	20%	0.201	S	C	*	.	H	α-helix	trans	-60.6	-34	-176	-61.6	-30	0	0	0	112.9	S368 L369 V370	D366-S368 VanDerWaalsContact C-N 3.25Å; D366-S368 PolarHBondContact O-N 2.94Å; D366-L369 PolarHBondContact O-N 3.47Å; D366-V370 WeakPolarHBondContact O-CG2 3.48Å; D366-V370 PolarHBondContact O-N 2.83Å; D366-V370 VanDerWaalsContact O-N 3.17Å
367	E	76.9	Confident	75.9	Confident	131 Å²	131	43.9 Å²	43.9	61%	0.612	21%	0.213	S	C	*	.	H	α-helix	trans	-59.7	-35.1	178.5	-164.5	-171	150.3	0	0	112.7	S365 K371	S365-E367 VanDerWaalsContact C-N 3.25Å; S365-E367 PolarHBondContact O-N 3.35Å; E367-K371 WeakPolarHBondContact O-CG 3.38Å; E367-K371 PolarHBondContact O-N 2.89Å; E367-K371 VanDerWaalsContact OE1-CE 3.28Å; E367-K371 WeakPolarHBondContact OE1-CE 3.14Å; E367-K371 IonicContact OE1-NZ 3.81Å; E367-K371 PolarHBondContact OE1-NZ 3.25Å
368	S	77.2	Confident	76.1	Confident	13 Å²	13	42.2 Å²	42.2	9%	0.091	21%	0.205	C	C	.	.	H	α-helix	trans	-67.4	-42.1	179.7	-71.8	0	0	0	0	112.1	F288 S365 D366 M372	F288-S368 VanDerWaalsContact CD2-CB 3.45Å; F288-S368 WeakPolarHBondContact CD2-OG 3.22Å; F288-S368 VanDerWaalsContact CE2-O 3.31Å; F288-S368 WeakPolarHBondContact CE2-O 3.07Å; S365-S368 WeakPolarHBondContact O-CB 3.43Å; S365-S368 PolarHBondContact O-N 3.27Å; S365-S368 VanDerWaalsContact O-N 3.12Å; S365-S368 WeakPolarHBondContact OG-CB 3.32Å; S365-S368 PolarHBondContact OG-OG 2.88Å; D366-S368 VanDerWaalsContact C-N 3.25Å; D366-S368 PolarHBondContact O-N 2.94Å; S368-M372 PolarHBondContact O-N 2.94Å
369	L	73.7	Confident	75.7	Confident	10 Å²	10	49.7 Å²	49.7	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-67.7	-41.9	177.7	-78.4	167.7	0	0	0	111.6	L362 T363 D366 K371 M372 F373 I400	L362-L369 HydrophobicContact CB-CD2 4.17Å; L362-L369 HydrophobicContact CB-CG 4.43Å; T363-L369 HydrophobicContact CG2-CD1 3.66Å; T363-L369 HydrophobicContact CG2-CD2 4.22Å; T363-L369 HydrophobicContact CG2-CG 4.36Å; D366-L369 PolarHBondContact O-N 3.47Å; L369-K371 VanDerWaalsContact C-N 3.32Å; L369-K371 PolarHBondContact O-N 3.08Å; L369-M372 WeakPolarHBondContact O-CB 3.49Å; L369-M372 PolarHBondContact O-N 3.45Å; L369-M372 VanDerWaalsContact O-N 3.14Å; L369-F373 WeakPolarHBondContact O-CD2 3.48Å; L369-F373 PolarHBondContact O-N 3.36Å; L369-I400 HydrophobicContact CD1-CD1 3.87Å
370	V	79.4	Confident	75.7	Confident	67 Å²	67	52.9 Å²	52.9	41%	0.406	26%	0.255	S	S	.	.	H	α-helix	trans	-57.4	-47.6	177.2	174.3	0	0	0	0	110.4	D366 M372 F373 D374	D366-V370 WeakPolarHBondContact O-CG2 3.48Å; D366-V370 PolarHBondContact O-N 2.83Å; D366-V370 VanDerWaalsContact O-N 3.17Å; V370-M372 VanDerWaalsContact C-N 3.29Å; V370-M372 PolarHBondContact O-N 3.36Å; V370-F373 PolarHBondContact O-N 3.28Å; V370-F373 VanDerWaalsContact O-N 3.11Å; V370-D374 PolarHBondContact O-N 3.49Å
371	K	80.8	Confident	76	Confident	64 Å²	64	46.2 Å²	46.2	28%	0.278	23%	0.23	S	C	.	.	H	α-helix	trans	-58.4	-38.4	176.6	-73.4	177.2	-175.3	169.4	0	113.3	F288 E367 L369 L375	F288-K371 HydrophobicContact CE2-CB 4.27Å; F288-K371 HydrophobicContact CZ-CB 3.95Å; F288-K371 HydrophobicContact CZ-CD 4.3Å; E367-K371 WeakPolarHBondContact O-CG 3.38Å; E367-K371 PolarHBondContact O-N 2.89Å; E367-K371 VanDerWaalsContact OE1-CE 3.28Å; E367-K371 WeakPolarHBondContact OE1-CE 3.14Å; E367-K371 IonicContact OE1-NZ 3.81Å; E367-K371 PolarHBondContact OE1-NZ 3.25Å; L369-K371 VanDerWaalsContact C-N 3.32Å; L369-K371 PolarHBondContact O-N 3.08Å; K371-L375 PolarHBondContact O-N 3.21Å; K371-L375 VanDerWaalsContact O-N 3.15Å
372	M	83	Confident	75.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-45.9	174.9	173.7	-171.4	-84.4	0	0	111.7	L292 S295 L362 S368 L369 V370 L375 L376 I388	L292-M372 HydrophobicContact CD1-CB 3.77Å; L292-M372 HydrophobicContact CD1-CE 3.6Å; L292-M372 HydrophobicContact CD1-CG 3.81Å; S295-M372 WeakPolarHBondContact OG-CE 3.49Å; L362-M372 HydrophobicContact CD1-CE 3.11Å; L362-M372 HydrophobicContact CD1-SD 4.28Å; L362-M372 HydrophobicContact CG-CE 4.49Å; S368-M372 PolarHBondContact O-N 2.94Å; L369-M372 WeakPolarHBondContact O-CB 3.49Å; L369-M372 PolarHBondContact O-N 3.45Å; L369-M372 VanDerWaalsContact O-N 3.14Å; V370-M372 VanDerWaalsContact C-N 3.29Å; V370-M372 PolarHBondContact O-N 3.36Å; M372-L375 WeakPolarHBondContact O-CB 3.35Å; M372-L375 PolarHBondContact O-N 2.99Å; M372-L376 HydrophobicContact CG-CD1 3.87Å; M372-L376 VanDerWaalsContact O-CG 3.32Å; M372-L376 WeakPolarHBondContact O-CG 3.29Å; M372-L376 PolarHBondContact O-N 2.83Å; M372-I388 HydrophobicContact SD-CD1 4.15Å; M372-I388 HydrophobicContact SD-CG2 3.66Å
373	F	81.3	Confident	75.2	Confident	7 Å²	7	51.6 Å²	51.6	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-70.2	-33.3	-179.2	-83.1	-75.7	0	0	0	112.8	L369 V370 L376 K377 R385 I388 T389 I400 H404	L369-F373 WeakPolarHBondContact O-CD2 3.48Å; L369-F373 PolarHBondContact O-N 3.36Å; V370-F373 PolarHBondContact O-N 3.28Å; V370-F373 VanDerWaalsContact O-N 3.11Å; F373-L376 CarbonylContact O-C 3.54Å; F373-L376 PolarHBondContact O-N 3.36Å; F373-K377 PolarHBondContact O-N 3.39Å; F373-R385 HydrophobicContact CD1-CG 4.11Å; F373-R385 HydrophobicContact CE1-CG 4.01Å; F373-I388 HydrophobicContact CE2-CG2 4.45Å; F373-I388 HydrophobicContact CZ-CG2 3.96Å; F373-T389 WeakPolarHBondContact CE1-OG1 3.34Å; F373-I400 HydrophobicContact CD2-CG2 3.8Å; F373-I400 HydrophobicContact CE1-CG2 4.43Å; F373-I400 HydrophobicContact CE2-CD1 4.49Å; F373-I400 HydrophobicContact CE2-CG2 3.43Å; F373-I400 VanDerWaalsContact CE2-CG2 3.43Å; F373-I400 HydrophobicContact CG-CG2 4.45Å; F373-I400 HydrophobicContact CZ-CG2 3.78Å; F373-H404 AromaticContact CD1-CE1 3.73Å; F373-H404 AromaticContact CD1-NE2 3.72Å; F373-H404 AromaticContact CE1-CE1 3.58Å; F373-H404 AromaticContact CE1-NE2 3.26Å; F373-H404 VanDerWaalsContact CE1-NE2 3.26Å; F373-H404 WeakPolarHBondContact CE1-NE2 2.87Å
374	D	80.7	Confident	75.5	Confident	87 Å²	87	51.1 Å²	51.1	47%	0.465	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-44.3	171.9	-72.6	-24.1	0	0	0	111.1	V370 L376 K377	V370-D374 PolarHBondContact O-N 3.49Å; D374-L376 VanDerWaalsContact C-N 3.28Å; D374-L376 PolarHBondContact O-N 2.95Å; D374-K377 VanDerWaalsContact O-CB 3.29Å; D374-K377 WeakPolarHBondContact O-CB 3.44Å; D374-K377 PolarHBondContact O-N 3.03Å
375	L	81.2	Confident	75.7	Confident	19 Å²	19	47.4 Å²	47.4	10%	0.099	24%	0.236	C	C	.	.	H	α-helix	trans	-59.2	-41.6	173.4	-178.6	71.8	0	0	0	111.7	F173 L207 V210 L296 K371 M372 K377 F381	F173-L375 HydrophobicContact CE1-CD1 4.08Å; F173-L375 HydrophobicContact CZ-CD1 4.34Å; L207-L375 WeakPolarHBondContact O-CD1 3.23Å; V210-L375 HydrophobicContact CG1-CD2 4.13Å; L296-L375 HydrophobicContact CD1-CD2 4.02Å; K371-L375 PolarHBondContact O-N 3.21Å; K371-L375 VanDerWaalsContact O-N 3.15Å; M372-L375 WeakPolarHBondContact O-CB 3.35Å; M372-L375 PolarHBondContact O-N 2.99Å; L375-K377 VanDerWaalsContact C-N 3.27Å; L375-K377 PolarHBondContact O-N 2.91Å; L375-F381 WeakPolarHBondContact O-CD2 3.25Å; L375-F381 WeakPolarHBondContact O-CE2 3.4Å
376	L	80.7	Confident	75.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	4.2	-176.4	-66.8	172.4	0	0	0	113.7	L296 M372 F373 D374 A378 F381 I384 R385 I388	L296-L376 HydrophobicContact CD2-CD1 4.14Å; L296-L376 HydrophobicContact CD2-CD2 3.78Å; L296-L376 HydrophobicContact CD2-CG 4.29Å; M372-L376 HydrophobicContact CG-CD1 3.87Å; M372-L376 VanDerWaalsContact O-CG 3.32Å; M372-L376 WeakPolarHBondContact O-CG 3.29Å; M372-L376 PolarHBondContact O-N 2.83Å; F373-L376 CarbonylContact O-C 3.54Å; F373-L376 PolarHBondContact O-N 3.36Å; D374-L376 VanDerWaalsContact C-N 3.28Å; D374-L376 PolarHBondContact O-N 2.95Å; L376-A378 VanDerWaalsContact C-N 3.25Å; L376-A378 PolarHBondContact O-N 3.08Å; L376-F381 HydrophobicContact CB-CB 4.44Å; L376-F381 HydrophobicContact CD2-CB 3.82Å; L376-F381 HydrophobicContact CD2-CD2 4.3Å; L376-F381 HydrophobicContact CD2-CG 4.05Å; L376-I384 HydrophobicContact CD2-CB 4.42Å; L376-I384 HydrophobicContact CD2-CG2 3.87Å; L376-R385 HydrophobicContact CB-CB 4.22Å; L376-R385 HydrophobicContact CB-CG 4.29Å; L376-R385 WeakPolarHBondContact O-CD 3.33Å; L376-R385 PolarHBondContact O-NH1 3.33Å; L376-I388 HydrophobicContact CD1-CD1 3.55Å
377	K	79.5	Confident	75.5	Confident	88 Å²	88	45.1 Å²	45.1	38%	0.383	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-28	-174.9	-162.1	170.7	-176	-172.2	0	113.4	D169 F373 D374 L375 R385	D169-K377 VanDerWaalsContact CG-CE 3.48Å; D169-K377 WeakPolarHBondContact OD1-CD 3.48Å; D169-K377 WeakPolarHBondContact OD1-CE 3.12Å; D169-K377 IonicContact OD1-NZ 3.07Å; D169-K377 PolarHBondContact OD1-NZ 3.42Å; D169-K377 WeakPolarHBondContact OD2-CE 3.48Å; D169-K377 IonicContact OD2-NZ 2.73Å; D169-K377 PolarHBondContact OD2-NZ 3.14Å; F373-K377 PolarHBondContact O-N 3.39Å; D374-K377 VanDerWaalsContact O-CB 3.29Å; D374-K377 WeakPolarHBondContact O-CB 3.44Å; D374-K377 PolarHBondContact O-N 3.03Å; L375-K377 VanDerWaalsContact C-N 3.27Å; L375-K377 PolarHBondContact O-N 2.91Å; K377-R385 PolarHBondContact O-NH1 3.26Å
378	A	74	Confident	75.4	Confident	5 Å²	5	38.9 Å²	38.9	4%	0.041	19%	0.191	C	C	.	.	S	Bend	trans	-61.3	145.4	179.1	0	0	0	0	0	113.3	P170 P171 F173 L376 Q380 F381 R385	P170-A378 HydrophobicContact CB-CB 4.18Å; P171-A378 HydrophobicContact CG-CB 4.12Å; F173-A378 HydrophobicContact CE2-CB 3.77Å; L376-A378 VanDerWaalsContact C-N 3.25Å; L376-A378 PolarHBondContact O-N 3.08Å; A378-Q380 VanDerWaalsContact C-N 3.27Å; A378-Q380 HydrophobicContact CB-CG 4.12Å; A378-Q380 PolarHBondContact O-N 3.15Å; A378-F381 HydrophobicContact CB-CD2 3.93Å; A378-F381 HydrophobicContact CB-CE2 4.27Å; A378-F381 PolarHBondContact O-N 3.26Å; A378-R385 PolarHBondContact O-NH1 3.43Å
379	Q	69.8	Low	74.9	Confident	156 Å²	156	38.9 Å²	38.9	73%	0.729	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-61.6	-34.8	-175.4	-165.5	-178.1	9.1	0	0	112.7	F381 A382	Q379-F381 PolarHBondContact O-N 3.4Å; Q379-F381 VanDerWaalsContact O-N 3.13Å; Q379-A382 VanDerWaalsContact O-CB 3.25Å; Q379-A382 WeakPolarHBondContact O-CB 3.32Å; Q379-A382 PolarHBondContact O-N 3.23Å
380	Q	73.7	Confident	74.4	Confident	68 Å²	68	38.8 Å²	38.8	32%	0.318	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-59.2	-24.4	176.2	66.4	-170.7	7.1	0	0	113.4	F173 A378	F173-Q380 VanDerWaalsContact CD2-NE2 3.31Å; A378-Q380 VanDerWaalsContact C-N 3.27Å; A378-Q380 HydrophobicContact CB-CG 4.12Å; A378-Q380 PolarHBondContact O-N 3.15Å
381	F	76.4	Confident	73.8	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-93.9	6.3	178.9	-57.6	-42.8	0	0	0	113.6	F173 L214 A215 L218 L375 L376 A378 Q379 K383 I384 R385	F173-F381 HydrophobicContact CD2-CE2 4.12Å; F173-F381 HydrophobicContact CD2-CZ 4.38Å; F173-F381 HydrophobicContact CE2-CD2 4.29Å; F173-F381 AromaticContact CE2-CE2 3.4Å; F173-F381 HydrophobicContact CE2-CE2 3.4Å; F173-F381 HydrophobicContact CE2-CZ 4.07Å; F173-F381 AromaticContact CZ-CE2 3.65Å; F173-F381 HydrophobicContact CZ-CE2 3.65Å; F173-F381 HydrophobicContact CZ-CZ 4.42Å; L214-F381 HydrophobicContact CB-CE1 3.79Å; L214-F381 HydrophobicContact CB-CZ 4.13Å; A215-F381 HydrophobicContact CB-CE1 4.49Å; A215-F381 HydrophobicContact CB-CZ 4.17Å; L218-F381 HydrophobicContact CD1-CD1 3.42Å; L218-F381 VanDerWaalsContact CD1-CD1 3.42Å; L218-F381 HydrophobicContact CD1-CE1 3.61Å; L375-F381 WeakPolarHBondContact O-CD2 3.25Å; L375-F381 WeakPolarHBondContact O-CE2 3.4Å; L376-F381 HydrophobicContact CB-CB 4.44Å; L376-F381 HydrophobicContact CD2-CB 3.82Å; L376-F381 HydrophobicContact CD2-CD2 4.3Å; L376-F381 HydrophobicContact CD2-CG 4.05Å; A378-F381 HydrophobicContact CB-CD2 3.93Å; A378-F381 HydrophobicContact CB-CE2 4.27Å; A378-F381 PolarHBondContact O-N 3.26Å; Q379-F381 PolarHBondContact O-N 3.4Å; Q379-F381 VanDerWaalsContact O-N 3.13Å; F381-K383 VanDerWaalsContact C-N 3.29Å; F381-K383 PolarHBondContact O-N 3.44Å; F381-I384 HydrophobicContact CD1-CD1 4.45Å; F381-I384 PolarHBondContact O-N 3.09Å; F381-I384 VanDerWaalsContact O-N 3.12Å; F381-R385 VanDerWaalsContact O-CB 3.31Å; F381-R385 WeakPolarHBondContact O-CB 3.18Å; F381-R385 PolarHBondContact O-N 3.23Å
382	A	67.8	Low	73.1	Confident	18 Å²	18	32.6 Å²	32.6	15%	0.149	16%	0.159	C	C	.	.	H	α-helix	trans	-53	-42.7	-174.7	0	0	0	0	0	113.4	Q379 R385 Q386	Q379-A382 VanDerWaalsContact O-CB 3.25Å; Q379-A382 WeakPolarHBondContact O-CB 3.32Å; Q379-A382 PolarHBondContact O-N 3.23Å; A382-R385 PolarHBondContact O-N 3.16Å; A382-Q386 WeakPolarHBondContact O-CB 3.38Å; A382-Q386 VanDerWaalsContact O-CG 3.28Å; A382-Q386 WeakPolarHBondContact O-CG 3.32Å; A382-Q386 PolarHBondContact O-N 3.42Å
383	K	66.8	Low	71.8	Confident	107 Å²	107	32.8 Å²	32.8	47%	0.465	16%	0.159	S	C	.	.	H	α-helix	trans	-64.8	-48.3	178	-63	-177	-175.1	179.8	0	112.5	C303 T308 F381 R385 Q386 V387	C303-K383 VanDerWaalsContact SG-C 3.55Å; T308-K383 HydrophobicContact CG2-CD 4.13Å; F381-K383 VanDerWaalsContact C-N 3.29Å; F381-K383 PolarHBondContact O-N 3.44Å; K383-R385 VanDerWaalsContact C-N 3.29Å; K383-R385 PolarHBondContact O-N 3.15Å; K383-Q386 PolarHBondContact O-N 3.13Å; K383-V387 PolarHBondContact O-N 2.63Å
384	I	74.7	Confident	70.7	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-44.1	178.6	-63.6	176.3	0	0	0	109.8	L218 L296 A299 F300 C303 L376 F381 Q386 V387 I388	L218-I384 HydrophobicContact CD1-CD1 3.95Å; L218-I384 HydrophobicContact CD2-CD1 4.44Å; L296-I384 HydrophobicContact CD2-CG2 4.08Å; A299-I384 HydrophobicContact CB-CG2 3.88Å; F300-I384 HydrophobicContact CB-CD1 4.38Å; F300-I384 HydrophobicContact CD2-CD1 4.02Å; C303-I384 HydrophobicContact CB-CG1 4.39Å; L376-I384 HydrophobicContact CD2-CB 4.42Å; L376-I384 HydrophobicContact CD2-CG2 3.87Å; F381-I384 HydrophobicContact CD1-CD1 4.45Å; F381-I384 PolarHBondContact O-N 3.09Å; F381-I384 VanDerWaalsContact O-N 3.12Å; I384-Q386 PolarHBondContact O-N 2.79Å; I384-V387 PolarHBondContact O-N 3.21Å; I384-I388 HydrophobicContact CG2-CD1 3.87Å; I384-I388 WeakPolarHBondContact O-CG1 3.21Å; I384-I388 PolarHBondContact O-N 3.09Å
385	R	74.4	Confident	69.7	Low	19 Å²	19	31.5 Å²	31.5	7%	0.072	15%	0.153	C	C	.	.	H	α-helix	trans	-58.5	-46.8	176	-171.8	172.9	63.8	-128.4	3.9	111.1	F373 L376 K377 A378 F381 A382 K383 V387 I388 T389 D408	F373-R385 HydrophobicContact CD1-CG 4.11Å; F373-R385 HydrophobicContact CE1-CG 4.01Å; L376-R385 HydrophobicContact CB-CB 4.22Å; L376-R385 HydrophobicContact CB-CG 4.29Å; L376-R385 WeakPolarHBondContact O-CD 3.33Å; L376-R385 PolarHBondContact O-NH1 3.33Å; K377-R385 PolarHBondContact O-NH1 3.26Å; A378-R385 PolarHBondContact O-NH1 3.43Å; F381-R385 VanDerWaalsContact O-CB 3.31Å; F381-R385 WeakPolarHBondContact O-CB 3.18Å; F381-R385 PolarHBondContact O-N 3.23Å; A382-R385 PolarHBondContact O-N 3.16Å; K383-R385 VanDerWaalsContact C-N 3.29Å; K383-R385 PolarHBondContact O-N 3.15Å; R385-V387 PolarHBondContact O-N 3.2Å; R385-I388 PolarHBondContact O-N 3.48Å; R385-T389 WeakPolarHBondContact O-CB 3.36Å; R385-T389 PolarHBondContact O-N 3.5Å; R385-T389 PolarHBondContact O-OG1 2.6Å; R385-D408 IonicContact NH2-OD2 3.42Å
386	Q	64.8	Low	68.3	Low	72 Å²	72	32 Å²	32	34%	0.336	16%	0.163	S	C	.	.	H	α-helix	trans	-60.6	-43.7	177.1	-76.5	172.2	-4.8	0	0	112.8	A382 K383 I384 T389 S390	A382-Q386 WeakPolarHBondContact O-CB 3.38Å; A382-Q386 VanDerWaalsContact O-CG 3.28Å; A382-Q386 WeakPolarHBondContact O-CG 3.32Å; A382-Q386 PolarHBondContact O-N 3.42Å; K383-Q386 PolarHBondContact O-N 3.13Å; I384-Q386 PolarHBondContact O-N 2.79Å; Q386-T389 PolarHBondContact O-N 2.99Å; Q386-S390 WeakPolarHBondContact O-CB 3.49Å; Q386-S390 PolarHBondContact O-N 3.12Å; Q386-S390 PolarHBondContact O-OG 2.97Å
387	V	69.6	Low	67.2	Low	14 Å²	14	37 Å²	37	9%	0.085	18%	0.181	C	C	.	.	H	α-helix	trans	-60.5	-47.4	175.9	172.6	0	0	0	0	110.5	A299 L302 K383 I384 R385 S390 C391	A299-V387 HydrophobicContact CB-CB 4.4Å; A299-V387 HydrophobicContact CB-CG1 4.06Å; L302-V387 HydrophobicContact CB-CG1 4.46Å; L302-V387 HydrophobicContact CD1-CG1 4.03Å; K383-V387 PolarHBondContact O-N 2.63Å; I384-V387 PolarHBondContact O-N 3.21Å; R385-V387 PolarHBondContact O-N 3.2Å; V387-S390 WeakPolarHBondContact O-CB 3.27Å; V387-S390 PolarHBondContact O-N 3.4Å; V387-C391 PolarHBondContact O-N 3.16Å; V387-C391 PolarHBondContact O-SG 2.88Å; V387-C391 VanDerWaalsContact O-SG 3.35Å
388	I	74.7	Confident	65.8	Low	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-44.5	179	-70.8	171.5	0	0	0	111.3	L296 A299 I359 M372 F373 L376 I384 R385 S390 C391 C392	L296-I388 HydrophobicContact CD2-CD1 3.91Å; A299-I388 HydrophobicContact CB-CD1 4.02Å; A299-I388 HydrophobicContact CB-CG1 3.77Å; I359-I388 HydrophobicContact CD1-CG2 4.09Å; M372-I388 HydrophobicContact SD-CD1 4.15Å; M372-I388 HydrophobicContact SD-CG2 3.66Å; F373-I388 HydrophobicContact CE2-CG2 4.45Å; F373-I388 HydrophobicContact CZ-CG2 3.96Å; L376-I388 HydrophobicContact CD1-CD1 3.55Å; I384-I388 HydrophobicContact CG2-CD1 3.87Å; I384-I388 WeakPolarHBondContact O-CG1 3.21Å; I384-I388 PolarHBondContact O-N 3.09Å; R385-I388 PolarHBondContact O-N 3.48Å; I388-S390 VanDerWaalsContact C-N 3.26Å; I388-S390 PolarHBondContact O-N 3.49Å; I388-C391 PolarHBondContact O-N 3.31Å; I388-C392 PolarHBondContact O-N 3.14Å; I388-C392 PolarHBondContact O-SG 3.36Å; I388-C392 VanDerWaalsContact O-SG 3.34Å
389	T	66.4	Low	64.8	Low	14 Å²	14	40.5 Å²	40.5	9%	0.086	20%	0.201	C	C	.	.	H	α-helix	trans	-57.4	-41.8	174.5	-55.8	0	0	0	0	110.8	F373 R385 Q386 C392 L393 H404	F373-T389 WeakPolarHBondContact CE1-OG1 3.34Å; R385-T389 WeakPolarHBondContact O-CB 3.36Å; R385-T389 PolarHBondContact O-N 3.5Å; R385-T389 PolarHBondContact O-OG1 2.6Å; Q386-T389 PolarHBondContact O-N 2.99Å; T389-C392 WeakPolarHBondContact O-CB 3.19Å; T389-C392 PolarHBondContact O-N 2.89Å; T389-L393 HydrophobicContact CG2-CD1 4.26Å; T389-L393 WeakPolarHBondContact O-CB 3.18Å; T389-L393 VanDerWaalsContact O-CG 3.24Å; T389-L393 WeakPolarHBondContact O-CG 3.43Å; T389-L393 PolarHBondContact O-N 3.38Å; T389-H404 PolarHBondContact OG1-CE1 3.28Å; T389-H404 PolarHBondContact OG1-NE2 3.39Å
390	S	62.4	Low	64	Low	7 Å²	7	34.1 Å²	34.1	5%	0.049	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-43.2	177.7	-52.9	0	0	0	0	111.8	F329 Q386 V387 I388 L393 L394	F329-S390 PolarHBondContact O-OG 3.47Å; Q386-S390 WeakPolarHBondContact O-CB 3.49Å; Q386-S390 PolarHBondContact O-N 3.12Å; Q386-S390 PolarHBondContact O-OG 2.97Å; V387-S390 WeakPolarHBondContact O-CB 3.27Å; V387-S390 PolarHBondContact O-N 3.4Å; I388-S390 VanDerWaalsContact C-N 3.26Å; I388-S390 PolarHBondContact O-N 3.49Å; S390-L393 WeakPolarHBondContact O-CB 3.4Å; S390-L393 PolarHBondContact O-N 2.89Å; S390-L394 WeakPolarHBondContact O-CG 3.4Å; S390-L394 PolarHBondContact O-N 2.9Å
391	C	68	Low	62.8	Low	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-38.8	174.4	-66.2	0	0	0	0	112.7	F352 T356 I359 V387 I388 L393 L394 L395	F352-C391 WeakPolarHBondContact CE2-SG 3.43Å; F352-C391 WeakPolarHBondContact CZ-SG 3.42Å; T356-C391 HydrophobicContact CG2-CB 4.26Å; I359-C391 HydrophobicContact CD1-CB 3.3Å; V387-C391 PolarHBondContact O-N 3.16Å; V387-C391 PolarHBondContact O-SG 2.88Å; V387-C391 VanDerWaalsContact O-SG 3.35Å; I388-C391 PolarHBondContact O-N 3.31Å; C391-L393 VanDerWaalsContact C-N 3.31Å; C391-L393 PolarHBondContact O-N 3.37Å; C391-L394 PolarHBondContact O-N 3.34Å; C391-L395 WeakPolarHBondContact O-CG 3.45Å; C391-L395 PolarHBondContact O-N 3.05Å
392	C	65.8	Low	61.3	Low	2 Å²	2	40.2 Å²	40.2	1%	0.014	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-40.4	173.2	-71.9	0	0	0	0	111.7	I359 I388 T389 L395 R397 I400	I359-C392 WeakPolarHBondContact CG2-SG 3.36Å; I388-C392 PolarHBondContact O-N 3.14Å; I388-C392 PolarHBondContact O-SG 3.36Å; I388-C392 VanDerWaalsContact O-SG 3.34Å; T389-C392 WeakPolarHBondContact O-CB 3.19Å; T389-C392 PolarHBondContact O-N 2.89Å; C392-L395 PolarHBondContact O-N 2.94Å; C392-R397 WeakPolarHBondContact O-CB 3.24Å; C392-R397 PolarHBondContact O-N 3.2Å; C392-R397 VanDerWaalsContact O-N 3.13Å; C392-I400 HydrophobicContact CB-CD1 4.06Å
393	L	56.2	Low	60.1	Low	3 Å²	3	43.5 Å²	43.5	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-61.8	-44.7	176.5	-76.7	171.3	0	0	0	111.1	T389 S390 C391 L395 G396 M401 C428 V431	T389-L393 HydrophobicContact CG2-CD1 4.26Å; T389-L393 WeakPolarHBondContact O-CB 3.18Å; T389-L393 VanDerWaalsContact O-CG 3.24Å; T389-L393 WeakPolarHBondContact O-CG 3.43Å; T389-L393 PolarHBondContact O-N 3.38Å; S390-L393 WeakPolarHBondContact O-CB 3.4Å; S390-L393 PolarHBondContact O-N 2.89Å; C391-L393 VanDerWaalsContact C-N 3.31Å; C391-L393 PolarHBondContact O-N 3.37Å; L393-L395 PolarHBondContact O-N 3.14Å; L393-G396 PolarHBondContact O-N 3.05Å; L393-M401 HydrophobicContact CD2-CG 4.25Å; L393-M401 HydrophobicContact CD2-SD 4.15Å; L393-C428 WeakPolarHBondContact CD1-SG 3.37Å; L393-C428 HydrophobicContact CD2-CB 4.26Å; L393-V431 HydrophobicContact CB-CG2 4.04Å; L393-V431 HydrophobicContact CD2-CB 4.27Å; L393-V431 HydrophobicContact CD2-CG1 4.11Å; L393-V431 HydrophobicContact CD2-CG2 4.29Å; L393-V431 WeakPolarHBondContact O-CG1 3.37Å; L393-V431 WeakPolarHBondContact O-CG2 3.44Å
394	L	57	Low	58.9	Low	18 Å²	18	40.5 Å²	40.5	9%	0.094	21%	0.207	C	C	.	.	H	α-helix	trans	-57.8	-32.8	174.8	-70.4	170.6	0	0	0	113.9	I313 F326 S328 F352 S390 C391 G396 W467	I313-L394 HydrophobicContact CB-CD2 4.26Å; I313-L394 HydrophobicContact CD1-CD1 3.4Å; I313-L394 HydrophobicContact CD1-CD2 4.42Å; I313-L394 HydrophobicContact CD1-CG 4.43Å; I313-L394 HydrophobicContact CG2-CD1 4.47Å; I313-L394 HydrophobicContact CG2-CD2 3.87Å; F326-L394 VanDerWaalsContact O-CD2 3.23Å; F326-L394 WeakPolarHBondContact O-CD2 2.97Å; S328-L394 WeakPolarHBondContact OG-CD1 3.49Å; S328-L394 WeakPolarHBondContact OG-CD2 3.32Å; S328-L394 WeakPolarHBondContact OG-CG 3.41Å; F352-L394 HydrophobicContact CE1-CD1 3.39Å; F352-L394 HydrophobicContact CZ-CD1 3.23Å; S390-L394 WeakPolarHBondContact O-CG 3.4Å; S390-L394 PolarHBondContact O-N 2.9Å; C391-L394 PolarHBondContact O-N 3.34Å; L394-G396 PolarHBondContact O-N 3.16Å; L394-W467 HydrophobicContact CD2-CH2 4.03Å; L394-W467 HydrophobicContact CD2-CZ3 3.88Å
395	L	59.9	Low	57	Low	50 Å²	50	45.1 Å²	45.1	26%	0.262	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	6.4	178.1	-67.6	169.2	0	0	0	113.3	I359 R360 C391 C392 L393	I359-L395 HydrophobicContact CB-CD1 3.91Å; I359-L395 HydrophobicContact CG2-CD1 3.51Å; R360-L395 HydrophobicContact CB-CD1 4.34Å; R360-L395 HydrophobicContact CB-CD2 4.45Å; C391-L395 WeakPolarHBondContact O-CG 3.45Å; C391-L395 PolarHBondContact O-N 3.05Å; C392-L395 PolarHBondContact O-N 2.94Å; L393-L395 PolarHBondContact O-N 3.14Å
396	G	52.1	Low	55	Low	30 Å²	30	50.4 Å²	50.4	31%	0.309	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	9.6	179.8	0	0	0	0	0	114.3	L393 L394 S398	L393-G396 PolarHBondContact O-N 3.05Å; L394-G396 PolarHBondContact O-N 3.16Å; G396-S398 PolarHBondContact O-N 3.03Å
397	R	56.4	Low	53.5	Low	103 Å²	103	51.2 Å²	51.2	39%	0.389	29%	0.286	S	S	.	.			trans	-103	77.6	-169.7	-63.2	-65.8	-169.6	157.7	6.3	111.8	T363 C392 I400	T363-R397 HydrophobicContact CG2-CG 4.16Å; C392-R397 WeakPolarHBondContact O-CB 3.24Å; C392-R397 PolarHBondContact O-N 3.2Å; C392-R397 VanDerWaalsContact O-N 3.13Å; R397-I400 HydrophobicContact CB-CD1 4.1Å
398	S	51.8	Low	51.7	Low	19 Å²	19	55.4 Å²	55.4	13%	0.133	31%	0.308	C	S	.	.			trans	-81.1	-23.1	-177.8	56	0	0	0	0	115.8	G396 I400 M401 E432	G396-S398 PolarHBondContact O-N 3.03Å; S398-I400 PolarHBondContact O-N 2.76Å; S398-M401 WeakPolarHBondContact O-CB 3.36Å; S398-M401 WeakPolarHBondContact O-CG 3.16Å; S398-M401 PolarHBondContact O-N 3.28Å; S398-E432 WeakPolarHBondContact CB-OE1 3.33Å; S398-E432 WeakPolarHBondContact OG-CG 3.4Å
399	E	51.3	Low	49.3	Very low	149 Å²	149	65.6 Å²	65.6	70%	0.696	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-56.5	-21.3	-174.8	-62.5	177.1	172	0	0	113.4	M401	E399-M401 VanDerWaalsContact C-N 3.26Å; E399-M401 PolarHBondContact O-N 2.6Å
400	I	53.4	Low	47.4	Very low	22 Å²	22	67.6 Å²	67.6	11%	0.113	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-73	-18.2	-179.2	-51.7	171.1	0	0	0	111.7	L369 F373 C392 R397 S398 N402 I403	L369-I400 HydrophobicContact CD1-CD1 3.87Å; F373-I400 HydrophobicContact CD2-CG2 3.8Å; F373-I400 HydrophobicContact CE1-CG2 4.43Å; F373-I400 HydrophobicContact CE2-CD1 4.49Å; F373-I400 HydrophobicContact CE2-CG2 3.43Å; F373-I400 VanDerWaalsContact CE2-CG2 3.43Å; F373-I400 HydrophobicContact CG-CG2 4.45Å; F373-I400 HydrophobicContact CZ-CG2 3.78Å; C392-I400 HydrophobicContact CB-CD1 4.06Å; R397-I400 HydrophobicContact CB-CD1 4.1Å; S398-I400 PolarHBondContact O-N 2.76Å; I400-N402 VanDerWaalsContact C-N 3.26Å; I400-N402 PolarHBondContact O-N 3.4Å; I400-I403 HydrophobicContact CG2-CD1 4.19Å; I400-I403 WeakPolarHBondContact O-CB 3.26Å; I400-I403 WeakPolarHBondContact O-CG1 3.49Å; I400-I403 PolarHBondContact O-N 3.25Å; I400-I403 VanDerWaalsContact O-N 3.11Å
401	M	48.1	Very low	45.7	Very low	56 Å²	56	71.8 Å²	71.8	28%	0.276	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-66.9	-22.9	-179.7	-70.5	-145.2	75.8	0	0	114.4	L393 S398 E399 I403 H404 S405 C428	L393-M401 HydrophobicContact CD2-CG 4.25Å; L393-M401 HydrophobicContact CD2-SD 4.15Å; S398-M401 WeakPolarHBondContact O-CB 3.36Å; S398-M401 WeakPolarHBondContact O-CG 3.16Å; S398-M401 PolarHBondContact O-N 3.28Å; E399-M401 VanDerWaalsContact C-N 3.26Å; E399-M401 PolarHBondContact O-N 2.6Å; M401-I403 PolarHBondContact O-N 3.49Å; M401-I403 VanDerWaalsContact O-N 3.13Å; M401-H404 PolarHBondContact O-N 3.06Å; M401-S405 PolarHBondContact O-N 3.05Å; M401-C428 HydrophobicContact SD-CB 3.46Å; M401-C428 WeakPolarHBondContact SD-CB 3.28Å; M401-C428 PolarHBondContact SD-SG 3.02Å
402	N	45.6	Very low	43.6	Very low	139 Å²	139	75.9 Å²	75.9	74%	0.743	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-62.4	-18.1	173.5	-85.5	-31	0	0	0	112.8	I400	I400-N402 VanDerWaalsContact C-N 3.26Å; I400-N402 PolarHBondContact O-N 3.4Å
403	I	43.6	Very low	41.8	Very low	88 Å²	88	81.7 Å²	81.7	45%	0.451	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-78.9	-23.5	175.6	-52.2	175.7	0	0	0	111	I400 M401	I400-I403 HydrophobicContact CG2-CD1 4.19Å; I400-I403 WeakPolarHBondContact O-CB 3.26Å; I400-I403 WeakPolarHBondContact O-CG1 3.49Å; I400-I403 PolarHBondContact O-N 3.25Å; I400-I403 VanDerWaalsContact O-N 3.11Å; M401-I403 PolarHBondContact O-N 3.49Å; M401-I403 VanDerWaalsContact O-N 3.13Å
404	H	39.6	Very low	40.7	Very low	44 Å²	44	87.2 Å²	87.2	20%	0.204	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-23.7	-170.7	-71.3	-59.8	0	0	0	115.7	F373 T389 M401 V406	F373-H404 AromaticContact CD1-CE1 3.73Å; F373-H404 AromaticContact CD1-NE2 3.72Å; F373-H404 AromaticContact CE1-CE1 3.58Å; F373-H404 AromaticContact CE1-NE2 3.26Å; F373-H404 VanDerWaalsContact CE1-NE2 3.26Å; F373-H404 WeakPolarHBondContact CE1-NE2 2.87Å; T389-H404 PolarHBondContact OG1-CE1 3.28Å; T389-H404 PolarHBondContact OG1-NE2 3.39Å; M401-H404 PolarHBondContact O-N 3.06Å; H404-V406 PolarHBondContact O-N 3.27Å
405	S	35.9	Very low	39.4	Very low	99 Å²	99	94.5 Å²	94.5	69%	0.692	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-2.9	-171	61.7	0	0	0	0	115.4	M401	M401-S405 PolarHBondContact O-N 3.05Å
406	V	31.9	Very low	38.2	Very low	129 Å²	129	95.5 Å²	95.5	78%	0.782	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	-19	-172.1	-176.3	0	0	0	0	114.1	H404	H404-V406 PolarHBondContact O-N 3.27Å
407	S	32.8	Very low	37.7	Very low	89 Å²	89	98.7 Å²	98.7	62%	0.622	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	-27.1	-163	-156.8	0	0	0	0	117.7	K409	S407-K409 PolarHBondContact O-N 2.92Å
408	D	32.2	Very low	37.4	Very low	102 Å²	102	97.4 Å²	97.4	55%	0.545	57%	0.566	S	S	.	*			trans	-96.5	77.1	179	-90.9	-34.2	0	0	0	111.5	R385	R385-D408 IonicContact NH2-OD2 3.42Å
409	K	25.8	Very low	37.6	Very low	214 Å²	214	97.7 Å²	97.7	93%	0.93	57%	0.568	S	S	*	*			trans	-113.1	58.9	153.6	-74.8	-173	178	-179.9	0	108.5	S407	S407-K409 PolarHBondContact O-N 2.92Å
410	G	26.3	Very low	38	Very low	56 Å²	56	91.4 Å²	91.4	58%	0.577	54%	0.539	S	S	*	.			trans	-97.5	125.4	173.3	0	0	0	0	0	109.9	C412	G410-C412 PolarHBondContact O-N 3.49Å
411	A	25.2	Very low	38.2	Very low	96 Å²	96	96.1 Å²	96.1	79%	0.793	56%	0.561	S	S	*	*			trans	-72.9	109.5	-174.7	0	0	0	0	0	112.8
412	C	25	Very low	39	Very low	85 Å²	85	94.6 Å²	94.6	57%	0.574	56%	0.555	S	S	*	*	S	Bend	trans	-155.6	136.7	147.7	-93.6	0	0	0	0	107.7	G410	G410-C412 PolarHBondContact O-N 3.49Å
413	D	27.2	Very low	40	Very low	125 Å²	125	88 Å²	88	67%	0.668	52%	0.52	S	S	*	.			trans	55.9	59.4	167.7	-54.1	-21.2	0	0	0	118.8	E415 E417	D413-E415 VanDerWaalsContact C-N 3.26Å; D413-E415 PolarHBondContact O-N 3.17Å; D413-E417 WeakPolarHBondContact O-CB 3.16Å; D413-E417 WeakPolarHBondContact O-CG 3.4Å; D413-E417 PolarHBondContact O-N 3.31Å
414	V	32.9	Very low	40.9	Very low	118 Å²	118	85.3 Å²	85.3	72%	0.715	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.5	-172.3	178.3	0	0	0	0	116.2
415	E	31	Very low	42.2	Very low	171 Å²	171	86.9 Å²	86.9	80%	0.799	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-46.2	-176.6	-68.7	-175.1	171.8	0	0	113.2	D413 S418	D413-E415 VanDerWaalsContact C-N 3.26Å; D413-E415 PolarHBondContact O-N 3.17Å; E415-S418 PolarHBondContact O-N 3.41Å; E415-S418 PolarHBondContact O-OG 3.17Å
416	A	34.8	Very low	43.8	Very low	71 Å²	71	82.1 Å²	82.1	59%	0.587	48%	0.482	S	S	*	.	H	α-helix	trans	-72.9	-32.4	178.4	0	0	0	0	0	113	S418 S419	A416-S418 VanDerWaalsContact C-N 3.34Å; A416-S419 PolarHBondContact O-OG 3.45Å
417	E	41.4	Very low	45.5	Very low	98 Å²	98	76.1 Å²	76.1	46%	0.458	45%	0.446	S	S	.	.	H	α-helix	trans	-69	-32.3	175.8	-70.1	-170.8	164.4	0	0	112.5	D413 S419 H421	D413-E417 WeakPolarHBondContact O-CB 3.16Å; D413-E417 WeakPolarHBondContact O-CG 3.4Å; D413-E417 PolarHBondContact O-N 3.31Å; E417-S419 VanDerWaalsContact C-N 3.32Å; E417-S419 PolarHBondContact O-N 3.5Å; E417-H421 WeakPolarHBondContact O-CB 3.05Å; E417-H421 PolarHBondContact O-N 3.36Å
418	S	49.5	Very low	46.7	Very low	76 Å²	76	72 Å²	72	53%	0.531	42%	0.417	S	S	.	.	H	α-helix	trans	-63.8	-39.3	-178.2	77.4	0	0	0	0	112.3	E415 A416 H421 S422	E415-S418 PolarHBondContact O-N 3.41Å; E415-S418 PolarHBondContact O-OG 3.17Å; A416-S418 VanDerWaalsContact C-N 3.34Å; S418-H421 PolarHBondContact O-N 3.3Å; S418-S422 PolarHBondContact O-N 2.72Å
419	S	56.5	Low	48.4	Very low	24 Å²	24	68.1 Å²	68.1	17%	0.168	40%	0.396	C	S	.	.	H	α-helix	trans	-72.7	-45.8	-175	87	0	0	0	0	109.5	A416 E417 H421 S422 Y445	A416-S419 PolarHBondContact O-OG 3.45Å; E417-S419 VanDerWaalsContact C-N 3.32Å; E417-S419 PolarHBondContact O-N 3.5Å; S419-H421 VanDerWaalsContact C-N 3.29Å; S419-H421 PolarHBondContact O-N 3.12Å; S419-S422 WeakPolarHBondContact O-CB 3.44Å; S419-S422 PolarHBondContact O-N 2.73Å; S419-S422 PolarHBondContact O-OG 3.47Å; S419-Y445 WeakPolarHBondContact O-CD2 3.46Å; S419-Y445 WeakPolarHBondContact O-CE2 3.24Å
420	L	59.1	Low	50.4	Low	17 Å²	17	58 Å²	58	9%	0.089	35%	0.352	C	S	.	.	H	α-helix	trans	-73.9	-25.7	-179.1	-143.3	141.8	0	0	0	110.4	V310 Y331 S422 L423 Q424 L472	V310-L420 HydrophobicContact CG1-CD2 4.29Å; V310-L420 HydrophobicContact CG2-CD1 4.12Å; V310-L420 HydrophobicContact CG2-CD2 3.53Å; Y331-L420 HydrophobicContact CD1-CD2 3.76Å; Y331-L420 HydrophobicContact CD2-CD2 4.05Å; Y331-L420 HydrophobicContact CE1-CB 3.54Å; Y331-L420 HydrophobicContact CE1-CD1 4.29Å; Y331-L420 HydrophobicContact CE1-CD2 3.21Å; Y331-L420 HydrophobicContact CE1-CG 3.78Å; Y331-L420 HydrophobicContact CE2-CD2 3.5Å; Y331-L420 VanDerWaalsContact CE2-CD2 3.5Å; Y331-L420 HydrophobicContact CG-CD2 4.19Å; Y331-L420 WeakPolarHBondContact OH-CA 3.49Å; Y331-L420 WeakPolarHBondContact OH-CB 3.01Å; Y331-L420 PolarHBondContact OH-O 2.98Å; L420-S422 PolarHBondContact O-N 3.24Å; L420-L423 HydrophobicContact CG-CD1 4.45Å; L420-L423 WeakPolarHBondContact O-CB 3.49Å; L420-L423 PolarHBondContact O-N 3.33Å; L420-L423 VanDerWaalsContact O-N 3.12Å; L420-Q424 PolarHBondContact O-N 3.48Å; L420-L472 HydrophobicContact CD1-CD2 4.49Å
421	H	58.5	Low	52	Low	122 Å²	122	55.6 Å²	55.6	57%	0.565	33%	0.326	S	S	*	.	H	α-helix	trans	-69.4	-30.8	178.4	-172.7	-54	0	0	0	110	Y331 E417 S418 S419 L423 Q424 L425	Y331-H421 WeakPolarHBondContact OH-CA 3.38Å; Y331-H421 PolarHBondContact OH-N 2.94Å; E417-H421 WeakPolarHBondContact O-CB 3.05Å; E417-H421 PolarHBondContact O-N 3.36Å; S418-H421 PolarHBondContact O-N 3.3Å; S419-H421 VanDerWaalsContact C-N 3.29Å; S419-H421 PolarHBondContact O-N 3.12Å; H421-L423 VanDerWaalsContact C-N 3.31Å; H421-Q424 PolarHBondContact O-N 2.85Å; H421-L425 VanDerWaalsContact O-CB 3.27Å; H421-L425 WeakPolarHBondContact O-CB 3.1Å; H421-L425 PolarHBondContact O-N 3.28Å
422	S	63.6	Low	53.9	Low	23 Å²	23	55 Å²	55	16%	0.161	31%	0.307	C	S	.	.	H	α-helix	trans	-68	-31.6	172.7	78.7	0	0	0	0	112.7	S418 S419 L420 A426 S441 Y445	S418-S422 PolarHBondContact O-N 2.72Å; S419-S422 WeakPolarHBondContact O-CB 3.44Å; S419-S422 PolarHBondContact O-N 2.73Å; S419-S422 PolarHBondContact O-OG 3.47Å; L420-S422 PolarHBondContact O-N 3.24Å; S422-A426 WeakPolarHBondContact O-CB 3.24Å; S422-A426 PolarHBondContact O-N 2.78Å; S422-S441 PolarHBondContact O-OG 3.25Å; S422-S441 VanDerWaalsContact O-OG 3.07Å; S422-Y445 WeakPolarHBondContact OG-CD2 3.33Å
423	L	67.8	Low	56.1	Low	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-73.2	-43.3	173.5	-65.8	176	0	0	0	111.7	F329 L420 H421 L425 A426 G427 L442 Y445 L472 Q477 Y480 C481	F329-L423 HydrophobicContact CD2-CB 4.39Å; F329-L423 WeakPolarHBondContact CD2-O 3.49Å; F329-L423 HydrophobicContact CE1-CB 4.39Å; F329-L423 HydrophobicContact CE2-CB 3.69Å; F329-L423 WeakPolarHBondContact CE2-O 3.34Å; F329-L423 HydrophobicContact CZ-CB 3.64Å; F329-L423 HydrophobicContact CZ-CD1 4.3Å; F329-L423 HydrophobicContact CZ-CG 4.38Å; L420-L423 HydrophobicContact CG-CD1 4.45Å; L420-L423 WeakPolarHBondContact O-CB 3.49Å; L420-L423 PolarHBondContact O-N 3.33Å; L420-L423 VanDerWaalsContact O-N 3.12Å; H421-L423 VanDerWaalsContact C-N 3.31Å; L423-L425 VanDerWaalsContact C-N 3.35Å; L423-L425 PolarHBondContact O-N 3.18Å; L423-A426 WeakPolarHBondContact O-CB 3.45Å; L423-A426 PolarHBondContact O-N 3.46Å; L423-G427 PolarHBondContact O-N 2.84Å; L423-L442 HydrophobicContact CD2-CD2 3.9Å; L423-Y445 HydrophobicContact CD1-CE1 4.09Å; L423-Y445 HydrophobicContact CD1-CE2 4.04Å; L423-Y445 HydrophobicContact CD2-CD1 3.92Å; L423-Y445 HydrophobicContact CD2-CD2 4.39Å; L423-Y445 HydrophobicContact CD2-CE1 4.09Å; L423-Y445 HydrophobicContact CD2-CG 4.06Å; L423-Y445 HydrophobicContact CG-CD1 4.46Å; L423-Y445 HydrophobicContact CG-CD2 4.21Å; L423-Y445 HydrophobicContact CG-CE1 4.34Å; L423-Y445 HydrophobicContact CG-CE2 4.04Å; L423-Y445 HydrophobicContact CG-CG 4.38Å; L423-L472 HydrophobicContact CD1-CD2 3.73Å; L423-Q477 HydrophobicContact CD1-CG 4.39Å; L423-Y480 HydrophobicContact CD2-CD1 4.49Å; L423-C481 WeakPolarHBondContact CD2-SG 3.23Å
424	Q	63	Low	58.5	Low	32 Å²	32	51.5 Å²	51.5	15%	0.15	29%	0.288	C	S	.	.	H	α-helix	trans	-55.8	-51.5	171.4	-168.9	77.7	32.6	0	0	110.6	F329 Y331 L420 H421 A426 G427 C428	F329-Q424 VanDerWaalsContact O-CD 3.31Å; F329-Q424 PolarHBondContact O-NE2 3.07Å; F329-Q424 PolarHBondContact O-OE1 3.43Å; Y331-Q424 HydrophobicContact CE2-CB 4.28Å; L420-Q424 PolarHBondContact O-N 3.48Å; H421-Q424 PolarHBondContact O-N 2.85Å; Q424-A426 VanDerWaalsContact C-N 3.27Å; Q424-A426 PolarHBondContact O-N 3.12Å; Q424-G427 PolarHBondContact O-N 3.48Å; Q424-G427 VanDerWaalsContact O-N 3.13Å; Q424-C428 PolarHBondContact O-N 3.31Å; Q424-C428 PolarHBondContact O-SG 3.06Å
425	L	66.6	Low	60.6	Low	77 Å²	77	47.2 Å²	47.2	40%	0.403	26%	0.26	S	S	.	.	H	α-helix	trans	-57.9	-40.9	178.2	-179.9	66.7	0	0	0	111.5	H421 L423 C428 L429	H421-L425 VanDerWaalsContact O-CB 3.27Å; H421-L425 WeakPolarHBondContact O-CB 3.1Å; H421-L425 PolarHBondContact O-N 3.28Å; L423-L425 VanDerWaalsContact C-N 3.35Å; L423-L425 PolarHBondContact O-N 3.18Å; L425-C428 PolarHBondContact O-N 2.9Å; L425-L429 HydrophobicContact CD1-CD1 4.36Å; L425-L429 HydrophobicContact CD1-CG 4.48Å; L425-L429 HydrophobicContact CG-CD1 3.97Å; L425-L429 WeakPolarHBondContact O-CB 3.5Å; L425-L429 VanDerWaalsContact O-CG 3.27Å; L425-L429 WeakPolarHBondContact O-CG 3.49Å; L425-L429 PolarHBondContact O-N 3.44Å
426	A	68.5	Low	63	Low	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-46.3	175.7	0	0	0	0	0	112.2	S422 L423 Q424 C428 L429 M430 L442	S422-A426 WeakPolarHBondContact O-CB 3.24Å; S422-A426 PolarHBondContact O-N 2.78Å; L423-A426 WeakPolarHBondContact O-CB 3.45Å; L423-A426 PolarHBondContact O-N 3.46Å; Q424-A426 VanDerWaalsContact C-N 3.27Å; Q424-A426 PolarHBondContact O-N 3.12Å; A426-C428 VanDerWaalsContact C-N 3.3Å; A426-C428 PolarHBondContact O-N 3.2Å; A426-L429 PolarHBondContact O-N 3.47Å; A426-M430 WeakPolarHBondContact O-CG 3.42Å; A426-M430 PolarHBondContact O-N 3.26Å; A426-L442 HydrophobicContact CB-CD1 4.34Å; A426-L442 HydrophobicContact CB-CD2 3.46Å; A426-L442 VanDerWaalsContact CB-CD2 3.46Å; A426-L442 HydrophobicContact CB-CG 3.56Å
427	G	67.6	Low	65.1	Low	2 Å²	2	40.2 Å²	40.2	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-55.9	-45.9	173.8	0	0	0	0	0	111.6	P327 L423 Q424 L429 M430 V431	P327-G427 WeakPolarHBondContact O-CA 3.21Å; L423-G427 PolarHBondContact O-N 2.84Å; Q424-G427 PolarHBondContact O-N 3.48Å; Q424-G427 VanDerWaalsContact O-N 3.13Å; G427-L429 PolarHBondContact O-N 3.37Å; G427-M430 WeakPolarHBondContact O-CB 3.38Å; G427-M430 PolarHBondContact O-N 3.24Å; G427-M430 VanDerWaalsContact O-N 3.17Å; G427-V431 WeakPolarHBondContact O-CG2 3.43Å; G427-V431 PolarHBondContact O-N 3.25Å
428	C	59.4	Low	66.8	Low	3 Å²	3	35.6 Å²	35.6	2%	0.02	20%	0.196	C	C	.	.	H	α-helix	trans	-60.9	-43.2	176.6	-57.9	0	0	0	0	113.2	L393 M401 Q424 L425 A426 M430 V431 E432	L393-C428 WeakPolarHBondContact CD1-SG 3.37Å; L393-C428 HydrophobicContact CD2-CB 4.26Å; M401-C428 HydrophobicContact SD-CB 3.46Å; M401-C428 WeakPolarHBondContact SD-CB 3.28Å; M401-C428 PolarHBondContact SD-SG 3.02Å; Q424-C428 PolarHBondContact O-N 3.31Å; Q424-C428 PolarHBondContact O-SG 3.06Å; L425-C428 PolarHBondContact O-N 2.9Å; A426-C428 VanDerWaalsContact C-N 3.3Å; A426-C428 PolarHBondContact O-N 3.2Å; C428-M430 VanDerWaalsContact C-N 3.29Å; C428-M430 PolarHBondContact O-N 3.27Å; C428-V431 WeakPolarHBondContact O-CB 2.94Å; C428-V431 PolarHBondContact O-N 3.43Å; C428-E432 PolarHBondContact O-N 3.08Å
429	L	67	Low	68.3	Low	21 Å²	21	32 Å²	32	11%	0.11	17%	0.17	C	C	.	.	H	α-helix	trans	-67.5	-30.9	177.3	-71.3	165.8	0	0	0	112.1	L425 A426 G427 E432 N434 M437 A438	L425-L429 HydrophobicContact CD1-CD1 4.36Å; L425-L429 HydrophobicContact CD1-CG 4.48Å; L425-L429 HydrophobicContact CG-CD1 3.97Å; L425-L429 WeakPolarHBondContact O-CB 3.5Å; L425-L429 VanDerWaalsContact O-CG 3.27Å; L425-L429 WeakPolarHBondContact O-CG 3.49Å; L425-L429 PolarHBondContact O-N 3.44Å; A426-L429 PolarHBondContact O-N 3.47Å; G427-L429 PolarHBondContact O-N 3.37Å; L429-E432 PolarHBondContact O-N 3.07Å; L429-N434 HydrophobicContact CD2-CB 4.4Å; L429-N434 CarbonylContact O-C 3.58Å; L429-N434 WeakPolarHBondContact O-CA 3.42Å; L429-N434 WeakPolarHBondContact O-CB 3.48Å; L429-N434 PolarHBondContact O-N 2.88Å; L429-M437 HydrophobicContact CD1-CB 3.86Å; L429-M437 HydrophobicContact CD2-CB 3.96Å; L429-M437 HydrophobicContact CG-CB 4.41Å; L429-A438 HydrophobicContact CB-CB 3.63Å
430	M	67.6	Low	69.6	Low	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-44	172.3	-69	179.4	71.2	0	0	110.8	F326 P327 A426 G427 C428 E432 S433 F435 A438 L442 C487	F326-M430 VanDerWaalsContact CD1-C 3.42Å; F326-M430 HydrophobicContact CD1-CB 4.42Å; F326-M430 WeakPolarHBondContact CD1-O 3.48Å; F326-M430 WeakPolarHBondContact CE1-O 3.32Å; P327-M430 HydrophobicContact CG-CE 3.83Å; P327-M430 HydrophobicContact CG-SD 3.56Å; P327-M430 VanDerWaalsContact CG-SD 3.56Å; A426-M430 WeakPolarHBondContact O-CG 3.42Å; A426-M430 PolarHBondContact O-N 3.26Å; G427-M430 WeakPolarHBondContact O-CB 3.38Å; G427-M430 PolarHBondContact O-N 3.24Å; G427-M430 VanDerWaalsContact O-N 3.17Å; C428-M430 VanDerWaalsContact C-N 3.29Å; C428-M430 PolarHBondContact O-N 3.27Å; M430-E432 VanDerWaalsContact C-N 3.29Å; M430-E432 PolarHBondContact O-N 3.1Å; M430-S433 WeakPolarHBondContact O-CA 3.44Å; M430-S433 PolarHBondContact O-N 3.37Å; M430-F435 HydrophobicContact CB-CE1 4.33Å; M430-F435 HydrophobicContact CG-CD1 4.39Å; M430-A438 HydrophobicContact CG-CB 3.52Å; M430-L442 HydrophobicContact SD-CD1 4.48Å; M430-C487 HydrophobicContact CE-CB 3.95Å
431	V	61.2	Low	70.6	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.03	18%	0.18	C	C	.	.	H	α-helix	trans	-56.3	-42.9	174.5	173.8	0	0	0	0	112	F326 L393 G427 C428 S433	F326-V431 HydrophobicContact CB-CB 4.42Å; F326-V431 HydrophobicContact CB-CG2 3.45Å; F326-V431 VanDerWaalsContact CB-CG2 3.45Å; F326-V431 HydrophobicContact CD1-CB 4.39Å; F326-V431 HydrophobicContact CD1-CG2 4.26Å; F326-V431 HydrophobicContact CD2-CB 4.49Å; F326-V431 HydrophobicContact CD2-CG2 4.2Å; F326-V431 HydrophobicContact CG-CB 4.19Å; F326-V431 HydrophobicContact CG-CG2 3.73Å; F326-V431 WeakPolarHBondContact CZ-O 3.4Å; L393-V431 HydrophobicContact CB-CG2 4.04Å; L393-V431 HydrophobicContact CD2-CB 4.27Å; L393-V431 HydrophobicContact CD2-CG1 4.11Å; L393-V431 HydrophobicContact CD2-CG2 4.29Å; L393-V431 WeakPolarHBondContact O-CG1 3.37Å; L393-V431 WeakPolarHBondContact O-CG2 3.44Å; G427-V431 WeakPolarHBondContact O-CG2 3.43Å; G427-V431 PolarHBondContact O-N 3.25Å; C428-V431 WeakPolarHBondContact O-CB 2.94Å; C428-V431 PolarHBondContact O-N 3.43Å; V431-S433 PolarHBondContact O-N 2.74Å
432	E	64.3	Low	71.6	Confident	85 Å²	85	29.4 Å²	29.4	40%	0.397	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-0.2	174.1	-76.2	180	-179.2	0	0	114.1	S398 C428 L429 M430 N434	S398-E432 WeakPolarHBondContact CB-OE1 3.33Å; S398-E432 WeakPolarHBondContact OG-CG 3.4Å; C428-E432 PolarHBondContact O-N 3.08Å; L429-E432 PolarHBondContact O-N 3.07Å; M430-E432 VanDerWaalsContact C-N 3.29Å; M430-E432 PolarHBondContact O-N 3.1Å; E432-N434 HydrophobicContact CB-CB 4.16Å; E432-N434 PolarHBondContact O-N 2.97Å; E432-N434 VanDerWaalsContact O-N 3.11Å
433	S	71.6	Confident	72.6	Confident	76 Å²	76	28.3 Å²	28.3	53%	0.531	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	19.1	-167.8	-56.4	0	0	0	0	113.1	M430 V431 F435	M430-S433 WeakPolarHBondContact O-CA 3.44Å; M430-S433 PolarHBondContact O-N 3.37Å; V431-S433 PolarHBondContact O-N 2.74Å; S433-F435 VanDerWaalsContact C-N 3.26Å; S433-F435 VanDerWaalsContact O-CD2 3.27Å; S433-F435 WeakPolarHBondContact O-CD2 3.45Å; S433-F435 PolarHBondContact O-N 3.36Å; S433-F435 VanDerWaalsContact O-N 3.15Å
434	N	76.3	Confident	73.4	Confident	59 Å²	59	31 Å²	31	32%	0.316	16%	0.164	S	C	.	.			trans	-90.8	60.5	176.5	-165.9	-12.3	0	0	0	110.5	L429 E432 A436 M437 A438	L429-N434 HydrophobicContact CD2-CB 4.4Å; L429-N434 CarbonylContact O-C 3.58Å; L429-N434 WeakPolarHBondContact O-CA 3.42Å; L429-N434 WeakPolarHBondContact O-CB 3.48Å; L429-N434 PolarHBondContact O-N 2.88Å; E432-N434 HydrophobicContact CB-CB 4.16Å; E432-N434 PolarHBondContact O-N 2.97Å; E432-N434 VanDerWaalsContact O-N 3.11Å; N434-A436 PolarHBondContact O-N 3.4Å; N434-A436 VanDerWaalsContact O-N 3.11Å; N434-M437 PolarHBondContact O-N 2.68Å; N434-M437 VanDerWaalsContact O-N 3.13Å; N434-M437 WeakPolarHBondContact OD1-CG 3.43Å; N434-M437 PolarHBondContact OD1-N 3.5Å; N434-A438 PolarHBondContact O-N 3.03Å
435	F	78.4	Confident	74.3	Confident	29 Å²	29	29.8 Å²	29.8	13%	0.127	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-25.3	-176.6	-59.7	-72.5	0	0	0	113.3	F326 M430 S433 G439 C488 K491 M492	F326-F435 HydrophobicContact CE1-CZ 4.39Å; M430-F435 HydrophobicContact CB-CE1 4.33Å; M430-F435 HydrophobicContact CG-CD1 4.39Å; S433-F435 VanDerWaalsContact C-N 3.26Å; S433-F435 VanDerWaalsContact O-CD2 3.27Å; S433-F435 WeakPolarHBondContact O-CD2 3.45Å; S433-F435 PolarHBondContact O-N 3.36Å; S433-F435 VanDerWaalsContact O-N 3.15Å; F435-G439 PolarHBondContact O-N 3.47Å; F435-C488 HydrophobicContact CB-CB 4.4Å; F435-K491 HydrophobicContact CB-CB 4.29Å; F435-K491 HydrophobicContact CD1-CB 4.07Å; F435-K491 HydrophobicContact CD1-CG 4.13Å; F435-K491 HydrophobicContact CD2-CB 3.59Å; F435-K491 HydrophobicContact CD2-CG 4.08Å; F435-K491 HydrophobicContact CE1-CB 4.33Å; F435-K491 HydrophobicContact CE1-CG 3.92Å; F435-K491 HydrophobicContact CE2-CB 3.87Å; F435-K491 HydrophobicContact CE2-CD 4.27Å; F435-K491 HydrophobicContact CE2-CG 3.85Å; F435-K491 HydrophobicContact CG-CB 3.7Å; F435-K491 HydrophobicContact CG-CG 4.22Å; F435-K491 HydrophobicContact CZ-CB 4.24Å; F435-K491 HydrophobicContact CZ-CD 4.29Å; F435-K491 HydrophobicContact CZ-CG 3.77Å; F435-M492 HydrophobicContact CB-SD 4.44Å
436	A	80.9	Confident	75	Confident	5 Å²	5	26.1 Å²	26.1	4%	0.041	14%	0.139	C	C	.	.	H	α-helix	trans	-67.1	-46.5	175.9	0	0	0	0	0	112.7	N434 R440 M492 F630 V632	N434-A436 PolarHBondContact O-N 3.4Å; N434-A436 VanDerWaalsContact O-N 3.11Å; A436-R440 WeakPolarHBondContact O-CG 3.42Å; A436-R440 PolarHBondContact O-N 3.18Å; A436-M492 HydrophobicContact CB-CE 4.5Å; A436-M492 HydrophobicContact CB-SD 4.13Å; A436-F630 HydrophobicContact CB-CB 4.38Å; A436-F630 WeakPolarHBondContact CB-O 3.49Å; A436-V632 HydrophobicContact CB-CG2 3.47Å; A436-V632 VanDerWaalsContact CB-CG2 3.47Å
437	M	77.6	Confident	75.6	Confident	90 Å²	90	29 Å²	29	44%	0.443	15%	0.153	S	C	.	.	H	α-helix	trans	-75.6	-38.1	177.8	-70.6	-64.4	-65.4	0	0	111.2	L429 N434 R440 S441	L429-M437 HydrophobicContact CD1-CB 3.86Å; L429-M437 HydrophobicContact CD2-CB 3.96Å; L429-M437 HydrophobicContact CG-CB 4.41Å; N434-M437 PolarHBondContact O-N 2.68Å; N434-M437 VanDerWaalsContact O-N 3.13Å; N434-M437 WeakPolarHBondContact OD1-CG 3.43Å; N434-M437 PolarHBondContact OD1-N 3.5Å; M437-R440 PolarHBondContact O-N 3.31Å; M437-S441 PolarHBondContact O-N 3.18Å
438	A	77.6	Confident	76.2	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.4	-51.1	174.7	0	0	0	0	0	111.6	L429 M430 N434 R440 S441 L442	L429-A438 HydrophobicContact CB-CB 3.63Å; M430-A438 HydrophobicContact CG-CB 3.52Å; N434-A438 PolarHBondContact O-N 3.03Å; A438-R440 VanDerWaalsContact C-N 3.28Å; A438-R440 PolarHBondContact O-N 2.89Å; A438-S441 WeakPolarHBondContact O-CB 3.39Å; A438-S441 PolarHBondContact O-N 3.27Å; A438-S441 VanDerWaalsContact O-N 3.1Å; A438-L442 WeakPolarHBondContact O-CG 3.4Å; A438-L442 PolarHBondContact O-N 3.42Å
439	G	80.6	Confident	76.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-35.2	179.5	0	0	0	0	0	113.2	F435 L443 L485	F435-G439 PolarHBondContact O-N 3.47Å; G439-L443 VanDerWaalsContact O-CB 3.23Å; G439-L443 WeakPolarHBondContact O-CB 3.43Å; G439-L443 PolarHBondContact O-N 2.99Å; G439-L485 WeakPolarHBondContact O-CD2 3.36Å
440	R	83.5	Confident	76.9	Confident	93 Å²	93	35 Å²	35	35%	0.351	20%	0.198	S	C	.	.	H	α-helix	trans	-68.7	-40.4	173.7	-71.6	176.5	-170.5	176.6	8.1	112.7	A436 M437 A438 L443 S444 F630	A436-R440 WeakPolarHBondContact O-CG 3.42Å; A436-R440 PolarHBondContact O-N 3.18Å; M437-R440 PolarHBondContact O-N 3.31Å; A438-R440 VanDerWaalsContact C-N 3.28Å; A438-R440 PolarHBondContact O-N 2.89Å; R440-L443 PolarHBondContact O-N 3.48Å; R440-S444 WeakPolarHBondContact O-CB 3.41Å; R440-S444 PolarHBondContact O-N 3.13Å; R440-F630 HydrophobicContact CG-CB 4Å; R440-F630 HydrophobicContact CG-CD2 4.31Å; R440-F630 HydrophobicContact CG-CG 4.45Å; R440-F630 PolarHBondContact NH2-O 3.15Å
441	S	80.6	Confident	76.7	Confident	15 Å²	15	41.5 Å²	41.5	11%	0.105	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-50	176.6	-166.2	0	0	0	0	110.3	S422 M437 A438 L443 S444 Y445	S422-S441 PolarHBondContact O-OG 3.25Å; S422-S441 VanDerWaalsContact O-OG 3.07Å; M437-S441 PolarHBondContact O-N 3.18Å; A438-S441 WeakPolarHBondContact O-CB 3.39Å; A438-S441 PolarHBondContact O-N 3.27Å; A438-S441 VanDerWaalsContact O-N 3.1Å; S441-L443 PolarHBondContact O-N 2.99Å; S441-S444 PolarHBondContact O-N 3.5Å; S441-S444 PolarHBondContact O-OG 3.11Å; S441-Y445 PolarHBondContact O-N 3.35Å; S441-Y445 VanDerWaalsContact O-N 3.1Å
442	L	81	Confident	76.7	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-59.7	-43.6	176.7	-67.2	171	0	0	0	112.3	L423 A426 M430 A438 S444 Y445 V446 L485	L423-L442 HydrophobicContact CD2-CD2 3.9Å; A426-L442 HydrophobicContact CB-CD1 4.34Å; A426-L442 HydrophobicContact CB-CD2 3.46Å; A426-L442 VanDerWaalsContact CB-CD2 3.46Å; A426-L442 HydrophobicContact CB-CG 3.56Å; M430-L442 HydrophobicContact SD-CD1 4.48Å; A438-L442 WeakPolarHBondContact O-CG 3.4Å; A438-L442 PolarHBondContact O-N 3.42Å; L442-S444 PolarHBondContact O-N 3.07Å; L442-Y445 WeakPolarHBondContact O-CB 3.47Å; L442-Y445 PolarHBondContact O-N 2.92Å; L442-V446 WeakPolarHBondContact O-CG2 3.44Å; L442-V446 PolarHBondContact O-N 3.15Å; L442-L485 HydrophobicContact CB-CD1 4.33Å; L442-L485 HydrophobicContact CB-CD2 3.74Å; L442-L485 HydrophobicContact CB-CG 3.77Å; L442-L485 HydrophobicContact CD1-CD2 4.38Å; L442-L485 HydrophobicContact CD1-CG 4.19Å
443	L	84.4	Confident	76.5	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.9	-39.7	179.3	-176.2	64.2	0	0	0	111.9	G439 R440 S441 Y445 V446 E447 L485 F619 I626 K627	G439-L443 VanDerWaalsContact O-CB 3.23Å; G439-L443 WeakPolarHBondContact O-CB 3.43Å; G439-L443 PolarHBondContact O-N 2.99Å; R440-L443 PolarHBondContact O-N 3.48Å; S441-L443 PolarHBondContact O-N 2.99Å; L443-Y445 PolarHBondContact O-N 3.43Å; L443-V446 PolarHBondContact O-N 3.37Å; L443-E447 HydrophobicContact CD1-CG 4.43Å; L443-E447 HydrophobicContact CG-CG 4.42Å; L443-E447 WeakPolarHBondContact O-CB 3.39Å; L443-E447 WeakPolarHBondContact O-CG 3.34Å; L443-E447 PolarHBondContact O-N 2.79Å; L443-L485 HydrophobicContact CB-CD2 4.34Å; L443-F619 HydrophobicContact CD1-CD1 3.75Å; L443-F619 HydrophobicContact CD1-CE1 4.05Å; L443-I626 HydrophobicContact CD1-CD1 4.36Å; L443-I626 HydrophobicContact CD1-CG2 4.39Å; L443-I626 HydrophobicContact CD2-CB 3.95Å; L443-I626 HydrophobicContact CD2-CG2 3.85Å; L443-K627 HydrophobicContact CD2-CD 4.39Å; L443-K627 HydrophobicContact CD2-CG 3.5Å
444	S	83.8	Confident	75.8	Confident	57 Å²	57	41.5 Å²	41.5	40%	0.399	23%	0.234	S	C	.	.	H	α-helix	trans	-62.1	-35.9	175.7	76.1	0	0	0	0	112.1	R440 S441 L442 A448	R440-S444 WeakPolarHBondContact O-CB 3.41Å; R440-S444 PolarHBondContact O-N 3.13Å; S441-S444 PolarHBondContact O-N 3.5Å; S441-S444 PolarHBondContact O-OG 3.11Å; L442-S444 PolarHBondContact O-N 3.07Å; S444-A448 WeakPolarHBondContact O-CB 3.46Å; S444-A448 PolarHBondContact O-N 3.13Å; S444-A448 VanDerWaalsContact O-N 3.07Å
445	Y	81.6	Confident	74.9	Confident	7 Å²	7	40.3 Å²	40.3	3%	0.027	23%	0.227	C	C	.	.	H	α-helix	trans	-68	-43.6	176	179.3	-89.1	0	0	0	112	S419 S422 L423 S441 L442 L443 A448 N449 Q477 C481	S419-Y445 WeakPolarHBondContact O-CD2 3.46Å; S419-Y445 WeakPolarHBondContact O-CE2 3.24Å; S422-Y445 WeakPolarHBondContact OG-CD2 3.33Å; L423-Y445 HydrophobicContact CD1-CE1 4.09Å; L423-Y445 HydrophobicContact CD1-CE2 4.04Å; L423-Y445 HydrophobicContact CD2-CD1 3.92Å; L423-Y445 HydrophobicContact CD2-CD2 4.39Å; L423-Y445 HydrophobicContact CD2-CE1 4.09Å; L423-Y445 HydrophobicContact CD2-CG 4.06Å; L423-Y445 HydrophobicContact CG-CD1 4.46Å; L423-Y445 HydrophobicContact CG-CD2 4.21Å; L423-Y445 HydrophobicContact CG-CE1 4.34Å; L423-Y445 HydrophobicContact CG-CE2 4.04Å; L423-Y445 HydrophobicContact CG-CG 4.38Å; S441-Y445 PolarHBondContact O-N 3.35Å; S441-Y445 VanDerWaalsContact O-N 3.1Å; L442-Y445 WeakPolarHBondContact O-CB 3.47Å; L442-Y445 PolarHBondContact O-N 2.92Å; L443-Y445 PolarHBondContact O-N 3.43Å; Y445-A448 PolarHBondContact O-N 2.94Å; Y445-N449 PolarHBondContact O-N 3.42Å; Y445-N449 VanDerWaalsContact O-N 3.14Å; Y445-N449 PolarHBondContact O-ND2 3.44Å; Y445-Q477 HydrophobicContact CE1-CB 4.17Å; Y445-Q477 VanDerWaalsContact OH-CB 3.32Å; Y445-Q477 WeakPolarHBondContact OH-CB 3.27Å; Y445-Q477 WeakPolarHBondContact OH-CG 3.35Å; Y445-Q477 PolarHBondContact OH-OE1 3.27Å; Y445-C481 WeakPolarHBondContact CD1-SG 3.29Å; Y445-C481 VanDerWaalsContact CE1-SG 3.58Å
446	V	82.4	Confident	73.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67	-40.5	177.2	175.4	0	0	0	0	111.4	L442 L443 A448 N449 S450 C481 L485 F619	L442-V446 WeakPolarHBondContact O-CG2 3.44Å; L442-V446 PolarHBondContact O-N 3.15Å; L443-V446 PolarHBondContact O-N 3.37Å; V446-A448 VanDerWaalsContact C-N 3.31Å; V446-A448 PolarHBondContact O-N 3.23Å; V446-N449 CarbonylContact O-C 3.42Å; V446-N449 PolarHBondContact O-N 3.33Å; V446-S450 WeakPolarHBondContact O-CA 3.49Å; V446-S450 WeakPolarHBondContact O-CB 3.45Å; V446-S450 PolarHBondContact O-N 3.08Å; V446-C481 HydrophobicContact CG2-CB 3.44Å; V446-C481 VanDerWaalsContact CG2-CB 3.44Å; V446-L485 HydrophobicContact CG2-CD1 4.15Å; V446-F619 HydrophobicContact CG1-CB 4.49Å; V446-F619 HydrophobicContact CG1-CD1 3.88Å; V446-F619 HydrophobicContact CG1-CD2 3.58Å; V446-F619 HydrophobicContact CG1-CE1 3.92Å; V446-F619 HydrophobicContact CG1-CE2 3.63Å; V446-F619 HydrophobicContact CG1-CG 3.72Å; V446-F619 HydrophobicContact CG1-CZ 3.8Å
447	E	81	Confident	72.1	Confident	60 Å²	60	48.4 Å²	48.4	28%	0.28	27%	0.271	S	S	.	.	H	α-helix	trans	-61	-41.3	175.5	-74.6	175	171.3	0	0	111.2	L443 N449 S450 K627	L443-E447 HydrophobicContact CD1-CG 4.43Å; L443-E447 HydrophobicContact CG-CG 4.42Å; L443-E447 WeakPolarHBondContact O-CB 3.39Å; L443-E447 WeakPolarHBondContact O-CG 3.34Å; L443-E447 PolarHBondContact O-N 2.79Å; E447-N449 VanDerWaalsContact C-N 3.35Å; E447-N449 PolarHBondContact O-N 2.91Å; E447-S450 PolarHBondContact O-OG 3.26Å; E447-K627 WeakPolarHBondContact OE1-CE 3.47Å; E447-K627 IonicContact OE1-NZ 3.12Å; E447-K627 PolarHBondContact OE1-NZ 3.14Å; E447-K627 WeakPolarHBondContact OE2-CE 3.35Å; E447-K627 IonicContact OE2-NZ 2.81Å; E447-K627 PolarHBondContact OE2-NZ 3.31Å
448	A	79.9	Confident	70.4	Confident	80 Å²	80	47 Å²	47	66%	0.661	27%	0.268	S	S	*	.	H	α-helix	trans	-69.4	-27.1	179	0	0	0	0	0	114.2	S444 Y445 V446	S444-A448 WeakPolarHBondContact O-CB 3.46Å; S444-A448 PolarHBondContact O-N 3.13Å; S444-A448 VanDerWaalsContact O-N 3.07Å; Y445-A448 PolarHBondContact O-N 2.94Å; V446-A448 VanDerWaalsContact C-N 3.31Å; V446-A448 PolarHBondContact O-N 3.23Å
449	N	74.3	Confident	68.3	Low	38 Å²	38	52.7 Å²	52.7	20%	0.203	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	22.6	-177.6	-61.2	-74.8	0	0	0	112.7	Y445 V446 E447 D451 D452 I478	Y445-N449 PolarHBondContact O-N 3.42Å; Y445-N449 VanDerWaalsContact O-N 3.14Å; Y445-N449 PolarHBondContact O-ND2 3.44Å; V446-N449 CarbonylContact O-C 3.42Å; V446-N449 PolarHBondContact O-N 3.33Å; E447-N449 VanDerWaalsContact C-N 3.35Å; E447-N449 PolarHBondContact O-N 2.91Å; N449-D451 PolarHBondContact O-N 3.44Å; N449-D451 VanDerWaalsContact O-N 3.16Å; N449-D452 PolarHBondContact O-N 3.24Å; N449-I478 HydrophobicContact CB-CD1 4.38Å; N449-I478 VanDerWaalsContact O-CD1 3.25Å; N449-I478 WeakPolarHBondContact O-CD1 3.27Å
450	S	66.2	Low	66.2	Low	34 Å²	34	57.3 Å²	57.3	24%	0.238	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-66.5	-17.1	-171	51.9	0	0	0	0	114.9	V446 E447 V453 K616	V446-S450 WeakPolarHBondContact O-CA 3.49Å; V446-S450 WeakPolarHBondContact O-CB 3.45Å; V446-S450 PolarHBondContact O-N 3.08Å; E447-S450 PolarHBondContact O-OG 3.26Å; S450-V453 WeakPolarHBondContact O-CG2 3.39Å; S450-K616 WeakPolarHBondContact O-CD 3.32Å; S450-K616 WeakPolarHBondContact O-CE 3.45Å; S450-K616 WeakPolarHBondContact O-CG 3.46Å
451	D	64	Low	64	Low	137 Å²	137	55 Å²	55	73%	0.733	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-76.1	-24	177.2	-70.7	-33.9	0	0	0	112.9	N449 K616	N449-D451 PolarHBondContact O-N 3.44Å; N449-D451 VanDerWaalsContact O-N 3.16Å; D451-K616 PolarHBondContact O-NZ 3.04Å
452	D	61	Low	61.9	Low	95 Å²	95	57.8 Å²	57.8	51%	0.508	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-102.3	27.2	-173.5	-78.3	-16.9	0	0	0	114	N449 C454 H474 I478	N449-D452 PolarHBondContact O-N 3.24Å; D452-C454 PolarHBondContact O-N 3.33Å; D452-H474 IonicContact OD2-CE1 3.8Å; D452-I478 WeakPolarHBondContact O-CD1 3.49Å
453	V	59.2	Low	59.9	Low	7 Å²	7	61.9 Å²	61.9	4%	0.042	39%	0.386	C	S	.	.			trans	-63.2	103.1	174.9	-174.5	0	0	0	0	109.5	S450 L455 I478 E612 K616	S450-V453 WeakPolarHBondContact O-CG2 3.39Å; V453-L455 HydrophobicContact CG1-CG 4.37Å; V453-I478 HydrophobicContact CB-CD1 4.42Å; V453-I478 HydrophobicContact CG1-CG2 4.35Å; V453-I478 HydrophobicContact CG2-CD1 4.05Å; V453-I478 HydrophobicContact CG2-CG2 4.3Å; V453-E612 HydrophobicContact CG1-CB 4.27Å; V453-E612 HydrophobicContact CG1-CG 4.19Å; V453-K616 HydrophobicContact CB-CG 4.31Å; V453-K616 HydrophobicContact CG2-CD 4.4Å; V453-K616 HydrophobicContact CG2-CG 3.76Å
454	C	58.4	Low	58.2	Low	64 Å²	64	67.1 Å²	67.1	43%	0.432	41%	0.409	S	S	.	.			trans	-121	117.8	169.9	-160.4	0	0	0	0	107.2	D452	D452-C454 PolarHBondContact O-N 3.33Å
455	L	56.3	Low	56.2	Low	34 Å²	34	70.9 Å²	70.9	18%	0.178	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-94.1	137	178.5	-63.5	171.4	0	0	0	110	V453 I482 V515 L611 E612 L615	V453-L455 HydrophobicContact CG1-CG 4.37Å; L455-I482 HydrophobicContact CD2-CD1 4.47Å; L455-V515 HydrophobicContact CD1-CG2 4.46Å; L455-V515 HydrophobicContact CD2-CG1 3.95Å; L455-V515 HydrophobicContact CD2-CG2 4.46Å; L455-L611 HydrophobicContact CD1-CD2 3.81Å; L455-L611 HydrophobicContact CD1-CG 4.06Å; L455-E612 HydrophobicContact CD1-CG 3.86Å; L455-E612 HydrophobicContact CG-CG 4.12Å; L455-E612 PolarHBondContact N-OE1 2.65Å; L455-L615 HydrophobicContact CD1-CD1 4.25Å
456	L	55.1	Low	54.4	Low	63 Å²	63	76.3 Å²	76.3	33%	0.33	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-68.8	147.1	177	-81.5	160.3	0	0	0	111.6	V458 N476	L456-V458 PolarHBondContact O-N 2.94Å; L456-N476 HydrophobicContact CD1-CB 3.94Å; L456-N476 WeakPolarHBondContact CD1-ND2 3.38Å; L456-N476 WeakPolarHBondContact CD1-OD1 3.25Å; L456-N476 WeakPolarHBondContact CD2-OD1 3.5Å; L456-N476 WeakPolarHBondContact CG-OD1 3.3Å
457	D	45.3	Very low	52.7	Low	141 Å²	141	81.5 Å²	81.5	75%	0.754	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-74.3	119.8	171.5	-123.5	-22.6	0	0	0	110.6	S459	D457-S459 PolarHBondContact O-N 2.94Å
458	V	42.3	Very low	51.2	Low	62 Å²	62	80.6 Å²	80.6	38%	0.376	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-70.2	-6.6	-163.8	-155.9	0	0	0	0	114.1	L456 S460 L461 Y516	L456-V458 PolarHBondContact O-N 2.94Å; V458-S460 PolarHBondContact O-N 3.4Å; V458-L461 PolarHBondContact O-N 2.92Å; V458-Y516 HydrophobicContact CB-CD1 4.05Å; V458-Y516 HydrophobicContact CB-CE1 4.33Å; V458-Y516 HydrophobicContact CG1-CD1 3.58Å; V458-Y516 HydrophobicContact CG1-CE1 4.18Å; V458-Y516 HydrophobicContact CG1-CG 4.43Å; V458-Y516 HydrophobicContact CG2-CD1 3.4Å; V458-Y516 HydrophobicContact CG2-CE1 3.65Å
459	S	33.5	Very low	49.9	Very low	118 Å²	118	80 Å²	80	83%	0.825	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-64.8	-9.8	-168.6	-38.8	0	0	0	0	114.5	D457	D457-S459 PolarHBondContact O-N 2.94Å
460	S	37.1	Very low	48.9	Very low	98 Å²	98	80 Å²	80	69%	0.685	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-114.8	4.3	-175.5	66.3	0	0	0	0	115.6	V458 P462	V458-S460 PolarHBondContact O-N 3.4Å; S460-P462 WeakPolarHBondContact O-CD 3.33Å
461	L	37.1	Very low	48.2	Very low	43 Å²	43	79.6 Å²	79.6	23%	0.225	45%	0.448	C	S	.	.			trans	-113	101.2	-179.3	-75.4	163.2	0	0	0	109.6	V458	V458-L461 PolarHBondContact O-N 2.92Å
462	P	36.9	Very low	47.9	Very low	74 Å²	74	73.7 Å²	73.7	48%	0.481	42%	0.417	S	S	.	.			trans	-69.3	151.8	179	-3.4	17.6	0	0	0	110.1	S460 F464	S460-P462 WeakPolarHBondContact O-CD 3.33Å; P462-F464 VanDerWaalsContact C-CD2 3.44Å; P462-F464 HydrophobicContact CB-CD2 3.76Å; P462-F464 HydrophobicContact CB-CE1 4.13Å; P462-F464 HydrophobicContact CB-CE2 3.13Å; P462-F464 HydrophobicContact CB-CZ 3.32Å; P462-F464 VanDerWaalsContact CD-CE2 3.42Å; P462-F464 HydrophobicContact CG-CD2 4.1Å; P462-F464 HydrophobicContact CG-CE2 3.11Å; P462-F464 HydrophobicContact CG-CZ 3.41Å; P462-F464 VanDerWaalsContact CG-CZ 3.41Å; P462-F464 WeakPolarHBondContact O-CD2 3.28Å; P462-F464 PolarHBondContact O-N 3.27Å
463	A	38.7	Very low	47.7	Very low	88 Å²	88	73.1 Å²	73.1	73%	0.727	41%	0.41	S	S	*	.			trans	-67.1	125.1	174.8	0	0	0	0	0	108.9
464	F	48.6	Very low	47.7	Very low	109 Å²	109	78.1 Å²	78.1	48%	0.478	43%	0.432	S	S	.	.			trans	-145.2	140.3	-175.7	-67.9	-70.4	0	0	0	116.1	P316 P462 D466	P316-F464 VanDerWaalsContact CB-O 3.32Å; P316-F464 WeakPolarHBondContact CB-O 3.36Å; P462-F464 VanDerWaalsContact C-CD2 3.44Å; P462-F464 HydrophobicContact CB-CD2 3.76Å; P462-F464 HydrophobicContact CB-CE1 4.13Å; P462-F464 HydrophobicContact CB-CE2 3.13Å; P462-F464 HydrophobicContact CB-CZ 3.32Å; P462-F464 VanDerWaalsContact CD-CE2 3.42Å; P462-F464 HydrophobicContact CG-CD2 4.1Å; P462-F464 HydrophobicContact CG-CE2 3.11Å; P462-F464 HydrophobicContact CG-CZ 3.41Å; P462-F464 VanDerWaalsContact CG-CZ 3.41Å; P462-F464 WeakPolarHBondContact O-CD2 3.28Å; P462-F464 PolarHBondContact O-N 3.27Å; F464-D466 VanDerWaalsContact C-N 3.3Å
465	D	42.1	Very low	47.8	Very low	136 Å²	136	80.7 Å²	80.7	73%	0.727	44%	0.438	S	S	*	.	S	Bend	trans	-81.1	1.4	171.3	-66.6	-39.8	0	0	0	113.4	P316	P316-D465 WeakPolarHBondContact CB-O 3.34Å
466	D	43.6	Very low	48.3	Very low	121 Å²	121	80 Å²	80	65%	0.647	43%	0.434	S	S	*	.	S	Bend	trans	-124.1	155.9	-175.2	-81.2	-34.3	0	0	0	113.7	F464 Q468	F464-D466 VanDerWaalsContact C-N 3.3Å; D466-Q468 PolarHBondContact O-N 2.96Å
467	W	46.6	Very low	49	Very low	110 Å²	110	77.6 Å²	77.6	42%	0.417	42%	0.422	S	S	.	.			trans	-56.6	130.7	178.7	-59.6	95.2	0	0	0	112.9	I313 P315 L394	I313-W467 HydrophobicContact CG2-CB 4.47Å; I313-W467 HydrophobicContact CG2-CD2 3.93Å; I313-W467 HydrophobicContact CG2-CE3 3.02Å; I313-W467 HydrophobicContact CG2-CZ3 3.4Å; I313-W467 VanDerWaalsContact CG2-CZ3 3.4Å; P315-W467 HydrophobicContact CB-CZ3 4.43Å; L394-W467 HydrophobicContact CD2-CH2 4.03Å; L394-W467 HydrophobicContact CD2-CZ3 3.88Å
468	Q	49.6	Very low	50.4	Low	41 Å²	41	71.1 Å²	71.1	19%	0.192	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.1	177.7	-66.7	-164.9	-33.8	0	0	112.6	V312 L314 D466 V470	V312-Q468 VanDerWaalsContact O-O 3.12Å; L314-Q468 PolarHBondContact N-O 3.15Å; L314-Q468 PolarHBondContact O-N 3.25Å; D466-Q468 PolarHBondContact O-N 2.96Å; Q468-V470 HydrophobicContact CB-CG2 4.19Å
469	F	51.8	Low	51.9	Low	68 Å²	68	68.6 Å²	68.6	30%	0.298	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	107.5	169.6	-67.8	-99.5	0	0	0	107.8	V311 K349 F352	V311-F469 HydrophobicContact CG1-CD1 3.28Å; V311-F469 HydrophobicContact CG1-CE1 3.68Å; V311-F469 HydrophobicContact CG1-CG 4.3Å; V311-F469 HydrophobicContact CG2-CD1 4.49Å; K349-F469 HydrophobicContact CG-CD2 4.2Å; K349-F469 HydrophobicContact CG-CE2 3.75Å; F352-F469 HydrophobicContact CB-CE1 4.38Å; F352-F469 HydrophobicContact CB-CZ 3.78Å; F352-F469 HydrophobicContact CD1-CZ 4.15Å; F352-F469 HydrophobicContact CD2-CE1 4.1Å; F352-F469 HydrophobicContact CD2-CZ 4.16Å; F352-F469 HydrophobicContact CG-CE1 4.15Å; F352-F469 AromaticContact CG-CZ 3.73Å; F352-F469 HydrophobicContact CG-CZ 3.73Å
470	V	52.8	Low	53.8	Low	37 Å²	37	63.2 Å²	63.2	22%	0.224	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.3	176.2	-176.9	0	0	0	0	109.3	V312 L314 Q468	V312-V470 VanDerWaalsContact CB-O 3.3Å; V312-V470 WeakPolarHBondContact CB-O 3.14Å; V312-V470 WeakPolarHBondContact CG2-O 3Å; V312-V470 PolarHBondContact N-O 3.34Å; V312-V470 VanDerWaalsContact N-O 3.16Å; V312-V470 PolarHBondContact O-N 2.92Å; L314-V470 HydrophobicContact CD1-CB 3.66Å; L314-V470 HydrophobicContact CD1-CG1 4.36Å; L314-V470 HydrophobicContact CD1-CG2 3.72Å; Q468-V470 HydrophobicContact CB-CG2 4.19Å
471	L	53	Low	55.8	Low	25 Å²	25	58.5 Å²	58.5	13%	0.131	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	123.8	173.8	175.7	68.7	0	0	0	110.4	V309 L336 L340 K473	V309-L471 HydrophobicContact CG1-CD1 3.78Å; L336-L471 HydrophobicContact CD1-CD1 3.3Å; L336-L471 HydrophobicContact CD1-CD2 3.7Å; L336-L471 HydrophobicContact CD1-CG 3.99Å; L336-L471 HydrophobicContact CD2-CD1 3.73Å; L336-L471 HydrophobicContact CD2-CD2 3.06Å; L336-L471 HydrophobicContact CD2-CG 3.84Å; L336-L471 HydrophobicContact CG-CD1 4.01Å; L336-L471 HydrophobicContact CG-CD2 3.51Å; L336-L471 HydrophobicContact CG-CG 4.29Å; L340-L471 HydrophobicContact CD1-CD2 3.8Å; L471-K473 HydrophobicContact CD2-CD 4.36Å; L471-K473 HydrophobicContact CD2-CG 3.8Å; L471-K473 HydrophobicContact CG-CG 4.26Å; L471-K473 PolarHBondContact O-N 3.36Å
472	L	56.8	Low	57.9	Low	14 Å²	14	56.5 Å²	56.5	7%	0.073	29%	0.289	C	S	.	.			trans	-82.3	95	172.5	-144.8	84.5	0	0	0	110.8	V310 V312 F329 L420 L423 Q477 Y480	V310-L472 HydrophobicContact CG1-CB 4.25Å; V312-L472 HydrophobicContact CG2-CB 3.65Å; V312-L472 HydrophobicContact CG2-CD1 3.69Å; V312-L472 HydrophobicContact CG2-CG 4.17Å; F329-L472 HydrophobicContact CE1-CD1 4.23Å; F329-L472 HydrophobicContact CE1-CD2 3.86Å; L420-L472 HydrophobicContact CD1-CD2 4.49Å; L423-L472 HydrophobicContact CD1-CD2 3.73Å; L472-Q477 HydrophobicContact CD2-CB 4.33Å; L472-Q477 HydrophobicContact CD2-CG 3.34Å; L472-Q477 HydrophobicContact CG-CG 3.73Å; L472-Y480 VanDerWaalsContact CD1-CB 3.49Å; L472-Y480 HydrophobicContact CD1-CD1 4.43Å; L472-Y480 HydrophobicContact CD1-CD2 4.38Å; L472-Y480 HydrophobicContact CD1-CG 3.83Å
473	K	56.8	Low	60	Low	83 Å²	83	54.1 Å²	54.1	36%	0.361	27%	0.271	S	S	.	.			trans	-80.3	159.3	163.7	-65.5	-176.3	178.6	-179.8	0	109.8	L471 E475 N476 Q477	L471-K473 HydrophobicContact CD2-CD 4.36Å; L471-K473 HydrophobicContact CD2-CG 3.8Å; L471-K473 HydrophobicContact CG-CG 4.26Å; L471-K473 PolarHBondContact O-N 3.36Å; K473-E475 PolarHBondContact O-N 2.91Å; K473-E475 VanDerWaalsContact O-N 3.16Å; K473-N476 PolarHBondContact O-N 3.05Å; K473-Q477 WeakPolarHBondContact O-CG 3.07Å; K473-Q477 PolarHBondContact O-N 3.27Å
474	H	60.3	Low	61.8	Low	111 Å²	111	50.2 Å²	50.2	51%	0.514	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-51.3	-38.4	172.7	-163.1	-74.8	0	0	0	111.5	D452 N476	D452-H474 IonicContact OD2-CE1 3.8Å; H474-N476 VanDerWaalsContact C-N 3.25Å; H474-N476 PolarHBondContact O-N 3.06Å
475	E	60.2	Low	63.5	Low	119 Å²	119	45 Å²	45	56%	0.556	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-62.8	-25.5	176.8	-61.7	166.5	-177.4	0	0	113.7	K473	K473-E475 PolarHBondContact O-N 2.91Å; K473-E475 VanDerWaalsContact O-N 3.16Å
476	N	65.8	Low	65.6	Low	18 Å²	18	38.6 Å²	38.6	10%	0.096	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-111.4	0.5	-171.8	-52.1	-13.8	0	0	0	112.8	L456 K473 H474 D479 Y480	L456-N476 HydrophobicContact CD1-CB 3.94Å; L456-N476 WeakPolarHBondContact CD1-ND2 3.38Å; L456-N476 WeakPolarHBondContact CD1-OD1 3.25Å; L456-N476 WeakPolarHBondContact CD2-OD1 3.5Å; L456-N476 WeakPolarHBondContact CG-OD1 3.3Å; K473-N476 PolarHBondContact O-N 3.05Å; H474-N476 VanDerWaalsContact C-N 3.25Å; H474-N476 PolarHBondContact O-N 3.06Å; N476-D479 WeakPolarHBondContact O-CB 3.44Å; N476-D479 PolarHBondContact O-N 2.96Å; N476-Y480 PolarHBondContact O-N 3.47Å; N476-Y480 VanDerWaalsContact O-N 3.16Å
477	Q	70.1	Confident	67.3	Low	14 Å²	14	33.7 Å²	33.7	7%	0.065	16%	0.156	C	C	.	.	H	α-helix	trans	-62.7	-49.1	-176.3	-88.3	165.4	6.7	0	0	111.6	L423 Y445 L472 K473 D479 Y480 C481	L423-Q477 HydrophobicContact CD1-CG 4.39Å; Y445-Q477 HydrophobicContact CE1-CB 4.17Å; Y445-Q477 VanDerWaalsContact OH-CB 3.32Å; Y445-Q477 WeakPolarHBondContact OH-CB 3.27Å; Y445-Q477 WeakPolarHBondContact OH-CG 3.35Å; Y445-Q477 PolarHBondContact OH-OE1 3.27Å; L472-Q477 HydrophobicContact CD2-CB 4.33Å; L472-Q477 HydrophobicContact CD2-CG 3.34Å; L472-Q477 HydrophobicContact CG-CG 3.73Å; K473-Q477 WeakPolarHBondContact O-CG 3.07Å; K473-Q477 PolarHBondContact O-N 3.27Å; Q477-D479 PolarHBondContact O-N 3.18Å; Q477-Y480 PolarHBondContact O-N 3.25Å; Q477-C481 PolarHBondContact O-N 2.88Å; Q477-C481 PolarHBondContact O-SG 2.87Å
478	I	75.1	Confident	69	Low	5 Å²	5	28.5 Å²	28.5	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-38.3	179.4	-66.6	171.2	0	0	0	110.5	N449 D452 V453 C481 I482	N449-I478 HydrophobicContact CB-CD1 4.38Å; N449-I478 VanDerWaalsContact O-CD1 3.25Å; N449-I478 WeakPolarHBondContact O-CD1 3.27Å; D452-I478 WeakPolarHBondContact O-CD1 3.49Å; V453-I478 HydrophobicContact CB-CD1 4.42Å; V453-I478 HydrophobicContact CG1-CG2 4.35Å; V453-I478 HydrophobicContact CG2-CD1 4.05Å; V453-I478 HydrophobicContact CG2-CG2 4.3Å; I478-C481 WeakPolarHBondContact O-CB 3.27Å; I478-C481 PolarHBondContact O-N 3.22Å; I478-C481 VanDerWaalsContact O-N 3.14Å; I478-I482 HydrophobicContact CG2-CD1 3.86Å; I478-I482 HydrophobicContact CG2-CG1 4.36Å; I478-I482 WeakPolarHBondContact O-CG1 3.44Å; I478-I482 PolarHBondContact O-N 3.07Å
479	D	73.8	Confident	70.7	Confident	8 Å²	8	26.5 Å²	26.5	4%	0.043	13%	0.127	C	C	.	.	H	α-helix	trans	-59.5	-51	178.4	-178.2	39.8	0	0	0	112.2	N476 Q477 C481 I482 R483 Y516	N476-D479 WeakPolarHBondContact O-CB 3.44Å; N476-D479 PolarHBondContact O-N 2.96Å; Q477-D479 PolarHBondContact O-N 3.18Å; D479-C481 VanDerWaalsContact C-N 3.27Å; D479-C481 PolarHBondContact O-N 2.79Å; D479-I482 PolarHBondContact O-N 2.84Å; D479-I482 VanDerWaalsContact O-N 3.15Å; D479-R483 WeakPolarHBondContact O-CG 3.34Å; D479-R483 PolarHBondContact O-N 3.16Å; D479-R483 IonicContact OD2-NE 2.69Å; D479-Y516 WeakPolarHBondContact OD1-CE2 3.38Å; D479-Y516 PolarHBondContact OD1-OH 3.4Å; D479-Y516 WeakPolarHBondContact OD2-CE2 3.43Å; D479-Y516 VanDerWaalsContact OD2-CZ 3.28Å; D479-Y516 PolarHBondContact OD2-OH 3.16Å
480	Y	73.4	Confident	72.2	Confident	5 Å²	5	23.4 Å²	23.4	2%	0.02	11%	0.114	C	C	.	.	H	α-helix	trans	-56.4	-41.9	173.3	168.6	-85.4	0	0	0	112.3	V312 L314 P327 F329 L423 L472 N476 Q477 I482 R483 S484	V312-Y480 HydrophobicContact CG1-CD2 3.42Å; V312-Y480 VanDerWaalsContact CG1-CD2 3.42Å; V312-Y480 HydrophobicContact CG1-CE2 3.24Å; V312-Y480 HydrophobicContact CG1-CG 4.42Å; L314-Y480 HydrophobicContact CD1-CD2 4.2Å; L314-Y480 HydrophobicContact CG-CD2 4.25Å; P327-Y480 HydrophobicContact CB-CE2 3.85Å; P327-Y480 WeakPolarHBondContact CB-OH 3.47Å; P327-Y480 WeakPolarHBondContact CG-OH 3.32Å; F329-Y480 HydrophobicContact CE1-CD1 4.24Å; F329-Y480 HydrophobicContact CE1-CE1 4.03Å; F329-Y480 HydrophobicContact CE1-CE2 4.34Å; F329-Y480 AromaticContact CE1-CZ 4Å; F329-Y480 HydrophobicContact CE2-CD1 4.29Å; F329-Y480 AromaticContact CE2-CE1 3.37Å; F329-Y480 HydrophobicContact CE2-CE1 3.37Å; F329-Y480 HydrophobicContact CE2-CE2 4.34Å; F329-Y480 AromaticContact CE2-CZ 3.33Å; F329-Y480 WeakPolarHBondContact CE2-OH 3.48Å; F329-Y480 AromaticContact CZ-CD1 3.46Å; F329-Y480 HydrophobicContact CZ-CD1 3.46Å; F329-Y480 VanDerWaalsContact CZ-CD1 3.46Å; F329-Y480 HydrophobicContact CZ-CD2 4.35Å; F329-Y480 AromaticContact CZ-CE1 2.96Å; F329-Y480 HydrophobicContact CZ-CE1 2.96Å; F329-Y480 AromaticContact CZ-CE2 3.89Å; F329-Y480 HydrophobicContact CZ-CE2 3.89Å; F329-Y480 HydrophobicContact CZ-CG 4.13Å; F329-Y480 AromaticContact CZ-CZ 3.13Å; F329-Y480 WeakPolarHBondContact CZ-OH 3.19Å; L423-Y480 HydrophobicContact CD2-CD1 4.49Å; L472-Y480 VanDerWaalsContact CD1-CB 3.49Å; L472-Y480 HydrophobicContact CD1-CD1 4.43Å; L472-Y480 HydrophobicContact CD1-CD2 4.38Å; L472-Y480 HydrophobicContact CD1-CG 3.83Å; N476-Y480 PolarHBondContact O-N 3.47Å; N476-Y480 VanDerWaalsContact O-N 3.16Å; Q477-Y480 PolarHBondContact O-N 3.25Å; Y480-I482 VanDerWaalsContact C-N 3.3Å; Y480-I482 PolarHBondContact O-N 2.96Å; Y480-R483 PolarHBondContact O-N 3.06Å; Y480-S484 WeakPolarHBondContact CE1-OG 3.45Å; Y480-S484 WeakPolarHBondContact O-CB 3.32Å; Y480-S484 PolarHBondContact O-N 2.76Å; Y480-S484 PolarHBondContact O-OG 3.13Å; Y480-S484 PolarHBondContact OH-OG 3.19Å
481	C	79.1	Confident	73.5	Confident	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.7	-42.3	178.4	-65.6	0	0	0	0	111.6	L423 Y445 V446 Q477 I478 D479 S484 L485	L423-C481 WeakPolarHBondContact CD2-SG 3.23Å; Y445-C481 WeakPolarHBondContact CD1-SG 3.29Å; Y445-C481 VanDerWaalsContact CE1-SG 3.58Å; V446-C481 HydrophobicContact CG2-CB 3.44Å; V446-C481 VanDerWaalsContact CG2-CB 3.44Å; Q477-C481 PolarHBondContact O-N 2.88Å; Q477-C481 PolarHBondContact O-SG 2.87Å; I478-C481 WeakPolarHBondContact O-CB 3.27Å; I478-C481 PolarHBondContact O-N 3.22Å; I478-C481 VanDerWaalsContact O-N 3.14Å; D479-C481 VanDerWaalsContact C-N 3.27Å; D479-C481 PolarHBondContact O-N 2.79Å; C481-S484 PolarHBondContact O-N 3.39Å; C481-L485 VanDerWaalsContact O-CB 3.27Å; C481-L485 WeakPolarHBondContact O-CB 3.31Å; C481-L485 VanDerWaalsContact O-CG 3.24Å; C481-L485 WeakPolarHBondContact O-CG 3.46Å; C481-L485 PolarHBondContact O-N 3.26Å
482	I	81.8	Confident	74.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.2	-49	178.8	-69	168.3	0	0	0	109.9	L455 I478 D479 Y480 S484 L485 I486 L512 V515 L615 F619	L455-I482 HydrophobicContact CD2-CD1 4.47Å; I478-I482 HydrophobicContact CG2-CD1 3.86Å; I478-I482 HydrophobicContact CG2-CG1 4.36Å; I478-I482 WeakPolarHBondContact O-CG1 3.44Å; I478-I482 PolarHBondContact O-N 3.07Å; D479-I482 PolarHBondContact O-N 2.84Å; D479-I482 VanDerWaalsContact O-N 3.15Å; Y480-I482 VanDerWaalsContact C-N 3.3Å; Y480-I482 PolarHBondContact O-N 2.96Å; I482-S484 VanDerWaalsContact C-N 3.29Å; I482-S484 PolarHBondContact O-N 3.13Å; I482-L485 WeakPolarHBondContact O-CB 3.44Å; I482-L485 PolarHBondContact O-N 3.47Å; I482-I486 HydrophobicContact CG2-CD1 4.16Å; I482-I486 WeakPolarHBondContact O-CG1 3.12Å; I482-I486 PolarHBondContact O-N 2.9Å; I482-L512 HydrophobicContact CG2-CB 4.13Å; I482-L512 HydrophobicContact CG2-CD2 4.19Å; I482-V515 HydrophobicContact CD1-CG2 4.22Å; I482-V515 HydrophobicContact CG2-CB 4.09Å; I482-V515 HydrophobicContact CG2-CG1 4.44Å; I482-V515 HydrophobicContact CG2-CG2 4Å; I482-L615 HydrophobicContact CD1-CD1 4.21Å; I482-F619 HydrophobicContact CD1-CE2 4.37Å; I482-F619 HydrophobicContact CG1-CE2 4.36Å; I482-F619 HydrophobicContact CG1-CZ 4.1Å
483	R	79.3	Confident	76.1	Confident	24 Å²	24	23.1 Å²	23.1	9%	0.091	11%	0.109	C	C	.	.	H	α-helix	trans	-56.8	-44.7	176.6	-62	-170.7	175.4	-169.5	-0.6	111.5	L314 D479 Y480 I486 C487 Y516 W520	L314-R483 VanDerWaalsContact CD2-NH1 3.35Å; D479-R483 WeakPolarHBondContact O-CG 3.34Å; D479-R483 PolarHBondContact O-N 3.16Å; D479-R483 IonicContact OD2-NE 2.69Å; Y480-R483 PolarHBondContact O-N 3.06Å; R483-I486 WeakPolarHBondContact O-CB 3.44Å; R483-I486 PolarHBondContact O-N 2.95Å; R483-C487 PolarHBondContact O-N 2.69Å; R483-C487 PolarHBondContact O-SG 2.81Å; R483-C487 VanDerWaalsContact O-SG 3.36Å; R483-Y516 VanDerWaalsContact CZ-CE2 3.48Å; R483-W520 HydrophobicContact CB-CH2 4.11Å; R483-W520 HydrophobicContact CB-CZ2 4.14Å; R483-W520 HydrophobicContact CG-CH2 4.38Å; R483-W520 HydrophobicContact CG-CZ2 3.95Å
484	S	77.9	Confident	76.6	Confident	6 Å²	6	21.9 Å²	21.9	4%	0.042	12%	0.119	C	C	.	.	H	α-helix	trans	-68.5	-37.3	179.3	-58.1	0	0	0	0	112.5	Y480 C481 I482 C487 C488	Y480-S484 WeakPolarHBondContact CE1-OG 3.45Å; Y480-S484 WeakPolarHBondContact O-CB 3.32Å; Y480-S484 PolarHBondContact O-N 2.76Å; Y480-S484 PolarHBondContact O-OG 3.13Å; Y480-S484 PolarHBondContact OH-OG 3.19Å; C481-S484 PolarHBondContact O-N 3.39Å; I482-S484 VanDerWaalsContact C-N 3.29Å; I482-S484 PolarHBondContact O-N 3.13Å; S484-C487 WeakPolarHBondContact O-CB 3.23Å; S484-C487 PolarHBondContact O-N 2.94Å; S484-C488 PolarHBondContact O-N 2.96Å; S484-C488 PolarHBondContact O-SG 3.29Å
485	L	84.2	Confident	76.9	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-63.4	-40.2	174.6	-82.7	166.7	0	0	0	111.8	G439 L442 L443 V446 C481 I482 C487 C488 L489 L512 F619 F630	G439-L485 WeakPolarHBondContact O-CD2 3.36Å; L442-L485 HydrophobicContact CB-CD1 4.33Å; L442-L485 HydrophobicContact CB-CD2 3.74Å; L442-L485 HydrophobicContact CB-CG 3.77Å; L442-L485 HydrophobicContact CD1-CD2 4.38Å; L442-L485 HydrophobicContact CD1-CG 4.19Å; L443-L485 HydrophobicContact CB-CD2 4.34Å; V446-L485 HydrophobicContact CG2-CD1 4.15Å; C481-L485 VanDerWaalsContact O-CB 3.27Å; C481-L485 WeakPolarHBondContact O-CB 3.31Å; C481-L485 VanDerWaalsContact O-CG 3.24Å; C481-L485 WeakPolarHBondContact O-CG 3.46Å; C481-L485 PolarHBondContact O-N 3.26Å; I482-L485 WeakPolarHBondContact O-CB 3.44Å; I482-L485 PolarHBondContact O-N 3.47Å; L485-C487 VanDerWaalsContact C-N 3.32Å; L485-C487 PolarHBondContact O-N 2.88Å; L485-C488 PolarHBondContact O-N 3.46Å; L485-L489 WeakPolarHBondContact O-CB 3.49Å; L485-L489 WeakPolarHBondContact O-CG 3.5Å; L485-L489 PolarHBondContact O-N 3.41Å; L485-L512 HydrophobicContact CB-CD1 4.11Å; L485-F619 HydrophobicContact CD1-CE1 4.27Å; L485-F630 HydrophobicContact CD2-CE2 4.29Å; L485-F630 HydrophobicContact CD2-CZ 4.15Å
486	I	85.1	Confident	76.9	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.5	-48.1	173.6	-66.8	163.8	0	0	0	109.5	I482 R483 C488 L489 A490 L512 M513 W520 L523	I482-I486 HydrophobicContact CG2-CD1 4.16Å; I482-I486 WeakPolarHBondContact O-CG1 3.12Å; I482-I486 PolarHBondContact O-N 2.9Å; R483-I486 WeakPolarHBondContact O-CB 3.44Å; R483-I486 PolarHBondContact O-N 2.95Å; I486-C488 PolarHBondContact O-N 3.33Å; I486-L489 PolarHBondContact O-N 2.95Å; I486-A490 VanDerWaalsContact O-CB 3.28Å; I486-A490 WeakPolarHBondContact O-CB 3.31Å; I486-A490 PolarHBondContact O-N 3.44Å; I486-L512 HydrophobicContact CD1-CB 3.87Å; I486-L512 HydrophobicContact CG1-CB 3.52Å; I486-L512 HydrophobicContact CG1-CD1 4.17Å; I486-M513 HydrophobicContact CD1-CG 4.23Å; I486-M513 HydrophobicContact CG2-CG 4.15Å; I486-W520 HydrophobicContact CB-CH2 4.28Å; I486-W520 HydrophobicContact CB-CZ3 4.45Å; I486-W520 HydrophobicContact CD1-CD2 4.3Å; I486-W520 HydrophobicContact CD1-CH2 4.06Å; I486-W520 HydrophobicContact CD1-CZ2 3.51Å; I486-W520 HydrophobicContact CG2-CD2 4.44Å; I486-W520 HydrophobicContact CG2-CE3 4.02Å; I486-W520 HydrophobicContact CG2-CH2 4.21Å; I486-W520 HydrophobicContact CG2-CZ3 3.9Å; I486-L523 HydrophobicContact CG2-CD2 3.55Å
487	C	79.6	Confident	76.3	Confident	19 Å²	19	20 Å²	20	13%	0.128	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-45.6	177.1	-62.1	0	0	0	0	112.2	M430 R483 S484 L485 A490 K491	M430-C487 HydrophobicContact CE-CB 3.95Å; R483-C487 PolarHBondContact O-N 2.69Å; R483-C487 PolarHBondContact O-SG 2.81Å; R483-C487 VanDerWaalsContact O-SG 3.36Å; S484-C487 WeakPolarHBondContact O-CB 3.23Å; S484-C487 PolarHBondContact O-N 2.94Å; L485-C487 VanDerWaalsContact C-N 3.32Å; L485-C487 PolarHBondContact O-N 2.88Å; C487-A490 PolarHBondContact O-N 3.29Å; C487-K491 WeakPolarHBondContact O-CG 3.37Å; C487-K491 PolarHBondContact O-N 3.15Å
488	C	81.7	Confident	76	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-46.8	177.4	-66.8	0	0	0	0	111.9	F435 S484 L485 I486 K491 M492 F630	F435-C488 HydrophobicContact CB-CB 4.4Å; S484-C488 PolarHBondContact O-N 2.96Å; S484-C488 PolarHBondContact O-SG 3.29Å; L485-C488 PolarHBondContact O-N 3.46Å; I486-C488 PolarHBondContact O-N 3.33Å; C488-K491 PolarHBondContact O-N 3.36Å; C488-M492 WeakPolarHBondContact O-CG 3.49Å; C488-M492 PolarHBondContact O-N 3.31Å; C488-M492 VanDerWaalsContact O-N 3.11Å; C488-F630 HydrophobicContact CB-CE1 3.92Å; C488-F630 HydrophobicContact CB-CZ 4.25Å
489	L	85.7	Confident	75.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.2	-41.8	178.6	-73.2	170.5	0	0	0	111.7	L485 I486 K491 M492 I493 I505 H508 C509 L512 C629 F630	L485-L489 WeakPolarHBondContact O-CB 3.49Å; L485-L489 WeakPolarHBondContact O-CG 3.5Å; L485-L489 PolarHBondContact O-N 3.41Å; I486-L489 PolarHBondContact O-N 2.95Å; L489-K491 VanDerWaalsContact C-N 3.31Å; L489-K491 PolarHBondContact O-N 3.13Å; L489-M492 WeakPolarHBondContact O-CB 3.45Å; L489-M492 PolarHBondContact O-N 3.02Å; L489-I493 PolarHBondContact O-N 3.1Å; L489-I505 HydrophobicContact CB-CG2 4.15Å; L489-I505 HydrophobicContact CD2-CG2 4.35Å; L489-I505 VanDerWaalsContact O-CG2 3.23Å; L489-I505 WeakPolarHBondContact O-CG2 3.45Å; L489-H508 HydrophobicContact CD1-CB 4.24Å; L489-C509 WeakPolarHBondContact CB-SG 3.43Å; L489-L512 HydrophobicContact CD1-CD1 3.85Å; L489-C629 HydrophobicContact CD2-CB 4.03Å; L489-F630 HydrophobicContact CD2-CE1 3.75Å; L489-F630 HydrophobicContact CD2-CE2 4.14Å; L489-F630 HydrophobicContact CD2-CZ 3.49Å; L489-F630 VanDerWaalsContact CD2-CZ 3.49Å; L489-F630 HydrophobicContact CG-CE1 4.14Å; L489-F630 HydrophobicContact CG-CZ 3.75Å
490	A	83.8	Confident	74.6	Confident	3 Å²	3	32.6 Å²	32.6	3%	0.025	21%	0.207	C	C	.	.	H	α-helix	trans	-58.6	-42.2	176.2	0	0	0	0	0	111.5	C319 I486 C487 M492 I493 L523 W526	C319-A490 HydrophobicContact CB-CB 4.15Å; I486-A490 VanDerWaalsContact O-CB 3.28Å; I486-A490 WeakPolarHBondContact O-CB 3.31Å; I486-A490 PolarHBondContact O-N 3.44Å; C487-A490 PolarHBondContact O-N 3.29Å; A490-M492 VanDerWaalsContact C-N 3.31Å; A490-M492 PolarHBondContact O-N 3.01Å; A490-I493 WeakPolarHBondContact O-CB 3.49Å; A490-I493 PolarHBondContact O-N 2.94Å; A490-L523 HydrophobicContact CB-CD1 3.89Å; A490-L523 HydrophobicContact CB-CD2 4.38Å; A490-W526 HydrophobicContact CB-CZ3 4.37Å; A490-W526 WeakPolarHBondContact O-CH2 3.39Å
491	K	80.3	Confident	74.8	Confident	48 Å²	48	33.9 Å²	33.9	21%	0.209	22%	0.218	C	C	.	.	H	α-helix	trans	-69.2	-26.2	175	-69.4	-67.5	-167.3	-177.3	0	113.3	C320 E321 E323 F435 C487 C488 L489 I493	C320-K491 PolarHBondContact O-NZ 2.87Å; E321-K491 PolarHBondContact O-NZ 3.32Å; E323-K491 PolarHBondContact O-NZ 2.93Å; F435-K491 HydrophobicContact CB-CB 4.29Å; F435-K491 HydrophobicContact CD1-CB 4.07Å; F435-K491 HydrophobicContact CD1-CG 4.13Å; F435-K491 HydrophobicContact CD2-CB 3.59Å; F435-K491 HydrophobicContact CD2-CG 4.08Å; F435-K491 HydrophobicContact CE1-CB 4.33Å; F435-K491 HydrophobicContact CE1-CG 3.92Å; F435-K491 HydrophobicContact CE2-CB 3.87Å; F435-K491 HydrophobicContact CE2-CD 4.27Å; F435-K491 HydrophobicContact CE2-CG 3.85Å; F435-K491 HydrophobicContact CG-CB 3.7Å; F435-K491 HydrophobicContact CG-CG 4.22Å; F435-K491 HydrophobicContact CZ-CB 4.24Å; F435-K491 HydrophobicContact CZ-CD 4.29Å; F435-K491 HydrophobicContact CZ-CG 3.77Å; C487-K491 WeakPolarHBondContact O-CG 3.37Å; C487-K491 PolarHBondContact O-N 3.15Å; C488-K491 PolarHBondContact O-N 3.36Å; L489-K491 VanDerWaalsContact C-N 3.31Å; L489-K491 PolarHBondContact O-N 3.13Å; K491-I493 PolarHBondContact O-N 3.13Å
492	M	82.2	Confident	75.1	Confident	8 Å²	8	34.8 Å²	34.8	4%	0.039	22%	0.223	C	C	.	.	H	α-helix	trans	-66.9	-22.9	174.2	-69.7	-55.4	-59.3	0	0	113.3	F435 A436 C488 L489 A490 G494 S495 N496 I505 F630	F435-M492 HydrophobicContact CB-SD 4.44Å; A436-M492 HydrophobicContact CB-CE 4.5Å; A436-M492 HydrophobicContact CB-SD 4.13Å; C488-M492 WeakPolarHBondContact O-CG 3.49Å; C488-M492 PolarHBondContact O-N 3.31Å; C488-M492 VanDerWaalsContact O-N 3.11Å; L489-M492 WeakPolarHBondContact O-CB 3.45Å; L489-M492 PolarHBondContact O-N 3.02Å; A490-M492 VanDerWaalsContact C-N 3.31Å; A490-M492 PolarHBondContact O-N 3.01Å; M492-G494 PolarHBondContact O-N 3.17Å; M492-S495 WeakPolarHBondContact CE-OG 3.37Å; M492-S495 PolarHBondContact O-N 2.88Å; M492-S495 PolarHBondContact O-OG 3.48Å; M492-N496 PolarHBondContact O-N 2.87Å; M492-I505 HydrophobicContact CB-CD1 4.13Å; M492-F630 HydrophobicContact CG-CD1 3.78Å; M492-F630 HydrophobicContact CG-CE1 4.02Å; M492-F630 HydrophobicContact SD-CD1 4.34Å
493	I	81.4	Confident	75.3	Confident	14 Å²	14	35.2 Å²	35.2	7%	0.072	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-42.5	179.8	-70.6	169.1	0	0	0	111.8	L489 A490 K491 S495 L502 I505 I506 W526 F527 I530	L489-I493 PolarHBondContact O-N 3.1Å; A490-I493 WeakPolarHBondContact O-CB 3.49Å; A490-I493 PolarHBondContact O-N 2.94Å; K491-I493 PolarHBondContact O-N 3.13Å; I493-S495 VanDerWaalsContact C-N 3.28Å; I493-S495 PolarHBondContact O-N 2.8Å; I493-L502 HydrophobicContact CB-CD1 3.87Å; I493-L502 HydrophobicContact CG1-CD1 3.77Å; I493-L502 HydrophobicContact CG2-CD1 3.49Å; I493-L502 VanDerWaalsContact CG2-CD1 3.49Å; I493-I505 HydrophobicContact CD1-CG2 4.19Å; I493-I505 HydrophobicContact CG1-CB 4.41Å; I493-I505 HydrophobicContact CG1-CG2 3.61Å; I493-I506 HydrophobicContact CD1-CG1 3.7Å; I493-I506 HydrophobicContact CG1-CG1 4.26Å; I493-W526 HydrophobicContact CB-CH2 3.72Å; I493-W526 HydrophobicContact CB-CZ3 4.21Å; I493-W526 HydrophobicContact CD1-CH2 4.09Å; I493-W526 HydrophobicContact CD1-CZ3 3.66Å; I493-W526 HydrophobicContact CG1-CH2 4.48Å; I493-W526 HydrophobicContact CG2-CH2 3.52Å; I493-W526 HydrophobicContact CG2-CZ2 3.98Å; I493-W526 HydrophobicContact CG2-CZ3 4.19Å; I493-F527 HydrophobicContact CD1-CD1 4.2Å; I493-F527 HydrophobicContact CD1-CE1 3.41Å; I493-F527 VanDerWaalsContact CD1-CE1 3.41Å; I493-F527 HydrophobicContact CD1-CZ 4.09Å; I493-I530 HydrophobicContact CG2-CD1 3.69Å
494	G	68.8	Low	75.7	Confident	56 Å²	56	37 Å²	37	58%	0.577	24%	0.236	S	C	*	.	H	α-helix	trans	-70	-22	178.5	0	0	0	0	0	114	M492	M492-G494 PolarHBondContact O-N 3.17Å
495	S	65.2	Low	76.2	Confident	77 Å²	77	36.7 Å²	36.7	54%	0.538	23%	0.234	S	C	.	.	H	α-helix	trans	-93.8	-15.8	-173.6	71	0	0	0	0	115.2	M492 I493	M492-S495 WeakPolarHBondContact CE-OG 3.37Å; M492-S495 PolarHBondContact O-N 2.88Å; M492-S495 PolarHBondContact O-OG 3.48Å; I493-S495 VanDerWaalsContact C-N 3.28Å; I493-S495 PolarHBondContact O-N 2.8Å
496	N	60.4	Low	76.5	Confident	21 Å²	21	36.6 Å²	36.6	11%	0.112	23%	0.234	C	C	.	.			trans	-103.9	120.1	-170.1	-98.1	-38.8	0	0	0	113.1	M492 I505	M492-N496 PolarHBondContact O-N 2.87Å; N496-I505 HydrophobicContact CB-CD1 4.42Å; N496-I505 WeakPolarHBondContact ND2-CD1 3.34Å
497	S	53	Low	76.7	Confident	110 Å²	110	36.6 Å²	36.6	77%	0.769	23%	0.234	S	C	*	.			trans	-83.3	-10.5	-176.5	66.3	0	0	0	0	115.5
498	K	64.4	Low	77.3	Confident	129 Å²	129	35.8 Å²	35.8	56%	0.561	23%	0.228	S	C	*	.			trans	-98.7	121.9	-175.9	-66.1	-175.5	-176	175	0	111.7	A500 A501 L502	K498-A500 PolarHBondContact O-N 3.1Å; K498-A501 HydrophobicContact CB-CB 4.49Å; K498-A501 PolarHBondContact O-N 3.37Å; K498-L502 PolarHBondContact O-N 3.43Å
499	T	59.8	Low	77.7	Confident	96 Å²	96	35.8 Å²	35.8	59%	0.589	23%	0.228	S	C	*	.	H	α-helix	trans	-54.8	-40.5	-177.8	45.6	0	0	0	0	114.7	L502 D503 R534	T499-L502 PolarHBondContact O-N 2.96Å; T499-D503 PolarHBondContact O-N 2.88Å; T499-R534 PolarHBondContact O-NH2 3.16Å
500	A	60.1	Low	77.9	Confident	68 Å²	68	35.9 Å²	35.9	56%	0.562	23%	0.229	S	C	*	.	H	α-helix	trans	-68.8	-37.8	-180	0	0	0	0	0	113	K498 L502 D504	K498-A500 PolarHBondContact O-N 3.1Å; A500-L502 VanDerWaalsContact C-N 3.29Å; A500-L502 PolarHBondContact O-N 3.45Å; A500-D504 PolarHBondContact O-N 3.24Å
501	A	76.9	Confident	78.3	Confident	31 Å²	31	35.7 Å²	35.7	26%	0.256	23%	0.227	S	C	.	.	H	α-helix	trans	-70	-31.6	176.5	0	0	0	0	0	111.5	K498 D504 I505	K498-A501 HydrophobicContact CB-CB 4.49Å; K498-A501 PolarHBondContact O-N 3.37Å; A501-D504 PolarHBondContact O-N 3.19Å; A501-I505 WeakPolarHBondContact O-CD1 3.49Å; A501-I505 WeakPolarHBondContact O-CG1 3.35Å; A501-I505 PolarHBondContact O-N 3.47Å
502	L	84.8	Confident	78.7	Confident	20 Å²	20	33.5 Å²	33.5	11%	0.105	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-41.8	177.9	179.2	58.9	0	0	0	112.1	I493 K498 T499 A500 I505 I506 I530	I493-L502 HydrophobicContact CB-CD1 3.87Å; I493-L502 HydrophobicContact CG1-CD1 3.77Å; I493-L502 HydrophobicContact CG2-CD1 3.49Å; I493-L502 VanDerWaalsContact CG2-CD1 3.49Å; K498-L502 PolarHBondContact O-N 3.43Å; T499-L502 PolarHBondContact O-N 2.96Å; A500-L502 VanDerWaalsContact C-N 3.29Å; A500-L502 PolarHBondContact O-N 3.45Å; L502-I505 PolarHBondContact O-N 3.25Å; L502-I506 HydrophobicContact CD1-CD1 4.03Å; L502-I506 HydrophobicContact CD1-CG1 4.34Å; L502-I506 HydrophobicContact CG-CD1 4.08Å; L502-I506 WeakPolarHBondContact O-CG1 3.44Å; L502-I506 PolarHBondContact O-N 2.99Å; L502-I530 HydrophobicContact CD2-CG2 4.39Å
503	D	87.1	Confident	79	Confident	8 Å²	8	33.1 Å²	33.1	4%	0.043	22%	0.216	C	C	.	.	H	α-helix	trans	-66.9	-38	176.8	-67.8	-10.8	0	0	0	111.8	T499 I506 G507 R534 F537 T538	T499-D503 PolarHBondContact O-N 2.88Å; D503-I506 PolarHBondContact O-N 3.28Å; D503-G507 PolarHBondContact O-N 2.91Å; D503-R534 IonicContact OD1-CZ 2.65Å; D503-R534 IonicContact OD1-NH1 3.5Å; D503-R534 PolarHBondContact OD1-NH1 3.48Å; D503-R534 IonicContact OD1-NH2 3.13Å; D503-R534 PolarHBondContact OD1-NH2 3.36Å; D503-R534 IonicContact OD2-NH2 2.81Å; D503-R534 PolarHBondContact OD2-NH2 3.36Å; D503-F537 HydrophobicContact CB-CD2 4.09Å; D503-F537 HydrophobicContact CB-CE2 4.15Å; D503-F537 WeakPolarHBondContact O-CE2 3.15Å; D503-T538 WeakPolarHBondContact CB-O 3.43Å; D503-T538 PolarHBondContact OD2-N 3.49Å
504	D	87.5	Confident	79.3	Confident	61 Å²	61	32.7 Å²	32.7	33%	0.326	21%	0.214	S	C	.	.	H	α-helix	trans	-62.3	-42.8	174.2	-74.7	-22.7	0	0	0	111.5	A500 A501 G507 H508	A500-D504 PolarHBondContact O-N 3.24Å; A501-D504 PolarHBondContact O-N 3.19Å; D504-G507 PolarHBondContact O-N 2.94Å; D504-H508 WeakPolarHBondContact O-CB 3.5Å; D504-H508 PolarHBondContact O-CD2 3.43Å; D504-H508 PolarHBondContact O-N 3.35Å
505	I	88.6	Confident	79.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.1	-50.8	176.6	-67.6	161.2	0	0	0	110.8	L489 M492 I493 N496 A501 L502 G507 H508 C509 C629	L489-I505 HydrophobicContact CB-CG2 4.15Å; L489-I505 HydrophobicContact CD2-CG2 4.35Å; L489-I505 VanDerWaalsContact O-CG2 3.23Å; L489-I505 WeakPolarHBondContact O-CG2 3.45Å; M492-I505 HydrophobicContact CB-CD1 4.13Å; I493-I505 HydrophobicContact CD1-CG2 4.19Å; I493-I505 HydrophobicContact CG1-CB 4.41Å; I493-I505 HydrophobicContact CG1-CG2 3.61Å; N496-I505 HydrophobicContact CB-CD1 4.42Å; N496-I505 WeakPolarHBondContact ND2-CD1 3.34Å; A501-I505 WeakPolarHBondContact O-CD1 3.49Å; A501-I505 WeakPolarHBondContact O-CG1 3.35Å; A501-I505 PolarHBondContact O-N 3.47Å; L502-I505 PolarHBondContact O-N 3.25Å; I505-G507 VanDerWaalsContact C-N 3.32Å; I505-G507 PolarHBondContact O-N 3.4Å; I505-H508 PolarHBondContact O-N 3.41Å; I505-C509 PolarHBondContact O-N 3Å; I505-C509 PolarHBondContact O-SG 3.08Å; I505-C629 HydrophobicContact CD1-CB 4.46Å; I505-C629 HydrophobicContact CG1-CB 3.7Å
506	I	89.9	Confident	80.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-42.1	-179.8	-66.8	167.5	0	0	0	110.4	I493 L502 D503 C509 I510 F527 I530 W531 F537	I493-I506 HydrophobicContact CD1-CG1 3.7Å; I493-I506 HydrophobicContact CG1-CG1 4.26Å; L502-I506 HydrophobicContact CD1-CD1 4.03Å; L502-I506 HydrophobicContact CD1-CG1 4.34Å; L502-I506 HydrophobicContact CG-CD1 4.08Å; L502-I506 WeakPolarHBondContact O-CG1 3.44Å; L502-I506 PolarHBondContact O-N 2.99Å; D503-I506 PolarHBondContact O-N 3.28Å; I506-C509 WeakPolarHBondContact O-CB 3.36Å; I506-C509 PolarHBondContact O-N 2.95Å; I506-I510 HydrophobicContact CG2-CD1 3.9Å; I506-I510 WeakPolarHBondContact O-CG1 3.43Å; I506-I510 PolarHBondContact O-N 2.95Å; I506-F527 HydrophobicContact CG1-CD1 4.41Å; I506-F527 HydrophobicContact CG1-CE1 4.42Å; I506-F527 HydrophobicContact CG2-CB 4.46Å; I506-F527 HydrophobicContact CG2-CD1 4.46Å; I506-F527 HydrophobicContact CG2-CD2 3.84Å; I506-F527 HydrophobicContact CG2-CE2 4.13Å; I506-F527 HydrophobicContact CG2-CG 4.02Å; I506-I530 HydrophobicContact CD1-CD1 4.44Å; I506-I530 HydrophobicContact CD1-CG2 4.07Å; I506-W531 HydrophobicContact CG2-CZ2 3.77Å; I506-F537 HydrophobicContact CB-CE2 3.91Å; I506-F537 HydrophobicContact CG2-CD2 4.46Å; I506-F537 HydrophobicContact CG2-CE2 3.73Å; I506-F537 HydrophobicContact CG2-CZ 4.09Å
507	G	90.7	Very high	81	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62	-43.5	176.8	0	0	0	0	0	112.8	D503 D504 I505 I510 V511	D503-G507 PolarHBondContact O-N 2.91Å; D504-G507 PolarHBondContact O-N 2.94Å; I505-G507 VanDerWaalsContact C-N 3.32Å; I505-G507 PolarHBondContact O-N 3.4Å; G507-I510 PolarHBondContact O-N 3.5Å; G507-V511 WeakPolarHBondContact O-CG2 3.33Å; G507-V511 PolarHBondContact O-N 3.12Å; G507-V511 VanDerWaalsContact O-N 3.13Å
508	H	91.4	Very high	82.3	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-64.8	-40.5	174	-67.3	-34.4	0	0	0	112.3	L489 D504 I505 I510 V511 L512 Y539 F618	L489-H508 HydrophobicContact CD1-CB 4.24Å; D504-H508 WeakPolarHBondContact O-CB 3.5Å; D504-H508 PolarHBondContact O-CD2 3.43Å; D504-H508 PolarHBondContact O-N 3.35Å; I505-H508 PolarHBondContact O-N 3.41Å; H508-I510 PolarHBondContact O-N 3.42Å; H508-V511 PolarHBondContact O-N 3.22Å; H508-L512 WeakPolarHBondContact O-CG 3.26Å; H508-L512 PolarHBondContact O-N 3.46Å; H508-Y539 AromaticContact CE1-CE2 3.95Å; H508-Y539 PolarHBondContact CE1-OH 3.48Å; H508-Y539 AromaticContact ND1-CE2 3.85Å; H508-Y539 AromaticContact ND1-CZ 3.77Å; H508-Y539 PolarHBondContact ND1-OH 3.28Å; H508-F618 HydrophobicContact CB-CZ 4.1Å; H508-F618 AromaticContact CG-CZ 3.98Å; H508-F618 AromaticContact ND1-CE2 3.48Å; H508-F618 WeakPolarHBondContact ND1-CE2 3.43Å; H508-F618 AromaticContact ND1-CZ 3.4Å; H508-F618 WeakPolarHBondContact ND1-CZ 3.45Å
509	C	89.6	Confident	82.9	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-57.3	-47.7	172.2	-77	0	0	0	0	111.6	L489 I505 I506 V511 L512 M513 F527	L489-C509 WeakPolarHBondContact CB-SG 3.43Å; I505-C509 PolarHBondContact O-N 3Å; I505-C509 PolarHBondContact O-SG 3.08Å; I506-C509 WeakPolarHBondContact O-CB 3.36Å; I506-C509 PolarHBondContact O-N 2.95Å; C509-V511 VanDerWaalsContact C-N 3.29Å; C509-V511 PolarHBondContact O-N 2.64Å; C509-L512 CarbonylContact O-C 3.6Å; C509-L512 PolarHBondContact O-N 2.84Å; C509-L512 VanDerWaalsContact O-N 3.1Å; C509-M513 HydrophobicContact CB-SD 4.23Å; C509-M513 WeakPolarHBondContact O-CB 2.98Å; C509-M513 WeakPolarHBondContact O-CG 3.15Å; C509-M513 PolarHBondContact O-N 3.36Å; C509-F527 HydrophobicContact CB-CE2 3.8Å; C509-F527 HydrophobicContact CB-CZ 3.68Å
510	I	90.8	Very high	83.8	Confident	2 Å²	2	17.9 Å²	17.9	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-61.7	-38.8	-178.8	-68.9	165.7	0	0	0	111.5	I506 G507 H508 L512 M513 F527 W531 F537 F542 V546 V551	I506-I510 HydrophobicContact CG2-CD1 3.9Å; I506-I510 WeakPolarHBondContact O-CG1 3.43Å; I506-I510 PolarHBondContact O-N 2.95Å; G507-I510 PolarHBondContact O-N 3.5Å; H508-I510 PolarHBondContact O-N 3.42Å; I510-L512 VanDerWaalsContact C-N 3.31Å; I510-L512 PolarHBondContact O-N 3.16Å; I510-M513 PolarHBondContact O-N 2.86Å; I510-F527 HydrophobicContact CD1-CD2 4.48Å; I510-F527 HydrophobicContact CG1-CD2 4.2Å; I510-F527 HydrophobicContact CG1-CE2 4.2Å; I510-W531 HydrophobicContact CD1-CH2 3.88Å; I510-W531 HydrophobicContact CD1-CZ2 3.69Å; I510-F537 HydrophobicContact CD1-CE1 4.47Å; I510-F537 HydrophobicContact CD1-CZ 4.23Å; I510-F542 HydrophobicContact CG2-CE2 4.12Å; I510-V546 HydrophobicContact CG2-CG2 4.1Å; I510-V551 HydrophobicContact CG2-CG1 3.82Å
511	V	91.3	Very high	84.7	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.1	-44.2	175.4	173.4	0	0	0	0	111	G507 H508 C509 Q514 Y539 V546 F618	G507-V511 WeakPolarHBondContact O-CG2 3.33Å; G507-V511 PolarHBondContact O-N 3.12Å; G507-V511 VanDerWaalsContact O-N 3.13Å; H508-V511 PolarHBondContact O-N 3.22Å; C509-V511 VanDerWaalsContact C-N 3.29Å; C509-V511 PolarHBondContact O-N 2.64Å; V511-Q514 PolarHBondContact O-NE2 2.92Å; V511-Y539 HydrophobicContact CG2-CE1 4.11Å; V511-V546 HydrophobicContact CG2-CG2 3.91Å; V511-F618 HydrophobicContact CB-CE1 4.42Å; V511-F618 HydrophobicContact CB-CE2 4.23Å; V511-F618 HydrophobicContact CB-CZ 4.14Å; V511-F618 HydrophobicContact CG1-CB 4.44Å; V511-F618 HydrophobicContact CG1-CD1 3.86Å; V511-F618 HydrophobicContact CG1-CD2 3.84Å; V511-F618 HydrophobicContact CG1-CE1 3.97Å; V511-F618 HydrophobicContact CG1-CE2 3.97Å; V511-F618 HydrophobicContact CG1-CG 3.78Å; V511-F618 HydrophobicContact CG1-CZ 4.03Å; V511-F618 HydrophobicContact CG2-CE2 4.29Å
512	L	89.1	Confident	84.9	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-73.6	-35.1	179.9	-64.1	179.3	0	0	0	113	I482 L485 I486 L489 H508 C509 I510 Q514 V515 L615 F618 F619	I482-L512 HydrophobicContact CG2-CB 4.13Å; I482-L512 HydrophobicContact CG2-CD2 4.19Å; L485-L512 HydrophobicContact CB-CD1 4.11Å; I486-L512 HydrophobicContact CD1-CB 3.87Å; I486-L512 HydrophobicContact CG1-CB 3.52Å; I486-L512 HydrophobicContact CG1-CD1 4.17Å; L489-L512 HydrophobicContact CD1-CD1 3.85Å; H508-L512 WeakPolarHBondContact O-CG 3.26Å; H508-L512 PolarHBondContact O-N 3.46Å; C509-L512 CarbonylContact O-C 3.6Å; C509-L512 PolarHBondContact O-N 2.84Å; C509-L512 VanDerWaalsContact O-N 3.1Å; I510-L512 VanDerWaalsContact C-N 3.31Å; I510-L512 PolarHBondContact O-N 3.16Å; L512-Q514 PolarHBondContact O-N 3.28Å; L512-Q514 VanDerWaalsContact O-N 3.13Å; L512-V515 WeakPolarHBondContact O-CB 3.36Å; L512-V515 WeakPolarHBondContact O-CG2 3.39Å; L512-V515 PolarHBondContact O-N 3.43Å; L512-L615 HydrophobicContact CD2-CD2 4.09Å; L512-F618 HydrophobicContact CD2-CD1 4.22Å; L512-F618 HydrophobicContact CD2-CE1 3.88Å; L512-F618 HydrophobicContact CG-CE1 4.23Å; L512-F619 HydrophobicContact CD2-CE1 4.06Å; L512-F619 HydrophobicContact CD2-CE2 4.36Å; L512-F619 HydrophobicContact CD2-CZ 3.53Å
513	M	87.8	Confident	84.8	Confident	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-64.6	-13.6	179.1	-73.5	162.9	72.9	0	0	113.6	I486 C509 I510 V515 W517 W520 L523 F524 F527	I486-M513 HydrophobicContact CD1-CG 4.23Å; I486-M513 HydrophobicContact CG2-CG 4.15Å; C509-M513 HydrophobicContact CB-SD 4.23Å; C509-M513 WeakPolarHBondContact O-CB 2.98Å; C509-M513 WeakPolarHBondContact O-CG 3.15Å; C509-M513 PolarHBondContact O-N 3.36Å; I510-M513 PolarHBondContact O-N 2.86Å; M513-V515 PolarHBondContact O-N 3.07Å; M513-W517 HydrophobicContact CE-CZ3 4.03Å; M513-W520 HydrophobicContact CB-CB 4.2Å; M513-W520 HydrophobicContact CB-CG 4.07Å; M513-W520 HydrophobicContact CE-CB 3.44Å; M513-W520 VanDerWaalsContact CE-CB 3.44Å; M513-W520 HydrophobicContact CE-CG 4.37Å; M513-W520 HydrophobicContact CG-CB 3.92Å; M513-W520 HydrophobicContact CG-CD2 4.32Å; M513-W520 HydrophobicContact CG-CG 3.84Å; M513-W520 VanDerWaalsContact O-CD1 3.25Å; M513-W520 HydrophobicContact SD-CB 4.48Å; M513-L523 HydrophobicContact CE-CB 4.27Å; M513-L523 HydrophobicContact CE-CD2 4.18Å; M513-L523 HydrophobicContact CE-CG 4.21Å; M513-L523 HydrophobicContact CG-CD2 4.41Å; M513-L523 HydrophobicContact SD-CD2 3.89Å; M513-L523 HydrophobicContact SD-CG 4.36Å; M513-F524 HydrophobicContact CE-CB 3.83Å; M513-F524 HydrophobicContact CE-CD2 4.16Å; M513-F524 HydrophobicContact CE-CG 4.5Å; M513-F527 HydrophobicContact CE-CE2 4.29Å; M513-F527 HydrophobicContact SD-CD2 4.38Å; M513-F527 HydrophobicContact SD-CE2 3.58Å; M513-F527 VanDerWaalsContact SD-CE2 3.58Å; M513-F527 HydrophobicContact SD-CZ 4.31Å
514	Q	88.5	Confident	84.8	Confident	5 Å²	5	18.4 Å²	18.4	2%	0.023	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.2	168.8	-65.3	179.3	103.5	0	0	111.5	V511 L512 Y516 Y545 V546 E548 V551 L611	V511-Q514 PolarHBondContact O-NE2 2.92Å; L512-Q514 PolarHBondContact O-N 3.28Å; L512-Q514 VanDerWaalsContact O-N 3.13Å; Q514-Y516 PolarHBondContact O-N 2.95Å; Q514-Y516 VanDerWaalsContact O-N 3.15Å; Q514-Y545 PolarHBondContact NE2-O 3.45Å; Q514-V546 VanDerWaalsContact OE1-CA 3.3Å; Q514-E548 HydrophobicContact CB-CB 4.44Å; Q514-E548 HydrophobicContact CG-CB 4.1Å; Q514-V551 HydrophobicContact CG-CG2 4.36Å; Q514-L611 HydrophobicContact CB-CD1 3.68Å
515	V	80	Confident	84.7	Confident	2 Å²	2	19.4 Å²	19.4	1%	0.012	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	107.8	170.1	-175.5	0	0	0	0	108.6	L455 I482 L512 M513 W520 L611 L615	L455-V515 HydrophobicContact CD1-CG2 4.46Å; L455-V515 HydrophobicContact CD2-CG1 3.95Å; L455-V515 HydrophobicContact CD2-CG2 4.46Å; I482-V515 HydrophobicContact CD1-CG2 4.22Å; I482-V515 HydrophobicContact CG2-CB 4.09Å; I482-V515 HydrophobicContact CG2-CG1 4.44Å; I482-V515 HydrophobicContact CG2-CG2 4Å; L512-V515 WeakPolarHBondContact O-CB 3.36Å; L512-V515 WeakPolarHBondContact O-CG2 3.39Å; L512-V515 PolarHBondContact O-N 3.43Å; M513-V515 PolarHBondContact O-N 3.07Å; V515-W520 PolarHBondContact O-NE1 2.94Å; V515-L611 HydrophobicContact CG2-CD2 4.26Å; V515-L615 HydrophobicContact CG2-CD1 3.49Å; V515-L615 VanDerWaalsContact CG2-CD1 3.49Å
516	Y	74	Confident	84.5	Confident	13 Å²	13	21.1 Å²	21.1	5%	0.051	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	40.4	-175.7	-44.8	-63.6	0	0	0	116.1	V458 D479 R483 Q514 I519	V458-Y516 HydrophobicContact CB-CD1 4.05Å; V458-Y516 HydrophobicContact CB-CE1 4.33Å; V458-Y516 HydrophobicContact CG1-CD1 3.58Å; V458-Y516 HydrophobicContact CG1-CE1 4.18Å; V458-Y516 HydrophobicContact CG1-CG 4.43Å; V458-Y516 HydrophobicContact CG2-CD1 3.4Å; V458-Y516 HydrophobicContact CG2-CE1 3.65Å; D479-Y516 WeakPolarHBondContact OD1-CE2 3.38Å; D479-Y516 PolarHBondContact OD1-OH 3.4Å; D479-Y516 WeakPolarHBondContact OD2-CE2 3.43Å; D479-Y516 VanDerWaalsContact OD2-CZ 3.28Å; D479-Y516 PolarHBondContact OD2-OH 3.16Å; R483-Y516 VanDerWaalsContact CZ-CE2 3.48Å; Q514-Y516 PolarHBondContact O-N 2.95Å; Q514-Y516 VanDerWaalsContact O-N 3.15Å; Y516-I519 HydrophobicContact CG-CD1 4.31Å; Y516-I519 VanDerWaalsContact O-CB 3.25Å; Y516-I519 WeakPolarHBondContact O-CB 3.5Å; Y516-I519 VanDerWaalsContact O-CG1 3.3Å; Y516-I519 WeakPolarHBondContact O-CG1 3.42Å; Y516-I519 PolarHBondContact O-N 3.26Å
517	W	76.3	Confident	84.4	Confident	36 Å²	36	21.1 Å²	21.1	14%	0.136	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	134.7	159.1	-168.7	-92.7	0	0	0	109.8	M513 F524 E550 V551 E554	M513-W517 HydrophobicContact CE-CZ3 4.03Å; W517-F524 HydrophobicContact CH2-CB 3.81Å; W517-F524 HydrophobicContact CH2-CD1 4.01Å; W517-F524 HydrophobicContact CH2-CD2 4.03Å; W517-F524 AromaticContact CH2-CG 3.68Å; W517-F524 HydrophobicContact CH2-CG 3.68Å; W517-F524 HydrophobicContact CZ3-CB 4.1Å; W517-F524 HydrophobicContact CZ3-CD2 4.17Å; W517-F524 HydrophobicContact CZ3-CG 4.16Å; W517-E550 PolarHBondContact NE1-OE2 2.81Å; W517-V551 HydrophobicContact CB-CG2 4.31Å; W517-V551 HydrophobicContact CD2-CG2 3.55Å; W517-V551 HydrophobicContact CE3-CG2 3.7Å; W517-V551 HydrophobicContact CG-CG2 3.81Å; W517-V551 HydrophobicContact CZ3-CG2 4.32Å; W517-E554 HydrophobicContact CH2-CG 4.46Å; W517-E554 HydrophobicContact CZ2-CG 3.82Å
518	P	80.4	Confident	84.2	Confident	77 Å²	77	22 Å²	22	50%	0.5	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	cis	-102.3	21.8	11.4	40.2	-37	0	0	0	115.5	W520 D521	P518-W520 PolarHBondContact O-N 2.92Å; P518-D521 PolarHBondContact O-N 3.32Å
519	I	76.4	Confident	84	Confident	43 Å²	43	24.3 Å²	24.3	22%	0.221	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-28	-177.6	-61.1	-177.6	0	0	0	111.8	V317 Y516 D521	V317-I519 HydrophobicContact CB-CG2 3.95Å; V317-I519 HydrophobicContact CG1-CG2 4.07Å; V317-I519 WeakPolarHBondContact CG1-O 3.23Å; V317-I519 HydrophobicContact CG2-CG2 3.56Å; Y516-I519 HydrophobicContact CG-CD1 4.31Å; Y516-I519 VanDerWaalsContact O-CB 3.25Å; Y516-I519 WeakPolarHBondContact O-CB 3.5Å; Y516-I519 VanDerWaalsContact O-CG1 3.3Å; Y516-I519 WeakPolarHBondContact O-CG1 3.42Å; Y516-I519 PolarHBondContact O-N 3.26Å; I519-D521 PolarHBondContact O-N 3.42Å
520	W	79.1	Confident	83.8	Confident	6 Å²	6	25.1 Å²	25.1	2%	0.023	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	13	-178.9	-51.7	104.7	0	0	0	115.6	V317 R483 I486 M513 V515 P518 T522 L523 F524	V317-W520 HydrophobicContact CG1-CD2 4.14Å; V317-W520 HydrophobicContact CG1-CE3 3.36Å; V317-W520 HydrophobicContact CG1-CH2 4.48Å; V317-W520 HydrophobicContact CG1-CZ3 3.57Å; V317-W520 HydrophobicContact CG2-CH2 4.44Å; V317-W520 HydrophobicContact CG2-CZ3 4.25Å; R483-W520 HydrophobicContact CB-CH2 4.11Å; R483-W520 HydrophobicContact CB-CZ2 4.14Å; R483-W520 HydrophobicContact CG-CH2 4.38Å; R483-W520 HydrophobicContact CG-CZ2 3.95Å; I486-W520 HydrophobicContact CB-CH2 4.28Å; I486-W520 HydrophobicContact CB-CZ3 4.45Å; I486-W520 HydrophobicContact CD1-CD2 4.3Å; I486-W520 HydrophobicContact CD1-CH2 4.06Å; I486-W520 HydrophobicContact CD1-CZ2 3.51Å; I486-W520 HydrophobicContact CG2-CD2 4.44Å; I486-W520 HydrophobicContact CG2-CE3 4.02Å; I486-W520 HydrophobicContact CG2-CH2 4.21Å; I486-W520 HydrophobicContact CG2-CZ3 3.9Å; M513-W520 HydrophobicContact CB-CB 4.2Å; M513-W520 HydrophobicContact CB-CG 4.07Å; M513-W520 HydrophobicContact CE-CB 3.44Å; M513-W520 VanDerWaalsContact CE-CB 3.44Å; M513-W520 HydrophobicContact CE-CG 4.37Å; M513-W520 HydrophobicContact CG-CB 3.92Å; M513-W520 HydrophobicContact CG-CD2 4.32Å; M513-W520 HydrophobicContact CG-CG 3.84Å; M513-W520 VanDerWaalsContact O-CD1 3.25Å; M513-W520 HydrophobicContact SD-CB 4.48Å; V515-W520 PolarHBondContact O-NE1 2.94Å; P518-W520 PolarHBondContact O-N 2.92Å; W520-T522 VanDerWaalsContact C-N 3.3Å; W520-T522 PolarHBondContact O-N 3.06Å; W520-L523 HydrophobicContact CE3-CD2 4.32Å; W520-L523 PolarHBondContact O-N 2.9Å; W520-L523 VanDerWaalsContact O-N 3.08Å; W520-F524 PolarHBondContact O-N 3.41Å
521	D	79.5	Confident	83.7	Confident	65 Å²	65	25 Å²	25	35%	0.348	13%	0.132	S	C	.	.	H	α-helix	trans	-54.9	-44.2	-177.2	-178.3	41.5	0	0	0	111.9	P518 I519 L523 F524 Q525	P518-D521 PolarHBondContact O-N 3.32Å; I519-D521 PolarHBondContact O-N 3.42Å; D521-L523 VanDerWaalsContact C-N 3.3Å; D521-L523 PolarHBondContact O-N 3.06Å; D521-F524 CarbonylContact O-C 3.54Å; D521-F524 WeakPolarHBondContact O-CA 3.32Å; D521-F524 WeakPolarHBondContact O-CB 3.34Å; D521-F524 PolarHBondContact O-N 3.32Å; D521-Q525 WeakPolarHBondContact O-CG 3.37Å; D521-Q525 PolarHBondContact O-N 3.31Å; D521-Q525 PolarHBondContact OD1-NE2 3.25Å
522	T	80	Confident	83.5	Confident	71 Å²	71	29 Å²	29	44%	0.436	15%	0.15	S	C	.	.	H	α-helix	trans	-55.7	-43.3	177.5	-47.9	0	0	0	0	112.6	V318 W520 Q525 W526	V318-T522 HydrophobicContact CG1-CG2 4.37Å; W520-T522 VanDerWaalsContact C-N 3.3Å; W520-T522 PolarHBondContact O-N 3.06Å; T522-Q525 PolarHBondContact O-N 3.11Å; T522-W526 PolarHBondContact O-N 2.91Å
523	L	81.9	Confident	83.3	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-68.7	-38.1	176.6	177.6	64	0	0	0	111.3	C319 I486 A490 M513 W520 D521 W526 F527	C319-L523 HydrophobicContact CB-CD1 3.84Å; I486-L523 HydrophobicContact CG2-CD2 3.55Å; A490-L523 HydrophobicContact CB-CD1 3.89Å; A490-L523 HydrophobicContact CB-CD2 4.38Å; M513-L523 HydrophobicContact CE-CB 4.27Å; M513-L523 HydrophobicContact CE-CD2 4.18Å; M513-L523 HydrophobicContact CE-CG 4.21Å; M513-L523 HydrophobicContact CG-CD2 4.41Å; M513-L523 HydrophobicContact SD-CD2 3.89Å; M513-L523 HydrophobicContact SD-CG 4.36Å; W520-L523 HydrophobicContact CE3-CD2 4.32Å; W520-L523 PolarHBondContact O-N 2.9Å; W520-L523 VanDerWaalsContact O-N 3.08Å; D521-L523 VanDerWaalsContact C-N 3.3Å; D521-L523 PolarHBondContact O-N 3.06Å; L523-W526 HydrophobicContact CD1-CE3 3.62Å; L523-W526 HydrophobicContact CD1-CZ3 4.07Å; L523-W526 WeakPolarHBondContact O-CB 3.25Å; L523-W526 PolarHBondContact O-N 3.47Å; L523-F527 HydrophobicContact CD1-CE1 3.78Å; L523-F527 HydrophobicContact CD1-CZ 3.93Å; L523-F527 HydrophobicContact CD2-CZ 4.11Å; L523-F527 HydrophobicContact CG-CE1 4.11Å; L523-F527 HydrophobicContact CG-CE2 4.27Å; L523-F527 HydrophobicContact CG-CZ 3.82Å; L523-F527 PolarHBondContact O-N 3.18Å; L523-F527 VanDerWaalsContact O-N 3.07Å
524	F	87.1	Confident	83.2	Confident	1 Å²	1	42 Å²	42	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-39.1	176.3	-166.8	-102	0	0	0	112.1	M513 W517 W520 D521 W526 F527 K528 W531 E554 I555	M513-F524 HydrophobicContact CE-CB 3.83Å; M513-F524 HydrophobicContact CE-CD2 4.16Å; M513-F524 HydrophobicContact CE-CG 4.5Å; W517-F524 HydrophobicContact CH2-CB 3.81Å; W517-F524 HydrophobicContact CH2-CD1 4.01Å; W517-F524 HydrophobicContact CH2-CD2 4.03Å; W517-F524 AromaticContact CH2-CG 3.68Å; W517-F524 HydrophobicContact CH2-CG 3.68Å; W517-F524 HydrophobicContact CZ3-CB 4.1Å; W517-F524 HydrophobicContact CZ3-CD2 4.17Å; W517-F524 HydrophobicContact CZ3-CG 4.16Å; W520-F524 PolarHBondContact O-N 3.41Å; D521-F524 CarbonylContact O-C 3.54Å; D521-F524 WeakPolarHBondContact O-CA 3.32Å; D521-F524 WeakPolarHBondContact O-CB 3.34Å; D521-F524 PolarHBondContact O-N 3.32Å; F524-W526 VanDerWaalsContact C-N 3.28Å; F524-W526 PolarHBondContact O-N 3.13Å; F524-F527 WeakPolarHBondContact O-CB 3.41Å; F524-F527 PolarHBondContact O-N 3.35Å; F524-F527 VanDerWaalsContact O-N 3.12Å; F524-K528 HydrophobicContact CD1-CD 4.42Å; F524-K528 HydrophobicContact CD1-CG 4.47Å; F524-K528 HydrophobicContact CE1-CD 4.4Å; F524-K528 HydrophobicContact CE1-CG 4.37Å; F524-K528 PolarHBondContact O-N 2.88Å; F524-W531 AromaticContact CE2-CH2 3.89Å; F524-W531 HydrophobicContact CE2-CH2 3.89Å; F524-W531 HydrophobicContact CE2-CZ3 4.31Å; F524-W531 HydrophobicContact CZ-CH2 4.06Å; F524-W531 HydrophobicContact CZ-CZ3 4.05Å; F524-E554 HydrophobicContact CD1-CB 4.48Å; F524-E554 HydrophobicContact CE1-CB 3.64Å; F524-E554 HydrophobicContact CE1-CG 4.24Å; F524-E554 HydrophobicContact CZ-CB 3.88Å; F524-I555 HydrophobicContact CE2-CG1 4.22Å; F524-I555 HydrophobicContact CZ-CG1 3.79Å
525	Q	85.4	Confident	83	Confident	82 Å²	82	46.9 Å²	46.9	38%	0.383	22%	0.22	S	C	.	.	H	α-helix	trans	-60.1	-39.5	172.2	-63.3	-60.4	-31.1	0	0	111.3	D521 T522 F527 K528 T529	D521-Q525 WeakPolarHBondContact O-CG 3.37Å; D521-Q525 PolarHBondContact O-N 3.31Å; D521-Q525 PolarHBondContact OD1-NE2 3.25Å; T522-Q525 PolarHBondContact O-N 3.11Å; Q525-F527 PolarHBondContact O-N 3.13Å; Q525-K528 WeakPolarHBondContact O-CB 3.4Å; Q525-K528 PolarHBondContact O-N 3.48Å; Q525-T529 PolarHBondContact O-N 3.15Å
526	W	85	Confident	83.4	Confident	36 Å²	36	50.2 Å²	50.2	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-42.4	173.1	-178.5	59.3	0	0	0	111.9	E321 A490 I493 T522 L523 F524 K528 T529 I530	E321-W526 HydrophobicContact CG-CZ2 3.91Å; A490-W526 HydrophobicContact CB-CZ3 4.37Å; A490-W526 WeakPolarHBondContact O-CH2 3.39Å; I493-W526 HydrophobicContact CB-CH2 3.72Å; I493-W526 HydrophobicContact CB-CZ3 4.21Å; I493-W526 HydrophobicContact CD1-CH2 4.09Å; I493-W526 HydrophobicContact CD1-CZ3 3.66Å; I493-W526 HydrophobicContact CG1-CH2 4.48Å; I493-W526 HydrophobicContact CG2-CH2 3.52Å; I493-W526 HydrophobicContact CG2-CZ2 3.98Å; I493-W526 HydrophobicContact CG2-CZ3 4.19Å; T522-W526 PolarHBondContact O-N 2.91Å; L523-W526 HydrophobicContact CD1-CE3 3.62Å; L523-W526 HydrophobicContact CD1-CZ3 4.07Å; L523-W526 WeakPolarHBondContact O-CB 3.25Å; L523-W526 PolarHBondContact O-N 3.47Å; F524-W526 VanDerWaalsContact C-N 3.28Å; F524-W526 PolarHBondContact O-N 3.13Å; W526-K528 VanDerWaalsContact C-N 3.31Å; W526-K528 PolarHBondContact O-N 2.84Å; W526-T529 WeakPolarHBondContact O-CB 3.44Å; W526-T529 PolarHBondContact O-N 3.11Å; W526-T529 PolarHBondContact O-OG1 3.38Å; W526-I530 HydrophobicContact CD2-CD1 4.07Å; W526-I530 HydrophobicContact CE3-CD1 4.27Å; W526-I530 HydrophobicContact CH2-CD1 4.34Å; W526-I530 HydrophobicContact CZ2-CD1 4.06Å; W526-I530 HydrophobicContact CZ3-CD1 4.44Å; W526-I530 PolarHBondContact O-N 2.83Å
527	F	88.6	Confident	84.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-38.5	174	-63	-14.8	0	0	0	112.8	I493 I506 C509 I510 M513 L523 F524 Q525 T529 I530 W531	I493-F527 HydrophobicContact CD1-CD1 4.2Å; I493-F527 HydrophobicContact CD1-CE1 3.41Å; I493-F527 VanDerWaalsContact CD1-CE1 3.41Å; I493-F527 HydrophobicContact CD1-CZ 4.09Å; I506-F527 HydrophobicContact CG1-CD1 4.41Å; I506-F527 HydrophobicContact CG1-CE1 4.42Å; I506-F527 HydrophobicContact CG2-CB 4.46Å; I506-F527 HydrophobicContact CG2-CD1 4.46Å; I506-F527 HydrophobicContact CG2-CD2 3.84Å; I506-F527 HydrophobicContact CG2-CE2 4.13Å; I506-F527 HydrophobicContact CG2-CG 4.02Å; C509-F527 HydrophobicContact CB-CE2 3.8Å; C509-F527 HydrophobicContact CB-CZ 3.68Å; I510-F527 HydrophobicContact CD1-CD2 4.48Å; I510-F527 HydrophobicContact CG1-CD2 4.2Å; I510-F527 HydrophobicContact CG1-CE2 4.2Å; M513-F527 HydrophobicContact CE-CE2 4.29Å; M513-F527 HydrophobicContact SD-CD2 4.38Å; M513-F527 HydrophobicContact SD-CE2 3.58Å; M513-F527 VanDerWaalsContact SD-CE2 3.58Å; M513-F527 HydrophobicContact SD-CZ 4.31Å; L523-F527 HydrophobicContact CD1-CE1 3.78Å; L523-F527 HydrophobicContact CD1-CZ 3.93Å; L523-F527 HydrophobicContact CD2-CZ 4.11Å; L523-F527 HydrophobicContact CG-CE1 4.11Å; L523-F527 HydrophobicContact CG-CE2 4.27Å; L523-F527 HydrophobicContact CG-CZ 3.82Å; L523-F527 PolarHBondContact O-N 3.18Å; L523-F527 VanDerWaalsContact O-N 3.07Å; F524-F527 WeakPolarHBondContact O-CB 3.41Å; F524-F527 PolarHBondContact O-N 3.35Å; F524-F527 VanDerWaalsContact O-N 3.12Å; Q525-F527 PolarHBondContact O-N 3.13Å; F527-T529 VanDerWaalsContact C-N 3.27Å; F527-T529 PolarHBondContact O-N 3.35Å; F527-I530 HydrophobicContact CD1-CD1 4.34Å; F527-I530 WeakPolarHBondContact O-CB 3.38Å; F527-I530 PolarHBondContact O-N 2.94Å; F527-I530 VanDerWaalsContact O-N 3.08Å; F527-W531 HydrophobicContact CB-CH2 4.19Å; F527-W531 HydrophobicContact CB-CZ2 4.01Å; F527-W531 VanDerWaalsContact O-CG 3.29Å; F527-W531 PolarHBondContact O-N 3.29Å
528	K	86.8	Confident	84.7	Confident	17 Å²	17	49.8 Å²	49.8	7%	0.074	24%	0.238	C	C	.	.	H	α-helix	trans	-55.6	-43.1	172.6	-65.3	176.5	-174.2	168.6	0	111.2	F524 Q525 W526 I530 W531 Q532 E554 V558	F524-K528 HydrophobicContact CD1-CD 4.42Å; F524-K528 HydrophobicContact CD1-CG 4.47Å; F524-K528 HydrophobicContact CE1-CD 4.4Å; F524-K528 HydrophobicContact CE1-CG 4.37Å; F524-K528 PolarHBondContact O-N 2.88Å; Q525-K528 WeakPolarHBondContact O-CB 3.4Å; Q525-K528 PolarHBondContact O-N 3.48Å; W526-K528 VanDerWaalsContact C-N 3.31Å; W526-K528 PolarHBondContact O-N 2.84Å; K528-I530 VanDerWaalsContact C-N 3.33Å; K528-I530 PolarHBondContact O-N 3.35Å; K528-W531 HydrophobicContact CG-CE3 4.43Å; K528-W531 HydrophobicContact CG-CZ3 4.39Å; K528-W531 PolarHBondContact O-N 3.43Å; K528-Q532 WeakPolarHBondContact O-CB 3.48Å; K528-Q532 WeakPolarHBondContact O-CG 3.39Å; K528-Q532 PolarHBondContact O-N 3.04Å; K528-E554 IonicContact NZ-OE2 3.7Å; K528-E554 PolarHBondContact NZ-OE2 3.37Å; K528-V558 HydrophobicContact CD-CG2 3.74Å; K528-V558 VanDerWaalsContact CE-CG2 3.42Å; K528-V558 HydrophobicContact CG-CG2 3.73Å
529	T	86.4	Confident	85.1	Confident	51 Å²	51	46.3 Å²	46.3	31%	0.313	21%	0.214	S	C	.	.	H	α-helix	trans	-64.5	-35.6	177.5	72.9	0	0	0	0	112.9	Q525 W526 F527 R533	Q525-T529 PolarHBondContact O-N 3.15Å; W526-T529 WeakPolarHBondContact O-CB 3.44Å; W526-T529 PolarHBondContact O-N 3.11Å; W526-T529 PolarHBondContact O-OG1 3.38Å; F527-T529 VanDerWaalsContact C-N 3.27Å; F527-T529 PolarHBondContact O-N 3.35Å; T529-R533 WeakPolarHBondContact O-CG 3.37Å; T529-R533 PolarHBondContact O-N 3.39Å
530	I	85.5	Confident	85.5	Confident	17 Å²	17	45.4 Å²	45.4	9%	0.087	22%	0.216	C	C	.	.	H	α-helix	trans	-68.1	-46.2	176.9	-62.8	172.8	0	0	0	110.5	I493 L502 I506 W526 F527 K528 Q532 R533 R534	I493-I530 HydrophobicContact CG2-CD1 3.69Å; L502-I530 HydrophobicContact CD2-CG2 4.39Å; I506-I530 HydrophobicContact CD1-CD1 4.44Å; I506-I530 HydrophobicContact CD1-CG2 4.07Å; W526-I530 HydrophobicContact CD2-CD1 4.07Å; W526-I530 HydrophobicContact CE3-CD1 4.27Å; W526-I530 HydrophobicContact CH2-CD1 4.34Å; W526-I530 HydrophobicContact CZ2-CD1 4.06Å; W526-I530 HydrophobicContact CZ3-CD1 4.44Å; W526-I530 PolarHBondContact O-N 2.83Å; F527-I530 HydrophobicContact CD1-CD1 4.34Å; F527-I530 WeakPolarHBondContact O-CB 3.38Å; F527-I530 PolarHBondContact O-N 2.94Å; F527-I530 VanDerWaalsContact O-N 3.08Å; K528-I530 VanDerWaalsContact C-N 3.33Å; K528-I530 PolarHBondContact O-N 3.35Å; I530-Q532 VanDerWaalsContact C-N 3.33Å; I530-Q532 PolarHBondContact O-N 3.11Å; I530-R533 PolarHBondContact O-N 3.04Å; I530-R534 PolarHBondContact O-N 3.39Å
531	W	89.1	Confident	85.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-39	178.7	-60.2	-29.4	0	0	0	112.2	I506 I510 F524 F527 K528 R533 R534 K535 F537 V558 I565 F567	I506-W531 HydrophobicContact CG2-CZ2 3.77Å; I510-W531 HydrophobicContact CD1-CH2 3.88Å; I510-W531 HydrophobicContact CD1-CZ2 3.69Å; F524-W531 AromaticContact CE2-CH2 3.89Å; F524-W531 HydrophobicContact CE2-CH2 3.89Å; F524-W531 HydrophobicContact CE2-CZ3 4.31Å; F524-W531 HydrophobicContact CZ-CH2 4.06Å; F524-W531 HydrophobicContact CZ-CZ3 4.05Å; F527-W531 HydrophobicContact CB-CH2 4.19Å; F527-W531 HydrophobicContact CB-CZ2 4.01Å; F527-W531 VanDerWaalsContact O-CG 3.29Å; F527-W531 PolarHBondContact O-N 3.29Å; K528-W531 HydrophobicContact CG-CE3 4.43Å; K528-W531 HydrophobicContact CG-CZ3 4.39Å; K528-W531 PolarHBondContact O-N 3.43Å; W531-R533 VanDerWaalsContact C-N 3.3Å; W531-R533 PolarHBondContact O-N 3.11Å; W531-R534 PolarHBondContact O-N 2.85Å; W531-K535 WeakPolarHBondContact O-CA 3.5Å; W531-K535 PolarHBondContact O-N 2.96Å; W531-F537 HydrophobicContact CG-CB 4.43Å; W531-F537 HydrophobicContact CZ2-CD1 4.28Å; W531-F537 HydrophobicContact CZ2-CE1 4.27Å; W531-F537 HydrophobicContact CZ2-CG 4.44Å; W531-F537 HydrophobicContact CZ2-CZ 4.42Å; W531-F537 AromaticContact NE1-CD2 3.41Å; W531-F537 AromaticContact NE1-CE2 3.98Å; W531-F537 AromaticContact NE1-CG 3.56Å; W531-V558 HydrophobicContact CE3-CG1 4.25Å; W531-I565 HydrophobicContact CB-CD1 4.05Å; W531-I565 HydrophobicContact CB-CG2 4.16Å; W531-F567 HydrophobicContact CD2-CE1 4.45Å; W531-F567 HydrophobicContact CE3-CE1 4.27Å; W531-F567 HydrophobicContact CE3-CZ 4.21Å; W531-F567 HydrophobicContact CZ3-CE1 4.44Å
532	Q	86.2	Confident	86.3	Confident	83 Å²	83	43.2 Å²	43.2	39%	0.388	21%	0.205	S	C	.	.	H	α-helix	trans	-56.6	-44	173.4	-77.9	167.3	17.4	0	0	112.3	K528 I530 Q562 I565	K528-Q532 WeakPolarHBondContact O-CB 3.48Å; K528-Q532 WeakPolarHBondContact O-CG 3.39Å; K528-Q532 PolarHBondContact O-N 3.04Å; I530-Q532 VanDerWaalsContact C-N 3.33Å; I530-Q532 PolarHBondContact O-N 3.11Å; Q532-Q562 VanDerWaalsContact CD-NE2 3.26Å; Q532-Q562 VanDerWaalsContact NE2-CD 3.33Å; Q532-I565 HydrophobicContact CG-CD1 4.13Å
533	R	85	Confident	86.6	Confident	206 Å²	206	41.4 Å²	41.4	78%	0.777	19%	0.19	S	C	*	.	H	α-helix	trans	-69.4	-41.3	179.3	-70.2	173.8	-176.9	179.2	2.7	112.1	T529 I530 W531	T529-R533 WeakPolarHBondContact O-CG 3.37Å; T529-R533 PolarHBondContact O-N 3.39Å; I530-R533 PolarHBondContact O-N 3.04Å; W531-R533 VanDerWaalsContact C-N 3.3Å; W531-R533 PolarHBondContact O-N 3.11Å
534	R	85.4	Confident	86.8	Confident	68 Å²	68	45 Å²	45	26%	0.257	21%	0.212	S	C	.	.	H	α-helix	trans	-86.8	-19.4	-174.3	-70	-179.1	59.6	-149.9	-12.5	114.1	T499 D503 I530 W531 K536	T499-R534 PolarHBondContact O-NH2 3.16Å; D503-R534 IonicContact OD1-CZ 2.65Å; D503-R534 IonicContact OD1-NH1 3.5Å; D503-R534 PolarHBondContact OD1-NH1 3.48Å; D503-R534 IonicContact OD1-NH2 3.13Å; D503-R534 PolarHBondContact OD1-NH2 3.36Å; D503-R534 IonicContact OD2-NH2 2.81Å; D503-R534 PolarHBondContact OD2-NH2 3.36Å; I530-R534 PolarHBondContact O-N 3.39Å; W531-R534 PolarHBondContact O-N 2.85Å; R534-K536 PolarHBondContact O-N 3.42Å
535	K	85.6	Confident	86.8	Confident	108 Å²	108	45 Å²	45	47%	0.47	21%	0.213	S	C	.	.	S	Bend	trans	54.2	14.3	-174.4	-59.4	-164.9	175	-153	0	115.3	W531 D564 I565 E566	W531-K535 WeakPolarHBondContact O-CA 3.5Å; W531-K535 PolarHBondContact O-N 2.96Å; K535-D564 HydrophobicContact CD-CB 4.44Å; K535-D564 IonicContact NZ-OD2 2.81Å; K535-D564 PolarHBondContact NZ-OD2 3.27Å; K535-I565 WeakPolarHBondContact O-CA 3.39Å; K535-E566 PolarHBondContact O-N 2.84Å
536	K	87.6	Confident	87	Confident	73 Å²	73	41.1 Å²	41.1	32%	0.317	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	139.4	-179.4	-174.3	167.2	-177.1	155.9	0	110.8	R534 T538 E566 E568	R534-K536 PolarHBondContact O-N 3.42Å; K536-T538 VanDerWaalsContact CE-OG1 3.25Å; K536-T538 WeakPolarHBondContact CE-OG1 3.45Å; K536-E566 WeakPolarHBondContact CA-O 3.43Å; K536-E566 HydrophobicContact CG-CB 4.43Å; K536-E568 WeakPolarHBondContact CE-OE1 3.17Å; K536-E568 VanDerWaalsContact NZ-CD 3.33Å; K536-E568 IonicContact NZ-OE1 2.71Å; K536-E568 PolarHBondContact NZ-OE1 3.04Å; K536-E568 IonicContact NZ-OE2 3.34Å
537	F	88.8	Confident	87.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	123	170.7	176.4	-119.1	0	0	0	110	D503 I506 I510 W531 Y539 E566 F567 E568 L569	D503-F537 HydrophobicContact CB-CD2 4.09Å; D503-F537 HydrophobicContact CB-CE2 4.15Å; D503-F537 WeakPolarHBondContact O-CE2 3.15Å; I506-F537 HydrophobicContact CB-CE2 3.91Å; I506-F537 HydrophobicContact CG2-CD2 4.46Å; I506-F537 HydrophobicContact CG2-CE2 3.73Å; I506-F537 HydrophobicContact CG2-CZ 4.09Å; I510-F537 HydrophobicContact CD1-CE1 4.47Å; I510-F537 HydrophobicContact CD1-CZ 4.23Å; W531-F537 HydrophobicContact CG-CB 4.43Å; W531-F537 HydrophobicContact CZ2-CD1 4.28Å; W531-F537 HydrophobicContact CZ2-CE1 4.27Å; W531-F537 HydrophobicContact CZ2-CG 4.44Å; W531-F537 HydrophobicContact CZ2-CZ 4.42Å; W531-F537 AromaticContact NE1-CD2 3.41Å; W531-F537 AromaticContact NE1-CE2 3.98Å; W531-F537 AromaticContact NE1-CG 3.56Å; F537-Y539 HydrophobicContact CZ-CG 4.45Å; F537-E566 PolarHBondContact N-O 3.44Å; F537-F567 HydrophobicContact CB-CD1 4.22Å; F537-F567 HydrophobicContact CB-CE1 4.28Å; F537-F567 AromaticContact CD1-CD1 3.86Å; F537-F567 HydrophobicContact CD1-CD1 3.86Å; F537-F567 HydrophobicContact CD1-CE1 4.04Å; F537-E568 PolarHBondContact O-N 3.19Å; F537-L569 HydrophobicContact CD1-CD2 3.79Å; F537-L569 HydrophobicContact CE1-CD2 3.72Å
538	T	88.8	Confident	87	Confident	40 Å²	40	43.2 Å²	43.2	25%	0.245	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	110.8	-175.3	-45	0	0	0	0	110.8	D503 K536 E568	D503-T538 WeakPolarHBondContact CB-O 3.43Å; D503-T538 PolarHBondContact OD2-N 3.49Å; K536-T538 VanDerWaalsContact CE-OG1 3.25Å; K536-T538 WeakPolarHBondContact CE-OG1 3.45Å; T538-E568 WeakPolarHBondContact CA-O 3.48Å; T538-E568 HydrophobicContact CG2-CB 3.86Å
539	Y	89.1	Confident	86.9	Confident	3 Å²	3	44 Å²	44	1%	0.012	21%	0.213	C	C	.	.			trans	-142.5	94.9	176	-172.3	-115.8	0	0	0	110.7	H508 V511 F537 N541 F542 E568 L569	H508-Y539 AromaticContact CE1-CE2 3.95Å; H508-Y539 PolarHBondContact CE1-OH 3.48Å; H508-Y539 AromaticContact ND1-CE2 3.85Å; H508-Y539 AromaticContact ND1-CZ 3.77Å; H508-Y539 PolarHBondContact ND1-OH 3.28Å; V511-Y539 HydrophobicContact CG2-CE1 4.11Å; F537-Y539 HydrophobicContact CZ-CG 4.45Å; Y539-N541 HydrophobicContact CE1-CB 4.06Å; Y539-N541 PolarHBondContact O-N 2.81Å; Y539-N541 VanDerWaalsContact O-N 3.11Å; Y539-F542 HydrophobicContact CD1-CB 3.76Å; Y539-F542 HydrophobicContact CD1-CD2 4.18Å; Y539-F542 HydrophobicContact CD1-CG 4.49Å; Y539-F542 VanDerWaalsContact O-CB 3.31Å; Y539-F542 WeakPolarHBondContact O-CB 3.29Å; Y539-F542 PolarHBondContact O-N 2.97Å; Y539-F542 VanDerWaalsContact O-N 3.16Å; Y539-E568 PolarHBondContact N-O 3.05Å; Y539-L569 CarbonylContact O-C 3.45Å; Y539-L569 WeakPolarHBondContact O-CA 3.28Å
540	G	84.4	Confident	86.9	Confident	24 Å²	24	46.2 Å²	46.2	25%	0.247	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.4	-171.4	0	0	0	0	0	115.4	P571	G540-P571 VanDerWaalsContact O-CD 3.25Å; G540-P571 WeakPolarHBondContact O-CD 3.37Å
541	N	86.6	Confident	87.1	Confident	25 Å²	25	45.5 Å²	45.5	13%	0.134	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	7.7	179.4	-72.4	-9.2	0	0	0	113	Y539 F543 V544 Y545 Q622 R625	Y539-N541 HydrophobicContact CE1-CB 4.06Å; Y539-N541 PolarHBondContact O-N 2.81Å; Y539-N541 VanDerWaalsContact O-N 3.11Å; N541-F543 PolarHBondContact O-N 2.8Å; N541-V544 WeakPolarHBondContact O-CB 3.49Å; N541-V544 PolarHBondContact O-N 3.23Å; N541-Y545 HydrophobicContact CB-CD2 3.94Å; N541-Y545 HydrophobicContact CB-CE2 3.83Å; N541-Y545 PolarHBondContact O-N 2.74Å; N541-Q622 PolarHBondContact ND2-NE2 3.07Å; N541-Q622 PolarHBondContact ND2-OE1 2.88Å; N541-R625 PolarHBondContact ND2-NH1 3.09Å; N541-R625 VanDerWaalsContact ND2-NH1 3.12Å
542	F	88.1	Confident	87.1	Confident	1 Å²	1	45.5 Å²	45.5	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-55.9	-58.2	-173	-174.4	-91.9	0	0	0	112.6	I510 Y539 V544 Y545 V546 L552 I555 L569	I510-F542 HydrophobicContact CG2-CE2 4.12Å; Y539-F542 HydrophobicContact CD1-CB 3.76Å; Y539-F542 HydrophobicContact CD1-CD2 4.18Å; Y539-F542 HydrophobicContact CD1-CG 4.49Å; Y539-F542 VanDerWaalsContact O-CB 3.31Å; Y539-F542 WeakPolarHBondContact O-CB 3.29Å; Y539-F542 PolarHBondContact O-N 2.97Å; Y539-F542 VanDerWaalsContact O-N 3.16Å; F542-V544 PolarHBondContact O-N 3.45Å; F542-Y545 PolarHBondContact O-N 2.81Å; F542-V546 HydrophobicContact CD2-CB 4.48Å; F542-V546 HydrophobicContact CD2-CG2 3.92Å; F542-V546 HydrophobicContact CE1-CB 4.1Å; F542-V546 HydrophobicContact CE1-CG1 4.24Å; F542-V546 HydrophobicContact CE2-CB 4.07Å; F542-V546 HydrophobicContact CE2-CG1 4.15Å; F542-V546 HydrophobicContact CE2-CG2 3.69Å; F542-V546 HydrophobicContact CG-CG2 4.4Å; F542-V546 HydrophobicContact CZ-CB 3.81Å; F542-V546 HydrophobicContact CZ-CG1 3.67Å; F542-V546 HydrophobicContact CZ-CG2 3.98Å; F542-V546 WeakPolarHBondContact O-CB 3.38Å; F542-V546 PolarHBondContact O-N 3.25Å; F542-L552 HydrophobicContact CE1-CD2 3.51Å; F542-L552 HydrophobicContact CZ-CD2 3.88Å; F542-I555 HydrophobicContact CD2-CD1 4.47Å; F542-I555 HydrophobicContact CE1-CD1 4.44Å; F542-I555 HydrophobicContact CE2-CD1 3.31Å; F542-I555 HydrophobicContact CZ-CD1 3.32Å; F542-L569 HydrophobicContact CB-CB 3.82Å; F542-L569 HydrophobicContact CB-CD1 4.48Å; F542-L569 HydrophobicContact CB-CD2 4.01Å; F542-L569 HydrophobicContact CB-CG 4.3Å; F542-L569 HydrophobicContact CD1-CB 4.11Å; F542-L569 HydrophobicContact CD1-CD1 3.59Å; F542-L569 HydrophobicContact CD1-CG 4.28Å; F542-L569 HydrophobicContact CD2-CD1 4.27Å; F542-L569 HydrophobicContact CD2-CD2 4.08Å; F542-L569 HydrophobicContact CE1-CD1 3.89Å; F542-L569 HydrophobicContact CG-CB 4.07Å; F542-L569 HydrophobicContact CG-CD1 3.83Å; F542-L569 HydrophobicContact CG-CD2 3.92Å; F542-L569 HydrophobicContact CG-CG 4.15Å; F542-L569 HydrophobicContact CZ-CD1 4.39Å
543	F	86.6	Confident	87.1	Confident	32 Å²	32	47.2 Å²	47.2	14%	0.14	22%	0.224	C	C	.	.	H	α-helix	trans	-73.5	6.3	178.9	-60.8	-65.9	0	0	0	114.1	N541 L569 T570 L596 Q599 I600 H603	N541-F543 PolarHBondContact O-N 2.8Å; F543-L569 HydrophobicContact CD2-CB 4.08Å; F543-L569 WeakPolarHBondContact CD2-O 3.23Å; F543-L569 HydrophobicContact CE2-CB 3.52Å; F543-L569 HydrophobicContact CE2-CD1 4.46Å; F543-L569 HydrophobicContact CZ-CB 4.11Å; F543-L569 HydrophobicContact CZ-CD1 4.21Å; F543-T570 HydrophobicContact CD2-CG2 3.91Å; F543-T570 HydrophobicContact CE2-CG2 4.06Å; F543-L596 HydrophobicContact CZ-CD1 4.16Å; F543-Q599 HydrophobicContact CE1-CB 4.48Å; F543-Q599 HydrophobicContact CE2-CB 3.91Å; F543-Q599 HydrophobicContact CZ-CB 3.68Å; F543-I600 HydrophobicContact CE1-CG1 3.87Å; F543-I600 HydrophobicContact CZ-CG1 4.19Å; F543-H603 HydrophobicContact CD1-CB 3.85Å; F543-H603 AromaticContact CD1-CD2 3.94Å; F543-H603 AromaticContact CD1-CG 3.75Å; F543-H603 HydrophobicContact CE1-CB 4.33Å; F543-H603 PolarHBondContact O-CE1 3.34Å; F543-H603 PolarHBondContact O-ND1 3.46Å
544	V	86.3	Confident	87.2	Confident	77 Å²	77	40 Å²	40	47%	0.467	20%	0.199	S	C	.	.	H	α-helix	trans	-90.4	-43.4	172.2	-176.1	0	0	0	0	109.7	N541 F542	N541-V544 WeakPolarHBondContact O-CB 3.49Å; N541-V544 PolarHBondContact O-N 3.23Å; F542-V544 PolarHBondContact O-N 3.45Å
545	Y	87.8	Confident	87.4	Confident	3 Å²	3	36.7 Å²	36.7	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-114.4	-17	-169.6	-54	-67.6	0	0	0	114.3	Q514 N541 F542 S614 F618 E621 Q622	Q514-Y545 PolarHBondContact NE2-O 3.45Å; N541-Y545 HydrophobicContact CB-CD2 3.94Å; N541-Y545 HydrophobicContact CB-CE2 3.83Å; N541-Y545 PolarHBondContact O-N 2.74Å; F542-Y545 PolarHBondContact O-N 2.81Å; Y545-S614 PolarHBondContact O-OG 3.44Å; Y545-S614 VanDerWaalsContact O-OG 3.13Å; Y545-F618 HydrophobicContact CD1-CB 3.81Å; Y545-F618 HydrophobicContact CD1-CD2 4.07Å; Y545-F618 HydrophobicContact CD1-CG 4.41Å; Y545-F618 AromaticContact CD2-CD2 3.72Å; Y545-F618 HydrophobicContact CD2-CD2 3.72Å; Y545-F618 HydrophobicContact CD2-CE2 4.28Å; Y545-F618 HydrophobicContact CE1-CB 4.06Å; Y545-F618 HydrophobicContact CE1-CD2 4.3Å; Y545-F618 AromaticContact CE2-CD2 3.95Å; Y545-F618 HydrophobicContact CE2-CD2 3.95Å; Y545-F618 HydrophobicContact CG-CB 4.29Å; Y545-F618 AromaticContact CG-CD2 3.78Å; Y545-F618 HydrophobicContact CG-CD2 3.78Å; Y545-F618 HydrophobicContact CG-CG 4.44Å; Y545-E621 PolarHBondContact OH-OE2 3.18Å; Y545-Q622 HydrophobicContact CE2-CG 3.6Å; Y545-Q622 WeakPolarHBondContact OH-CG 3.45Å; Y545-Q622 PolarHBondContact OH-NE2 2.99Å
546	V	88.8	Confident	87.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.			trans	-92.7	110.4	177.5	-173.4	0	0	0	0	110.5	I510 V511 Q514 F542 V551 L552 H603	I510-V546 HydrophobicContact CG2-CG2 4.1Å; V511-V546 HydrophobicContact CG2-CG2 3.91Å; Q514-V546 VanDerWaalsContact OE1-CA 3.3Å; F542-V546 HydrophobicContact CD2-CB 4.48Å; F542-V546 HydrophobicContact CD2-CG2 3.92Å; F542-V546 HydrophobicContact CE1-CB 4.1Å; F542-V546 HydrophobicContact CE1-CG1 4.24Å; F542-V546 HydrophobicContact CE2-CB 4.07Å; F542-V546 HydrophobicContact CE2-CG1 4.15Å; F542-V546 HydrophobicContact CE2-CG2 3.69Å; F542-V546 HydrophobicContact CG-CG2 4.4Å; F542-V546 HydrophobicContact CZ-CB 3.81Å; F542-V546 HydrophobicContact CZ-CG1 3.67Å; F542-V546 HydrophobicContact CZ-CG2 3.98Å; F542-V546 WeakPolarHBondContact O-CB 3.38Å; F542-V546 PolarHBondContact O-N 3.25Å; V546-V551 HydrophobicContact CG1-CB 4.39Å; V546-V551 HydrophobicContact CG1-CG1 3.94Å; V546-L552 HydrophobicContact CG1-CD2 3.99Å; V546-L552 HydrophobicContact CG1-CG 4.42Å; V546-H603 PolarHBondContact O-NE2 3.19Å
547	N	86.6	Confident	87.4	Confident	14 Å²	14	35.1 Å²	35.1	8%	0.075	18%	0.184	C	C	.	.			trans	-125.4	-15.8	-173.4	-63.3	-47.6	0	0	0	113.4	H603 R608 S614	N547-H603 PolarHBondContact OD1-NE2 3.19Å; N547-H603 VanDerWaalsContact OD1-NE2 3.15Å; N547-R608 HydrophobicContact CB-CG 4.49Å; N547-R608 WeakPolarHBondContact O-CD 3.4Å; N547-R608 PolarHBondContact O-NH1 3.01Å; N547-S614 PolarHBondContact ND2-OG 2.87Å
548	E	86.7	Confident	87.3	Confident	65 Å²	65	35.3 Å²	35.3	30%	0.304	18%	0.184	S	C	.	.			trans	-69.3	122.2	179.3	-160.9	58.1	-138.8	0	0	110.8	Q514 E550 V551 L552	Q514-E548 HydrophobicContact CB-CB 4.44Å; Q514-E548 HydrophobicContact CG-CB 4.1Å; E548-E550 PolarHBondContact O-N 3.02Å; E548-V551 HydrophobicContact CB-CB 4.35Å; E548-V551 HydrophobicContact CB-CG2 4.03Å; E548-V551 HydrophobicContact CG-CG2 4.34Å; E548-V551 PolarHBondContact O-N 3.29Å; E548-L552 WeakPolarHBondContact O-CG 3.27Å; E548-L552 PolarHBondContact O-N 3.07Å
549	P	85.3	Confident	87.2	Confident	33 Å²	33	33.6 Å²	33.6	21%	0.214	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-37.1	-172.7	25.8	-27.7	0	0	0	112.1	V551 L552 E553 M604	P549-V551 VanDerWaalsContact C-N 3.34Å; P549-V551 PolarHBondContact O-N 3.12Å; P549-L552 WeakPolarHBondContact O-CB 3.49Å; P549-L552 PolarHBondContact O-N 3.21Å; P549-L552 VanDerWaalsContact O-N 3.16Å; P549-E553 WeakPolarHBondContact O-CB 3.47Å; P549-E553 WeakPolarHBondContact O-CG 3.35Å; P549-E553 PolarHBondContact O-N 3.16Å; P549-M604 HydrophobicContact CB-SD 4.39Å
550	E	87.5	Confident	87	Confident	99 Å²	99	40.6 Å²	40.6	46%	0.463	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-39.6	179.2	-61.6	-172.4	-174.4	0	0	112.1	W517 E548 E553 E554	W517-E550 PolarHBondContact NE1-OE2 2.81Å; E548-E550 PolarHBondContact O-N 3.02Å; E550-E553 PolarHBondContact O-N 3.04Å; E550-E554 PolarHBondContact O-N 3.29Å
551	V	88.1	Confident	87	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-39.2	175.4	179.4	0	0	0	0	111.3	I510 Q514 W517 V546 E548 P549 E554 I555	I510-V551 HydrophobicContact CG2-CG1 3.82Å; Q514-V551 HydrophobicContact CG-CG2 4.36Å; W517-V551 HydrophobicContact CB-CG2 4.31Å; W517-V551 HydrophobicContact CD2-CG2 3.55Å; W517-V551 HydrophobicContact CE3-CG2 3.7Å; W517-V551 HydrophobicContact CG-CG2 3.81Å; W517-V551 HydrophobicContact CZ3-CG2 4.32Å; V546-V551 HydrophobicContact CG1-CB 4.39Å; V546-V551 HydrophobicContact CG1-CG1 3.94Å; E548-V551 HydrophobicContact CB-CB 4.35Å; E548-V551 HydrophobicContact CB-CG2 4.03Å; E548-V551 HydrophobicContact CG-CG2 4.34Å; E548-V551 PolarHBondContact O-N 3.29Å; P549-V551 VanDerWaalsContact C-N 3.34Å; P549-V551 PolarHBondContact O-N 3.12Å; V551-E554 PolarHBondContact O-N 3.25Å; V551-I555 PolarHBondContact O-N 3.07Å
552	L	88.8	Confident	86.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-41.1	176	-65.9	173.7	0	0	0	111.7	F542 V546 E548 P549 I555 A556 I600 M604	F542-L552 HydrophobicContact CE1-CD2 3.51Å; F542-L552 HydrophobicContact CZ-CD2 3.88Å; V546-L552 HydrophobicContact CG1-CD2 3.99Å; V546-L552 HydrophobicContact CG1-CG 4.42Å; E548-L552 WeakPolarHBondContact O-CG 3.27Å; E548-L552 PolarHBondContact O-N 3.07Å; P549-L552 WeakPolarHBondContact O-CB 3.49Å; P549-L552 PolarHBondContact O-N 3.21Å; P549-L552 VanDerWaalsContact O-N 3.16Å; L552-I555 PolarHBondContact O-N 3.42Å; L552-A556 WeakPolarHBondContact O-CB 3.43Å; L552-A556 PolarHBondContact O-N 3.21Å; L552-I600 HydrophobicContact CB-CG2 4.15Å; L552-M604 HydrophobicContact CD1-CG 3.95Å; L552-M604 HydrophobicContact CD1-SD 4.35Å
553	E	87.3	Confident	86.5	Confident	120 Å²	120	50 Å²	50	56%	0.561	25%	0.251	S	S	*	.	H	α-helix	trans	-62.5	-43.3	176.1	-75.8	179.7	-168.6	0	0	111.5	P549 E550 I555 A556 Y557	P549-E553 WeakPolarHBondContact O-CB 3.47Å; P549-E553 WeakPolarHBondContact O-CG 3.35Å; P549-E553 PolarHBondContact O-N 3.16Å; E550-E553 PolarHBondContact O-N 3.04Å; E553-I555 PolarHBondContact O-N 3.04Å; E553-A556 WeakPolarHBondContact O-CB 3.35Å; E553-A556 PolarHBondContact O-N 3.49Å; E553-Y557 WeakPolarHBondContact O-CB 3.47Å; E553-Y557 PolarHBondContact O-N 3.27Å
554	E	87.9	Confident	86.3	Confident	53 Å²	53	53.3 Å²	53.3	25%	0.248	27%	0.27	C	S	.	.	H	α-helix	trans	-61.3	-42.2	176.4	-86.1	-57.5	127.5	0	0	112.9	W517 F524 K528 E550 V551 Y557 V558	W517-E554 HydrophobicContact CH2-CG 4.46Å; W517-E554 HydrophobicContact CZ2-CG 3.82Å; F524-E554 HydrophobicContact CD1-CB 4.48Å; F524-E554 HydrophobicContact CE1-CB 3.64Å; F524-E554 HydrophobicContact CE1-CG 4.24Å; F524-E554 HydrophobicContact CZ-CB 3.88Å; K528-E554 IonicContact NZ-OE2 3.7Å; K528-E554 PolarHBondContact NZ-OE2 3.37Å; E550-E554 PolarHBondContact O-N 3.29Å; V551-E554 PolarHBondContact O-N 3.25Å; E554-Y557 WeakPolarHBondContact O-CB 3.38Å; E554-Y557 PolarHBondContact O-N 3.16Å; E554-V558 WeakPolarHBondContact O-CG2 3.43Å; E554-V558 PolarHBondContact O-N 2.88Å
555	I	88.3	Confident	86.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.6	-39.4	175.8	-68.2	180	0	0	0	111.2	F524 F542 V551 L552 E553 Y557 V558 A559 F567 L569 L596	F524-I555 HydrophobicContact CE2-CG1 4.22Å; F524-I555 HydrophobicContact CZ-CG1 3.79Å; F542-I555 HydrophobicContact CD2-CD1 4.47Å; F542-I555 HydrophobicContact CE1-CD1 4.44Å; F542-I555 HydrophobicContact CE2-CD1 3.31Å; F542-I555 HydrophobicContact CZ-CD1 3.32Å; V551-I555 PolarHBondContact O-N 3.07Å; L552-I555 PolarHBondContact O-N 3.42Å; E553-I555 PolarHBondContact O-N 3.04Å; I555-Y557 VanDerWaalsContact C-N 3.26Å; I555-Y557 PolarHBondContact O-N 3.11Å; I555-V558 PolarHBondContact O-N 3.29Å; I555-A559 PolarHBondContact O-N 2.8Å; I555-F567 HydrophobicContact CG2-CD1 4.24Å; I555-F567 HydrophobicContact CG2-CE1 4.13Å; I555-L569 HydrophobicContact CG2-CD1 4.36Å; I555-L596 HydrophobicContact CG2-CD2 4.24Å
556	A	86.1	Confident	86.1	Confident	33 Å²	33	54.6 Å²	54.6	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-39.3	174	0	0	0	0	0	111.4	L552 E553 A559 H560 I600	L552-A556 WeakPolarHBondContact O-CB 3.43Å; L552-A556 PolarHBondContact O-N 3.21Å; E553-A556 WeakPolarHBondContact O-CB 3.35Å; E553-A556 PolarHBondContact O-N 3.49Å; A556-A559 PolarHBondContact O-N 2.73Å; A556-H560 WeakPolarHBondContact O-CB 3.35Å; A556-H560 PolarHBondContact O-N 3.5Å; A556-I600 HydrophobicContact CB-CD1 3.84Å
557	Y	87.6	Confident	86	Confident	115 Å²	115	54.9 Å²	54.9	45%	0.451	27%	0.272	S	S	.	.	H	α-helix	trans	-63.7	-46.4	176	179.1	-103.1	0	0	0	111.6	E553 E554 I555 A559 H560 Q561	E553-Y557 WeakPolarHBondContact O-CB 3.47Å; E553-Y557 PolarHBondContact O-N 3.27Å; E554-Y557 WeakPolarHBondContact O-CB 3.38Å; E554-Y557 PolarHBondContact O-N 3.16Å; I555-Y557 VanDerWaalsContact C-N 3.26Å; I555-Y557 PolarHBondContact O-N 3.11Å; Y557-A559 PolarHBondContact O-N 3.36Å; Y557-H560 PolarHBondContact O-N 3.1Å; Y557-H560 VanDerWaalsContact O-N 3.16Å; Y557-Q561 HydrophobicContact CD1-CG 4.41Å; Y557-Q561 HydrophobicContact CD2-CG 4.4Å; Y557-Q561 VanDerWaalsContact CE1-CD 3.48Å; Y557-Q561 HydrophobicContact CE1-CG 4.14Å; Y557-Q561 HydrophobicContact CE2-CG 4.12Å; Y557-Q561 WeakPolarHBondContact O-CG 3.38Å; Y557-Q561 PolarHBondContact O-N 3.1Å; Y557-Q561 PolarHBondContact OH-NE2 3.39Å
558	V	86.3	Confident	86	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-58.9	-47.2	175.2	175.3	0	0	0	0	111.2	K528 W531 E554 I555 H560 Q561 Q562 I565 F567	K528-V558 HydrophobicContact CD-CG2 3.74Å; K528-V558 VanDerWaalsContact CE-CG2 3.42Å; K528-V558 HydrophobicContact CG-CG2 3.73Å; W531-V558 HydrophobicContact CE3-CG1 4.25Å; E554-V558 WeakPolarHBondContact O-CG2 3.43Å; E554-V558 PolarHBondContact O-N 2.88Å; I555-V558 PolarHBondContact O-N 3.29Å; V558-H560 VanDerWaalsContact C-N 3.26Å; V558-H560 PolarHBondContact O-N 2.89Å; V558-Q561 PolarHBondContact O-N 3.41Å; V558-Q562 PolarHBondContact O-N 3.02Å; V558-I565 HydrophobicContact CG1-CD1 4.32Å; V558-F567 HydrophobicContact CB-CZ 4.43Å; V558-F567 HydrophobicContact CG1-CE2 4.26Å; V558-F567 HydrophobicContact CG1-CZ 3.83Å
559	A	85.9	Confident	85.9	Confident	4 Å²	4	54.6 Å²	54.6	3%	0.033	27%	0.27	C	S	.	.	H	α-helix	trans	-65	-29.9	178.7	0	0	0	0	0	113.1	I555 A556 Y557 F567 A593 L596	I555-A559 PolarHBondContact O-N 2.8Å; A556-A559 PolarHBondContact O-N 2.73Å; Y557-A559 PolarHBondContact O-N 3.36Å; A559-F567 HydrophobicContact CB-CD2 3.93Å; A559-F567 HydrophobicContact CB-CE2 3.89Å; A559-A593 HydrophobicContact CB-CB 4.48Å; A559-A593 WeakPolarHBondContact O-CB 3.35Å; A559-L596 HydrophobicContact CB-CD2 3.44Å; A559-L596 VanDerWaalsContact CB-CD2 3.44Å
560	H	85.3	Confident	85.6	Confident	150 Å²	150	55.4 Å²	55.4	69%	0.694	28%	0.275	S	S	*	.	H	α-helix	trans	-72.5	-46.3	174.6	-177.5	65.5	0	0	0	112.1	A556 Y557 V558	A556-H560 WeakPolarHBondContact O-CB 3.35Å; A556-H560 PolarHBondContact O-N 3.5Å; Y557-H560 PolarHBondContact O-N 3.1Å; Y557-H560 VanDerWaalsContact O-N 3.16Å; V558-H560 VanDerWaalsContact C-N 3.26Å; V558-H560 PolarHBondContact O-N 2.89Å
561	Q	85.4	Confident	84.6	Confident	111 Å²	111	53.2 Å²	53.2	52%	0.519	27%	0.269	S	S	.	.	H	α-helix	trans	-70.7	-33.1	-179.8	-69.4	-153.6	-29.2	0	0	112.9	Y557 V558 P563	Y557-Q561 HydrophobicContact CD1-CG 4.41Å; Y557-Q561 HydrophobicContact CD2-CG 4.4Å; Y557-Q561 VanDerWaalsContact CE1-CD 3.48Å; Y557-Q561 HydrophobicContact CE1-CG 4.14Å; Y557-Q561 HydrophobicContact CE2-CG 4.12Å; Y557-Q561 WeakPolarHBondContact O-CG 3.38Å; Y557-Q561 PolarHBondContact O-N 3.1Å; Y557-Q561 PolarHBondContact OH-NE2 3.39Å; V558-Q561 PolarHBondContact O-N 3.41Å; Q561-P563 WeakPolarHBondContact O-CD 3.35Å
562	Q	83.7	Confident	82.9	Confident	54 Å²	54	58 Å²	58	25%	0.252	30%	0.298	S	S	.	.			trans	-128.7	75.5	-172.1	-63.1	-175.7	-28.8	0	0	110.5	Q532 V558 D564 I565	Q532-Q562 VanDerWaalsContact CD-NE2 3.26Å; Q532-Q562 VanDerWaalsContact NE2-CD 3.33Å; V558-Q562 PolarHBondContact O-N 3.02Å; Q562-D564 PolarHBondContact O-N 2.89Å; Q562-D564 VanDerWaalsContact O-N 3.09Å; Q562-I565 HydrophobicContact CB-CD1 3.78Å; Q562-I565 HydrophobicContact CB-CG1 4.14Å; Q562-I565 PolarHBondContact O-N 3.01Å; Q562-I565 VanDerWaalsContact O-N 3.14Å; Q562-I565 VanDerWaalsContact OE1-CD1 3.29Å
563	P	80.2	Confident	80.8	Confident	82 Å²	82	66.3 Å²	66.3	53%	0.532	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-13	-176.1	28.1	-36.1	0	0	0	113.9	Q561 I565	Q561-P563 WeakPolarHBondContact O-CD 3.35Å; P563-I565 VanDerWaalsContact C-N 3.25Å; P563-I565 PolarHBondContact O-N 3.41Å
564	D	83	Confident	78.6	Confident	103 Å²	103	68.5 Å²	68.5	55%	0.551	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.6	174.3	-84.6	21.6	0	0	0	113.6	K535 Q562	K535-D564 HydrophobicContact CD-CB 4.44Å; K535-D564 IonicContact NZ-OD2 2.81Å; K535-D564 PolarHBondContact NZ-OD2 3.27Å; Q562-D564 PolarHBondContact O-N 2.89Å; Q562-D564 VanDerWaalsContact O-N 3.09Å
565	I	84.8	Confident	76.3	Confident	5 Å²	5	72.8 Å²	72.8	3%	0.026	37%	0.369	C	S	.	.	S	Bend	trans	-86.6	119	-177.6	-57.1	175.7	0	0	0	109	W531 Q532 K535 V558 Q562 P563 F567	W531-I565 HydrophobicContact CB-CD1 4.05Å; W531-I565 HydrophobicContact CB-CG2 4.16Å; Q532-I565 HydrophobicContact CG-CD1 4.13Å; K535-I565 WeakPolarHBondContact O-CA 3.39Å; V558-I565 HydrophobicContact CG1-CD1 4.32Å; Q562-I565 HydrophobicContact CB-CD1 3.78Å; Q562-I565 HydrophobicContact CB-CG1 4.14Å; Q562-I565 PolarHBondContact O-N 3.01Å; Q562-I565 VanDerWaalsContact O-N 3.14Å; Q562-I565 VanDerWaalsContact OE1-CD1 3.29Å; P563-I565 VanDerWaalsContact C-N 3.25Å; P563-I565 PolarHBondContact O-N 3.41Å; I565-F567 HydrophobicContact CB-CD2 4.47Å; I565-F567 HydrophobicContact CB-CE2 3.9Å; I565-F567 HydrophobicContact CB-CZ 4.49Å; I565-F567 HydrophobicContact CG2-CD2 4.06Å; I565-F567 HydrophobicContact CG2-CE1 4.48Å; I565-F567 HydrophobicContact CG2-CE2 3.53Å; I565-F567 HydrophobicContact CG2-CZ 3.77Å; I565-F567 PolarHBondContact O-N 3.45Å
566	E	85.2	Confident	73.8	Confident	101 Å²	101	78.9 Å²	78.9	47%	0.472	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	113	176.3	-69.1	-173.1	165.1	0	0	112.1	K535 K536 F537 N592	K535-E566 PolarHBondContact O-N 2.84Å; K536-E566 WeakPolarHBondContact CA-O 3.43Å; K536-E566 HydrophobicContact CG-CB 4.43Å; F537-E566 PolarHBondContact N-O 3.44Å; E566-N592 VanDerWaalsContact CA-ND2 3.28Å; E566-N592 WeakPolarHBondContact CA-ND2 3.41Å
567	F	86.2	Confident	71.1	Confident	7 Å²	7	83 Å²	83	3%	0.031	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	109.3	175	-71.9	-86.2	0	0	0	111	W531 F537 I555 V558 A559 I565 L569 N592 L596	W531-F567 HydrophobicContact CD2-CE1 4.45Å; W531-F567 HydrophobicContact CE3-CE1 4.27Å; W531-F567 HydrophobicContact CE3-CZ 4.21Å; W531-F567 HydrophobicContact CZ3-CE1 4.44Å; F537-F567 HydrophobicContact CB-CD1 4.22Å; F537-F567 HydrophobicContact CB-CE1 4.28Å; F537-F567 AromaticContact CD1-CD1 3.86Å; F537-F567 HydrophobicContact CD1-CD1 3.86Å; F537-F567 HydrophobicContact CD1-CE1 4.04Å; I555-F567 HydrophobicContact CG2-CD1 4.24Å; I555-F567 HydrophobicContact CG2-CE1 4.13Å; V558-F567 HydrophobicContact CB-CZ 4.43Å; V558-F567 HydrophobicContact CG1-CE2 4.26Å; V558-F567 HydrophobicContact CG1-CZ 3.83Å; A559-F567 HydrophobicContact CB-CD2 3.93Å; A559-F567 HydrophobicContact CB-CE2 3.89Å; I565-F567 HydrophobicContact CB-CD2 4.47Å; I565-F567 HydrophobicContact CB-CE2 3.9Å; I565-F567 HydrophobicContact CB-CZ 4.49Å; I565-F567 HydrophobicContact CG2-CD2 4.06Å; I565-F567 HydrophobicContact CG2-CE1 4.48Å; I565-F567 HydrophobicContact CG2-CE2 3.53Å; I565-F567 HydrophobicContact CG2-CZ 3.77Å; I565-F567 PolarHBondContact O-N 3.45Å; F567-L569 HydrophobicContact CB-CG 4.22Å; F567-L569 HydrophobicContact CD1-CD2 4.49Å; F567-N592 PolarHBondContact N-ND2 3.31Å; F567-L596 HydrophobicContact CB-CD1 4.41Å; F567-L596 HydrophobicContact CB-CD2 4.13Å; F567-L596 HydrophobicContact CD2-CD2 4.23Å; F567-L596 HydrophobicContact CG-CD2 4.18Å
568	E	86.1	Confident	68.4	Low	71 Å²	71	86.6 Å²	86.6	33%	0.332	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	83.8	174.2	-76.1	-179.2	-160.7	0	0	110	K536 F537 T538 Y539	K536-E568 WeakPolarHBondContact CE-OE1 3.17Å; K536-E568 VanDerWaalsContact NZ-CD 3.33Å; K536-E568 IonicContact NZ-OE1 2.71Å; K536-E568 PolarHBondContact NZ-OE1 3.04Å; K536-E568 IonicContact NZ-OE2 3.34Å; F537-E568 PolarHBondContact O-N 3.19Å; T538-E568 WeakPolarHBondContact CA-O 3.48Å; T538-E568 HydrophobicContact CG2-CB 3.86Å; Y539-E568 PolarHBondContact N-O 3.05Å
569	L	85.1	Confident	65.7	Low	1 Å²	1	96.9 Å²	96.9	1%	0.005	49%	0.49	C	S	.	.			trans	-99.5	4	-171.1	-59.5	-172.8	0	0	0	114.6	F537 Y539 F542 F543 I555 F567 L596	F537-L569 HydrophobicContact CD1-CD2 3.79Å; F537-L569 HydrophobicContact CE1-CD2 3.72Å; Y539-L569 CarbonylContact O-C 3.45Å; Y539-L569 WeakPolarHBondContact O-CA 3.28Å; F542-L569 HydrophobicContact CB-CB 3.82Å; F542-L569 HydrophobicContact CB-CD1 4.48Å; F542-L569 HydrophobicContact CB-CD2 4.01Å; F542-L569 HydrophobicContact CB-CG 4.3Å; F542-L569 HydrophobicContact CD1-CB 4.11Å; F542-L569 HydrophobicContact CD1-CD1 3.59Å; F542-L569 HydrophobicContact CD1-CG 4.28Å; F542-L569 HydrophobicContact CD2-CD1 4.27Å; F542-L569 HydrophobicContact CD2-CD2 4.08Å; F542-L569 HydrophobicContact CE1-CD1 3.89Å; F542-L569 HydrophobicContact CG-CB 4.07Å; F542-L569 HydrophobicContact CG-CD1 3.83Å; F542-L569 HydrophobicContact CG-CD2 3.92Å; F542-L569 HydrophobicContact CG-CG 4.15Å; F542-L569 HydrophobicContact CZ-CD1 4.39Å; F543-L569 HydrophobicContact CD2-CB 4.08Å; F543-L569 WeakPolarHBondContact CD2-O 3.23Å; F543-L569 HydrophobicContact CE2-CB 3.52Å; F543-L569 HydrophobicContact CE2-CD1 4.46Å; F543-L569 HydrophobicContact CZ-CB 4.11Å; F543-L569 HydrophobicContact CZ-CD1 4.21Å; I555-L569 HydrophobicContact CG2-CD1 4.36Å; F567-L569 HydrophobicContact CB-CG 4.22Å; F567-L569 HydrophobicContact CD1-CD2 4.49Å; L569-L596 HydrophobicContact CD1-CD1 3.5Å; L569-L596 VanDerWaalsContact CD1-CD1 3.5Å; L569-L596 HydrophobicContact CG-CD1 4.23Å
570	T	78.8	Confident	62.9	Low	50 Å²	50	104.8 Å²	104.8	31%	0.307	53%	0.526	S	S	.	.	S	Bend	trans	-116	146.2	178.8	47.9	0	0	0	0	111.2	F543 V572	F543-T570 HydrophobicContact CD2-CG2 3.91Å; F543-T570 HydrophobicContact CE2-CG2 4.06Å; T570-V572 PolarHBondContact O-N 3.26Å
571	P	66	Low	60.1	Low	53 Å²	53	103.8 Å²	103.8	34%	0.344	54%	0.535	S	S	.	.			trans	-66.1	128.1	-177.8	25.5	-29.4	0	0	0	110.3	G540 Q573 K574	G540-P571 VanDerWaalsContact O-CD 3.25Å; G540-P571 WeakPolarHBondContact O-CD 3.37Å; P571-Q573 PolarHBondContact O-N 3.33Å; P571-K574 PolarHBondContact O-N 3.44Å; P571-K574 VanDerWaalsContact O-N 3.15Å
572	V	52.6	Low	57.3	Low	101 Å²	101	104 Å²	104	61%	0.612	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-53.4	-25	-174.5	-177.1	0	0	0	0	113	T570 K574 L575	T570-V572 PolarHBondContact O-N 3.26Å; V572-K574 PolarHBondContact O-N 3.36Å; V572-L575 PolarHBondContact O-N 3.18Å
573	Q	44.4	Very low	54.7	Low	175 Å²	175	107.8 Å²	107.8	82%	0.818	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-65.8	-17.2	-178.7	-67.8	-178	-6.5	0	0	114.9	P571	P571-Q573 PolarHBondContact O-N 3.33Å
574	K	42.4	Very low	52.2	Low	166 Å²	166	108.5 Å²	108.5	72%	0.722	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-84.4	-5.1	176.9	-73.4	-174.9	178.9	175.1	0	114.7	P571 V572	P571-K574 PolarHBondContact O-N 3.44Å; P571-K574 VanDerWaalsContact O-N 3.15Å; V572-K574 PolarHBondContact O-N 3.36Å
575	L	39.4	Very low	49.7	Very low	143 Å²	143	108.8 Å²	108.8	75%	0.749	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-82.1	-6.7	179.5	-91.4	125.2	0	0	0	114.9	V572	V572-L575 PolarHBondContact O-N 3.18Å
576	V	34.7	Very low	47.1	Very low	129 Å²	129	113.5 Å²	113.5	78%	0.782	63%	0.634	S	S	*	*	S	Bend	trans	-97.2	-9.7	-175.8	-176.4	0	0	0	0	113.8
577	T	30.1	Very low	44.5	Very low	120 Å²	120	118.4 Å²	118.4	74%	0.736	65%	0.654	S	S	*	*	S	Bend	trans	-124.6	28.9	-171.9	36.8	0	0	0	0	116.8
578	K	31.5	Very low	42	Very low	189 Å²	189	121.2 Å²	121.2	82%	0.822	69%	0.685	S	S	*	*			trans	-125.7	73.2	160.6	-90.8	-175.1	175.9	178.9	0	112.7	Q580	K578-Q580 PolarHBondContact O-N 2.85Å; K578-Q580 VanDerWaalsContact O-N 3.15Å
579	K	28.7	Very low	39.9	Very low	219 Å²	219	128.2 Å²	128.2	95%	0.952	71%	0.714	S	S	*	*			trans	-77.2	58.9	151.1	-110.4	-175.9	-179	177.1	0	109.3
580	Q	28.1	Very low	38.6	Very low	171 Å²	171	133 Å²	133	80%	0.799	74%	0.739	S	S	*	*			trans	-150.6	72.3	169.9	-98.8	-176.1	0.3	0	0	108.2	K578	K578-Q580 PolarHBondContact O-N 2.85Å; K578-Q580 VanDerWaalsContact O-N 3.15Å
581	C	25.1	Very low	38.1	Very low	128 Å²	128	133.2 Å²	133.2	87%	0.865	74%	0.743	S	S	*	*			trans	-167.7	84.3	149.6	-104.6	0	0	0	0	106.1
582	S	27.3	Very low	38.5	Very low	117 Å²	117	133 Å²	133	82%	0.818	74%	0.739	S	S	*	*			trans	-66.6	139.6	162.4	-44.2	0	0	0	0	108.2
583	P	29.8	Very low	39.6	Very low	133 Å²	133	129.4 Å²	129.4	86%	0.864	72%	0.72	S	S	*	*			trans	-82.6	130.7	-165	32.9	-32.9	0	0	0	111.2
584	A	27.4	Very low	41.1	Very low	97 Å²	97	127.3 Å²	127.3	80%	0.802	71%	0.708	S	S	*	*			trans	-112.7	124.7	157.9	0	0	0	0	0	108.2
585	S	30.7	Very low	43	Very low	108 Å²	108	122.1 Å²	122.1	76%	0.755	69%	0.69	S	S	*	*	S	Bend	trans	74	93.3	168.4	-179.9	0	0	0	0	118	K587	S585-K587 PolarHBondContact O-N 3.43Å
586	S	28.8	Very low	45.1	Very low	104 Å²	104	115.4 Å²	115.4	73%	0.727	66%	0.655	S	S	*	*			trans	3.7	109.1	138.4	50.1	0	0	0	0	118.2
587	K	31.6	Very low	47.4	Very low	204 Å²	204	117 Å²	117	89%	0.887	65%	0.647	S	S	*	*				164.8	112.5	123.5	-90.3	172	179.9	177.2	0	111.7	S585	S585-K587 PolarHBondContact O-N 3.43Å
588	G	34	Very low	49.9	Very low	67 Å²	67	115.1 Å²	115.1	69%	0.691	63%	0.632	S	S	*	*			trans	89.1	118.8	158	0	0	0	0	0	116.2	L590	G588-L590 PolarHBondContact O-N 2.88Å; G588-L590 VanDerWaalsContact O-N 3.12Å
589	K	42.3	Very low	52.5	Low	217 Å²	217	108.4 Å²	108.4	94%	0.943	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-50.1	119.4	157.8	-87.9	178.5	173.8	179.8	0	107.1	S591	K589-S591 PolarHBondContact O-N 2.88Å
590	L	57.4	Low	55.2	Low	101 Å²	101	98.4 Å²	98.4	53%	0.529	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-56.5	128.9	170.4	-100.1	79.7	0	0	0	107.5	G588 K594 V595 L598	G588-L590 PolarHBondContact O-N 2.88Å; G588-L590 VanDerWaalsContact O-N 3.12Å; L590-K594 HydrophobicContact CB-CB 4.45Å; L590-K594 HydrophobicContact CD2-CB 3.95Å; L590-K594 HydrophobicContact CG-CB 4.22Å; L590-K594 HydrophobicContact CG-CD 4.46Å; L590-V595 HydrophobicContact CB-CG2 3.81Å; L590-V595 HydrophobicContact CD2-CG2 4.24Å; L590-L598 HydrophobicContact CD2-CD1 3.91Å
591	S	68.7	Low	57.9	Low	55 Å²	55	94.2 Å²	94.2	39%	0.385	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-60.7	149.7	172.8	54.9	0	0	0	0	109.8	K589 A593 K594 V595	K589-S591 PolarHBondContact O-N 2.88Å; S591-A593 PolarHBondContact O-N 3.32Å; S591-K594 WeakPolarHBondContact O-CB 3.21Å; S591-K594 PolarHBondContact O-N 2.97Å; S591-K594 WeakPolarHBondContact OG-CG 3.42Å; S591-V595 PolarHBondContact O-N 2.94Å
592	N	74	Confident	60.8	Low	49 Å²	49	94 Å²	94	26%	0.262	53%	0.527	S	S	.	.	H	α-helix	trans	-52.1	-42.6	-178.2	-162.5	-18.4	0	0	0	111.5	E566 F567 K594 V595 L596	E566-N592 VanDerWaalsContact CA-ND2 3.28Å; E566-N592 WeakPolarHBondContact CA-ND2 3.41Å; F567-N592 PolarHBondContact N-ND2 3.31Å; N592-K594 VanDerWaalsContact C-N 3.31Å; N592-K594 PolarHBondContact O-N 3.42Å; N592-V595 PolarHBondContact O-N 3.44Å; N592-L596 WeakPolarHBondContact O-CB 3.38Å; N592-L596 PolarHBondContact O-N 3Å
593	A	74.3	Confident	63.5	Low	25 Å²	25	89.2 Å²	89.2	21%	0.207	49%	0.492	C	S	.	.	H	α-helix	trans	-55.3	-38.1	174.4	0	0	0	0	0	114.6	A559 S591 R597	A559-A593 HydrophobicContact CB-CB 4.48Å; A559-A593 WeakPolarHBondContact O-CB 3.35Å; S591-A593 PolarHBondContact O-N 3.32Å; A593-R597 WeakPolarHBondContact O-CB 3.41Å; A593-R597 PolarHBondContact O-N 3.36Å
594	K	76.8	Confident	66	Low	131 Å²	131	86.6 Å²	86.6	57%	0.57	47%	0.469	S	S	*	.	H	α-helix	trans	-72.3	-37	177.1	-73.8	-179.6	-179.8	-179	0	111.9	L590 S591 N592 L598	L590-K594 HydrophobicContact CB-CB 4.45Å; L590-K594 HydrophobicContact CD2-CB 3.95Å; L590-K594 HydrophobicContact CG-CB 4.22Å; L590-K594 HydrophobicContact CG-CD 4.46Å; S591-K594 WeakPolarHBondContact O-CB 3.21Å; S591-K594 PolarHBondContact O-N 2.97Å; S591-K594 WeakPolarHBondContact OG-CG 3.42Å; N592-K594 VanDerWaalsContact C-N 3.31Å; N592-K594 PolarHBondContact O-N 3.42Å; K594-L598 WeakPolarHBondContact O-CG 3.23Å; K594-L598 PolarHBondContact O-N 2.94Å
595	V	81.9	Confident	68.6	Low	58 Å²	58	86.6 Å²	86.6	35%	0.352	46%	0.463	S	S	.	.	H	α-helix	trans	-66.9	-46.4	176.2	178.1	0	0	0	0	110.1	L590 S591 N592 R597 L598 Q599	L590-V595 HydrophobicContact CB-CG2 3.81Å; L590-V595 HydrophobicContact CD2-CG2 4.24Å; S591-V595 PolarHBondContact O-N 2.94Å; N592-V595 PolarHBondContact O-N 3.44Å; V595-R597 PolarHBondContact O-N 2.98Å; V595-L598 PolarHBondContact O-N 3.21Å; V595-Q599 WeakPolarHBondContact O-CG 3.32Å; V595-Q599 PolarHBondContact O-N 3.08Å
596	L	83.7	Confident	71	Confident	1 Å²	1	87.9 Å²	87.9	1%	0.005	46%	0.455	C	S	.	.	H	α-helix	trans	-59.7	-44.9	177.6	-178.9	66.7	0	0	0	111.7	F543 I555 A559 F567 L569 N592 L598 Q599 I600	F543-L596 HydrophobicContact CZ-CD1 4.16Å; I555-L596 HydrophobicContact CG2-CD2 4.24Å; A559-L596 HydrophobicContact CB-CD2 3.44Å; A559-L596 VanDerWaalsContact CB-CD2 3.44Å; F567-L596 HydrophobicContact CB-CD1 4.41Å; F567-L596 HydrophobicContact CB-CD2 4.13Å; F567-L596 HydrophobicContact CD2-CD2 4.23Å; F567-L596 HydrophobicContact CG-CD2 4.18Å; L569-L596 HydrophobicContact CD1-CD1 3.5Å; L569-L596 VanDerWaalsContact CD1-CD1 3.5Å; L569-L596 HydrophobicContact CG-CD1 4.23Å; N592-L596 WeakPolarHBondContact O-CB 3.38Å; N592-L596 PolarHBondContact O-N 3Å; L596-L598 VanDerWaalsContact C-N 3.34Å; L596-L598 PolarHBondContact O-N 3.33Å; L596-Q599 WeakPolarHBondContact O-CB 3.41Å; L596-Q599 PolarHBondContact O-N 3.48Å; L596-Q599 VanDerWaalsContact O-N 3.09Å; L596-I600 HydrophobicContact CD1-CD1 4.31Å; L596-I600 HydrophobicContact CD1-CG1 4.5Å; L596-I600 HydrophobicContact CG-CD1 3.98Å; L596-I600 WeakPolarHBondContact O-CG1 3.47Å; L596-I600 PolarHBondContact O-N 3.19Å
597	R	82.4	Confident	73.1	Confident	162 Å²	162	92.4 Å²	92.4	61%	0.611	47%	0.465	S	S	*	.	H	α-helix	trans	-57.5	-45.7	176.2	-179	177	170.6	155.7	3.4	112.1	A593 V595 Q599 I600 E601	A593-R597 WeakPolarHBondContact O-CB 3.41Å; A593-R597 PolarHBondContact O-N 3.36Å; V595-R597 PolarHBondContact O-N 2.98Å; R597-Q599 VanDerWaalsContact C-N 3.29Å; R597-Q599 PolarHBondContact O-N 3.12Å; R597-I600 PolarHBondContact O-N 3.41Å; R597-E601 HydrophobicContact CG-CG 4.46Å; R597-E601 WeakPolarHBondContact CG-OE1 3.36Å; R597-E601 IonicContact CZ-OE1 3.6Å; R597-E601 IonicContact NE-OE1 2.84Å; R597-E601 PolarHBondContact NE-OE1 3.18Å; R597-E601 IonicContact NH2-OE1 2.88Å; R597-E601 WeakPolarHBondContact O-CB 3.38Å; R597-E601 WeakPolarHBondContact O-CG 3.48Å; R597-E601 PolarHBondContact O-N 2.64Å
598	L	83.4	Confident	75.2	Confident	82 Å²	82	88.3 Å²	88.3	43%	0.429	44%	0.444	S	S	.	.	H	α-helix	trans	-62.8	-35.8	176.3	-72.6	168.8	0	0	0	112.2	L590 K594 V595 L596 Q602	L590-L598 HydrophobicContact CD2-CD1 3.91Å; K594-L598 WeakPolarHBondContact O-CG 3.23Å; K594-L598 PolarHBondContact O-N 2.94Å; V595-L598 PolarHBondContact O-N 3.21Å; L596-L598 VanDerWaalsContact C-N 3.34Å; L596-L598 PolarHBondContact O-N 3.33Å; L598-Q602 WeakPolarHBondContact O-CB 3.48Å; L598-Q602 VanDerWaalsContact O-CG 3.23Å; L598-Q602 WeakPolarHBondContact O-CG 3.42Å; L598-Q602 PolarHBondContact O-N 3.05Å
599	Q	86	Confident	77.4	Confident	47 Å²	47	88.1 Å²	88.1	22%	0.22	43%	0.43	C	S	.	.	H	α-helix	trans	-67.6	-42.2	175.5	-70.7	178.4	-25.6	0	0	111.9	F543 V595 L596 R597 Q602 H603	F543-Q599 HydrophobicContact CE1-CB 4.48Å; F543-Q599 HydrophobicContact CE2-CB 3.91Å; F543-Q599 HydrophobicContact CZ-CB 3.68Å; V595-Q599 WeakPolarHBondContact O-CG 3.32Å; V595-Q599 PolarHBondContact O-N 3.08Å; L596-Q599 WeakPolarHBondContact O-CB 3.41Å; L596-Q599 PolarHBondContact O-N 3.48Å; L596-Q599 VanDerWaalsContact O-N 3.09Å; R597-Q599 VanDerWaalsContact C-N 3.29Å; R597-Q599 PolarHBondContact O-N 3.12Å; Q599-Q602 PolarHBondContact O-N 2.91Å; Q599-H603 WeakPolarHBondContact O-CB 3.45Å; Q599-H603 PolarHBondContact O-N 3.23Å
600	I	85	Confident	79.3	Confident	9 Å²	9	81.4 Å²	81.4	5%	0.046	41%	0.408	C	S	.	.	H	α-helix	trans	-64.6	-45.8	175.7	-67.3	169.4	0	0	0	110.4	F543 L552 A556 L596 R597 Q602 H603 M604	F543-I600 HydrophobicContact CE1-CG1 3.87Å; F543-I600 HydrophobicContact CZ-CG1 4.19Å; L552-I600 HydrophobicContact CB-CG2 4.15Å; A556-I600 HydrophobicContact CB-CD1 3.84Å; L596-I600 HydrophobicContact CD1-CD1 4.31Å; L596-I600 HydrophobicContact CD1-CG1 4.5Å; L596-I600 HydrophobicContact CG-CD1 3.98Å; L596-I600 WeakPolarHBondContact O-CG1 3.47Å; L596-I600 PolarHBondContact O-N 3.19Å; R597-I600 PolarHBondContact O-N 3.41Å; I600-Q602 VanDerWaalsContact C-N 3.32Å; I600-Q602 PolarHBondContact O-N 2.78Å; I600-H603 PolarHBondContact O-N 2.93Å; I600-H603 VanDerWaalsContact O-N 3.1Å; I600-M604 HydrophobicContact CG2-CE 4.07Å; I600-M604 HydrophobicContact CG2-CG 4.22Å; I600-M604 WeakPolarHBondContact O-CB 3.49Å; I600-M604 WeakPolarHBondContact O-CG 3.33Å; I600-M604 PolarHBondContact O-N 3.49Å
601	E	84.8	Confident	80.5	Confident	84 Å²	84	78.8 Å²	78.8	39%	0.393	39%	0.394	S	S	.	.	H	α-helix	trans	-58.6	-43.4	176.2	-74.4	172.5	-174.1	0	0	111.4	R597 S605	R597-E601 HydrophobicContact CG-CG 4.46Å; R597-E601 WeakPolarHBondContact CG-OE1 3.36Å; R597-E601 IonicContact CZ-OE1 3.6Å; R597-E601 IonicContact NE-OE1 2.84Å; R597-E601 PolarHBondContact NE-OE1 3.18Å; R597-E601 IonicContact NH2-OE1 2.88Å; R597-E601 WeakPolarHBondContact O-CB 3.38Å; R597-E601 WeakPolarHBondContact O-CG 3.48Å; R597-E601 PolarHBondContact O-N 2.64Å; E601-S605 PolarHBondContact O-N 3.4Å; E601-S605 VanDerWaalsContact O-N 3.11Å
602	Q	85.9	Confident	81.1	Confident	122 Å²	122	79.2 Å²	79.2	57%	0.57	39%	0.39	S	S	*	.	H	α-helix	trans	-65.5	-37.1	174.7	-75.4	175.3	14.4	0	0	112.8	L598 Q599 I600 S605	L598-Q602 WeakPolarHBondContact O-CB 3.48Å; L598-Q602 VanDerWaalsContact O-CG 3.23Å; L598-Q602 WeakPolarHBondContact O-CG 3.42Å; L598-Q602 PolarHBondContact O-N 3.05Å; Q599-Q602 PolarHBondContact O-N 2.91Å; I600-Q602 VanDerWaalsContact C-N 3.32Å; I600-Q602 PolarHBondContact O-N 2.78Å; Q602-S605 PolarHBondContact O-OG 3.26Å
603	H	84.8	Confident	81.5	Confident	18 Å²	18	81.1 Å²	81.1	8%	0.083	40%	0.4	C	S	.	.	H	α-helix	trans	-68.2	-46.8	177.5	-171.1	58.3	0	0	0	111.4	F543 V546 N547 Q599 I600 S605 K606	F543-H603 HydrophobicContact CD1-CB 3.85Å; F543-H603 AromaticContact CD1-CD2 3.94Å; F543-H603 AromaticContact CD1-CG 3.75Å; F543-H603 HydrophobicContact CE1-CB 4.33Å; F543-H603 PolarHBondContact O-CE1 3.34Å; F543-H603 PolarHBondContact O-ND1 3.46Å; V546-H603 PolarHBondContact O-NE2 3.19Å; N547-H603 PolarHBondContact OD1-NE2 3.19Å; N547-H603 VanDerWaalsContact OD1-NE2 3.15Å; Q599-H603 WeakPolarHBondContact O-CB 3.45Å; Q599-H603 PolarHBondContact O-N 3.23Å; I600-H603 PolarHBondContact O-N 2.93Å; I600-H603 VanDerWaalsContact O-N 3.1Å; H603-S605 PolarHBondContact O-N 3.09Å; H603-K606 PolarHBondContact O-N 3.02Å; H603-K606 VanDerWaalsContact O-N 3.16Å
604	M	82.1	Confident	82	Confident	77 Å²	77	80 Å²	80	38%	0.379	39%	0.391	S	S	.	.	H	α-helix	trans	-64.9	-23.3	177.9	-68.2	-149.2	-72.9	0	0	113.5	P549 L552 I600 K606	P549-M604 HydrophobicContact CB-SD 4.39Å; L552-M604 HydrophobicContact CD1-CG 3.95Å; L552-M604 HydrophobicContact CD1-SD 4.35Å; I600-M604 HydrophobicContact CG2-CE 4.07Å; I600-M604 HydrophobicContact CG2-CG 4.22Å; I600-M604 WeakPolarHBondContact O-CB 3.49Å; I600-M604 WeakPolarHBondContact O-CG 3.33Å; I600-M604 PolarHBondContact O-N 3.49Å; M604-K606 VanDerWaalsContact C-N 3.26Å; M604-K606 PolarHBondContact O-N 3.46Å
605	S	81.3	Confident	82.4	Confident	97 Å²	97	73.8 Å²	73.8	68%	0.678	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-12.3	176.1	74.1	0	0	0	0	114.7	E601 Q602 H603	E601-S605 PolarHBondContact O-N 3.4Å; E601-S605 VanDerWaalsContact O-N 3.11Å; Q602-S605 PolarHBondContact O-OG 3.26Å; H603-S605 PolarHBondContact O-N 3.09Å
606	K	81.8	Confident	82.5	Confident	136 Å²	136	74 Å²	74	59%	0.591	36%	0.36	S	S	*	.	S	Bend	trans	-91.6	154.9	-179	-64.3	174.7	-171.9	167.7	0	111.4	H603 M604 R608	H603-K606 PolarHBondContact O-N 3.02Å; H603-K606 VanDerWaalsContact O-N 3.16Å; M604-K606 VanDerWaalsContact C-N 3.26Å; M604-K606 PolarHBondContact O-N 3.46Å; K606-R608 PolarHBondContact O-N 3.24Å
607	Q	72.7	Confident	82.6	Confident	199 Å²	199	75.8 Å²	75.8	93%	0.93	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-63.4	123.6	170.3	-166.7	174.1	3.8	0	0	109.2
608	R	75.8	Confident	83	Confident	117 Å²	117	68.1 Å²	68.1	44%	0.442	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-92.6	135.6	-175.7	-69	-179.3	-75.8	175.7	-1.2	110.3	N547 K606	N547-R608 HydrophobicContact CB-CG 4.49Å; N547-R608 WeakPolarHBondContact O-CD 3.4Å; N547-R608 PolarHBondContact O-NH1 3.01Å; K606-R608 PolarHBondContact O-N 3.24Å
609	P	80.5	Confident	83.1	Confident	64 Å²	64	64.4 Å²	64.4	42%	0.416	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-64.5	158.9	168.2	29.9	-33.2	0	0	0	109.6	D613	P609-D613 HydrophobicContact CB-CB 4.27Å
610	T	81.8	Confident	83.1	Confident	76 Å²	76	66.4 Å²	66.4	47%	0.466	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-63.5	157.3	170.9	69	0	0	0	0	109.8	E612 D613 S614	T610-E612 PolarHBondContact O-N 2.88Å; T610-D613 PolarHBondContact O-N 3.26Å; T610-D613 WeakPolarHBondContact OG1-CB 3.36Å; T610-D613 PolarHBondContact OG1-N 3.37Å; T610-D613 PolarHBondContact OG1-OD2 3.02Å; T610-S614 WeakPolarHBondContact O-CB 3.44Å; T610-S614 PolarHBondContact O-N 2.87Å
611	L	82.7	Confident	83.1	Confident	45 Å²	45	71.8 Å²	71.8	24%	0.236	37%	0.368	C	S	.	.	H	α-helix	trans	-58.5	-40.2	178.5	-179.6	61	0	0	0	111	L455 Q514 V515 S614 L615	L455-L611 HydrophobicContact CD1-CD2 3.81Å; L455-L611 HydrophobicContact CD1-CG 4.06Å; Q514-L611 HydrophobicContact CB-CD1 3.68Å; V515-L611 HydrophobicContact CG2-CD2 4.26Å; L611-S614 WeakPolarHBondContact O-CB 3.34Å; L611-S614 PolarHBondContact O-N 3.34Å; L611-L615 HydrophobicContact CD1-CD1 4.23Å; L611-L615 HydrophobicContact CD1-CG 4.38Å; L611-L615 HydrophobicContact CG-CD1 4.03Å; L611-L615 VanDerWaalsContact O-CG 3.29Å; L611-L615 WeakPolarHBondContact O-CG 3.46Å; L611-L615 PolarHBondContact O-N 3.33Å
612	E	81.3	Confident	83.2	Confident	65 Å²	65	68.4 Å²	68.4	30%	0.304	35%	0.352	S	S	.	.	H	α-helix	trans	-62.4	-48.5	177.7	-62.3	-179.7	161.2	0	0	111.8	V453 L455 T610 S614 L615 K616	V453-E612 HydrophobicContact CG1-CB 4.27Å; V453-E612 HydrophobicContact CG1-CG 4.19Å; L455-E612 HydrophobicContact CD1-CG 3.86Å; L455-E612 HydrophobicContact CG-CG 4.12Å; L455-E612 PolarHBondContact N-OE1 2.65Å; T610-E612 PolarHBondContact O-N 2.88Å; E612-S614 VanDerWaalsContact C-N 3.31Å; E612-S614 PolarHBondContact O-N 3.16Å; E612-L615 PolarHBondContact O-N 2.84Å; E612-K616 WeakPolarHBondContact O-CG 3.25Å; E612-K616 PolarHBondContact O-N 3.47Å
613	D	82	Confident	83.1	Confident	89 Å²	89	62.7 Å²	62.7	48%	0.476	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-39.7	177.4	-65.4	-38.5	0	0	0	111.8	P609 T610 K616 S617	P609-D613 HydrophobicContact CB-CB 4.27Å; T610-D613 PolarHBondContact O-N 3.26Å; T610-D613 WeakPolarHBondContact OG1-CB 3.36Å; T610-D613 PolarHBondContact OG1-N 3.37Å; T610-D613 PolarHBondContact OG1-OD2 3.02Å; D613-K616 PolarHBondContact O-N 3.38Å; D613-S617 PolarHBondContact O-N 3.2Å; D613-S617 PolarHBondContact O-OG 3.4Å
614	S	85.7	Confident	83	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.014	35%	0.349	C	S	.	.	H	α-helix	trans	-60.7	-45.6	175.4	-168.6	0	0	0	0	110.8	Y545 N547 T610 L611 E612 S617 F618	Y545-S614 PolarHBondContact O-OG 3.44Å; Y545-S614 VanDerWaalsContact O-OG 3.13Å; N547-S614 PolarHBondContact ND2-OG 2.87Å; T610-S614 WeakPolarHBondContact O-CB 3.44Å; T610-S614 PolarHBondContact O-N 2.87Å; L611-S614 WeakPolarHBondContact O-CB 3.34Å; L611-S614 PolarHBondContact O-N 3.34Å; E612-S614 VanDerWaalsContact C-N 3.31Å; E612-S614 PolarHBondContact O-N 3.16Å; S614-S617 PolarHBondContact O-N 3.01Å; S614-S617 PolarHBondContact O-OG 3.26Å; S614-F618 VanDerWaalsContact O-CB 3.31Å; S614-F618 WeakPolarHBondContact O-CB 3.18Å; S614-F618 PolarHBondContact O-N 3.19Å
615	L	85.3	Confident	83	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-68.3	-40.2	179.3	-71.1	168.4	0	0	0	112.6	L455 I482 L512 V515 L611 E612 S617 F618 F619	L455-L615 HydrophobicContact CD1-CD1 4.25Å; I482-L615 HydrophobicContact CD1-CD1 4.21Å; L512-L615 HydrophobicContact CD2-CD2 4.09Å; V515-L615 HydrophobicContact CG2-CD1 3.49Å; V515-L615 VanDerWaalsContact CG2-CD1 3.49Å; L611-L615 HydrophobicContact CD1-CD1 4.23Å; L611-L615 HydrophobicContact CD1-CG 4.38Å; L611-L615 HydrophobicContact CG-CD1 4.03Å; L611-L615 VanDerWaalsContact O-CG 3.29Å; L611-L615 WeakPolarHBondContact O-CG 3.46Å; L611-L615 PolarHBondContact O-N 3.33Å; E612-L615 PolarHBondContact O-N 2.84Å; L615-S617 VanDerWaalsContact C-N 3.34Å; L615-S617 PolarHBondContact O-N 3.22Å; L615-F618 WeakPolarHBondContact O-CB 3.42Å; L615-F618 PolarHBondContact O-N 3.15Å; L615-F618 VanDerWaalsContact O-N 3.13Å; L615-F619 HydrophobicContact CB-CD2 4.47Å; L615-F619 HydrophobicContact CB-CE2 4.27Å; L615-F619 HydrophobicContact CD2-CE2 4.39Å; L615-F619 WeakPolarHBondContact O-CD2 3.49Å; L615-F619 PolarHBondContact O-N 2.95Å
616	K	84.6	Confident	83.2	Confident	63 Å²	63	65.1 Å²	65.1	27%	0.274	32%	0.321	S	S	.	.	H	α-helix	trans	-58.8	-45.9	173.7	-70.8	-174.1	-172.6	-174.4	0	111.4	S450 D451 V453 E612 D613 F618 S620	S450-K616 WeakPolarHBondContact O-CD 3.32Å; S450-K616 WeakPolarHBondContact O-CE 3.45Å; S450-K616 WeakPolarHBondContact O-CG 3.46Å; D451-K616 PolarHBondContact O-NZ 3.04Å; V453-K616 HydrophobicContact CB-CG 4.31Å; V453-K616 HydrophobicContact CG2-CD 4.4Å; V453-K616 HydrophobicContact CG2-CG 3.76Å; E612-K616 WeakPolarHBondContact O-CG 3.25Å; E612-K616 PolarHBondContact O-N 3.47Å; D613-K616 PolarHBondContact O-N 3.38Å; K616-F618 VanDerWaalsContact C-N 3.32Å; K616-F618 PolarHBondContact O-N 3.37Å; K616-S620 WeakPolarHBondContact O-CB 3.36Å; K616-S620 PolarHBondContact O-N 3.42Å; K616-S620 VanDerWaalsContact O-N 3.16Å; K616-S620 PolarHBondContact O-OG 3.31Å
617	S	85.8	Confident	83.3	Confident	38 Å²	38	61 Å²	61	27%	0.266	30%	0.303	S	S	.	.	H	α-helix	trans	-64.6	-37.2	174.7	77.4	0	0	0	0	112.1	D613 S614 L615 S620 E621	D613-S617 PolarHBondContact O-N 3.2Å; D613-S617 PolarHBondContact O-OG 3.4Å; S614-S617 PolarHBondContact O-N 3.01Å; S614-S617 PolarHBondContact O-OG 3.26Å; L615-S617 VanDerWaalsContact C-N 3.34Å; L615-S617 PolarHBondContact O-N 3.22Å; S617-S620 WeakPolarHBondContact CA-OG 3.48Å; S617-S620 PolarHBondContact O-OG 3.28Å; S617-S620 VanDerWaalsContact O-OG 3.07Å; S617-E621 VanDerWaalsContact O-CB 3.27Å; S617-E621 WeakPolarHBondContact O-CB 3.41Å; S617-E621 VanDerWaalsContact O-CG 3.32Å; S617-E621 WeakPolarHBondContact O-CG 3.31Å; S617-E621 PolarHBondContact O-N 3.24Å
618	F	88.8	Confident	83.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.7	-48.3	179.6	177.5	-112.3	0	0	0	112.2	H508 V511 L512 Y545 S614 L615 K616 Q622 I626	H508-F618 HydrophobicContact CB-CZ 4.1Å; H508-F618 AromaticContact CG-CZ 3.98Å; H508-F618 AromaticContact ND1-CE2 3.48Å; H508-F618 WeakPolarHBondContact ND1-CE2 3.43Å; H508-F618 AromaticContact ND1-CZ 3.4Å; H508-F618 WeakPolarHBondContact ND1-CZ 3.45Å; V511-F618 HydrophobicContact CB-CE1 4.42Å; V511-F618 HydrophobicContact CB-CE2 4.23Å; V511-F618 HydrophobicContact CB-CZ 4.14Å; V511-F618 HydrophobicContact CG1-CB 4.44Å; V511-F618 HydrophobicContact CG1-CD1 3.86Å; V511-F618 HydrophobicContact CG1-CD2 3.84Å; V511-F618 HydrophobicContact CG1-CE1 3.97Å; V511-F618 HydrophobicContact CG1-CE2 3.97Å; V511-F618 HydrophobicContact CG1-CG 3.78Å; V511-F618 HydrophobicContact CG1-CZ 4.03Å; V511-F618 HydrophobicContact CG2-CE2 4.29Å; L512-F618 HydrophobicContact CD2-CD1 4.22Å; L512-F618 HydrophobicContact CD2-CE1 3.88Å; L512-F618 HydrophobicContact CG-CE1 4.23Å; Y545-F618 HydrophobicContact CD1-CB 3.81Å; Y545-F618 HydrophobicContact CD1-CD2 4.07Å; Y545-F618 HydrophobicContact CD1-CG 4.41Å; Y545-F618 AromaticContact CD2-CD2 3.72Å; Y545-F618 HydrophobicContact CD2-CD2 3.72Å; Y545-F618 HydrophobicContact CD2-CE2 4.28Å; Y545-F618 HydrophobicContact CE1-CB 4.06Å; Y545-F618 HydrophobicContact CE1-CD2 4.3Å; Y545-F618 AromaticContact CE2-CD2 3.95Å; Y545-F618 HydrophobicContact CE2-CD2 3.95Å; Y545-F618 HydrophobicContact CG-CB 4.29Å; Y545-F618 AromaticContact CG-CD2 3.78Å; Y545-F618 HydrophobicContact CG-CD2 3.78Å; Y545-F618 HydrophobicContact CG-CG 4.44Å; S614-F618 VanDerWaalsContact O-CB 3.31Å; S614-F618 WeakPolarHBondContact O-CB 3.18Å; S614-F618 PolarHBondContact O-N 3.19Å; L615-F618 WeakPolarHBondContact O-CB 3.42Å; L615-F618 PolarHBondContact O-N 3.15Å; L615-F618 VanDerWaalsContact O-N 3.13Å; K616-F618 VanDerWaalsContact C-N 3.32Å; K616-F618 PolarHBondContact O-N 3.37Å; F618-Q622 HydrophobicContact CD2-CB 3.92Å; F618-Q622 HydrophobicContact CD2-CG 3.75Å; F618-Q622 HydrophobicContact CE2-CB 3.83Å; F618-Q622 HydrophobicContact CE2-CG 3.89Å; F618-Q622 WeakPolarHBondContact O-CA 3.5Å; F618-Q622 VanDerWaalsContact O-CB 3.23Å; F618-Q622 WeakPolarHBondContact O-CB 3.42Å; F618-Q622 PolarHBondContact O-N 3.34Å; F618-I626 HydrophobicContact CD1-CD1 4.16Å; F618-I626 HydrophobicContact CE1-CD1 3.43Å; F618-I626 VanDerWaalsContact CE1-CD1 3.43Å; F618-I626 HydrophobicContact CE1-CG1 4.38Å; F618-I626 HydrophobicContact CE2-CD1 4.41Å; F618-I626 HydrophobicContact CZ-CD1 3.57Å; F618-I626 HydrophobicContact CZ-CG1 4.06Å
619	F	86.9	Confident	84.2	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-39.4	179.5	-71.1	-62.1	0	0	0	112.2	L443 V446 I482 L485 L512 L615 G623 I626	L443-F619 HydrophobicContact CD1-CD1 3.75Å; L443-F619 HydrophobicContact CD1-CE1 4.05Å; V446-F619 HydrophobicContact CG1-CB 4.49Å; V446-F619 HydrophobicContact CG1-CD1 3.88Å; V446-F619 HydrophobicContact CG1-CD2 3.58Å; V446-F619 HydrophobicContact CG1-CE1 3.92Å; V446-F619 HydrophobicContact CG1-CE2 3.63Å; V446-F619 HydrophobicContact CG1-CG 3.72Å; V446-F619 HydrophobicContact CG1-CZ 3.8Å; I482-F619 HydrophobicContact CD1-CE2 4.37Å; I482-F619 HydrophobicContact CG1-CE2 4.36Å; I482-F619 HydrophobicContact CG1-CZ 4.1Å; L485-F619 HydrophobicContact CD1-CE1 4.27Å; L512-F619 HydrophobicContact CD2-CE1 4.06Å; L512-F619 HydrophobicContact CD2-CE2 4.36Å; L512-F619 HydrophobicContact CD2-CZ 3.53Å; L615-F619 HydrophobicContact CB-CD2 4.47Å; L615-F619 HydrophobicContact CB-CE2 4.27Å; L615-F619 HydrophobicContact CD2-CE2 4.39Å; L615-F619 WeakPolarHBondContact O-CD2 3.49Å; L615-F619 PolarHBondContact O-N 2.95Å; F619-G623 VanDerWaalsContact O-CA 3.31Å; F619-G623 WeakPolarHBondContact O-CA 3.4Å; F619-G623 PolarHBondContact O-N 2.94Å; F619-I626 HydrophobicContact CD1-CD1 4.29Å; F619-I626 HydrophobicContact CE1-CD1 4.48Å
620	S	84.7	Confident	84.3	Confident	90 Å²	90	49.3 Å²	49.3	63%	0.629	25%	0.247	S	C	*	.	H	α-helix	trans	-69.3	-42	178.1	55.7	0	0	0	0	113.4	K616 S617	K616-S620 WeakPolarHBondContact O-CB 3.36Å; K616-S620 PolarHBondContact O-N 3.42Å; K616-S620 VanDerWaalsContact O-N 3.16Å; K616-S620 PolarHBondContact O-OG 3.31Å; S617-S620 WeakPolarHBondContact CA-OG 3.48Å; S617-S620 PolarHBondContact O-OG 3.28Å; S617-S620 VanDerWaalsContact O-OG 3.07Å
621	E	86.6	Confident	83.9	Confident	122 Å²	122	51.5 Å²	51.5	57%	0.57	25%	0.25	S	C	*	.	H	α-helix	trans	-89.3	-32.3	-175.7	-64.1	-178.9	168	0	0	113.8	Y545 S617	Y545-E621 PolarHBondContact OH-OE2 3.18Å; S617-E621 VanDerWaalsContact O-CB 3.27Å; S617-E621 WeakPolarHBondContact O-CB 3.41Å; S617-E621 VanDerWaalsContact O-CG 3.32Å; S617-E621 WeakPolarHBondContact O-CG 3.31Å; S617-E621 PolarHBondContact O-N 3.24Å
622	Q	86	Confident	82.8	Confident	13 Å²	13	53.9 Å²	53.9	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-107.3	-2	-175.8	-53.5	-56.9	-44.2	0	0	113.8	N541 Y545 F618 E624 R625 I626	N541-Q622 PolarHBondContact ND2-NE2 3.07Å; N541-Q622 PolarHBondContact ND2-OE1 2.88Å; Y545-Q622 HydrophobicContact CE2-CG 3.6Å; Y545-Q622 WeakPolarHBondContact OH-CG 3.45Å; Y545-Q622 PolarHBondContact OH-NE2 2.99Å; F618-Q622 HydrophobicContact CD2-CB 3.92Å; F618-Q622 HydrophobicContact CD2-CG 3.75Å; F618-Q622 HydrophobicContact CE2-CB 3.83Å; F618-Q622 HydrophobicContact CE2-CG 3.89Å; F618-Q622 WeakPolarHBondContact O-CA 3.5Å; F618-Q622 VanDerWaalsContact O-CB 3.23Å; F618-Q622 WeakPolarHBondContact O-CB 3.42Å; F618-Q622 PolarHBondContact O-N 3.34Å; Q622-E624 VanDerWaalsContact C-N 3.28Å; Q622-E624 PolarHBondContact O-N 3.18Å; Q622-E624 VanDerWaalsContact O-N 3.16Å; Q622-R625 WeakPolarHBondContact O-CA 3.18Å; Q622-R625 WeakPolarHBondContact O-CB 3.43Å; Q622-R625 PolarHBondContact O-N 2.88Å; Q622-I626 HydrophobicContact CB-CD1 4.48Å; Q622-I626 WeakPolarHBondContact O-CG1 3.36Å; Q622-I626 PolarHBondContact O-N 3.19Å
623	G	83	Confident	81.4	Confident	2 Å²	2	55.4 Å²	55.4	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-48.4	-45.9	-179.4	0	0	0	0	0	113.6	F619 R625 I626 K627	F619-G623 VanDerWaalsContact O-CA 3.31Å; F619-G623 WeakPolarHBondContact O-CA 3.4Å; F619-G623 PolarHBondContact O-N 2.94Å; G623-R625 VanDerWaalsContact C-N 3.33Å; G623-R625 PolarHBondContact O-N 3.22Å; G623-I626 PolarHBondContact O-N 3.24Å; G623-K627 WeakPolarHBondContact O-CG 3.25Å; G623-K627 PolarHBondContact O-N 2.89Å
624	E	83.5	Confident	79.4	Confident	121 Å²	121	66.1 Å²	66.1	57%	0.565	31%	0.31	S	S	*	.	H	α-helix	trans	-67.2	-27.3	176.1	-73.9	-59.1	128.8	0	0	114.4	Q622 K627 K628	Q622-E624 VanDerWaalsContact C-N 3.28Å; Q622-E624 PolarHBondContact O-N 3.18Å; Q622-E624 VanDerWaalsContact O-N 3.16Å; E624-K627 VanDerWaalsContact OE1-CD 3.26Å; E624-K627 WeakPolarHBondContact OE1-CD 3.38Å; E624-K627 IonicContact OE1-NZ 2.74Å; E624-K627 PolarHBondContact OE1-NZ 3.5Å; E624-K627 VanDerWaalsContact OE1-NZ 3.12Å; E624-K628 WeakPolarHBondContact O-CG 3.47Å; E624-K628 PolarHBondContact O-N 3.37Å
625	R	83.5	Confident	79.1	Confident	120 Å²	120	69.4 Å²	69.4	45%	0.453	33%	0.325	S	S	.	.	H	α-helix	trans	-75.7	-41.7	173.1	-62.6	-157.2	-171.1	163.5	-3.4	111	N541 Q622 G623 K627 K628 C629	N541-R625 PolarHBondContact ND2-NH1 3.09Å; N541-R625 VanDerWaalsContact ND2-NH1 3.12Å; Q622-R625 WeakPolarHBondContact O-CA 3.18Å; Q622-R625 WeakPolarHBondContact O-CB 3.43Å; Q622-R625 PolarHBondContact O-N 2.88Å; G623-R625 VanDerWaalsContact C-N 3.33Å; G623-R625 PolarHBondContact O-N 3.22Å; R625-K627 VanDerWaalsContact C-N 3.31Å; R625-K627 PolarHBondContact O-N 2.78Å; R625-K628 WeakPolarHBondContact O-CB 3.38Å; R625-K628 PolarHBondContact O-N 2.86Å; R625-C629 PolarHBondContact O-N 3.03Å
626	I	84.2	Confident	78.8	Confident	1 Å²	1	73 Å²	73	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-61.1	-41.9	173.8	-56.4	166.9	0	0	0	109.9	L443 F618 F619 Q622 G623 K628 C629 F630	L443-I626 HydrophobicContact CD1-CD1 4.36Å; L443-I626 HydrophobicContact CD1-CG2 4.39Å; L443-I626 HydrophobicContact CD2-CB 3.95Å; L443-I626 HydrophobicContact CD2-CG2 3.85Å; F618-I626 HydrophobicContact CD1-CD1 4.16Å; F618-I626 HydrophobicContact CE1-CD1 3.43Å; F618-I626 VanDerWaalsContact CE1-CD1 3.43Å; F618-I626 HydrophobicContact CE1-CG1 4.38Å; F618-I626 HydrophobicContact CE2-CD1 4.41Å; F618-I626 HydrophobicContact CZ-CD1 3.57Å; F618-I626 HydrophobicContact CZ-CG1 4.06Å; F619-I626 HydrophobicContact CD1-CD1 4.29Å; F619-I626 HydrophobicContact CE1-CD1 4.48Å; Q622-I626 HydrophobicContact CB-CD1 4.48Å; Q622-I626 WeakPolarHBondContact O-CG1 3.36Å; Q622-I626 PolarHBondContact O-N 3.19Å; G623-I626 PolarHBondContact O-N 3.24Å; I626-K628 VanDerWaalsContact C-N 3.26Å; I626-K628 PolarHBondContact O-N 3.47Å; I626-C629 VanDerWaalsContact O-CB 3.25Å; I626-C629 WeakPolarHBondContact O-CB 3.49Å; I626-C629 PolarHBondContact O-N 3.14Å; I626-C629 VanDerWaalsContact O-N 3.07Å; I626-F630 HydrophobicContact CG2-CE2 3.84Å; I626-F630 VanDerWaalsContact O-CD2 3.32Å; I626-F630 WeakPolarHBondContact O-CD2 3.28Å
627	K	84.9	Confident	78.5	Confident	51 Å²	51	73.6 Å²	73.6	22%	0.222	35%	0.345	C	S	.	.	H	α-helix	trans	-57.6	-35.8	172.9	-75.3	170.2	178.4	142.4	0	113.1	L443 E447 G623 E624 R625 F630	L443-K627 HydrophobicContact CD2-CD 4.39Å; L443-K627 HydrophobicContact CD2-CG 3.5Å; E447-K627 WeakPolarHBondContact OE1-CE 3.47Å; E447-K627 IonicContact OE1-NZ 3.12Å; E447-K627 PolarHBondContact OE1-NZ 3.14Å; E447-K627 WeakPolarHBondContact OE2-CE 3.35Å; E447-K627 IonicContact OE2-NZ 2.81Å; E447-K627 PolarHBondContact OE2-NZ 3.31Å; G623-K627 WeakPolarHBondContact O-CG 3.25Å; G623-K627 PolarHBondContact O-N 2.89Å; E624-K627 VanDerWaalsContact OE1-CD 3.26Å; E624-K627 WeakPolarHBondContact OE1-CD 3.38Å; E624-K627 IonicContact OE1-NZ 2.74Å; E624-K627 PolarHBondContact OE1-NZ 3.5Å; E624-K627 VanDerWaalsContact OE1-NZ 3.12Å; R625-K627 VanDerWaalsContact C-N 3.31Å; R625-K627 PolarHBondContact O-N 2.78Å; K627-F630 PolarHBondContact O-N 3.31Å
628	K	84.5	Confident	78.1	Confident	127 Å²	127	75.6 Å²	75.6	55%	0.552	35%	0.35	S	S	*	.	H	α-helix	trans	-69	-32.5	176.9	-73.7	170.4	-173.5	174.8	0	112.3	E624 R625 I626 F630 K631	E624-K628 WeakPolarHBondContact O-CG 3.47Å; E624-K628 PolarHBondContact O-N 3.37Å; R625-K628 WeakPolarHBondContact O-CB 3.38Å; R625-K628 PolarHBondContact O-N 2.86Å; I626-K628 VanDerWaalsContact C-N 3.26Å; I626-K628 PolarHBondContact O-N 3.47Å; K628-F630 PolarHBondContact O-N 3.39Å; K628-K631 WeakPolarHBondContact O-CB 3.37Å; K628-K631 PolarHBondContact O-N 2.71Å
629	C	82.6	Confident	77.4	Confident	7 Å²	7	80.4 Å²	80.4	5%	0.047	37%	0.372	C	S	.	.	H	α-helix	trans	-59.4	-30.4	173.6	-65.6	0	0	0	0	112.3	L489 I505 R625 I626 K631	L489-C629 HydrophobicContact CD2-CB 4.03Å; I505-C629 HydrophobicContact CD1-CB 4.46Å; I505-C629 HydrophobicContact CG1-CB 3.7Å; R625-C629 PolarHBondContact O-N 3.03Å; I626-C629 VanDerWaalsContact O-CB 3.25Å; I626-C629 WeakPolarHBondContact O-CB 3.49Å; I626-C629 PolarHBondContact O-N 3.14Å; I626-C629 VanDerWaalsContact O-N 3.07Å; C629-K631 VanDerWaalsContact C-N 3.34Å; C629-K631 PolarHBondContact O-N 3.12Å
630	F	81.7	Confident	76.7	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	14.7	175.5	-59.7	-59.3	0	0	0	114.4	A436 R440 L485 C488 L489 M492 I626 K627 K628 V632	A436-F630 HydrophobicContact CB-CB 4.38Å; A436-F630 WeakPolarHBondContact CB-O 3.49Å; R440-F630 HydrophobicContact CG-CB 4Å; R440-F630 HydrophobicContact CG-CD2 4.31Å; R440-F630 HydrophobicContact CG-CG 4.45Å; R440-F630 PolarHBondContact NH2-O 3.15Å; L485-F630 HydrophobicContact CD2-CE2 4.29Å; L485-F630 HydrophobicContact CD2-CZ 4.15Å; C488-F630 HydrophobicContact CB-CE1 3.92Å; C488-F630 HydrophobicContact CB-CZ 4.25Å; L489-F630 HydrophobicContact CD2-CE1 3.75Å; L489-F630 HydrophobicContact CD2-CE2 4.14Å; L489-F630 HydrophobicContact CD2-CZ 3.49Å; L489-F630 VanDerWaalsContact CD2-CZ 3.49Å; L489-F630 HydrophobicContact CG-CE1 4.14Å; L489-F630 HydrophobicContact CG-CZ 3.75Å; M492-F630 HydrophobicContact CG-CD1 3.78Å; M492-F630 HydrophobicContact CG-CE1 4.02Å; M492-F630 HydrophobicContact SD-CD1 4.34Å; I626-F630 HydrophobicContact CG2-CE2 3.84Å; I626-F630 VanDerWaalsContact O-CD2 3.32Å; I626-F630 WeakPolarHBondContact O-CD2 3.28Å; K627-F630 PolarHBondContact O-N 3.31Å; K628-F630 PolarHBondContact O-N 3.39Å; F630-V632 PolarHBondContact O-N 3.25Å
631	K	74.4	Confident	76.2	Confident	122 Å²	122	85.1 Å²	85.1	53%	0.53	38%	0.379	S	S	.	.			trans	-83.1	105.7	170.7	-74.8	-174.3	178.3	-174.8	0	109.8	K628 C629 N633	K628-K631 WeakPolarHBondContact O-CB 3.37Å; K628-K631 PolarHBondContact O-N 2.71Å; C629-K631 VanDerWaalsContact C-N 3.34Å; C629-K631 PolarHBondContact O-N 3.12Å; K631-N633 PolarHBondContact O-N 3.46Å
632	V	58.9	Low	75.4	Confident	95 Å²	95	82.3 Å²	82.3	58%	0.576	36%	0.364	S	S	*	.			trans	-68.1	114.5	168	-172.5	0	0	0	0	107.7	A436 F630 R634	A436-V632 HydrophobicContact CB-CG2 3.47Å; A436-V632 VanDerWaalsContact CB-CG2 3.47Å; F630-V632 PolarHBondContact O-N 3.25Å; V632-R634 PolarHBondContact O-N 2.81Å
633	N	51.4	Low	74.5	Confident	97 Å²	97	88.1 Å²	88.1	52%	0.519	39%	0.39	S	S	.	.			trans	-68.5	115.2	166.8	-71	-44.6	0	0	0	106.8	K631	K631-N633 PolarHBondContact O-N 3.46Å
634	R	41.5	Very low	73.7	Confident	314 Å²	314	95.9 Å²	95.9	100%	1.185	42%	0.423	S	S	*	.			trans	-68.6	0	167.7	-81.9	-173.3	176.7	178.4	-1.3	110.9	V632	V632-R634 PolarHBondContact O-N 2.81Å

Retrieved 634 of 634 residues in 432.4 ms (Link to these results)

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