A0A077Z654_TRITR Loading...

Innexin

Structural component of the gap junctions.

AlphaFold DB , UniProt , Accession A0A077Z654, Species TRITR (Trichuris trichiura, Whipworm), Gene inx, Length 425 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	40.8	Very low	41.9	Very low	244 Å²	244	146.9 Å²	146.9	100%	1.202	79%	0.787	S	S	*	*				0	56.5	0	-59.7	-172.6	-151.2	0	0	111.5
2	R	35.6	Very low	42.3	Very low	244 Å²	244	145.5 Å²	145.5	92%	0.921	77%	0.768	S	S	*	*			trans	-143	98.7	174.1	-75.2	-173.8	-166.1	176.3	4.4	108
3	N	38.3	Very low	42.7	Very low	158 Å²	158	138.8 Å²	138.8	85%	0.845	74%	0.737	S	S	*	*			trans	-130.6	134.8	165.2	-88.5	-15.7	0	0	0	106.4
4	L	38.2	Very low	43	Very low	174 Å²	174	140.6 Å²	140.6	91%	0.911	74%	0.735	S	S	*	*			trans	76.6	75.7	163.6	-54.8	162.6	0	0	0	116.4
5	A	41.6	Very low	43.4	Very low	103 Å²	103	135.1 Å²	135.1	85%	0.851	72%	0.718	S	S	*	*			trans	-96	103.5	144.3	0	0	0	0	0	106.6	E7	A5-E7 PolarHBondContact O-N 2.99Å
6	E	46.5	Very low	43.6	Very low	166 Å²	166	132.8 Å²	132.8	78%	0.776	71%	0.705	S	S	*	*			trans	-64.1	120.7	176.3	-137.8	176	162.7	0	0	109.1	V8	E6-V8 PolarHBondContact O-N 3.24Å
7	E	40.8	Very low	44	Very low	179 Å²	179	133.6 Å²	133.6	84%	0.836	70%	0.698	S	S	*	*			trans	-63.5	102.1	172.3	-98.5	177.5	154.6	0	0	109.7	A5 T9	A5-E7 PolarHBondContact O-N 2.99Å; E7-T9 PolarHBondContact O-N 3.39Å; E7-T9 VanDerWaalsContact O-N 3.16Å
8	V	45.4	Very low	44.5	Very low	109 Å²	109	130.4 Å²	130.4	66%	0.661	69%	0.686	S	S	*	*			trans	-75.9	98.1	167.6	-179.7	0	0	0	0	107.7	E6	E6-V8 PolarHBondContact O-N 3.24Å
9	T	42.2	Very low	44.8	Very low	69 Å²	69	129.3 Å²	129.3	42%	0.423	68%	0.68	S	S	.	*			trans	-68	144.6	174.6	52.5	0	0	0	0	111.2	E7 A11 K12	E7-T9 PolarHBondContact O-N 3.39Å; E7-T9 VanDerWaalsContact O-N 3.16Å; T9-A11 PolarHBondContact O-N 2.87Å; T9-K12 PolarHBondContact O-N 3.27Å
10	P	46	Very low	45.4	Very low	100 Å²	100	128 Å²	128	65%	0.649	67%	0.673	S	S	*	*	H	α-helix	trans	-58.8	-16.3	-179.5	21	-32.2	0	0	0	114.2	T13 K14	P10-T13 PolarHBondContact O-OG1 3.49Å; P10-K14 PolarHBondContact O-N 3.05Å
11	A	46	Very low	46	Very low	70 Å²	70	124.1 Å²	124.1	58%	0.579	66%	0.66	S	S	*	*	H	α-helix	trans	-68.9	-37.4	172.9	0	0	0	0	0	113	T9 K14 A15	T9-A11 PolarHBondContact O-N 2.87Å; A11-K14 PolarHBondContact O-N 2.95Å; A11-A15 PolarHBondContact O-N 2.86Å
12	K	45.8	Very low	46.6	Very low	130 Å²	130	117.5 Å²	117.5	57%	0.565	63%	0.628	S	S	*	*	H	α-helix	trans	-68.7	-36.2	177.3	-78.7	-174.3	176.1	177.9	0	111.6	T9 A15 L16	T9-K12 PolarHBondContact O-N 3.27Å; K12-A15 PolarHBondContact O-N 2.83Å; K12-L16 PolarHBondContact O-N 3.47Å
13	T	48.1	Very low	47.9	Very low	58 Å²	58	110.6 Å²	110.6	36%	0.356	61%	0.61	S	S	.	*	H	α-helix	trans	-65.9	-44.9	175.1	-3.1	0	0	0	0	111.1	P10 A15 L16 Y17	P10-T13 PolarHBondContact O-OG1 3.49Å; T13-A15 VanDerWaalsContact C-N 3.27Å; T13-A15 PolarHBondContact O-N 3.45Å; T13-L16 PolarHBondContact O-N 2.97Å; T13-L16 VanDerWaalsContact O-N 3.1Å; T13-Y17 HydrophobicContact CG2-CE2 4.37Å; T13-Y17 WeakPolarHBondContact O-CD2 3.39Å; T13-Y17 VanDerWaalsContact O-CE2 3.23Å; T13-Y17 WeakPolarHBondContact O-CE2 3.33Å
14	K	46.2	Very low	48.9	Very low	165 Å²	165	105.9 Å²	105.9	72%	0.717	59%	0.589	S	S	*	*	H	α-helix	trans	-60.9	-30.6	176.4	-78.5	-175.3	178.4	-178.5	0	114	P10 A11 P18	P10-K14 PolarHBondContact O-N 3.05Å; A11-K14 PolarHBondContact O-N 2.95Å; K14-P18 WeakPolarHBondContact O-CD 3.42Å
15	A	49.2	Very low	50.2	Low	58 Å²	58	103.9 Å²	103.9	48%	0.479	58%	0.577	S	S	.	*	H	α-helix	trans	-78.5	-20.7	176.1	0	0	0	0	0	114	A11 K12 T13 P18	A11-A15 PolarHBondContact O-N 2.86Å; K12-A15 PolarHBondContact O-N 2.83Å; T13-A15 VanDerWaalsContact C-N 3.27Å; T13-A15 PolarHBondContact O-N 3.45Å; A15-P18 WeakPolarHBondContact O-CD 3.29Å; A15-P18 WeakPolarHBondContact O-CG 3.4Å
16	L	46.4	Very low	51.3	Low	97 Å²	97	103.8 Å²	103.8	51%	0.508	56%	0.562	S	S	.	*	H	α-helix	trans	-79	-33.6	179.8	-167.9	69.7	0	0	0	112.7	K12 T13 L19 L20	K12-L16 PolarHBondContact O-N 3.47Å; T13-L16 PolarHBondContact O-N 2.97Å; T13-L16 VanDerWaalsContact O-N 3.1Å; L16-L19 PolarHBondContact O-N 2.96Å; L16-L20 HydrophobicContact CD2-CD1 4.38Å; L16-L20 HydrophobicContact CG-CD1 4.13Å; L16-L20 PolarHBondContact O-N 3.25Å; L16-L20 VanDerWaalsContact O-N 3.1Å
17	Y	51.5	Low	52.4	Low	148 Å²	148	100.5 Å²	100.5	58%	0.58	55%	0.553	S	S	*	*	H	α-helix	trans	-57.3	-46.3	178	-67.9	-77.6	0	0	0	114.6	T13 L19 L20 A21	T13-Y17 HydrophobicContact CG2-CE2 4.37Å; T13-Y17 WeakPolarHBondContact O-CD2 3.39Å; T13-Y17 VanDerWaalsContact O-CE2 3.23Å; T13-Y17 WeakPolarHBondContact O-CE2 3.33Å; Y17-L19 VanDerWaalsContact C-N 3.29Å; Y17-L19 PolarHBondContact O-N 3.48Å; Y17-L20 PolarHBondContact O-N 2.66Å; Y17-A21 WeakPolarHBondContact O-CB 3.41Å; Y17-A21 PolarHBondContact O-N 2.6Å
18	P	51.7	Low	53.8	Low	76 Å²	76	94.6 Å²	94.6	49%	0.494	53%	0.527	S	S	.	.	H	α-helix	trans	-65.7	-30.2	178	22	-31.3	0	0	0	112.9	K14 A15 L22	K14-P18 WeakPolarHBondContact O-CD 3.42Å; A15-P18 WeakPolarHBondContact O-CD 3.29Å; A15-P18 WeakPolarHBondContact O-CG 3.4Å; P18-L22 WeakPolarHBondContact O-CB 3.49Å; P18-L22 PolarHBondContact O-N 2.97Å
19	L	50.4	Low	55.1	Low	108 Å²	108	90.8 Å²	90.8	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-69.8	-45.6	175.7	-72.6	169	0	0	0	111.8	L16 Y17 A21 L22 D23	L16-L19 PolarHBondContact O-N 2.96Å; Y17-L19 VanDerWaalsContact C-N 3.29Å; Y17-L19 PolarHBondContact O-N 3.48Å; L19-A21 VanDerWaalsContact C-N 3.29Å; L19-A21 PolarHBondContact O-N 3.35Å; L19-L22 PolarHBondContact O-N 3.28Å; L19-L22 VanDerWaalsContact O-N 3.14Å; L19-D23 PolarHBondContact O-N 3.33Å
20	L	57.4	Low	56.6	Low	104 Å²	104	90.4 Å²	90.4	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-35.7	174.2	-71.4	169.2	0	0	0	112.2	L16 Y17 S24	L16-L20 HydrophobicContact CD2-CD1 4.38Å; L16-L20 HydrophobicContact CG-CD1 4.13Å; L16-L20 PolarHBondContact O-N 3.25Å; L16-L20 VanDerWaalsContact O-N 3.1Å; Y17-L20 PolarHBondContact O-N 2.66Å; L20-S24 WeakPolarHBondContact O-CB 3.42Å; L20-S24 PolarHBondContact O-N 3.33Å; L20-S24 PolarHBondContact O-OG 3.36Å
21	A	57	Low	57.9	Low	47 Å²	47	88.5 Å²	88.5	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-65.4	-40.7	172.7	0	0	0	0	0	111.6	Y17 L19 S24 M25	Y17-A21 WeakPolarHBondContact O-CB 3.41Å; Y17-A21 PolarHBondContact O-N 2.6Å; L19-A21 VanDerWaalsContact C-N 3.29Å; L19-A21 PolarHBondContact O-N 3.35Å; A21-S24 WeakPolarHBondContact CA-OG 3.43Å; A21-S24 PolarHBondContact O-OG 3.43Å; A21-M25 VanDerWaalsContact O-CG 3.26Å; A21-M25 WeakPolarHBondContact O-CG 3.49Å; A21-M25 PolarHBondContact O-N 3.22Å
22	L	55.2	Low	59.2	Low	104 Å²	104	88 Å²	88	55%	0.545	48%	0.48	S	S	.	.	H	α-helix	trans	-67	-43.7	178.7	-148.2	90	0	0	0	112.1	P18 L19 M25 N26	P18-L22 WeakPolarHBondContact O-CB 3.49Å; P18-L22 PolarHBondContact O-N 2.97Å; L19-L22 PolarHBondContact O-N 3.28Å; L19-L22 VanDerWaalsContact O-N 3.14Å; L22-M25 PolarHBondContact O-N 3.1Å; L22-N26 PolarHBondContact O-N 3.16Å
23	D	61.3	Low	60.6	Low	99 Å²	99	91.8 Å²	91.8	53%	0.529	49%	0.491	S	S	.	.	H	α-helix	trans	-65.1	-41.9	178.6	-76.6	-22.4	0	0	0	111.7	L19 M25 N26 V27	L19-D23 PolarHBondContact O-N 3.33Å; D23-M25 VanDerWaalsContact C-N 3.34Å; D23-M25 PolarHBondContact O-N 3.24Å; D23-N26 PolarHBondContact O-N 3.37Å; D23-V27 WeakPolarHBondContact O-CG2 3.47Å; D23-V27 PolarHBondContact O-N 3.37Å
24	S	60.8	Low	61.9	Low	59 Å²	59	92.3 Å²	92.3	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-62.7	-40	174.2	51.7	0	0	0	0	111.9	L20 A21 N26 V27 I28	L20-S24 WeakPolarHBondContact O-CB 3.42Å; L20-S24 PolarHBondContact O-N 3.33Å; L20-S24 PolarHBondContact O-OG 3.36Å; A21-S24 WeakPolarHBondContact CA-OG 3.43Å; A21-S24 PolarHBondContact O-OG 3.43Å; S24-N26 PolarHBondContact O-N 2.72Å; S24-V27 PolarHBondContact O-N 2.87Å; S24-I28 VanDerWaalsContact O-CD1 3.27Å; S24-I28 WeakPolarHBondContact O-CD1 3.43Å; S24-I28 WeakPolarHBondContact O-CG1 3.5Å; S24-I28 PolarHBondContact O-N 3.39Å
25	M	63.7	Low	63.4	Low	132 Å²	132	84.5 Å²	84.5	65%	0.65	46%	0.461	S	S	*	.	H	α-helix	trans	-63.1	-37.3	173.9	-72.2	-169.1	90.9	0	0	113.2	A21 L22 D23 I28 G29	A21-M25 VanDerWaalsContact O-CG 3.26Å; A21-M25 WeakPolarHBondContact O-CG 3.49Å; A21-M25 PolarHBondContact O-N 3.22Å; L22-M25 PolarHBondContact O-N 3.1Å; D23-M25 VanDerWaalsContact C-N 3.34Å; D23-M25 PolarHBondContact O-N 3.24Å; M25-I28 PolarHBondContact O-N 3.04Å; M25-G29 PolarHBondContact O-N 2.91Å
26	N	66.1	Low	64.9	Low	102 Å²	102	89.7 Å²	89.7	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-65.5	-42.4	175.2	-77.3	-29.6	0	0	0	112.2	L22 D23 S24 G29 S30	L22-N26 PolarHBondContact O-N 3.16Å; D23-N26 PolarHBondContact O-N 3.37Å; S24-N26 PolarHBondContact O-N 2.72Å; N26-G29 PolarHBondContact O-N 2.8Å; N26-S30 PolarHBondContact O-N 3.29Å
27	V	69.9	Low	66.5	Low	97 Å²	97	87 Å²	87	59%	0.588	47%	0.465	S	S	*	.	H	α-helix	trans	-62	-47.3	175.9	173.7	0	0	0	0	110.4	D23 S24 G29 S30 F31	D23-V27 WeakPolarHBondContact O-CG2 3.47Å; D23-V27 PolarHBondContact O-N 3.37Å; S24-V27 PolarHBondContact O-N 2.87Å; V27-G29 VanDerWaalsContact C-N 3.34Å; V27-G29 PolarHBondContact O-N 3.12Å; V27-S30 PolarHBondContact O-N 3.22Å; V27-S30 PolarHBondContact O-OG 3.2Å; V27-F31 PolarHBondContact O-N 3.35Å
28	I	69.2	Low	67.9	Low	55 Å²	55	84.5 Å²	84.5	28%	0.282	45%	0.454	S	S	.	.	H	α-helix	trans	-60.1	-45.9	176.9	-64.9	155.6	0	0	0	110.3	S24 M25 S30 F31 V32 V61	S24-I28 VanDerWaalsContact O-CD1 3.27Å; S24-I28 WeakPolarHBondContact O-CD1 3.43Å; S24-I28 WeakPolarHBondContact O-CG1 3.5Å; S24-I28 PolarHBondContact O-N 3.39Å; M25-I28 PolarHBondContact O-N 3.04Å; I28-S30 VanDerWaalsContact C-N 3.31Å; I28-S30 PolarHBondContact O-N 3.42Å; I28-F31 PolarHBondContact O-N 2.93Å; I28-F31 VanDerWaalsContact O-N 3.14Å; I28-V32 HydrophobicContact CG2-CG2 4.12Å; I28-V32 WeakPolarHBondContact O-CB 2.85Å; I28-V32 VanDerWaalsContact O-CG2 3.26Å; I28-V32 WeakPolarHBondContact O-CG2 3.45Å; I28-V32 PolarHBondContact O-N 3.04Å; I28-V61 HydrophobicContact CD1-CG2 3.43Å; I28-V61 VanDerWaalsContact CD1-CG2 3.43Å; I28-V61 HydrophobicContact CG1-CG2 4.22Å
29	G	73.7	Confident	69.4	Low	28 Å²	28	83 Å²	83	29%	0.289	44%	0.444	S	S	.	.	H	α-helix	trans	-58.9	-40.8	177.2	0	0	0	0	0	112.9	M25 N26 V27 R33	M25-G29 PolarHBondContact O-N 2.91Å; N26-G29 PolarHBondContact O-N 2.8Å; V27-G29 VanDerWaalsContact C-N 3.34Å; V27-G29 PolarHBondContact O-N 3.12Å; G29-R33 VanDerWaalsContact O-CG 3.29Å; G29-R33 WeakPolarHBondContact O-CG 3.31Å; G29-R33 PolarHBondContact O-N 3.42Å
30	S	72.9	Confident	71	Confident	62 Å²	62	78 Å²	78	43%	0.434	42%	0.418	S	S	.	.	H	α-helix	trans	-66.1	-40.4	175	78.6	0	0	0	0	112.3	N26 V27 I28 R33 T34	N26-S30 PolarHBondContact O-N 3.29Å; V27-S30 PolarHBondContact O-N 3.22Å; V27-S30 PolarHBondContact O-OG 3.2Å; I28-S30 VanDerWaalsContact C-N 3.31Å; I28-S30 PolarHBondContact O-N 3.42Å; S30-R33 PolarHBondContact O-N 2.86Å; S30-T34 PolarHBondContact O-N 3.33Å; S30-T34 VanDerWaalsContact O-N 3.11Å; S30-T34 PolarHBondContact O-OG1 2.96Å
31	F	72.4	Confident	72.5	Confident	59 Å²	59	73.6 Å²	73.6	26%	0.259	40%	0.395	S	S	.	.	H	α-helix	trans	-66.9	-45.2	178	-168.5	-87.8	0	0	0	111.1	V27 I28 R33 T34 L35 L57 Y137	V27-F31 PolarHBondContact O-N 3.35Å; I28-F31 PolarHBondContact O-N 2.93Å; I28-F31 VanDerWaalsContact O-N 3.14Å; F31-R33 VanDerWaalsContact C-N 3.29Å; F31-R33 PolarHBondContact O-N 3.07Å; F31-T34 CarbonylContact O-C 3.6Å; F31-T34 WeakPolarHBondContact O-CA 3.32Å; F31-T34 VanDerWaalsContact O-CB 3.22Å; F31-T34 WeakPolarHBondContact O-CB 3.38Å; F31-T34 PolarHBondContact O-N 2.76Å; F31-L35 HydrophobicContact CD1-CD1 4.07Å; F31-L35 HydrophobicContact CD1-CD2 4.45Å; F31-L35 HydrophobicContact CD1-CG 4.06Å; F31-L35 HydrophobicContact CE1-CD1 3.98Å; F31-L35 HydrophobicContact CE1-CD2 3.8Å; F31-L35 HydrophobicContact CE1-CG 3.9Å; F31-L35 HydrophobicContact CZ-CD2 4.42Å; F31-L35 PolarHBondContact O-N 3.38Å; F31-L57 HydrophobicContact CD1-CD1 3.38Å; F31-L57 HydrophobicContact CE1-CD1 3.5Å; F31-Y137 HydrophobicContact CZ-CD1 4.41Å; F31-Y137 HydrophobicContact CZ-CG 4.36Å
32	V	74.7	Confident	74.1	Confident	59 Å²	59	72.2 Å²	72.2	36%	0.358	38%	0.381	S	S	.	.	H	α-helix	trans	-60.1	-37.3	175.7	173.2	0	0	0	0	111.5	I28 T34 L35 L54	I28-V32 HydrophobicContact CG2-CG2 4.12Å; I28-V32 WeakPolarHBondContact O-CB 2.85Å; I28-V32 VanDerWaalsContact O-CG2 3.26Å; I28-V32 WeakPolarHBondContact O-CG2 3.45Å; I28-V32 PolarHBondContact O-N 3.04Å; V32-T34 VanDerWaalsContact C-N 3.27Å; V32-T34 PolarHBondContact O-N 3.24Å; V32-L35 WeakPolarHBondContact O-CB 3.28Å; V32-L35 PolarHBondContact O-N 3.04Å; V32-L54 HydrophobicContact CG2-CD1 4.36Å
33	R	74	Confident	75.8	Confident	210 Å²	210	69.3 Å²	69.3	79%	0.792	38%	0.377	S	S	*	.	H	α-helix	trans	-64.7	-32.7	171.7	-71.3	174.5	-163.9	176.6	6.1	112.5	G29 S30 F31 L35 K36	G29-R33 VanDerWaalsContact O-CG 3.29Å; G29-R33 WeakPolarHBondContact O-CG 3.31Å; G29-R33 PolarHBondContact O-N 3.42Å; S30-R33 PolarHBondContact O-N 2.86Å; F31-R33 VanDerWaalsContact C-N 3.29Å; F31-R33 PolarHBondContact O-N 3.07Å; R33-L35 PolarHBondContact O-N 3.34Å; R33-K36 PolarHBondContact O-N 3.3Å
34	T	76.3	Confident	77.4	Confident	70 Å²	70	66.8 Å²	66.8	43%	0.429	36%	0.363	S	S	.	.	H	α-helix	trans	-73.2	-19.4	177.7	-48.5	0	0	0	0	112.2	S30 F31 V32 K36 Y137	S30-T34 PolarHBondContact O-N 3.33Å; S30-T34 VanDerWaalsContact O-N 3.11Å; S30-T34 PolarHBondContact O-OG1 2.96Å; F31-T34 CarbonylContact O-C 3.6Å; F31-T34 WeakPolarHBondContact O-CA 3.32Å; F31-T34 VanDerWaalsContact O-CB 3.22Å; F31-T34 WeakPolarHBondContact O-CB 3.38Å; F31-T34 PolarHBondContact O-N 2.76Å; V32-T34 VanDerWaalsContact C-N 3.27Å; V32-T34 PolarHBondContact O-N 3.24Å; T34-K36 PolarHBondContact O-N 3.16Å; T34-Y137 WeakPolarHBondContact CG2-OH 3.41Å; T34-Y137 PolarHBondContact O-OH 3.08Å; T34-Y137 VanDerWaalsContact O-OH 3.11Å
35	L	77.4	Confident	79	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	15.1	172.9	-66.6	-179.1	0	0	0	113.5	F31 V32 R33 A37 Y50 C53 L57 Y137	F31-L35 HydrophobicContact CD1-CD1 4.07Å; F31-L35 HydrophobicContact CD1-CD2 4.45Å; F31-L35 HydrophobicContact CD1-CG 4.06Å; F31-L35 HydrophobicContact CE1-CD1 3.98Å; F31-L35 HydrophobicContact CE1-CD2 3.8Å; F31-L35 HydrophobicContact CE1-CG 3.9Å; F31-L35 HydrophobicContact CZ-CD2 4.42Å; F31-L35 PolarHBondContact O-N 3.38Å; V32-L35 WeakPolarHBondContact O-CB 3.28Å; V32-L35 PolarHBondContact O-N 3.04Å; R33-L35 PolarHBondContact O-N 3.34Å; L35-A37 PolarHBondContact O-N 2.99Å; L35-Y50 HydrophobicContact CB-CD2 3.86Å; L35-Y50 HydrophobicContact CB-CE2 4.06Å; L35-Y50 WeakPolarHBondContact O-CD2 3.42Å; L35-Y50 WeakPolarHBondContact O-CE2 3.4Å; L35-C53 HydrophobicContact CD1-CB 4.48Å; L35-C53 HydrophobicContact CD2-CB 4.28Å; L35-L57 HydrophobicContact CD1-CD1 3.98Å; L35-Y137 HydrophobicContact CD2-CD2 3.51Å; L35-Y137 HydrophobicContact CD2-CE2 3.56Å; L35-Y137 HydrophobicContact CD2-CG 4.46Å
36	K	80.2	Confident	80.5	Confident	167 Å²	167	61.1 Å²	61.1	73%	0.726	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-59.8	128.7	178.7	-168.3	175	-179	178.1	0	112.3	R33 T34 R38	R33-K36 PolarHBondContact O-N 3.3Å; T34-K36 PolarHBondContact O-N 3.16Å; K36-R38 PolarHBondContact O-N 3.38Å
37	A	80	Confident	81.8	Confident	42 Å²	42	57.8 Å²	57.8	35%	0.347	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-55.3	130.1	171.8	0	0	0	0	0	110.5	L35 Y49	L35-A37 PolarHBondContact O-N 2.99Å; A37-Y49 WeakPolarHBondContact CA-OH 3.44Å
38	R	82.1	Confident	83	Confident	94 Å²	94	53.2 Å²	53.2	36%	0.355	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-93.7	165.2	-179.2	-69.7	-166	172.8	-138.4	-1.7	111.1	K36 D40 R46 Y49 R144	K36-R38 PolarHBondContact O-N 3.38Å; R38-D40 WeakPolarHBondContact CB-OD1 3.34Å; R38-R46 PolarHBondContact O-NH2 2.98Å; R38-Y49 PolarHBondContact N-OH 3.45Å; R38-R144 VanDerWaalsContact CZ-NE 3.32Å; R38-R144 VanDerWaalsContact NE-NE 3.15Å; R38-R144 VanDerWaalsContact NE-NH2 3.17Å; R38-R144 VanDerWaalsContact NH2-CZ 3.28Å
39	P	82.3	Confident	84.2	Confident	45 Å²	45	50.6 Å²	50.6	29%	0.292	27%	0.266	S	S	.	.	S	Bend	trans	-87.1	-5.5	176.5	33.1	-34.8	0	0	0	113.5	A155 I158 H379	P39-A155 HydrophobicContact CG-CB 4.12Å; P39-I158 HydrophobicContact CB-CB 4.38Å; P39-I158 HydrophobicContact CB-CG2 3.99Å; P39-I158 WeakPolarHBondContact O-CD1 3.29Å; P39-I158 WeakPolarHBondContact O-CG2 3.46Å; P39-H379 PolarHBondContact O-CD2 2.77Å; P39-H379 PolarHBondContact O-CE1 3.02Å; P39-H379 VanDerWaalsContact O-CG 3.29Å; P39-H379 PolarHBondContact O-ND1 3.33Å; P39-H379 PolarHBondContact O-NE2 3.23Å; P39-H379 VanDerWaalsContact O-NE2 3.08Å
40	D	84.1	Confident	85.1	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	27%	0.265	C	S	.	.	S	Bend	trans	-107.7	20.7	-174.5	63.7	-42.5	0	0	0	114.3	R38 W143 L154 A155 I158	R38-D40 WeakPolarHBondContact CB-OD1 3.34Å; D40-W143 PolarHBondContact OD2-NE1 3.17Å; D40-L154 HydrophobicContact CB-CD2 4.13Å; D40-L154 HydrophobicContact CB-CG 4.06Å; D40-A155 HydrophobicContact CB-CB 4.09Å; D40-I158 HydrophobicContact CB-CD1 4.1Å
41	D	88.8	Confident	86.1	Confident	10 Å²	10	55.3 Å²	55.3	5%	0.053	27%	0.267	C	S	.	.	S	Bend	trans	-124.6	152.3	-172.9	62.9	-6.1	0	0	0	112.9	D45 R46 Y49 H379	D41-D45 HydrophobicContact CB-CB 4.32Å; D41-R46 VanDerWaalsContact CG-NE 3.32Å; D41-R46 IonicContact OD1-CZ 3.68Å; D41-R46 IonicContact OD1-NE 3.76Å; D41-R46 PolarHBondContact OD1-NE 3.29Å; D41-R46 IonicContact OD1-NH2 3.82Å; D41-R46 PolarHBondContact OD1-NH2 3.21Å; D41-R46 WeakPolarHBondContact OD2-CG 3.48Å; D41-R46 IonicContact OD2-NE 2.64Å; D41-R46 PolarHBondContact OD2-NE 2.72Å; D41-Y49 HydrophobicContact CB-CE1 4.43Å; D41-Y49 VanDerWaalsContact OD2-CE1 3.29Å; D41-Y49 WeakPolarHBondContact OD2-CE1 3.35Å; D41-Y49 VanDerWaalsContact OD2-CZ 3.28Å; D41-Y49 PolarHBondContact OD2-OH 2.73Å; D41-H379 PolarHBondContact O-CE1 3.44Å; D41-H379 PolarHBondContact O-NE2 2.82Å; D41-H379 VanDerWaalsContact O-NE2 3.09Å
42	D	91	Very high	87.2	Confident	19 Å²	19	52.5 Å²	52.5	10%	0.102	26%	0.255	C	S	.	.			trans	-79.4	156.8	175	-161.5	-8.1	0	0	0	111.4	I44 D45 R46 K226 N323 W327	D42-I44 PolarHBondContact O-N 2.85Å; D42-D45 WeakPolarHBondContact CB-OD2 3.35Å; D42-D45 PolarHBondContact N-OD2 3.43Å; D42-D45 WeakPolarHBondContact O-CB 3.35Å; D42-D45 PolarHBondContact O-N 2.97Å; D42-R46 PolarHBondContact O-N 3.5Å; D42-R46 VanDerWaalsContact O-N 3.11Å; D42-K226 IonicContact OD2-NZ 2.72Å; D42-N323 PolarHBondContact OD2-ND2 3.17Å; D42-N323 PolarHBondContact OD2-OD1 3.36Å; D42-W327 PolarHBondContact OD2-NE1 3.31Å
43	G	92	Very high	88.1	Confident	43 Å²	43	49.7 Å²	49.7	44%	0.443	24%	0.238	S	C	.	.	H	α-helix	trans	-56.8	-33	174.9	0	0	0	0	0	112.8	R46 L47	G43-R46 WeakPolarHBondContact O-CB 3.39Å; G43-R46 PolarHBondContact O-N 3.36Å; G43-L47 PolarHBondContact O-N 2.92Å
44	I	94.7	Very high	89	Confident	46 Å²	46	41.8 Å²	41.8	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-74.7	-29.9	176.2	-53.2	-63.8	0	0	0	112.1	D42 R46 L47 S48 A319 T320 N323	D42-I44 PolarHBondContact O-N 2.85Å; I44-R46 VanDerWaalsContact C-N 3.32Å; I44-L47 WeakPolarHBondContact O-CB 3.26Å; I44-L47 PolarHBondContact O-N 3.43Å; I44-S48 PolarHBondContact O-N 3.46Å; I44-A319 HydrophobicContact CD1-CB 4.21Å; I44-A319 HydrophobicContact CG2-CB 4.18Å; I44-T320 HydrophobicContact CG2-CG2 3.99Å; I44-N323 HydrophobicContact CB-CB 3.99Å; I44-N323 HydrophobicContact CG1-CB 4.07Å; I44-N323 WeakPolarHBondContact CG1-ND2 3.5Å; I44-N323 HydrophobicContact CG2-CB 3.79Å
45	D	94.2	Very high	89.9	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.027	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-43.1	171.9	-61.1	-37	0	0	0	109.9	D41 D42 L47 S48 Y49 Y222 K226 Y229	D41-D45 HydrophobicContact CB-CB 4.32Å; D42-D45 WeakPolarHBondContact CB-OD2 3.35Å; D42-D45 PolarHBondContact N-OD2 3.43Å; D42-D45 WeakPolarHBondContact O-CB 3.35Å; D42-D45 PolarHBondContact O-N 2.97Å; D45-L47 VanDerWaalsContact C-N 3.27Å; D45-L47 PolarHBondContact O-N 3.45Å; D45-S48 PolarHBondContact O-N 3.22Å; D45-Y49 HydrophobicContact CB-CD1 4.28Å; D45-Y49 HydrophobicContact CB-CE1 4.31Å; D45-Y49 WeakPolarHBondContact O-CD1 3.24Å; D45-Y49 PolarHBondContact O-N 3.25Å; D45-Y222 PolarHBondContact OD2-OH 3.25Å; D45-K226 WeakPolarHBondContact OD1-CE 3.34Å; D45-K226 IonicContact OD1-NZ 3.21Å; D45-K226 PolarHBondContact OD1-NZ 3.37Å; D45-K226 WeakPolarHBondContact OD2-CE 3.45Å; D45-K226 IonicContact OD2-NZ 3.19Å; D45-K226 PolarHBondContact OD2-NZ 3.24Å; D45-Y229 HydrophobicContact CB-CE2 4.04Å; D45-Y229 WeakPolarHBondContact OD1-CD2 3.24Å; D45-Y229 WeakPolarHBondContact OD1-CE2 3.26Å
46	R	93.9	Very high	90.8	Very high	66 Å²	66	40.1 Å²	40.1	25%	0.249	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-37.8	175	-62.8	178	-172.7	172.4	6.8	111.8	R38 D41 D42 G43 I44 S48 Y49 Y50 Y51	R38-R46 PolarHBondContact O-NH2 2.98Å; D41-R46 VanDerWaalsContact CG-NE 3.32Å; D41-R46 IonicContact OD1-CZ 3.68Å; D41-R46 IonicContact OD1-NE 3.76Å; D41-R46 PolarHBondContact OD1-NE 3.29Å; D41-R46 IonicContact OD1-NH2 3.82Å; D41-R46 PolarHBondContact OD1-NH2 3.21Å; D41-R46 WeakPolarHBondContact OD2-CG 3.48Å; D41-R46 IonicContact OD2-NE 2.64Å; D41-R46 PolarHBondContact OD2-NE 2.72Å; D42-R46 PolarHBondContact O-N 3.5Å; D42-R46 VanDerWaalsContact O-N 3.11Å; G43-R46 WeakPolarHBondContact O-CB 3.39Å; G43-R46 PolarHBondContact O-N 3.36Å; I44-R46 VanDerWaalsContact C-N 3.32Å; R46-S48 PolarHBondContact O-N 2.99Å; R46-Y49 HydrophobicContact CB-CE1 4.4Å; R46-Y49 HydrophobicContact CG-CE1 3.99Å; R46-Y50 WeakPolarHBondContact O-CA 3.31Å; R46-Y50 WeakPolarHBondContact O-CB 3.48Å; R46-Y50 PolarHBondContact O-N 3.24Å; R46-Y51 HydrophobicContact CB-CE2 4.39Å; R46-Y51 WeakPolarHBondContact O-CD2 3.32Å; R46-Y51 PolarHBondContact O-N 2.91Å
47	L	95	Very high	91.4	Very high	33 Å²	33	33.4 Å²	33.4	17%	0.173	17%	0.171	C	C	.	.	I	π-helix	trans	-53.9	-44.1	173.2	-174.7	66.9	0	0	0	111.4	G43 I44 D45 T52 W312 V316 A319	G43-L47 PolarHBondContact O-N 2.92Å; I44-L47 WeakPolarHBondContact O-CB 3.26Å; I44-L47 PolarHBondContact O-N 3.43Å; D45-L47 VanDerWaalsContact C-N 3.27Å; D45-L47 PolarHBondContact O-N 3.45Å; L47-T52 WeakPolarHBondContact O-CB 3.48Å; L47-T52 PolarHBondContact O-N 2.93Å; L47-T52 PolarHBondContact O-OG1 2.84Å; L47-W312 HydrophobicContact CD1-CH2 3.97Å; L47-W312 HydrophobicContact CD1-CZ2 3.76Å; L47-V316 HydrophobicContact CD2-CG2 4.26Å; L47-V316 HydrophobicContact CG-CG2 4.18Å; L47-A319 HydrophobicContact CD2-CB 3.92Å
48	S	94.8	Very high	91.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.177	C	C	.	.	I	π-helix	trans	-75.2	-67.1	178.4	-59.9	0	0	0	0	113.2	I44 D45 R46 Y50 T52 T320	I44-S48 PolarHBondContact O-N 3.46Å; D45-S48 PolarHBondContact O-N 3.22Å; R46-S48 PolarHBondContact O-N 2.99Å; S48-Y50 PolarHBondContact O-N 3.5Å; S48-T52 VanDerWaalsContact O-CB 3.29Å; S48-T52 WeakPolarHBondContact O-CB 3.31Å; S48-T320 VanDerWaalsContact OG-CG2 3.31Å; S48-T320 WeakPolarHBondContact OG-CG2 3.49Å
49	Y	93.4	Very high	92.5	Very high	1 Å²	1	33 Å²	33	0%	0.004	17%	0.169	C	C	.	.	I	π-helix	trans	-77.8	-24	-168.9	82.5	-96.7	0	0	0	113.9	A37 R38 D41 D45 R46 C53 F136 Y137 C140 Y229	A37-Y49 WeakPolarHBondContact CA-OH 3.44Å; R38-Y49 PolarHBondContact N-OH 3.45Å; D41-Y49 HydrophobicContact CB-CE1 4.43Å; D41-Y49 VanDerWaalsContact OD2-CE1 3.29Å; D41-Y49 WeakPolarHBondContact OD2-CE1 3.35Å; D41-Y49 VanDerWaalsContact OD2-CZ 3.28Å; D41-Y49 PolarHBondContact OD2-OH 2.73Å; D45-Y49 HydrophobicContact CB-CD1 4.28Å; D45-Y49 HydrophobicContact CB-CE1 4.31Å; D45-Y49 WeakPolarHBondContact O-CD1 3.24Å; D45-Y49 PolarHBondContact O-N 3.25Å; R46-Y49 HydrophobicContact CB-CE1 4.4Å; R46-Y49 HydrophobicContact CG-CE1 3.99Å; Y49-C53 WeakPolarHBondContact O-CB 3.26Å; Y49-F136 WeakPolarHBondContact CA-O 3.45Å; Y49-F136 WeakPolarHBondContact CB-O 3.06Å; Y49-Y137 HydrophobicContact CD2-CD2 4.19Å; Y49-Y137 HydrophobicContact CD2-CE2 4.15Å; Y49-C140 HydrophobicContact CD1-CB 4.42Å; Y49-C140 HydrophobicContact CD2-CB 4.31Å; Y49-C140 HydrophobicContact CG-CB 4.01Å; Y49-Y229 WeakPolarHBondContact CD1-OH 3.27Å
50	Y	92.7	Very high	93	Very high	68 Å²	68	31.5 Å²	31.5	27%	0.267	16%	0.159	S	C	.	.	I	π-helix	trans	-98.7	-67	-177.5	177.6	-112.6	0	0	0	111.4	L35 R46 S48 L54	L35-Y50 HydrophobicContact CB-CD2 3.86Å; L35-Y50 HydrophobicContact CB-CE2 4.06Å; L35-Y50 WeakPolarHBondContact O-CD2 3.42Å; L35-Y50 WeakPolarHBondContact O-CE2 3.4Å; R46-Y50 WeakPolarHBondContact O-CA 3.31Å; R46-Y50 WeakPolarHBondContact O-CB 3.48Å; R46-Y50 PolarHBondContact O-N 3.24Å; S48-Y50 PolarHBondContact O-N 3.5Å; Y50-L54 WeakPolarHBondContact O-CB 3.37Å; Y50-L54 PolarHBondContact O-N 2.69Å
51	Y	93.8	Very high	93.3	Very high	121 Å²	121	34 Å²	34	48%	0.475	17%	0.174	S	C	.	.	I	π-helix	trans	-68.5	-47.4	-172.5	-68.5	-73.2	0	0	0	112.2	R46 L54 I55	R46-Y51 HydrophobicContact CB-CE2 4.39Å; R46-Y51 WeakPolarHBondContact O-CD2 3.32Å; R46-Y51 PolarHBondContact O-N 2.91Å; Y51-L54 PolarHBondContact O-N 3.48Å; Y51-I55 WeakPolarHBondContact O-CB 3.26Å; Y51-I55 VanDerWaalsContact O-CG1 3.26Å; Y51-I55 WeakPolarHBondContact O-CG1 3.31Å; Y51-I55 PolarHBondContact O-N 2.88Å
52	T	96.2	Very high	93.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	I	π-helix	trans	-66.5	-42.3	179.7	-53	0	0	0	0	111.4	L47 S48 L54 I55 L56 F136 W312 F313	L47-T52 WeakPolarHBondContact O-CB 3.48Å; L47-T52 PolarHBondContact O-N 2.93Å; L47-T52 PolarHBondContact O-OG1 2.84Å; S48-T52 VanDerWaalsContact O-CB 3.29Å; S48-T52 WeakPolarHBondContact O-CB 3.31Å; T52-L54 PolarHBondContact O-N 2.93Å; T52-I55 PolarHBondContact O-N 2.92Å; T52-L56 HydrophobicContact CG2-CD1 4Å; T52-L56 HydrophobicContact CG2-CG 4.47Å; T52-L56 WeakPolarHBondContact O-CB 3.35Å; T52-L56 VanDerWaalsContact O-CG 3.3Å; T52-L56 WeakPolarHBondContact O-CG 3.47Å; T52-L56 PolarHBondContact O-N 3.3Å; T52-F136 HydrophobicContact CG2-CD1 4.01Å; T52-F136 HydrophobicContact CG2-CD2 3.8Å; T52-F136 HydrophobicContact CG2-CE1 3.82Å; T52-F136 HydrophobicContact CG2-CE2 3.58Å; T52-F136 HydrophobicContact CG2-CG 4Å; T52-F136 HydrophobicContact CG2-CZ 3.6Å; T52-W312 PolarHBondContact OG1-NE1 2.84Å; T52-F313 HydrophobicContact CG2-CD1 4.22Å; T52-F313 HydrophobicContact CG2-CE1 3.73Å
53	C	94.4	Very high	93.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.4	-45.6	174.2	-169.5	0	0	0	0	111.9	L35 Y49 L56 L57 A133	L35-C53 HydrophobicContact CD1-CB 4.48Å; L35-C53 HydrophobicContact CD2-CB 4.28Å; Y49-C53 WeakPolarHBondContact O-CB 3.26Å; C53-L56 PolarHBondContact O-N 2.67Å; C53-L57 VanDerWaalsContact O-CG 3.27Å; C53-L57 WeakPolarHBondContact O-CG 3.47Å; C53-L57 PolarHBondContact O-N 3.26Å; C53-A133 PolarHBondContact SG-O 2.87Å
54	L	92.7	Very high	93.3	Very high	43 Å²	43	36 Å²	36	23%	0.225	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-45	177.6	-178.4	65.2	0	0	0	112.1	V32 Y50 Y51 T52 L57 I58	V32-L54 HydrophobicContact CG2-CD1 4.36Å; Y50-L54 WeakPolarHBondContact O-CB 3.37Å; Y50-L54 PolarHBondContact O-N 2.69Å; Y51-L54 PolarHBondContact O-N 3.48Å; T52-L54 PolarHBondContact O-N 2.93Å; L54-L57 PolarHBondContact O-N 3.34Å; L54-I58 HydrophobicContact CD1-CD1 4.04Å; L54-I58 HydrophobicContact CD1-CG1 4.37Å; L54-I58 HydrophobicContact CG-CD1 3.86Å; L54-I58 WeakPolarHBondContact O-CB 3.28Å; L54-I58 VanDerWaalsContact O-CG1 3.26Å; L54-I58 WeakPolarHBondContact O-CG1 3.48Å; L54-I58 PolarHBondContact O-N 3.04Å
55	I	94.8	Very high	93	Very high	36 Å²	36	36.1 Å²	36.1	19%	0.185	19%	0.188	C	C	.	.	H	α-helix	trans	-57.4	-49.6	175.9	-75	166.7	0	0	0	110.6	Y51 T52 L57 I58 L59 F308 L309 W312	Y51-I55 WeakPolarHBondContact O-CB 3.26Å; Y51-I55 VanDerWaalsContact O-CG1 3.26Å; Y51-I55 WeakPolarHBondContact O-CG1 3.31Å; Y51-I55 PolarHBondContact O-N 2.88Å; T52-I55 PolarHBondContact O-N 2.92Å; I55-L57 PolarHBondContact O-N 2.92Å; I55-I58 PolarHBondContact O-N 3.27Å; I55-L59 HydrophobicContact CG2-CD1 3.98Å; I55-L59 WeakPolarHBondContact O-CG 3.47Å; I55-L59 PolarHBondContact O-N 3.38Å; I55-F308 HydrophobicContact CG2-CE1 3.74Å; I55-L309 HydrophobicContact CG2-CD2 4.21Å; I55-W312 HydrophobicContact CD1-CD2 4.07Å; I55-W312 HydrophobicContact CD1-CE3 4.43Å; I55-W312 HydrophobicContact CD1-CH2 3.87Å; I55-W312 HydrophobicContact CD1-CZ2 3.45Å; I55-W312 VanDerWaalsContact CD1-CZ2 3.45Å; I55-W312 HydrophobicContact CD1-CZ3 4.34Å
56	L	95.7	Very high	92.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.7	-41.1	-179.3	-72.6	167.9	0	0	0	112.3	T52 C53 L59 S60 L129 E132 A133 F136 L309 F313	T52-L56 HydrophobicContact CG2-CD1 4Å; T52-L56 HydrophobicContact CG2-CG 4.47Å; T52-L56 WeakPolarHBondContact O-CB 3.35Å; T52-L56 VanDerWaalsContact O-CG 3.3Å; T52-L56 WeakPolarHBondContact O-CG 3.47Å; T52-L56 PolarHBondContact O-N 3.3Å; C53-L56 PolarHBondContact O-N 2.67Å; L56-L59 PolarHBondContact O-N 3.45Å; L56-S60 VanDerWaalsContact O-CB 3.29Å; L56-S60 WeakPolarHBondContact O-CB 3.45Å; L56-S60 PolarHBondContact O-N 3.43Å; L56-L129 HydrophobicContact CD2-CD2 3.82Å; L56-E132 HydrophobicContact CD1-CB 3.87Å; L56-E132 HydrophobicContact CD2-CB 4.33Å; L56-E132 WeakPolarHBondContact CD2-OE2 3.49Å; L56-A133 HydrophobicContact CB-CB 3.82Å; L56-A133 HydrophobicContact CD1-CB 4.37Å; L56-F136 HydrophobicContact CD1-CD2 3.5Å; L56-F136 VanDerWaalsContact CD1-CD2 3.5Å; L56-F136 HydrophobicContact CD1-CE2 3.8Å; L56-L309 HydrophobicContact CD2-CD1 3.92Å; L56-L309 HydrophobicContact CD2-CD2 3.6Å; L56-L309 HydrophobicContact CD2-CG 4.42Å; L56-L309 HydrophobicContact CG-CD2 4.42Å; L56-F313 HydrophobicContact CD1-CE1 4.29Å; L56-F313 HydrophobicContact CD1-CZ 4.25Å; L56-F313 HydrophobicContact CD2-CE1 4.39Å; L56-F313 HydrophobicContact CD2-CZ 3.98Å
57	L	92.6	Very high	92.2	Very high	25 Å²	25	36.5 Å²	36.5	13%	0.131	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-43.3	175.7	-70.3	170.8	0	0	0	112.2	F31 L35 C53 L54 I55 L59 S60 V61 A133	F31-L57 HydrophobicContact CD1-CD1 3.38Å; F31-L57 HydrophobicContact CE1-CD1 3.5Å; L35-L57 HydrophobicContact CD1-CD1 3.98Å; C53-L57 VanDerWaalsContact O-CG 3.27Å; C53-L57 WeakPolarHBondContact O-CG 3.47Å; C53-L57 PolarHBondContact O-N 3.26Å; L54-L57 PolarHBondContact O-N 3.34Å; I55-L57 PolarHBondContact O-N 2.92Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-L59 PolarHBondContact O-N 3.37Å; L57-S60 PolarHBondContact O-N 2.98Å; L57-V61 WeakPolarHBondContact O-CB 3.33Å; L57-V61 VanDerWaalsContact O-CG2 3.24Å; L57-V61 WeakPolarHBondContact O-CG2 3.38Å; L57-V61 PolarHBondContact O-N 2.96Å; L57-A133 HydrophobicContact CD2-CB 3.96Å; L57-A133 HydrophobicContact CG-CB 3.95Å
58	I	92.1	Very high	91.5	Very high	93 Å²	93	41.3 Å²	41.3	48%	0.477	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-44.4	176.9	-69.9	168	0	0	0	110.1	L54 I55 V61 T62	L54-I58 HydrophobicContact CD1-CD1 4.04Å; L54-I58 HydrophobicContact CD1-CG1 4.37Å; L54-I58 HydrophobicContact CG-CD1 3.86Å; L54-I58 WeakPolarHBondContact O-CB 3.28Å; L54-I58 VanDerWaalsContact O-CG1 3.26Å; L54-I58 WeakPolarHBondContact O-CG1 3.48Å; L54-I58 PolarHBondContact O-N 3.04Å; I55-I58 PolarHBondContact O-N 3.27Å; I58-V61 PolarHBondContact O-N 3.31Å; I58-T62 VanDerWaalsContact O-CB 3.3Å; I58-T62 WeakPolarHBondContact O-CB 3.3Å; I58-T62 PolarHBondContact O-N 3.35Å; I58-T62 PolarHBondContact O-OG1 2.78Å
59	L	94	Very high	90.8	Very high	36 Å²	36	47.5 Å²	47.5	19%	0.188	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-45	176.5	-70.9	173	0	0	0	111.8	I55 L56 L57 V61 T62 I63 L129 A305 L309	I55-L59 HydrophobicContact CG2-CD1 3.98Å; I55-L59 WeakPolarHBondContact O-CG 3.47Å; I55-L59 PolarHBondContact O-N 3.38Å; L56-L59 PolarHBondContact O-N 3.45Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-L59 PolarHBondContact O-N 3.37Å; L59-V61 VanDerWaalsContact C-N 3.35Å; L59-V61 PolarHBondContact O-N 2.91Å; L59-T62 PolarHBondContact O-N 3.24Å; L59-I63 WeakPolarHBondContact O-CB 3.47Å; L59-I63 VanDerWaalsContact O-CG1 3.29Å; L59-I63 WeakPolarHBondContact O-CG1 3.39Å; L59-I63 PolarHBondContact O-N 3.17Å; L59-L129 HydrophobicContact CB-CD1 4Å; L59-A305 HydrophobicContact CD2-CB 4.21Å; L59-L309 HydrophobicContact CD1-CD1 3.94Å; L59-L309 HydrophobicContact CD1-CD2 3.75Å; L59-L309 HydrophobicContact CD1-CG 3.84Å
60	S	93.2	Very high	90.1	Very high	12 Å²	12	48.9 Å²	48.9	8%	0.084	26%	0.26	C	S	.	.	H	α-helix	trans	-56.5	-47.1	176	177	0	0	0	0	111.8	L56 L57 S64 P126	L56-S60 VanDerWaalsContact O-CB 3.29Å; L56-S60 WeakPolarHBondContact O-CB 3.45Å; L56-S60 PolarHBondContact O-N 3.43Å; L57-S60 PolarHBondContact O-N 2.98Å; S60-S64 VanDerWaalsContact O-CB 3.27Å; S60-S64 WeakPolarHBondContact O-CB 3.28Å; S60-S64 PolarHBondContact O-N 3.32Å; S60-S64 PolarHBondContact O-OG 3.21Å; S60-P126 PolarHBondContact OG-O 3.06Å
61	V	90.1	Very high	89.7	Confident	57 Å²	57	50.8 Å²	50.8	35%	0.345	27%	0.271	S	S	.	.	H	α-helix	trans	-67.6	-42.6	178.7	174.1	0	0	0	0	111.5	I28 L57 I58 L59 S64 A65	I28-V61 HydrophobicContact CD1-CG2 3.43Å; I28-V61 VanDerWaalsContact CD1-CG2 3.43Å; I28-V61 HydrophobicContact CG1-CG2 4.22Å; L57-V61 WeakPolarHBondContact O-CB 3.33Å; L57-V61 VanDerWaalsContact O-CG2 3.24Å; L57-V61 WeakPolarHBondContact O-CG2 3.38Å; L57-V61 PolarHBondContact O-N 2.96Å; I58-V61 PolarHBondContact O-N 3.31Å; L59-V61 VanDerWaalsContact C-N 3.35Å; L59-V61 PolarHBondContact O-N 2.91Å; V61-S64 WeakPolarHBondContact O-CB 3.16Å; V61-S64 PolarHBondContact O-N 3.32Å; V61-A65 WeakPolarHBondContact O-CB 3.47Å; V61-A65 PolarHBondContact O-N 3.08Å
62	T	90	Very high	89.4	Confident	77 Å²	77	45.9 Å²	45.9	47%	0.472	25%	0.254	S	S	.	.	H	α-helix	trans	-65.3	-44.8	-178.9	-56.4	0	0	0	0	111.4	I58 L59 A65 K66	I58-T62 VanDerWaalsContact O-CB 3.3Å; I58-T62 WeakPolarHBondContact O-CB 3.3Å; I58-T62 PolarHBondContact O-N 3.35Å; I58-T62 PolarHBondContact O-OG1 2.78Å; L59-T62 PolarHBondContact O-N 3.24Å; T62-A65 PolarHBondContact O-N 3.4Å; T62-K66 PolarHBondContact O-N 3.17Å; T62-K66 VanDerWaalsContact O-N 3.13Å
63	I	91.1	Very high	89.2	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-67.9	-40.9	177.3	-63.8	171.5	0	0	0	110.1	L59 A65 K66 Q67 V125 P126 L129 I298 A305	L59-I63 WeakPolarHBondContact O-CB 3.47Å; L59-I63 VanDerWaalsContact O-CG1 3.29Å; L59-I63 WeakPolarHBondContact O-CG1 3.39Å; L59-I63 PolarHBondContact O-N 3.17Å; I63-A65 VanDerWaalsContact C-N 3.33Å; I63-A65 PolarHBondContact O-N 3.32Å; I63-K66 PolarHBondContact O-N 3.14Å; I63-K66 VanDerWaalsContact O-N 3.16Å; I63-Q67 WeakPolarHBondContact O-CB 3.27Å; I63-Q67 PolarHBondContact O-N 3.38Å; I63-V125 HydrophobicContact CD1-CG1 3.75Å; I63-V125 HydrophobicContact CG2-CG1 4.1Å; I63-P126 HydrophobicContact CB-CG 4.5Å; I63-P126 HydrophobicContact CG2-CG 4Å; I63-L129 HydrophobicContact CD1-CD1 3.76Å; I63-I298 HydrophobicContact CG2-CD1 4.18Å; I63-I298 HydrophobicContact CG2-CG1 4.46Å; I63-A305 HydrophobicContact CD1-CB 4.1Å
64	S	90.2	Very high	89.2	Confident	30 Å²	30	50 Å²	50	21%	0.21	27%	0.274	C	S	.	.	H	α-helix	trans	-56.7	-45.8	172.5	-63.9	0	0	0	0	112	S60 V61 K66 Q67 Y68 P126	S60-S64 VanDerWaalsContact O-CB 3.27Å; S60-S64 WeakPolarHBondContact O-CB 3.28Å; S60-S64 PolarHBondContact O-N 3.32Å; S60-S64 PolarHBondContact O-OG 3.21Å; V61-S64 WeakPolarHBondContact O-CB 3.16Å; V61-S64 PolarHBondContact O-N 3.32Å; S64-K66 VanDerWaalsContact C-N 3.28Å; S64-K66 PolarHBondContact O-N 3.36Å; S64-Q67 PolarHBondContact O-N 3.01Å; S64-Q67 VanDerWaalsContact O-N 3.1Å; S64-Y68 WeakPolarHBondContact O-CD2 3.49Å; S64-Y68 PolarHBondContact O-N 3.36Å; S64-P126 WeakPolarHBondContact OG-CB 3.41Å
65	A	87.7	Confident	89.4	Confident	49 Å²	49	48.4 Å²	48.4	41%	0.405	27%	0.266	S	S	.	.	H	α-helix	trans	-59.5	-42.2	178.5	0	0	0	0	0	110.9	V61 T62 I63 Q67 V69 G70	V61-A65 WeakPolarHBondContact O-CB 3.47Å; V61-A65 PolarHBondContact O-N 3.08Å; T62-A65 PolarHBondContact O-N 3.4Å; I63-A65 VanDerWaalsContact C-N 3.33Å; I63-A65 PolarHBondContact O-N 3.32Å; A65-Q67 VanDerWaalsContact C-N 3.33Å; A65-Q67 PolarHBondContact O-N 3.42Å; A65-V69 VanDerWaalsContact O-CB 3.22Å; A65-V69 WeakPolarHBondContact O-CB 3.49Å; A65-V69 PolarHBondContact O-N 2.99Å; A65-G70 PolarHBondContact O-N 3.1Å
66	K	86.9	Confident	89.4	Confident	67 Å²	67	56.7 Å²	56.7	29%	0.291	30%	0.295	S	S	.	.	H	α-helix	trans	-66.4	-34.9	175.8	-172	60.9	178.6	179	0	112.8	T62 I63 S64 G70 F301	T62-K66 PolarHBondContact O-N 3.17Å; T62-K66 VanDerWaalsContact O-N 3.13Å; I63-K66 PolarHBondContact O-N 3.14Å; I63-K66 VanDerWaalsContact O-N 3.16Å; S64-K66 VanDerWaalsContact C-N 3.28Å; S64-K66 PolarHBondContact O-N 3.36Å; K66-G70 WeakPolarHBondContact O-CA 3.48Å; K66-G70 PolarHBondContact O-N 3.34Å; K66-F301 HydrophobicContact CD-CE2 4.27Å; K66-F301 HydrophobicContact CG-CD2 4.29Å; K66-F301 HydrophobicContact CG-CE2 4.31Å
67	Q	84.7	Confident	89.4	Confident	11 Å²	11	57.9 Å²	57.9	5%	0.051	30%	0.303	C	S	.	.	H	α-helix	trans	-75.1	-39.7	-178.3	-172.9	168.9	-33	0	0	113.5	I63 S64 A65 F94 Y122 Q123 I298	I63-Q67 WeakPolarHBondContact O-CB 3.27Å; I63-Q67 PolarHBondContact O-N 3.38Å; S64-Q67 PolarHBondContact O-N 3.01Å; S64-Q67 VanDerWaalsContact O-N 3.1Å; A65-Q67 VanDerWaalsContact C-N 3.33Å; A65-Q67 PolarHBondContact O-N 3.42Å; Q67-F94 HydrophobicContact CG-CE1 4.44Å; Q67-F94 HydrophobicContact CG-CZ 3.71Å; Q67-Y122 PolarHBondContact OE1-O 3.31Å; Q67-Q123 PolarHBondContact NE2-O 3.04Å; Q67-I298 HydrophobicContact CB-CD1 3.86Å; Q67-I298 HydrophobicContact CG-CD1 4.14Å
68	Y	81.1	Confident	89.4	Confident	134 Å²	134	58.5 Å²	58.5	53%	0.525	31%	0.308	S	S	.	.	H	α-helix	trans	-102.8	-27.8	-172.8	-63.5	-67.4	0	0	0	114.5	S64	S64-Y68 WeakPolarHBondContact O-CD2 3.49Å; S64-Y68 PolarHBondContact O-N 3.36Å
69	V	79.2	Confident	89.5	Confident	131 Å²	131	59.1 Å²	59.1	79%	0.794	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-30.8	178.3	-173.4	0	0	0	0	111	A65	A65-V69 VanDerWaalsContact O-CB 3.22Å; A65-V69 WeakPolarHBondContact O-CB 3.49Å; A65-V69 PolarHBondContact O-N 2.99Å
70	G	79.2	Confident	89.4	Confident	29 Å²	29	64 Å²	64	30%	0.299	35%	0.349	S	S	.	.	S	Bend	trans	-86.7	178.8	177.2	0	0	0	0	0	113.5	A65 K66 P72	A65-G70 PolarHBondContact O-N 3.1Å; K66-G70 WeakPolarHBondContact O-CA 3.48Å; K66-G70 PolarHBondContact O-N 3.34Å; G70-P72 VanDerWaalsContact O-CD 3.29Å; G70-P72 WeakPolarHBondContact O-CD 3.37Å
71	Q	84.9	Confident	89.4	Confident	108 Å²	108	64.8 Å²	64.8	51%	0.505	35%	0.351	S	S	.	.			trans	-90.1	104	163.2	-67.7	173.6	-31.4	0	0	107.3	I73 M297	Q71-I73 VanDerWaalsContact C-N 3.28Å; Q71-I73 PolarHBondContact O-N 2.97Å; Q71-M297 HydrophobicContact CB-CE 4.26Å; Q71-M297 WeakPolarHBondContact O-CE 3.33Å
72	P	87.6	Confident	89.6	Confident	18 Å²	18	66 Å²	66	12%	0.117	36%	0.359	C	S	.	.	S	Bend	trans	-70.8	-28.6	-176.5	27.4	-34.1	0	0	0	112.4	G70 F94 M297	G70-P72 VanDerWaalsContact O-CD 3.29Å; G70-P72 WeakPolarHBondContact O-CD 3.37Å; P72-F94 HydrophobicContact CB-CD2 4.03Å; P72-F94 HydrophobicContact CB-CE2 3.65Å; P72-F94 HydrophobicContact CB-CZ 4.23Å; P72-F94 HydrophobicContact CG-CD1 4.46Å; P72-F94 HydrophobicContact CG-CD2 3.73Å; P72-F94 HydrophobicContact CG-CE1 4.41Å; P72-F94 HydrophobicContact CG-CE2 3.67Å; P72-F94 HydrophobicContact CG-CG 4.15Å; P72-F94 HydrophobicContact CG-CZ 4.04Å; P72-M297 PolarHBondContact O-N 2.7Å
73	I	91.8	Very high	89.8	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.026	36%	0.357	C	S	.	.			trans	-136.9	145.9	-177.7	-163.3	168.7	0	0	0	109.2	Q71 E90 C93 F94 T98 C294 V295 L296	Q71-I73 VanDerWaalsContact C-N 3.28Å; Q71-I73 PolarHBondContact O-N 2.97Å; I73-E90 HydrophobicContact CG2-CB 4.37Å; I73-C93 HydrophobicContact CD1-CB 4.28Å; I73-F94 HydrophobicContact CG2-CB 3.91Å; I73-F94 HydrophobicContact CG2-CD2 4.34Å; I73-F94 HydrophobicContact CG2-CG 4.49Å; I73-T98 HydrophobicContact CD1-CG2 4.04Å; I73-C294 HydrophobicContact CD1-CB 3.59Å; I73-C294 HydrophobicContact CG1-CB 3.68Å; I73-V295 WeakPolarHBondContact CA-O 3.32Å; I73-L296 HydrophobicContact CB-CD1 4.33Å; I73-L296 HydrophobicContact CD1-CD1 4.35Å; I73-L296 HydrophobicContact CG1-CD1 4.31Å
74	Q	94.1	Very high	89.9	Confident	81 Å²	81	67.2 Å²	67.2	38%	0.379	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134.1	169.6	-76.7	179.1	-22	0	0	108.6	E90 C294 V295 M297	Q74-E90 WeakPolarHBondContact CA-OE1 3.26Å; Q74-C294 CarbonylContact O-C 3.51Å; Q74-C294 VanDerWaalsContact O-CA 3.31Å; Q74-C294 WeakPolarHBondContact O-CA 3.33Å; Q74-V295 PolarHBondContact N-O 3.31Å; Q74-V295 PolarHBondContact O-N 3.38Å; Q74-M297 HydrophobicContact CB-CE 4.49Å; Q74-M297 HydrophobicContact CG-CE 3.72Å
75	C	95.9	Very high	90	Very high	11 Å²	11	71.2 Å²	71.2	7%	0.074	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.7	-172.2	-61.4	0	0	0	0	113.4	V77 E90 I292 C294	C75-V77 HydrophobicContact CB-CG1 4.34Å; C75-V77 PolarHBondContact O-N 3.42Å; C75-V77 VanDerWaalsContact O-N 3.15Å; C75-E90 HydrophobicContact CB-CG 4.03Å; C75-E90 PolarHBondContact N-OE1 3.42Å; C75-I292 HydrophobicContact CB-CD1 3.69Å; C75-C294 HydrophobicContact CB-CB 4.09Å; C75-C294 WeakPolarHBondContact CB-SG 3.3Å; C75-C294 WeakPolarHBondContact SG-CB 3.5Å; C75-C294 CovalentContact SG-SG 2.05Å; C75-C294 PolarHBondContact SG-SG 2.98Å
76	W	95.6	Very high	90.4	Very high	210 Å²	210	72.6 Å²	72.6	80%	0.795	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	94.9	170.7	-173.8	-94.1	0	0	0	109.7	Q293	W76-Q293 HydrophobicContact CB-CB 4.5Å; W76-Q293 WeakPolarHBondContact CB-O 3.38Å; W76-Q293 PolarHBondContact N-O 2.88Å
77	V	94.5	Very high	90.7	Very high	25 Å²	25	75.3 Å²	75.3	15%	0.152	40%	0.404	C	S	.	.			trans	-95.5	153.7	179.9	-62.6	0	0	0	0	112.1	C75 F81 E86 A89 I292	C75-V77 HydrophobicContact CB-CG1 4.34Å; C75-V77 PolarHBondContact O-N 3.42Å; C75-V77 VanDerWaalsContact O-N 3.15Å; V77-F81 HydrophobicContact CB-CB 4.38Å; V77-F81 HydrophobicContact CB-CD2 3.85Å; V77-F81 HydrophobicContact CB-CG 4.39Å; V77-F81 HydrophobicContact CG1-CD2 4.14Å; V77-F81 HydrophobicContact CG2-CB 4.22Å; V77-F81 HydrophobicContact CG2-CD2 4.48Å; V77-E86 HydrophobicContact CG1-CG 4.39Å; V77-E86 HydrophobicContact CG2-CB 4.01Å; V77-E86 HydrophobicContact CG2-CG 3.82Å; V77-A89 HydrophobicContact CG1-CB 4.09Å; V77-I292 HydrophobicContact CG1-CD1 4.13Å
78	P	94.2	Very high	91.1	Very high	37 Å²	37	79.8 Å²	79.8	24%	0.24	42%	0.421	C	S	.	.			trans	-60	145.9	175.6	-23.7	34.7	0	0	0	113	Q80 F81	P78-Q80 HydrophobicContact CB-CG 4.33Å; P78-Q80 PolarHBondContact O-N 3.03Å; P78-F81 HydrophobicContact CG-CE1 4.45Å; P78-F81 WeakPolarHBondContact O-CB 3.39Å; P78-F81 PolarHBondContact O-N 3.35Å
79	A	93.3	Very high	91.7	Very high	107 Å²	107	73.4 Å²	73.4	88%	0.884	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.8	-175.4	0	0	0	0	0	114.9	F81	A79-F81 VanDerWaalsContact C-N 3.3Å
80	Q	93	Very high	92.4	Very high	138 Å²	138	68.4 Å²	68.4	65%	0.645	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-12.7	175.5	65.9	-87.2	18.5	0	0	114.3	P78	P78-Q80 HydrophobicContact CB-CG 4.33Å; P78-Q80 PolarHBondContact O-N 3.03Å
81	F	92.4	Very high	93	Very high	29 Å²	29	72.1 Å²	72.1	13%	0.127	38%	0.377	C	S	.	.			trans	-73.8	128.6	178.3	-81.1	20.9	0	0	0	109.8	V77 P78 A79 W85 A89 F279 Y290	V77-F81 HydrophobicContact CB-CB 4.38Å; V77-F81 HydrophobicContact CB-CD2 3.85Å; V77-F81 HydrophobicContact CB-CG 4.39Å; V77-F81 HydrophobicContact CG1-CD2 4.14Å; V77-F81 HydrophobicContact CG2-CB 4.22Å; V77-F81 HydrophobicContact CG2-CD2 4.48Å; P78-F81 HydrophobicContact CG-CE1 4.45Å; P78-F81 WeakPolarHBondContact O-CB 3.39Å; P78-F81 PolarHBondContact O-N 3.35Å; A79-F81 VanDerWaalsContact C-N 3.3Å; F81-W85 HydrophobicContact CB-CB 3.81Å; F81-W85 HydrophobicContact CD1-CB 4.5Å; F81-W85 HydrophobicContact CD2-CB 3.79Å; F81-W85 HydrophobicContact CE2-CB 4.46Å; F81-W85 HydrophobicContact CG-CB 3.8Å; F81-A89 HydrophobicContact CE2-CB 4.49Å; F81-F279 HydrophobicContact CE2-CE2 4.26Å; F81-F279 AromaticContact CE2-CZ 3.66Å; F81-F279 HydrophobicContact CE2-CZ 3.66Å; F81-F279 HydrophobicContact CZ-CE2 4.28Å; F81-F279 AromaticContact CZ-CZ 3.85Å; F81-F279 HydrophobicContact CZ-CZ 3.85Å; F81-Y290 HydrophobicContact CE1-CE1 4.35Å; F81-Y290 HydrophobicContact CZ-CD1 4.36Å; F81-Y290 HydrophobicContact CZ-CD2 4.5Å; F81-Y290 HydrophobicContact CZ-CE1 4.32Å; F81-Y290 HydrophobicContact CZ-CE2 4.45Å; F81-Y290 HydrophobicContact CZ-CG 4.45Å
82	T	94.1	Very high	93.4	Very high	82 Å²	82	69.8 Å²	69.8	50%	0.503	36%	0.364	S	S	.	.			trans	-72.5	163.3	169.1	75.9	0	0	0	0	109.6	A84 W85 E86	T82-A84 PolarHBondContact O-N 2.63Å; T82-W85 WeakPolarHBondContact O-CA 3.22Å; T82-W85 WeakPolarHBondContact O-CB 3.41Å; T82-W85 PolarHBondContact O-N 2.77Å; T82-E86 PolarHBondContact O-N 3.28Å
83	G	93.9	Very high	93.6	Very high	42 Å²	42	69 Å²	69	43%	0.433	36%	0.359	S	S	.	.	H	α-helix	trans	-56.8	-23.6	178.5	0	0	0	0	0	114.5	Q87	G83-Q87 VanDerWaalsContact O-CG 3.31Å; G83-Q87 WeakPolarHBondContact O-CG 3.18Å; G83-Q87 PolarHBondContact O-N 2.9Å; G83-Q87 VanDerWaalsContact O-N 3.1Å
84	A	93.8	Very high	93.6	Very high	67 Å²	67	70.1 Å²	70.1	55%	0.554	36%	0.364	S	S	*	.	H	α-helix	trans	-72.9	-37	172.8	0	0	0	0	0	112.6	T82 Y88	T82-A84 PolarHBondContact O-N 2.63Å; A84-Y88 WeakPolarHBondContact O-CB 3.35Å; A84-Y88 PolarHBondContact O-N 2.96Å
85	W	93.1	Very high	93.4	Very high	114 Å²	114	70.7 Å²	70.7	43%	0.432	37%	0.372	S	S	.	.	H	α-helix	trans	-70.2	-37	174.3	-75.6	97.7	0	0	0	111.8	F81 T82 Y88 A89 V281	F81-W85 HydrophobicContact CB-CB 3.81Å; F81-W85 HydrophobicContact CD1-CB 4.5Å; F81-W85 HydrophobicContact CD2-CB 3.79Å; F81-W85 HydrophobicContact CE2-CB 4.46Å; F81-W85 HydrophobicContact CG-CB 3.8Å; T82-W85 WeakPolarHBondContact O-CA 3.22Å; T82-W85 WeakPolarHBondContact O-CB 3.41Å; T82-W85 PolarHBondContact O-N 2.77Å; W85-Y88 PolarHBondContact O-N 3.1Å; W85-A89 WeakPolarHBondContact O-CB 3.45Å; W85-A89 PolarHBondContact O-N 3.05Å; W85-V281 HydrophobicContact CH2-CG1 3.92Å; W85-V281 HydrophobicContact CZ3-CG1 3.89Å; W85-V281 HydrophobicContact CZ3-CG2 4Å
86	E	94.3	Very high	92.9	Very high	78 Å²	78	75.1 Å²	75.1	36%	0.364	39%	0.392	S	S	.	.	H	α-helix	trans	-59.4	-53	172	-175.7	179.1	179.8	0	0	110.9	V77 T82 Y88 A89 E90	V77-E86 HydrophobicContact CG1-CG 4.39Å; V77-E86 HydrophobicContact CG2-CB 4.01Å; V77-E86 HydrophobicContact CG2-CG 3.82Å; T82-E86 PolarHBondContact O-N 3.28Å; E86-Y88 VanDerWaalsContact C-N 3.29Å; E86-Y88 PolarHBondContact O-N 2.7Å; E86-A89 PolarHBondContact O-N 2.92Å; E86-A89 VanDerWaalsContact O-N 3.12Å; E86-E90 WeakPolarHBondContact O-CG 3.42Å; E86-E90 PolarHBondContact O-N 2.74Å
87	Q	93.1	Very high	92.6	Very high	124 Å²	124	67.4 Å²	67.4	58%	0.579	37%	0.366	S	S	*	.	H	α-helix	trans	-59.8	-38.1	176.2	-73.8	176.1	5.5	0	0	112.8	G83 N91	G83-Q87 VanDerWaalsContact O-CG 3.31Å; G83-Q87 WeakPolarHBondContact O-CG 3.18Å; G83-Q87 PolarHBondContact O-N 2.9Å; G83-Q87 VanDerWaalsContact O-N 3.1Å; Q87-N91 VanDerWaalsContact O-CB 3.32Å; Q87-N91 WeakPolarHBondContact O-CB 3.39Å; Q87-N91 VanDerWaalsContact O-CG 3.26Å; Q87-N91 PolarHBondContact O-N 3.02Å; Q87-N91 PolarHBondContact O-ND2 3Å
88	Y	93.4	Very high	92.5	Very high	105 Å²	105	66.2 Å²	66.2	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-63.1	-48.4	174.3	173.1	-95.6	0	0	0	111.2	A84 W85 E86 N91 Y92 F279	A84-Y88 WeakPolarHBondContact O-CB 3.35Å; A84-Y88 PolarHBondContact O-N 2.96Å; W85-Y88 PolarHBondContact O-N 3.1Å; E86-Y88 VanDerWaalsContact C-N 3.29Å; E86-Y88 PolarHBondContact O-N 2.7Å; Y88-N91 PolarHBondContact O-N 2.89Å; Y88-Y92 HydrophobicContact CE1-CD2 4.41Å; Y88-Y92 AromaticContact CZ-CD2 3.96Å; Y88-Y92 WeakPolarHBondContact O-CB 3.25Å; Y88-Y92 PolarHBondContact O-N 3.32Å; Y88-F279 HydrophobicContact CE1-CD2 4.48Å
89	A	94	Very high	92.5	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-46.7	-179.7	0	0	0	0	0	111.4	V77 F81 W85 E86 N91 Y92 C93 F279 I292	V77-A89 HydrophobicContact CG1-CB 4.09Å; F81-A89 HydrophobicContact CE2-CB 4.49Å; W85-A89 WeakPolarHBondContact O-CB 3.45Å; W85-A89 PolarHBondContact O-N 3.05Å; E86-A89 PolarHBondContact O-N 2.92Å; E86-A89 VanDerWaalsContact O-N 3.12Å; A89-N91 PolarHBondContact O-N 2.96Å; A89-Y92 PolarHBondContact O-N 3.49Å; A89-C93 VanDerWaalsContact O-CB 3.26Å; A89-C93 WeakPolarHBondContact O-CB 3.33Å; A89-C93 PolarHBondContact O-N 2.85Å; A89-C93 PolarHBondContact O-SG 3.3Å; A89-F279 HydrophobicContact CB-CE1 4.19Å; A89-F279 HydrophobicContact CB-CZ 4.2Å; A89-I292 HydrophobicContact CB-CD1 3.96Å
90	E	93.4	Very high	92.4	Very high	27 Å²	27	61.8 Å²	61.8	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-59.5	-47.9	176.8	-70.6	-178.1	152.7	0	0	112.2	I73 Q74 C75 E86 C93 F94	I73-E90 HydrophobicContact CG2-CB 4.37Å; Q74-E90 WeakPolarHBondContact CA-OE1 3.26Å; C75-E90 HydrophobicContact CB-CG 4.03Å; C75-E90 PolarHBondContact N-OE1 3.42Å; E86-E90 WeakPolarHBondContact O-CG 3.42Å; E86-E90 PolarHBondContact O-N 2.74Å; E90-C93 PolarHBondContact O-N 3.42Å; E90-F94 WeakPolarHBondContact O-CB 3.31Å; E90-F94 PolarHBondContact O-N 3.32Å
91	N	91.8	Very high	92.3	Very high	107 Å²	107	56.6 Å²	56.6	57%	0.572	29%	0.291	S	S	*	.	H	α-helix	trans	-67.2	-39.8	178.8	-74	-46.5	0	0	0	112.2	Q87 Y88 A89 F94 V95	Q87-N91 VanDerWaalsContact O-CB 3.32Å; Q87-N91 WeakPolarHBondContact O-CB 3.39Å; Q87-N91 VanDerWaalsContact O-CG 3.26Å; Q87-N91 PolarHBondContact O-N 3.02Å; Q87-N91 PolarHBondContact O-ND2 3Å; Y88-N91 PolarHBondContact O-N 2.89Å; A89-N91 PolarHBondContact O-N 2.96Å; N91-F94 PolarHBondContact O-N 3.41Å; N91-V95 WeakPolarHBondContact O-CG2 3.31Å; N91-V95 PolarHBondContact O-N 2.95Å; N91-V95 VanDerWaalsContact O-N 3.14Å
92	Y	93.4	Very high	92.1	Very high	59 Å²	59	56.2 Å²	56.2	23%	0.231	29%	0.293	C	S	.	.	H	α-helix	trans	-61.9	-49.7	176.7	-175.2	-80	0	0	0	110.4	Y88 A89 F94 V95 Q96 F279	Y88-Y92 HydrophobicContact CE1-CD2 4.41Å; Y88-Y92 AromaticContact CZ-CD2 3.96Å; Y88-Y92 WeakPolarHBondContact O-CB 3.25Å; Y88-Y92 PolarHBondContact O-N 3.32Å; A89-Y92 PolarHBondContact O-N 3.49Å; Y92-F94 VanDerWaalsContact C-N 3.3Å; Y92-F94 PolarHBondContact O-N 3.3Å; Y92-V95 PolarHBondContact O-N 3.19Å; Y92-V95 VanDerWaalsContact O-N 3.08Å; Y92-Q96 HydrophobicContact CD1-CB 4.09Å; Y92-Q96 HydrophobicContact CD1-CG 3.93Å; Y92-Q96 HydrophobicContact CD2-CG 4.4Å; Y92-Q96 HydrophobicContact CE1-CB 3.77Å; Y92-Q96 HydrophobicContact CE1-CG 3.54Å; Y92-Q96 HydrophobicContact CE2-CG 4.05Å; Y92-Q96 HydrophobicContact CG-CG 4.35Å; Y92-Q96 WeakPolarHBondContact O-CB 3.49Å; Y92-Q96 PolarHBondContact O-N 2.84Å; Y92-F279 HydrophobicContact CD1-CB 3.3Å; Y92-F279 HydrophobicContact CD1-CG 4.35Å; Y92-F279 HydrophobicContact CE1-CB 3.23Å; Y92-F279 HydrophobicContact CG-CB 4.09Å
93	C	93.4	Very high	91.7	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-36.5	178.7	-69.4	0	0	0	0	112.5	I73 A89 E90 V95 C277	I73-C93 HydrophobicContact CD1-CB 4.28Å; A89-C93 VanDerWaalsContact O-CB 3.26Å; A89-C93 WeakPolarHBondContact O-CB 3.33Å; A89-C93 PolarHBondContact O-N 2.85Å; A89-C93 PolarHBondContact O-SG 3.3Å; E90-C93 PolarHBondContact O-N 3.42Å; C93-V95 VanDerWaalsContact C-N 3.27Å; C93-V95 PolarHBondContact O-N 3.48Å; C93-C277 WeakPolarHBondContact CA-SG 3.33Å; C93-C277 HydrophobicContact CB-CB 3.67Å; C93-C277 WeakPolarHBondContact CB-SG 3.49Å; C93-C277 WeakPolarHBondContact SG-CB 3.47Å; C93-C277 CovalentContact SG-SG 2.02Å; C93-C277 PolarHBondContact SG-SG 3.35Å
94	F	90.8	Very high	91.3	Very high	30 Å²	30	61.6 Å²	61.6	13%	0.132	32%	0.315	C	S	.	.	H	α-helix	trans	-63	-34.3	174	-174.6	-111.2	0	0	0	112.4	Q67 P72 I73 E90 N91 Y92 Y122 Q123	Q67-F94 HydrophobicContact CG-CE1 4.44Å; Q67-F94 HydrophobicContact CG-CZ 3.71Å; P72-F94 HydrophobicContact CB-CD2 4.03Å; P72-F94 HydrophobicContact CB-CE2 3.65Å; P72-F94 HydrophobicContact CB-CZ 4.23Å; P72-F94 HydrophobicContact CG-CD1 4.46Å; P72-F94 HydrophobicContact CG-CD2 3.73Å; P72-F94 HydrophobicContact CG-CE1 4.41Å; P72-F94 HydrophobicContact CG-CE2 3.67Å; P72-F94 HydrophobicContact CG-CG 4.15Å; P72-F94 HydrophobicContact CG-CZ 4.04Å; I73-F94 HydrophobicContact CG2-CB 3.91Å; I73-F94 HydrophobicContact CG2-CD2 4.34Å; I73-F94 HydrophobicContact CG2-CG 4.49Å; E90-F94 WeakPolarHBondContact O-CB 3.31Å; E90-F94 PolarHBondContact O-N 3.32Å; N91-F94 PolarHBondContact O-N 3.41Å; Y92-F94 VanDerWaalsContact C-N 3.3Å; Y92-F94 PolarHBondContact O-N 3.3Å; F94-Y122 HydrophobicContact CD2-CE2 4.05Å; F94-Y122 AromaticContact CE2-CD2 3.96Å; F94-Y122 HydrophobicContact CE2-CD2 3.96Å; F94-Y122 AromaticContact CE2-CE2 3.93Å; F94-Y122 HydrophobicContact CE2-CE2 3.93Å; F94-Q123 HydrophobicContact CZ-CG 4.49Å; F94-Q123 PolarHBondContact O-NE2 3.08Å
95	V	90.3	Very high	91	Very high	93 Å²	93	62.7 Å²	62.7	56%	0.564	31%	0.312	S	S	*	.	H	α-helix	trans	-88.3	-38	-176.9	173.8	0	0	0	0	113	N91 Y92 C93 N97 Q123	N91-V95 WeakPolarHBondContact O-CG2 3.31Å; N91-V95 PolarHBondContact O-N 2.95Å; N91-V95 VanDerWaalsContact O-N 3.14Å; Y92-V95 PolarHBondContact O-N 3.19Å; Y92-V95 VanDerWaalsContact O-N 3.08Å; C93-V95 VanDerWaalsContact C-N 3.27Å; C93-V95 PolarHBondContact O-N 3.48Å; V95-N97 VanDerWaalsContact C-N 3.31Å; V95-N97 PolarHBondContact O-N 3.33Å; V95-Q123 VanDerWaalsContact C-NE2 3.31Å; V95-Q123 PolarHBondContact O-NE2 2.89Å
96	Q	86.2	Confident	90.8	Very high	103 Å²	103	64.5 Å²	64.5	48%	0.481	33%	0.33	S	S	.	.	S	Bend	trans	-89.3	11.1	-171	-71.6	-74.7	-7.8	0	0	114.8	Y92	Y92-Q96 HydrophobicContact CD1-CB 4.09Å; Y92-Q96 HydrophobicContact CD1-CG 3.93Å; Y92-Q96 HydrophobicContact CD2-CG 4.4Å; Y92-Q96 HydrophobicContact CE1-CB 3.77Å; Y92-Q96 HydrophobicContact CE1-CG 3.54Å; Y92-Q96 HydrophobicContact CE2-CG 4.05Å; Y92-Q96 HydrophobicContact CG-CG 4.35Å; Y92-Q96 WeakPolarHBondContact O-CB 3.49Å; Y92-Q96 PolarHBondContact O-N 2.84Å
97	N	88.8	Confident	90.5	Very high	49 Å²	49	63.9 Å²	63.9	26%	0.262	33%	0.329	S	S	.	.			trans	65.2	163.6	-172.1	-50.9	-46.9	0	0	0	113.3	V95 G120	V95-N97 VanDerWaalsContact C-N 3.31Å; V95-N97 PolarHBondContact O-N 3.33Å; N97-G120 WeakPolarHBondContact OD1-CA 3.25Å
98	T	92.7	Very high	90.3	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	152	-178.4	54.1	0	0	0	0	108.6	I73 I119 Y122 T275 M276 C277	I73-T98 HydrophobicContact CD1-CG2 4.04Å; T98-I119 PolarHBondContact N-O 3.28Å; T98-I119 PolarHBondContact O-N 2.98Å; T98-Y122 WeakPolarHBondContact CG2-OH 3.46Å; T98-Y122 PolarHBondContact OG1-OH 3.36Å; T98-T275 WeakPolarHBondContact CB-OG1 3.24Å; T98-T275 PolarHBondContact OG1-OG1 3.21Å; T98-M276 CarbonylContact C-O 3.6Å; T98-M276 WeakPolarHBondContact CA-O 3.48Å; T98-C277 HydrophobicContact CG2-CB 4.27Å
99	Y	92.9	Very high	89.9	Confident	5 Å²	5	61.7 Å²	61.7	2%	0.02	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	153	177.1	62.1	-84.7	0	0	0	111.6	L101 I107 R114 L117 T275 M276 D278 T291	Y99-L101 HydrophobicContact CD2-CD1 3.92Å; Y99-L101 HydrophobicContact CD2-CG 4.14Å; Y99-L101 HydrophobicContact CE2-CD1 3.54Å; Y99-L101 HydrophobicContact CE2-CG 4.26Å; Y99-I107 HydrophobicContact CE2-CG2 4.4Å; Y99-I107 WeakPolarHBondContact OH-CG2 3.2Å; Y99-R114 HydrophobicContact CD1-CB 4.48Å; Y99-R114 HydrophobicContact CE1-CB 4.47Å; Y99-R114 HydrophobicContact CE2-CG 4.46Å; Y99-L117 VanDerWaalsContact CA-O 3.25Å; Y99-L117 WeakPolarHBondContact CA-O 3.39Å; Y99-L117 VanDerWaalsContact CB-O 3.32Å; Y99-L117 WeakPolarHBondContact CB-O 3.08Å; Y99-T275 CarbonylContact O-C 3.55Å; Y99-T275 WeakPolarHBondContact O-CA 3.26Å; Y99-T275 WeakPolarHBondContact O-CB 3.33Å; Y99-M276 HydrophobicContact CD1-CB 4.26Å; Y99-M276 WeakPolarHBondContact CD1-O 3.43Å; Y99-M276 HydrophobicContact CD2-CB 4Å; Y99-M276 HydrophobicContact CE1-CB 3.77Å; Y99-M276 HydrophobicContact CE2-CB 3.49Å; Y99-M276 VanDerWaalsContact CE2-CB 3.49Å; Y99-M276 HydrophobicContact CE2-CG 4.08Å; Y99-M276 HydrophobicContact CG-CB 4.36Å; Y99-M276 PolarHBondContact N-O 2.79Å; Y99-M276 PolarHBondContact O-N 3.44Å; Y99-D278 PolarHBondContact OH-OD1 3.04Å; Y99-T291 WeakPolarHBondContact OH-CG2 3.34Å
100	W	91.8	Very high	89.5	Confident	45 Å²	45	67.4 Å²	67.4	17%	0.17	36%	0.357	C	S	.	.			trans	-109.1	138.2	177.4	179.3	74.7	0	0	0	111.4	A102 L117 I119 W265 E266 P272 V274	W100-A102 HydrophobicContact CH2-CB 4.5Å; W100-L117 PolarHBondContact N-O 3.38Å; W100-I119 HydrophobicContact CB-CD1 3.64Å; W100-W265 AromaticContact NE1-CE3 3.8Å; W100-W265 AromaticContact NE1-CZ3 3.65Å; W100-E266 WeakPolarHBondContact CZ2-O 3.33Å; W100-P272 HydrophobicContact CB-CB 4.13Å; W100-P272 HydrophobicContact CB-CG 3.77Å; W100-P272 HydrophobicContact CD2-CB 4.27Å; W100-P272 HydrophobicContact CG-CB 3.55Å; W100-P272 HydrophobicContact CG-CG 3.69Å; W100-V274 VanDerWaalsContact CD1-O 3.3Å
101	L	90.1	Very high	89	Confident	30 Å²	30	68.8 Å²	68.8	16%	0.157	37%	0.368	C	S	.	.			trans	-139.9	147.8	172.4	-74.6	164.7	0	0	0	107.1	Y99 I107 L117	Y99-L101 HydrophobicContact CD2-CD1 3.92Å; Y99-L101 HydrophobicContact CD2-CG 4.14Å; Y99-L101 HydrophobicContact CE2-CD1 3.54Å; Y99-L101 HydrophobicContact CE2-CG 4.26Å; L101-I107 HydrophobicContact CD1-CB 4.44Å; L101-I107 HydrophobicContact CD1-CG1 4.26Å; L101-I107 HydrophobicContact CD1-CG2 4.42Å; L101-L117 HydrophobicContact CD2-CD1 3.36Å; L101-L117 HydrophobicContact CG-CD1 3.96Å
102	A	88.5	Confident	88.6	Confident	20 Å²	20	68.7 Å²	68.7	17%	0.165	36%	0.364	C	S	.	.			trans	-63.8	146.1	167.6	0	0	0	0	0	109.2	W100 S104 D105	W100-A102 HydrophobicContact CH2-CB 4.5Å; A102-S104 PolarHBondContact O-N 2.85Å; A102-S104 VanDerWaalsContact O-N 3.12Å; A102-D105 PolarHBondContact O-N 3.14Å
103	I	85.6	Confident	88.3	Confident	137 Å²	137	69 Å²	69	70%	0.703	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.7	-177.3	-63.1	171.6	0	0	0	111.6	D105	I103-D105 VanDerWaalsContact C-N 3.34Å
104	S	85.9	Confident	88	Confident	100 Å²	100	70.2 Å²	70.2	70%	0.699	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-19.4	175.9	53.2	0	0	0	0	114.4	A102	A102-S104 PolarHBondContact O-N 2.85Å; A102-S104 VanDerWaalsContact O-N 3.12Å
105	D	87.8	Confident	87.7	Confident	91 Å²	91	73.7 Å²	73.7	49%	0.487	39%	0.389	S	S	.	.	S	Bend	trans	-87.6	137.9	-172.1	-64.4	-9.5	0	0	0	110.3	A102 I103	A102-D105 PolarHBondContact O-N 3.14Å; I103-D105 VanDerWaalsContact C-N 3.34Å
106	N	87.9	Confident	87.4	Confident	152 Å²	152	77.2 Å²	77.2	81%	0.813	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-68.7	139.9	174.7	-67.7	-42.5	0	0	0	110.1	P108	N106-P108 WeakPolarHBondContact O-CD 3.47Å
107	I	88.7	Confident	87.4	Confident	64 Å²	64	75.4 Å²	75.4	33%	0.328	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-65.4	121.8	174.4	-55.5	173.1	0	0	0	108	Y99 L101 D109 R114 M276 T291	Y99-I107 HydrophobicContact CE2-CG2 4.4Å; Y99-I107 WeakPolarHBondContact OH-CG2 3.2Å; L101-I107 HydrophobicContact CD1-CB 4.44Å; L101-I107 HydrophobicContact CD1-CG1 4.26Å; L101-I107 HydrophobicContact CD1-CG2 4.42Å; I107-D109 PolarHBondContact O-N 3.28Å; I107-R114 VanDerWaalsContact CG2-CZ 3.41Å; I107-M276 HydrophobicContact CD1-CE 3.98Å; I107-T291 HydrophobicContact CD1-CG2 4Å
108	P	89	Confident	87.3	Confident	32 Å²	32	77.2 Å²	77.2	21%	0.208	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-56	133.9	-179.5	-25.7	33.7	0	0	0	111.6	N106 E110 N113 R114	N106-P108 WeakPolarHBondContact O-CD 3.47Å; P108-E110 VanDerWaalsContact C-N 3.33Å; P108-E110 PolarHBondContact O-N 3.32Å; P108-N113 HydrophobicContact CB-CB 3.82Å; P108-N113 HydrophobicContact CG-CB 4.36Å; P108-R114 HydrophobicContact CB-CG 4.3Å; P108-R114 VanDerWaalsContact O-CZ 3.25Å; P108-R114 PolarHBondContact O-NE 3.39Å; P108-R114 PolarHBondContact O-NH2 3.38Å
109	D	84.7	Confident	87.1	Confident	152 Å²	152	78.4 Å²	78.4	81%	0.813	41%	0.406	S	S	*	.	S	Bend	trans	-65.9	-39.8	-179.3	-67.4	-41.3	0	0	0	111.5	I107	I107-D109 PolarHBondContact O-N 3.28Å
110	E	85.9	Confident	86.7	Confident	119 Å²	119	79.1 Å²	79.1	56%	0.556	42%	0.415	S	S	*	.	S	Bend	trans	-76	127.7	179.8	-66.5	176.9	173	0	0	111.3	P108 E112 N113	P108-E110 VanDerWaalsContact C-N 3.33Å; P108-E110 PolarHBondContact O-N 3.32Å; E110-E112 PolarHBondContact O-N 3.12Å; E110-N113 PolarHBondContact O-N 3.42Å; E110-N113 PolarHBondContact OE2-ND2 3.01Å
111	P	82.1	Confident	86.6	Confident	57 Å²	57	78.5 Å²	78.5	37%	0.37	41%	0.413	S	S	.	.	H	α-helix	trans	-61.6	-29.7	179	21.4	-30.5	0	0	0	113.4	R114 K115	P111-R114 WeakPolarHBondContact O-CB 3.22Å; P111-R114 PolarHBondContact O-N 2.88Å; P111-K115 PolarHBondContact O-N 3.45Å
112	E	84.6	Confident	86.5	Confident	105 Å²	105	77.1 Å²	77.1	49%	0.491	41%	0.405	S	S	.	.	H	α-helix	trans	-66.3	-41.6	-177.9	-61.4	-55.2	144.3	0	0	111.4	E110 R114 K115	E110-E112 PolarHBondContact O-N 3.12Å; E112-R114 PolarHBondContact O-N 2.78Å; E112-K115 WeakPolarHBondContact O-CB 3.29Å; E112-K115 PolarHBondContact O-N 2.9Å; E112-K115 IonicContact OE1-NZ 2.73Å; E112-K115 PolarHBondContact OE1-NZ 3.17Å; E112-K115 WeakPolarHBondContact OE2-CD 3.35Å; E112-K115 WeakPolarHBondContact OE2-CE 3.17Å; E112-K115 IonicContact OE2-NZ 3.05Å; E112-K115 PolarHBondContact OE2-NZ 2.94Å
113	N	87.4	Confident	86.5	Confident	65 Å²	65	77.7 Å²	77.7	35%	0.348	41%	0.405	S	S	.	.	H	α-helix	trans	-63.7	-27.8	176.4	-62	-23	0	0	0	112	P108 E110 K115	P108-N113 HydrophobicContact CB-CB 3.82Å; P108-N113 HydrophobicContact CG-CB 4.36Å; E110-N113 PolarHBondContact O-N 3.42Å; E110-N113 PolarHBondContact OE2-ND2 3.01Å; N113-K115 VanDerWaalsContact C-N 3.34Å
114	R	87.5	Confident	86.8	Confident	25 Å²	25	78.5 Å²	78.5	9%	0.094	40%	0.399	C	S	.	.	H	α-helix	trans	-71.9	-27.8	173.7	-55.8	-177.5	-167.4	-170.2	-3.6	112.4	Y99 I107 P108 P111 E112 L117 D278 T291	Y99-R114 HydrophobicContact CD1-CB 4.48Å; Y99-R114 HydrophobicContact CE1-CB 4.47Å; Y99-R114 HydrophobicContact CE2-CG 4.46Å; I107-R114 VanDerWaalsContact CG2-CZ 3.41Å; P108-R114 HydrophobicContact CB-CG 4.3Å; P108-R114 VanDerWaalsContact O-CZ 3.25Å; P108-R114 PolarHBondContact O-NE 3.39Å; P108-R114 PolarHBondContact O-NH2 3.38Å; P111-R114 WeakPolarHBondContact O-CB 3.22Å; P111-R114 PolarHBondContact O-N 2.88Å; E112-R114 PolarHBondContact O-N 2.78Å; R114-L117 PolarHBondContact O-N 3.48Å; R114-D278 WeakPolarHBondContact CD-OD2 3.48Å; R114-D278 IonicContact CZ-OD2 3.68Å; R114-D278 IonicContact NE-OD2 3.77Å; R114-D278 VanDerWaalsContact NH1-CG 3.34Å; R114-D278 IonicContact NH1-OD1 3.16Å; R114-D278 PolarHBondContact NH1-OD1 2.9Å; R114-D278 VanDerWaalsContact NH1-OD1 3.16Å; R114-D278 IonicContact NH1-OD2 2.8Å; R114-D278 PolarHBondContact NH1-OD2 3.38Å; R114-T291 PolarHBondContact NH1-OG1 3.11Å
115	K	84.3	Confident	87.1	Confident	103 Å²	103	73.7 Å²	73.7	45%	0.448	37%	0.366	S	S	.	.	H	α-helix	trans	-68.3	-35.6	179.1	-66.7	-177.2	-168.1	158.1	0	112.3	P111 E112 N113 L117 Q118	P111-K115 PolarHBondContact O-N 3.45Å; E112-K115 WeakPolarHBondContact O-CB 3.29Å; E112-K115 PolarHBondContact O-N 2.9Å; E112-K115 IonicContact OE1-NZ 2.73Å; E112-K115 PolarHBondContact OE1-NZ 3.17Å; E112-K115 WeakPolarHBondContact OE2-CD 3.35Å; E112-K115 WeakPolarHBondContact OE2-CE 3.17Å; E112-K115 IonicContact OE2-NZ 3.05Å; E112-K115 PolarHBondContact OE2-NZ 2.94Å; N113-K115 VanDerWaalsContact C-N 3.34Å; K115-L117 PolarHBondContact O-N 3.44Å; K115-Q118 VanDerWaalsContact O-CB 3.3Å; K115-Q118 WeakPolarHBondContact O-CB 3.45Å; K115-Q118 WeakPolarHBondContact O-CG 3.31Å; K115-Q118 PolarHBondContact O-N 3.32Å; K115-Q118 VanDerWaalsContact O-N 3.12Å
116	E	83.3	Confident	87.3	Confident	168 Å²	168	69.5 Å²	69.5	79%	0.785	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.6	178.1	-61.1	-173.1	169.5	0	0	113
117	L	85.2	Confident	87.5	Confident	64 Å²	64	67.2 Å²	67.2	34%	0.335	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	2.4	179.5	-61.6	170.7	0	0	0	113.1	Y99 W100 L101 R114 K115	Y99-L117 VanDerWaalsContact CA-O 3.25Å; Y99-L117 WeakPolarHBondContact CA-O 3.39Å; Y99-L117 VanDerWaalsContact CB-O 3.32Å; Y99-L117 WeakPolarHBondContact CB-O 3.08Å; W100-L117 PolarHBondContact N-O 3.38Å; L101-L117 HydrophobicContact CD2-CD1 3.36Å; L101-L117 HydrophobicContact CG-CD1 3.96Å; R114-L117 PolarHBondContact O-N 3.48Å; K115-L117 PolarHBondContact O-N 3.44Å
118	Q	87.7	Confident	87.8	Confident	88 Å²	88	64.9 Å²	64.9	41%	0.411	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	139.3	-177.1	-74.8	178	-4.6	0	0	112.4	K115	K115-Q118 VanDerWaalsContact O-CB 3.3Å; K115-Q118 WeakPolarHBondContact O-CB 3.45Å; K115-Q118 WeakPolarHBondContact O-CG 3.31Å; K115-Q118 PolarHBondContact O-N 3.32Å; K115-Q118 VanDerWaalsContact O-N 3.12Å
119	I	87.3	Confident	88.1	Confident	24 Å²	24	63.4 Å²	63.4	12%	0.123	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	112.6	177.5	-56.2	176.7	0	0	0	106.8	T98 W100 Y121 Y122 P272	T98-I119 PolarHBondContact N-O 3.28Å; T98-I119 PolarHBondContact O-N 2.98Å; W100-I119 HydrophobicContact CB-CD1 3.64Å; I119-Y121 HydrophobicContact CG2-CD1 3.61Å; I119-Y121 HydrophobicContact CG2-CE1 3.3Å; I119-Y122 HydrophobicContact CG2-CD1 4.14Å; I119-Y122 HydrophobicContact CG2-CE1 4.19Å; I119-Y122 WeakPolarHBondContact O-CE1 3.47Å; I119-P272 HydrophobicContact CD1-CG 3.32Å
120	G	85.8	Confident	88.4	Confident	20 Å²	20	57.8 Å²	57.8	21%	0.206	28%	0.279	C	S	.	.			trans	-124.5	1.8	-179.2	0	0	0	0	0	114.8	N97 Y122	N97-G120 WeakPolarHBondContact OD1-CA 3.25Å; G120-Y122 VanDerWaalsContact C-N 3.32Å; G120-Y122 PolarHBondContact O-N 3.15Å
121	Y	89	Confident	88.8	Confident	33 Å²	33	56.3 Å²	56.3	13%	0.129	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-67.8	-30.1	-173.5	65.4	-105.2	0	0	0	113.1	I119 Q123 W124 V125 F243 L244 F271 N299	I119-Y121 HydrophobicContact CG2-CD1 3.61Å; I119-Y121 HydrophobicContact CG2-CE1 3.3Å; Y121-Q123 PolarHBondContact O-N 3.16Å; Y121-Q123 VanDerWaalsContact O-N 3.16Å; Y121-W124 PolarHBondContact O-N 3.46Å; Y121-V125 HydrophobicContact CD2-CG2 3.99Å; Y121-V125 PolarHBondContact O-N 3.15Å; Y121-F243 HydrophobicContact CD2-CE1 4.23Å; Y121-F243 HydrophobicContact CG-CE1 4.38Å; Y121-F243 WeakPolarHBondContact O-CZ 3.39Å; Y121-L244 HydrophobicContact CD2-CD2 4.17Å; Y121-L244 HydrophobicContact CE1-CD2 4.48Å; Y121-L244 HydrophobicContact CE2-CD2 4.2Å; Y121-L244 HydrophobicContact CG-CD2 4.37Å; Y121-F271 HydrophobicContact CE2-CD1 4.32Å; Y121-F271 HydrophobicContact CE2-CE1 4.13Å; Y121-F271 AromaticContact CZ-CD1 3.99Å; Y121-F271 WeakPolarHBondContact OH-CD1 3.22Å; Y121-N299 PolarHBondContact OH-ND2 3.29Å; Y121-N299 PolarHBondContact OH-OD1 3.28Å
122	Y	88.6	Confident	89.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-62.4	-28.8	-170.5	50.7	-100.7	0	0	0	113.3	Q67 F94 T98 I119 G120 W124 L296	Q67-Y122 PolarHBondContact OE1-O 3.31Å; F94-Y122 HydrophobicContact CD2-CE2 4.05Å; F94-Y122 AromaticContact CE2-CD2 3.96Å; F94-Y122 HydrophobicContact CE2-CD2 3.96Å; F94-Y122 AromaticContact CE2-CE2 3.93Å; F94-Y122 HydrophobicContact CE2-CE2 3.93Å; T98-Y122 WeakPolarHBondContact CG2-OH 3.46Å; T98-Y122 PolarHBondContact OG1-OH 3.36Å; I119-Y122 HydrophobicContact CG2-CD1 4.14Å; I119-Y122 HydrophobicContact CG2-CE1 4.19Å; I119-Y122 WeakPolarHBondContact O-CE1 3.47Å; G120-Y122 VanDerWaalsContact C-N 3.32Å; G120-Y122 PolarHBondContact O-N 3.15Å; Y122-W124 PolarHBondContact O-N 3.02Å; Y122-L296 HydrophobicContact CD1-CD2 3.63Å; Y122-L296 HydrophobicContact CD2-CD1 4.43Å; Y122-L296 HydrophobicContact CE1-CD1 4.45Å; Y122-L296 HydrophobicContact CE1-CD2 3.67Å; Y122-L296 HydrophobicContact CE2-CD1 4.28Å; Y122-L296 HydrophobicContact CG-CD2 4.2Å
123	Q	88.3	Confident	90	Very high	33 Å²	33	48.6 Å²	48.6	15%	0.154	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-62.9	-32.7	174.1	-60.2	171.1	-19.1	0	0	112.2	Q67 F94 V95 Y121	Q67-Q123 PolarHBondContact NE2-O 3.04Å; F94-Q123 HydrophobicContact CZ-CG 4.49Å; F94-Q123 PolarHBondContact O-NE2 3.08Å; V95-Q123 VanDerWaalsContact C-NE2 3.31Å; V95-Q123 PolarHBondContact O-NE2 2.89Å; Y121-Q123 PolarHBondContact O-N 3.16Å; Y121-Q123 VanDerWaalsContact O-N 3.16Å
124	W	92	Very high	90.2	Very high	153 Å²	153	48.6 Å²	48.6	58%	0.58	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-11.3	-170.8	-63.4	95.4	0	0	0	113.9	Y121 Y122 F127 M128 F243	Y121-W124 PolarHBondContact O-N 3.46Å; Y122-W124 PolarHBondContact O-N 3.02Å; W124-F127 HydrophobicContact CE3-CD2 4.32Å; W124-F127 PolarHBondContact O-N 3.14Å; W124-M128 WeakPolarHBondContact O-CB 3.39Å; W124-M128 PolarHBondContact O-N 3.46Å; W124-F243 HydrophobicContact CB-CE2 3.8Å; W124-F243 HydrophobicContact CB-CZ 4.03Å
125	V	93.1	Very high	90.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-51.3	-49.4	-175.3	171.9	0	0	0	0	112.5	I63 Y121 F127 M128 L129 F243 F306	I63-V125 HydrophobicContact CD1-CG1 3.75Å; I63-V125 HydrophobicContact CG2-CG1 4.1Å; Y121-V125 HydrophobicContact CD2-CG2 3.99Å; Y121-V125 PolarHBondContact O-N 3.15Å; V125-F127 VanDerWaalsContact C-N 3.33Å; V125-F127 PolarHBondContact O-N 3.06Å; V125-M128 PolarHBondContact O-N 3.45Å; V125-L129 HydrophobicContact CG1-CD1 3.89Å; V125-L129 HydrophobicContact CG1-CG 4.3Å; V125-L129 WeakPolarHBondContact O-CG 3.35Å; V125-L129 PolarHBondContact O-N 3.36Å; V125-F243 HydrophobicContact CG2-CE1 3.83Å; V125-F243 HydrophobicContact CG2-CZ 3.92Å; V125-F306 HydrophobicContact CB-CZ 4.42Å; V125-F306 HydrophobicContact CG1-CE2 3.94Å; V125-F306 HydrophobicContact CG1-CZ 3.78Å; V125-F306 HydrophobicContact CG2-CE2 3.79Å; V125-F306 HydrophobicContact CG2-CZ 3.92Å
126	P	91.8	Very high	91.2	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-65.2	-36.9	-176.6	-19.8	31.8	0	0	0	113.8	S60 I63 S64 A130	S60-P126 PolarHBondContact OG-O 3.06Å; I63-P126 HydrophobicContact CB-CG 4.5Å; I63-P126 HydrophobicContact CG2-CG 4Å; S64-P126 WeakPolarHBondContact OG-CB 3.41Å; P126-A130 PolarHBondContact O-N 3.49Å; P126-A130 VanDerWaalsContact O-N 3.15Å
127	F	92.3	Very high	91.7	Very high	105 Å²	105	39.5 Å²	39.5	46%	0.461	20%	0.197	S	C	.	.	H	α-helix	trans	-69.1	-42.3	177.6	-58.6	-65.8	0	0	0	111.2	W124 V125 A130 I131	W124-F127 HydrophobicContact CE3-CD2 4.32Å; W124-F127 PolarHBondContact O-N 3.14Å; V125-F127 VanDerWaalsContact C-N 3.33Å; V125-F127 PolarHBondContact O-N 3.06Å; F127-A130 PolarHBondContact O-N 3.24Å; F127-I131 WeakPolarHBondContact O-CG1 3.16Å; F127-I131 PolarHBondContact O-N 2.7Å
128	M	94.3	Very high	92.1	Very high	14 Å²	14	40 Å²	40	7%	0.069	20%	0.199	C	C	.	.	H	α-helix	trans	-58.5	-49.9	175.8	179.5	-87.7	-167.2	0	0	110.7	W124 V125 A130 I131 E132 L239 L240 F243 F306	W124-M128 WeakPolarHBondContact O-CB 3.39Å; W124-M128 PolarHBondContact O-N 3.46Å; V125-M128 PolarHBondContact O-N 3.45Å; M128-A130 VanDerWaalsContact C-N 3.29Å; M128-A130 PolarHBondContact O-N 3.26Å; M128-I131 WeakPolarHBondContact O-CA 3.41Å; M128-I131 WeakPolarHBondContact O-CB 3.28Å; M128-I131 PolarHBondContact O-N 2.97Å; M128-E132 HydrophobicContact CE-CG 4.06Å; M128-E132 WeakPolarHBondContact CE-OE1 3.47Å; M128-E132 WeakPolarHBondContact O-CG 3.36Å; M128-E132 PolarHBondContact O-N 3.23Å; M128-E132 VanDerWaalsContact SD-CD 3.53Å; M128-E132 HydrophobicContact SD-CG 3.89Å; M128-L239 HydrophobicContact CE-CG 4.39Å; M128-L240 HydrophobicContact CE-CB 4.47Å; M128-L240 HydrophobicContact CE-CD1 3.94Å; M128-F243 HydrophobicContact CB-CD2 4.21Å; M128-F243 HydrophobicContact CB-CE2 3.85Å; M128-F243 HydrophobicContact CB-CZ 4.08Å; M128-F243 HydrophobicContact CE-CB 3.96Å; M128-F243 HydrophobicContact CE-CD1 4.11Å; M128-F243 HydrophobicContact CE-CG 4.02Å; M128-F243 HydrophobicContact CG-CD1 4.3Å; M128-F243 HydrophobicContact CG-CD2 3.79Å; M128-F243 HydrophobicContact CG-CE1 4.45Å; M128-F243 HydrophobicContact CG-CE2 3.95Å; M128-F243 HydrophobicContact CG-CG 3.97Å; M128-F243 HydrophobicContact CG-CZ 4.27Å; M128-F243 HydrophobicContact SD-CD1 4.42Å; M128-F306 HydrophobicContact CE-CE1 4.45Å; M128-F306 HydrophobicContact SD-CE1 4.32Å
129	L	94.9	Very high	92.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-35.5	177.2	-67.3	175.3	0	0	0	113.2	L56 L59 I63 V125 E132 A133 F306 L309	L56-L129 HydrophobicContact CD2-CD2 3.82Å; L59-L129 HydrophobicContact CB-CD1 4Å; I63-L129 HydrophobicContact CD1-CD1 3.76Å; V125-L129 HydrophobicContact CG1-CD1 3.89Å; V125-L129 HydrophobicContact CG1-CG 4.3Å; V125-L129 WeakPolarHBondContact O-CG 3.35Å; V125-L129 PolarHBondContact O-N 3.36Å; L129-E132 PolarHBondContact O-N 3.07Å; L129-A133 WeakPolarHBondContact O-CB 3.23Å; L129-A133 PolarHBondContact O-N 3.15Å; L129-F306 HydrophobicContact CD2-CE1 4.37Å; L129-L309 HydrophobicContact CD2-CD1 3.45Å; L129-L309 VanDerWaalsContact CD2-CD1 3.45Å
130	A	92.2	Very high	92.6	Very high	34 Å²	34	34.9 Å²	34.9	28%	0.281	18%	0.176	S	C	.	.	H	α-helix	trans	-69.4	-35.8	175.3	0	0	0	0	0	112.6	P126 F127 M128 S134	P126-A130 PolarHBondContact O-N 3.49Å; P126-A130 VanDerWaalsContact O-N 3.15Å; F127-A130 PolarHBondContact O-N 3.24Å; M128-A130 VanDerWaalsContact C-N 3.29Å; M128-A130 PolarHBondContact O-N 3.26Å; A130-S134 PolarHBondContact O-N 3.43Å; A130-S134 VanDerWaalsContact O-N 3.09Å; A130-S134 PolarHBondContact O-OG 3.45Å
131	I	93.9	Very high	92.9	Very high	88 Å²	88	37.4 Å²	37.4	45%	0.451	18%	0.183	S	C	.	.	H	α-helix	trans	-67.1	-45	173.2	-68.5	166.1	0	0	0	110.1	F127 M128 A133 S134 F135	F127-I131 WeakPolarHBondContact O-CG1 3.16Å; F127-I131 PolarHBondContact O-N 2.7Å; M128-I131 WeakPolarHBondContact O-CA 3.41Å; M128-I131 WeakPolarHBondContact O-CB 3.28Å; M128-I131 PolarHBondContact O-N 2.97Å; I131-A133 VanDerWaalsContact C-N 3.31Å; I131-A133 PolarHBondContact O-N 2.85Å; I131-S134 WeakPolarHBondContact O-CB 3.14Å; I131-S134 PolarHBondContact O-N 3.45Å; I131-S134 VanDerWaalsContact O-N 3.08Å; I131-F135 HydrophobicContact CG2-CD2 4.06Å; I131-F135 HydrophobicContact CG2-CE2 3.62Å; I131-F135 HydrophobicContact CG2-CZ 3.99Å; I131-F135 PolarHBondContact O-N 3.44Å
132	E	96	Very high	93.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57	-46.1	174.6	-66.6	-164.9	142.8	0	0	111.3	L56 M128 L129 S134 F135 F136 Q236 L239	L56-E132 HydrophobicContact CD1-CB 3.87Å; L56-E132 HydrophobicContact CD2-CB 4.33Å; L56-E132 WeakPolarHBondContact CD2-OE2 3.49Å; M128-E132 HydrophobicContact CE-CG 4.06Å; M128-E132 WeakPolarHBondContact CE-OE1 3.47Å; M128-E132 WeakPolarHBondContact O-CG 3.36Å; M128-E132 PolarHBondContact O-N 3.23Å; M128-E132 VanDerWaalsContact SD-CD 3.53Å; M128-E132 HydrophobicContact SD-CG 3.89Å; L129-E132 PolarHBondContact O-N 3.07Å; E132-S134 PolarHBondContact O-N 3.48Å; E132-F135 PolarHBondContact O-N 3.19Å; E132-F135 VanDerWaalsContact O-N 3.14Å; E132-F136 WeakPolarHBondContact O-CD2 3.36Å; E132-F136 PolarHBondContact O-N 2.92Å; E132-Q236 VanDerWaalsContact CG-OE1 3.23Å; E132-Q236 PolarHBondContact OE1-OE1 2.9Å; E132-L239 HydrophobicContact CG-CD2 3.73Å
133	A	94.8	Very high	93.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.5	-39.9	176.3	0	0	0	0	0	111.8	C53 L56 L57 L129 I131 F136 Y137	C53-A133 PolarHBondContact SG-O 2.87Å; L56-A133 HydrophobicContact CB-CB 3.82Å; L56-A133 HydrophobicContact CD1-CB 4.37Å; L57-A133 HydrophobicContact CD2-CB 3.96Å; L57-A133 HydrophobicContact CG-CB 3.95Å; L129-A133 WeakPolarHBondContact O-CB 3.23Å; L129-A133 PolarHBondContact O-N 3.15Å; I131-A133 VanDerWaalsContact C-N 3.31Å; I131-A133 PolarHBondContact O-N 2.85Å; A133-F136 PolarHBondContact O-N 3.28Å; A133-Y137 PolarHBondContact O-N 2.96Å
134	S	93	Very high	93.3	Very high	66 Å²	66	39.8 Å²	39.8	46%	0.462	20%	0.195	S	C	.	.	H	α-helix	trans	-65.5	-41.5	177.4	-58.4	0	0	0	0	112	A130 I131 E132 Y137 L138	A130-S134 PolarHBondContact O-N 3.43Å; A130-S134 VanDerWaalsContact O-N 3.09Å; A130-S134 PolarHBondContact O-OG 3.45Å; I131-S134 WeakPolarHBondContact O-CB 3.14Å; I131-S134 PolarHBondContact O-N 3.45Å; I131-S134 VanDerWaalsContact O-N 3.08Å; E132-S134 PolarHBondContact O-N 3.48Å; S134-Y137 PolarHBondContact O-N 3.04Å; S134-Y137 VanDerWaalsContact O-N 3.15Å; S134-L138 PolarHBondContact O-N 2.84Å
135	F	95.7	Very high	93.1	Very high	90 Å²	90	38 Å²	38	40%	0.395	20%	0.197	S	C	.	.	H	α-helix	trans	-66.9	-36	176.4	-71.7	-31.1	0	0	0	113.1	I131 E132 Y137 L138 P139 N232 Q236 L239	I131-F135 HydrophobicContact CG2-CD2 4.06Å; I131-F135 HydrophobicContact CG2-CE2 3.62Å; I131-F135 HydrophobicContact CG2-CZ 3.99Å; I131-F135 PolarHBondContact O-N 3.44Å; E132-F135 PolarHBondContact O-N 3.19Å; E132-F135 VanDerWaalsContact O-N 3.14Å; F135-Y137 PolarHBondContact O-N 2.92Å; F135-L138 HydrophobicContact CD1-CD1 4.44Å; F135-L138 PolarHBondContact O-N 3.42Å; F135-P139 VanDerWaalsContact O-CD 3.28Å; F135-P139 WeakPolarHBondContact O-CD 3.37Å; F135-N232 WeakPolarHBondContact CB-OD1 3.43Å; F135-Q236 VanDerWaalsContact CB-NE2 3.28Å; F135-L239 HydrophobicContact CD2-CD2 4.28Å; F135-L239 HydrophobicContact CE2-CD2 4.26Å
136	F	95.8	Very high	93	Very high	1 Å²	1	40.6 Å²	40.6	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-64.5	-28.6	170.7	-85.8	-75.2	0	0	0	113.5	Y49 T52 L56 E132 A133 N232 Q236 F313 V316	Y49-F136 WeakPolarHBondContact CA-O 3.45Å; Y49-F136 WeakPolarHBondContact CB-O 3.06Å; T52-F136 HydrophobicContact CG2-CD1 4.01Å; T52-F136 HydrophobicContact CG2-CD2 3.8Å; T52-F136 HydrophobicContact CG2-CE1 3.82Å; T52-F136 HydrophobicContact CG2-CE2 3.58Å; T52-F136 HydrophobicContact CG2-CG 4Å; T52-F136 HydrophobicContact CG2-CZ 3.6Å; L56-F136 HydrophobicContact CD1-CD2 3.5Å; L56-F136 VanDerWaalsContact CD1-CD2 3.5Å; L56-F136 HydrophobicContact CD1-CE2 3.8Å; E132-F136 WeakPolarHBondContact O-CD2 3.36Å; E132-F136 PolarHBondContact O-N 2.92Å; A133-F136 PolarHBondContact O-N 3.28Å; F136-N232 WeakPolarHBondContact CA-ND2 3.28Å; F136-N232 WeakPolarHBondContact CD1-ND2 3.29Å; F136-N232 WeakPolarHBondContact CE1-ND2 3.31Å; F136-N232 WeakPolarHBondContact CG-ND2 3.21Å; F136-Q236 HydrophobicContact CD2-CG 4.32Å; F136-Q236 HydrophobicContact CE2-CB 4.43Å; F136-Q236 HydrophobicContact CE2-CG 3.5Å; F136-Q236 VanDerWaalsContact CE2-CG 3.5Å; F136-Q236 HydrophobicContact CZ-CB 4.46Å; F136-Q236 HydrophobicContact CZ-CG 3.67Å; F136-F313 HydrophobicContact CE2-CD1 4.11Å; F136-F313 AromaticContact CE2-CE1 3.44Å; F136-F313 HydrophobicContact CE2-CE1 3.44Å; F136-F313 VanDerWaalsContact CE2-CE1 3.44Å; F136-F313 AromaticContact CE2-CZ 3.78Å; F136-F313 HydrophobicContact CE2-CZ 3.78Å; F136-F313 AromaticContact CZ-CD1 3.82Å; F136-F313 HydrophobicContact CZ-CD1 3.82Å; F136-F313 AromaticContact CZ-CE1 3.64Å; F136-F313 HydrophobicContact CZ-CE1 3.64Å; F136-F313 HydrophobicContact CZ-CZ 4.3Å; F136-V316 HydrophobicContact CE1-CG1 4.12Å
137	Y	93.4	Very high	92.7	Very high	14 Å²	14	41.2 Å²	41.2	6%	0.055	21%	0.213	C	C	.	.	H	α-helix	trans	-83.2	-26.1	178.3	-166.5	-110.1	0	0	0	113.6	F31 T34 L35 Y49 A133 S134 F135 P139 C140 I141 R144	F31-Y137 HydrophobicContact CZ-CD1 4.41Å; F31-Y137 HydrophobicContact CZ-CG 4.36Å; T34-Y137 WeakPolarHBondContact CG2-OH 3.41Å; T34-Y137 PolarHBondContact O-OH 3.08Å; T34-Y137 VanDerWaalsContact O-OH 3.11Å; L35-Y137 HydrophobicContact CD2-CD2 3.51Å; L35-Y137 HydrophobicContact CD2-CE2 3.56Å; L35-Y137 HydrophobicContact CD2-CG 4.46Å; Y49-Y137 HydrophobicContact CD2-CD2 4.19Å; Y49-Y137 HydrophobicContact CD2-CE2 4.15Å; A133-Y137 PolarHBondContact O-N 2.96Å; S134-Y137 PolarHBondContact O-N 3.04Å; S134-Y137 VanDerWaalsContact O-N 3.15Å; F135-Y137 PolarHBondContact O-N 2.92Å; Y137-P139 VanDerWaalsContact C-CD 3.49Å; Y137-C140 VanDerWaalsContact O-CB 3.27Å; Y137-C140 WeakPolarHBondContact O-CB 3.48Å; Y137-C140 PolarHBondContact O-N 2.86Å; Y137-C140 VanDerWaalsContact O-N 3.08Å; Y137-I141 HydrophobicContact CD1-CD1 3.56Å; Y137-I141 HydrophobicContact CD1-CG1 3.69Å; Y137-I141 HydrophobicContact CE1-CD1 3.77Å; Y137-I141 HydrophobicContact CE1-CG1 3.59Å; Y137-I141 PolarHBondContact O-N 3.24Å; Y137-R144 VanDerWaalsContact OH-CZ 3.26Å; Y137-R144 PolarHBondContact OH-NH1 3.01Å; Y137-R144 PolarHBondContact OH-NH2 2.82Å
138	L	93.9	Very high	92.2	Very high	73 Å²	73	45.7 Å²	45.7	38%	0.382	23%	0.228	S	C	.	.	H	α-helix	trans	-53.1	-45.5	-175.6	-170.8	159.7	0	0	0	114.3	S134 F135 C140 I141 V142 L228	S134-L138 PolarHBondContact O-N 2.84Å; F135-L138 HydrophobicContact CD1-CD1 4.44Å; F135-L138 PolarHBondContact O-N 3.42Å; L138-C140 PolarHBondContact O-N 2.89Å; L138-I141 WeakPolarHBondContact O-CA 3.33Å; L138-I141 WeakPolarHBondContact O-CB 3.37Å; L138-I141 PolarHBondContact O-N 3.08Å; L138-V142 HydrophobicContact CD2-CG2 3.76Å; L138-V142 PolarHBondContact O-N 3.33Å; L138-L228 HydrophobicContact CD2-CD2 3.92Å
139	P	94.2	Very high	91.5	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-31.2	-179.7	-16.4	27.3	0	0	0	112.8	F135 Y137 V142 W143 V225 L228 Y229	F135-P139 VanDerWaalsContact O-CD 3.28Å; F135-P139 WeakPolarHBondContact O-CD 3.37Å; Y137-P139 VanDerWaalsContact C-CD 3.49Å; P139-V142 PolarHBondContact O-N 3.48Å; P139-W143 PolarHBondContact O-N 3.31Å; P139-V225 HydrophobicContact CB-CG1 4.28Å; P139-L228 HydrophobicContact CB-CB 4.3Å; P139-L228 HydrophobicContact CB-CD2 3.88Å; P139-L228 HydrophobicContact CB-CG 4Å; P139-L228 HydrophobicContact CG-CD2 4.19Å; P139-L228 HydrophobicContact CG-CG 3.95Å; P139-Y229 HydrophobicContact CB-CD1 3.75Å; P139-Y229 HydrophobicContact CB-CD2 4.05Å; P139-Y229 HydrophobicContact CB-CE1 3.6Å; P139-Y229 HydrophobicContact CB-CE2 3.93Å; P139-Y229 HydrophobicContact CB-CG 3.96Å; P139-Y229 HydrophobicContact CG-CD1 3.61Å; P139-Y229 HydrophobicContact CG-CE1 3.7Å; P139-Y229 HydrophobicContact CG-CG 4.14Å
140	C	92.2	Very high	90.6	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-40.1	173.3	-169.9	0	0	0	0	111.4	Y49 Y137 L138 W143 R144 Y229	Y49-C140 HydrophobicContact CD1-CB 4.42Å; Y49-C140 HydrophobicContact CD2-CB 4.31Å; Y49-C140 HydrophobicContact CG-CB 4.01Å; Y137-C140 VanDerWaalsContact O-CB 3.27Å; Y137-C140 WeakPolarHBondContact O-CB 3.48Å; Y137-C140 PolarHBondContact O-N 2.86Å; Y137-C140 VanDerWaalsContact O-N 3.08Å; L138-C140 PolarHBondContact O-N 2.89Å; C140-W143 PolarHBondContact O-N 3.17Å; C140-R144 VanDerWaalsContact O-CG 3.22Å; C140-R144 WeakPolarHBondContact O-CG 3.07Å; C140-R144 PolarHBondContact O-N 3.44Å; C140-R144 PolarHBondContact SG-NE 3.25Å; C140-R144 PolarHBondContact SG-NH2 3.29Å; C140-Y229 PolarHBondContact N-OH 3.03Å
141	I	92	Very high	89.9	Confident	72 Å²	72	50.8 Å²	50.8	37%	0.369	26%	0.262	S	S	.	.	H	α-helix	trans	-62	-46.3	174.3	-63.8	174.1	0	0	0	110.1	Y137 L138 W143 R144 L145	Y137-I141 HydrophobicContact CD1-CD1 3.56Å; Y137-I141 HydrophobicContact CD1-CG1 3.69Å; Y137-I141 HydrophobicContact CE1-CD1 3.77Å; Y137-I141 HydrophobicContact CE1-CG1 3.59Å; Y137-I141 PolarHBondContact O-N 3.24Å; L138-I141 WeakPolarHBondContact O-CA 3.33Å; L138-I141 WeakPolarHBondContact O-CB 3.37Å; L138-I141 PolarHBondContact O-N 3.08Å; I141-W143 VanDerWaalsContact C-N 3.33Å; I141-W143 PolarHBondContact O-N 2.95Å; I141-R144 PolarHBondContact O-N 3.15Å; I141-R144 VanDerWaalsContact O-N 3.12Å; I141-L145 HydrophobicContact CG2-CD1 3.65Å; I141-L145 HydrophobicContact CG2-CG 4.07Å; I141-L145 WeakPolarHBondContact O-CG 3.18Å; I141-L145 PolarHBondContact O-N 3.32Å
142	V	93.1	Very high	89.3	Confident	43 Å²	43	46.7 Å²	46.7	26%	0.261	24%	0.241	S	C	.	.	H	α-helix	trans	-57.7	-45.8	178.5	173.8	0	0	0	0	111.1	L138 P139 R144 L145 L146 V225 L228	L138-V142 HydrophobicContact CD2-CG2 3.76Å; L138-V142 PolarHBondContact O-N 3.33Å; P139-V142 PolarHBondContact O-N 3.48Å; V142-R144 PolarHBondContact O-N 3.48Å; V142-L145 PolarHBondContact O-N 3.4Å; V142-L146 HydrophobicContact CG1-CD1 3.82Å; V142-L146 WeakPolarHBondContact O-CB 3.39Å; V142-L146 WeakPolarHBondContact O-CG 3.27Å; V142-L146 PolarHBondContact O-N 3.45Å; V142-L146 VanDerWaalsContact O-N 3.17Å; V142-V225 HydrophobicContact CG1-CG2 4.25Å; V142-L228 HydrophobicContact CB-CD2 4.23Å; V142-L228 HydrophobicContact CG1-CD2 4.44Å; V142-L228 HydrophobicContact CG2-CD2 3.9Å
143	W	92.3	Very high	88.7	Confident	15 Å²	15	54.5 Å²	54.5	6%	0.057	27%	0.271	C	S	.	.	H	α-helix	trans	-58	-47.9	174.2	174.7	-109.8	0	0	0	112.1	D40 P139 C140 I141 L145 L146 N147 L154 L218 L221 Y222 V225 F371	D40-W143 PolarHBondContact OD2-NE1 3.17Å; P139-W143 PolarHBondContact O-N 3.31Å; C140-W143 PolarHBondContact O-N 3.17Å; I141-W143 VanDerWaalsContact C-N 3.33Å; I141-W143 PolarHBondContact O-N 2.95Å; W143-L145 PolarHBondContact O-N 3.45Å; W143-L146 PolarHBondContact O-N 3.38Å; W143-N147 HydrophobicContact CD2-CB 4.17Å; W143-N147 HydrophobicContact CE3-CB 4.44Å; W143-N147 HydrophobicContact CZ2-CB 4.28Å; W143-N147 VanDerWaalsContact CZ2-ND2 3.35Å; W143-N147 WeakPolarHBondContact CZ2-ND2 3.46Å; W143-N147 WeakPolarHBondContact O-CB 3.22Å; W143-N147 PolarHBondContact O-N 2.89Å; W143-L154 HydrophobicContact CZ2-CD2 4.12Å; W143-L218 HydrophobicContact CH2-CD1 3.55Å; W143-L218 HydrophobicContact CH2-CG 4.34Å; W143-L218 HydrophobicContact CZ2-CD1 4.38Å; W143-L218 HydrophobicContact CZ3-CD1 4.06Å; W143-L221 HydrophobicContact CE3-CD2 4.04Å; W143-L221 HydrophobicContact CE3-CG 3.97Å; W143-L221 HydrophobicContact CZ3-CB 4.47Å; W143-L221 HydrophobicContact CZ3-CD2 4.01Å; W143-L221 HydrophobicContact CZ3-CG 3.98Å; W143-Y222 HydrophobicContact CE3-CD2 4.17Å; W143-Y222 AromaticContact CH2-CD2 3.82Å; W143-Y222 HydrophobicContact CH2-CD2 3.82Å; W143-Y222 HydrophobicContact CH2-CG 4.37Å; W143-Y222 HydrophobicContact CZ2-CD2 4.29Å; W143-Y222 AromaticContact CZ3-CD2 3.77Å; W143-Y222 HydrophobicContact CZ3-CD2 3.77Å; W143-Y222 HydrophobicContact CZ3-CG 4.21Å; W143-V225 HydrophobicContact CB-CG1 4.21Å; W143-V225 HydrophobicContact CB-CG2 3.97Å; W143-V225 HydrophobicContact CE3-CG2 4.22Å; W143-F371 HydrophobicContact CH2-CE1 4.25Å; W143-F371 HydrophobicContact CH2-CZ 4.31Å
144	R	88.1	Confident	88.4	Confident	58 Å²	58	54.6 Å²	54.6	22%	0.219	27%	0.271	C	S	.	.	H	α-helix	trans	-62.5	-42.8	-178	-70.4	168.2	-172.1	-160.6	3.1	112.8	R38 Y137 C140 I141 V142	R38-R144 VanDerWaalsContact CZ-NE 3.32Å; R38-R144 VanDerWaalsContact NE-NE 3.15Å; R38-R144 VanDerWaalsContact NE-NH2 3.17Å; R38-R144 VanDerWaalsContact NH2-CZ 3.28Å; Y137-R144 VanDerWaalsContact OH-CZ 3.26Å; Y137-R144 PolarHBondContact OH-NH1 3.01Å; Y137-R144 PolarHBondContact OH-NH2 2.82Å; C140-R144 VanDerWaalsContact O-CG 3.22Å; C140-R144 WeakPolarHBondContact O-CG 3.07Å; C140-R144 PolarHBondContact O-N 3.44Å; C140-R144 PolarHBondContact SG-NE 3.25Å; C140-R144 PolarHBondContact SG-NH2 3.29Å; I141-R144 PolarHBondContact O-N 3.15Å; I141-R144 VanDerWaalsContact O-N 3.12Å; V142-R144 PolarHBondContact O-N 3.48Å
145	L	89.1	Confident	88.2	Confident	117 Å²	117	52.7 Å²	52.7	61%	0.613	26%	0.259	S	S	*	.	H	α-helix	trans	-70.8	-33.1	-177.2	-67.7	177	0	0	0	112.2	I141 V142 W143	I141-L145 HydrophobicContact CG2-CD1 3.65Å; I141-L145 HydrophobicContact CG2-CG 4.07Å; I141-L145 WeakPolarHBondContact O-CG 3.18Å; I141-L145 PolarHBondContact O-N 3.32Å; V142-L145 PolarHBondContact O-N 3.4Å; W143-L145 PolarHBondContact O-N 3.45Å
146	L	89.2	Confident	87.9	Confident	54 Å²	54	53.3 Å²	53.3	28%	0.283	26%	0.263	S	S	.	.	H	α-helix	trans	-98.6	-29.5	-173.3	-61.6	179.7	0	0	0	113.7	V142 W143 W148 Q149 Y217 L221	V142-L146 HydrophobicContact CG1-CD1 3.82Å; V142-L146 WeakPolarHBondContact O-CB 3.39Å; V142-L146 WeakPolarHBondContact O-CG 3.27Å; V142-L146 PolarHBondContact O-N 3.45Å; V142-L146 VanDerWaalsContact O-N 3.17Å; W143-L146 PolarHBondContact O-N 3.38Å; L146-W148 VanDerWaalsContact C-N 3.26Å; L146-W148 PolarHBondContact O-N 3.44Å; L146-Q149 WeakPolarHBondContact O-CB 3.48Å; L146-Q149 PolarHBondContact O-N 3.44Å; L146-Y217 PolarHBondContact O-OH 3Å; L146-Y217 VanDerWaalsContact O-OH 3.12Å; L146-L221 HydrophobicContact CB-CD1 3.61Å; L146-L221 HydrophobicContact CB-CD2 3.65Å; L146-L221 HydrophobicContact CB-CG 4.28Å; L146-L221 HydrophobicContact CD1-CD1 3.62Å; L146-L221 HydrophobicContact CG-CD1 4.27Å
147	N	86.6	Confident	87.6	Confident	14 Å²	14	53.7 Å²	53.7	8%	0.075	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-38.5	-176.6	-179.9	10.4	0	0	0	112.1	W143 Q149 S150 L218 L221	W143-N147 HydrophobicContact CD2-CB 4.17Å; W143-N147 HydrophobicContact CE3-CB 4.44Å; W143-N147 HydrophobicContact CZ2-CB 4.28Å; W143-N147 VanDerWaalsContact CZ2-ND2 3.35Å; W143-N147 WeakPolarHBondContact CZ2-ND2 3.46Å; W143-N147 WeakPolarHBondContact O-CB 3.22Å; W143-N147 PolarHBondContact O-N 2.89Å; N147-Q149 PolarHBondContact O-N 2.99Å; N147-Q149 VanDerWaalsContact O-N 3.14Å; N147-S150 VanDerWaalsContact O-CB 3.29Å; N147-S150 WeakPolarHBondContact O-CB 3.35Å; N147-S150 PolarHBondContact O-N 3.49Å; N147-S150 PolarHBondContact O-OG 3.28Å; N147-L218 WeakPolarHBondContact OD1-CD1 3.4Å; N147-L221 HydrophobicContact CB-CD2 4.38Å
148	W	81.2	Confident	87.5	Confident	200 Å²	200	53.2 Å²	53.2	76%	0.758	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-58.1	-31.1	179.5	117.8	-91	0	0	0	113.2	L146 S150 G151	L146-W148 VanDerWaalsContact C-N 3.26Å; L146-W148 PolarHBondContact O-N 3.44Å; W148-S150 PolarHBondContact O-N 3.03Å; W148-S150 VanDerWaalsContact O-N 3.15Å; W148-G151 PolarHBondContact O-N 2.85Å
149	Q	79	Confident	87.4	Confident	85 Å²	85	52 Å²	52	40%	0.397	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-66.5	-17.2	-179.1	-60.4	-178.1	-9.7	0	0	112.9	L146 N147 G151 Y217	L146-Q149 WeakPolarHBondContact O-CB 3.48Å; L146-Q149 PolarHBondContact O-N 3.44Å; N147-Q149 PolarHBondContact O-N 2.99Å; N147-Q149 VanDerWaalsContact O-N 3.14Å; Q149-G151 PolarHBondContact O-N 2.62Å; Q149-Y217 HydrophobicContact CB-CE1 4.35Å; Q149-Y217 WeakPolarHBondContact CB-OH 3.47Å; Q149-Y217 PolarHBondContact OE1-OH 3.26Å
150	S	77.2	Confident	87.2	Confident	13 Å²	13	54.8 Å²	54.8	9%	0.091	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-67.9	-18.5	173.6	73	0	0	0	0	112.9	N147 W148 I152 Q190	N147-S150 VanDerWaalsContact O-CB 3.29Å; N147-S150 WeakPolarHBondContact O-CB 3.35Å; N147-S150 PolarHBondContact O-N 3.49Å; N147-S150 PolarHBondContact O-OG 3.28Å; W148-S150 PolarHBondContact O-N 3.03Å; W148-S150 VanDerWaalsContact O-N 3.15Å; S150-I152 PolarHBondContact O-N 2.97Å; S150-I152 PolarHBondContact OG-N 3.3Å; S150-I152 VanDerWaalsContact OG-N 3.08Å; S150-I152 PolarHBondContact OG-O 2.97Å; S150-Q190 PolarHBondContact O-NE2 3.22Å
151	G	76.7	Confident	87.1	Confident	58 Å²	58	54.6 Å²	54.6	60%	0.598	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-1.2	-170.1	0	0	0	0	0	113.8	W148 Q149	W148-G151 PolarHBondContact O-N 2.85Å; Q149-G151 PolarHBondContact O-N 2.62Å
152	I	81.4	Confident	86.9	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	28%	0.275	C	S	.	.			trans	-108.3	116.8	-175.8	-53.6	-174.8	0	0	0	109.1	S150 L154 S186 I372	S150-I152 PolarHBondContact O-N 2.97Å; S150-I152 PolarHBondContact OG-N 3.3Å; S150-I152 VanDerWaalsContact OG-N 3.08Å; S150-I152 PolarHBondContact OG-O 2.97Å; I152-L154 VanDerWaalsContact C-N 3.3Å; I152-L154 PolarHBondContact O-N 2.99Å; I152-S186 WeakPolarHBondContact CD1-OG 3.13Å; I152-I372 HydrophobicContact CD1-CD1 3.55Å; I152-I372 HydrophobicContact CG2-CD1 3.97Å
153	R	84.3	Confident	86.6	Confident	165 Å²	165	55.2 Å²	55.2	62%	0.623	28%	0.284	S	S	*	.			trans	-86	73.7	175.1	-67.7	-168.3	-112.2	157.5	-13.6	110	A155 E156 L157	R153-A155 VanDerWaalsContact C-N 3.32Å; R153-A155 PolarHBondContact O-N 3.41Å; R153-E156 HydrophobicContact CB-CB 3.99Å; R153-E156 WeakPolarHBondContact CD-OE2 3.29Å; R153-E156 IonicContact CZ-OE2 3.76Å; R153-E156 IonicContact NE-OE2 3.29Å; R153-E156 IonicContact NH1-OE1 3.23Å; R153-E156 IonicContact NH1-OE2 3.19Å; R153-E156 PolarHBondContact NH1-OE2 3.17Å; R153-E156 WeakPolarHBondContact O-CB 3.32Å; R153-E156 PolarHBondContact O-N 3.27Å; R153-E156 VanDerWaalsContact O-N 3.1Å; R153-L157 PolarHBondContact O-N 2.65Å
154	L	88.7	Confident	86.1	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-54.5	-43.9	-174.3	-177.3	60.8	0	0	0	113.1	D40 W143 I152 E156 L157 I158 F371 I372 M375	D40-L154 HydrophobicContact CB-CD2 4.13Å; D40-L154 HydrophobicContact CB-CG 4.06Å; W143-L154 HydrophobicContact CZ2-CD2 4.12Å; I152-L154 VanDerWaalsContact C-N 3.3Å; I152-L154 PolarHBondContact O-N 2.99Å; L154-E156 VanDerWaalsContact C-N 3.33Å; L154-E156 PolarHBondContact O-N 3.28Å; L154-L157 WeakPolarHBondContact O-CB 3.41Å; L154-L157 PolarHBondContact O-N 3.4Å; L154-I158 HydrophobicContact CD1-CD1 3.79Å; L154-I158 HydrophobicContact CD1-CG1 4.1Å; L154-I158 HydrophobicContact CD2-CD1 4.42Å; L154-I158 HydrophobicContact CG-CD1 3.75Å; L154-I158 HydrophobicContact CG-CG1 4.43Å; L154-I158 WeakPolarHBondContact O-CG1 3.19Å; L154-I158 PolarHBondContact O-N 3.45Å; L154-F371 HydrophobicContact CD2-CE1 3.99Å; L154-I372 HydrophobicContact CD1-CB 4.46Å; L154-I372 HydrophobicContact CD1-CG1 4.23Å; L154-I372 HydrophobicContact CD1-CG2 4.02Å; L154-M375 HydrophobicContact CD1-CB 4.47Å; L154-M375 HydrophobicContact CD2-CG 4.27Å
155	A	88.7	Confident	85.6	Confident	26 Å²	26	59.8 Å²	59.8	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-41	178.9	0	0	0	0	0	112.7	P39 D40 R153 S159	P39-A155 HydrophobicContact CG-CB 4.12Å; D40-A155 HydrophobicContact CB-CB 4.09Å; R153-A155 VanDerWaalsContact C-N 3.32Å; R153-A155 PolarHBondContact O-N 3.41Å; A155-S159 WeakPolarHBondContact O-CB 3.13Å; A155-S159 PolarHBondContact O-N 3.34Å; A155-S159 PolarHBondContact O-OG 3.25Å
156	E	88.3	Confident	85.1	Confident	103 Å²	103	59.2 Å²	59.2	48%	0.481	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-44.8	177.7	-170.5	173.6	179.5	0	0	110.3	R153 L154 I158 S159 L160	R153-E156 HydrophobicContact CB-CB 3.99Å; R153-E156 WeakPolarHBondContact CD-OE2 3.29Å; R153-E156 IonicContact CZ-OE2 3.76Å; R153-E156 IonicContact NE-OE2 3.29Å; R153-E156 IonicContact NH1-OE1 3.23Å; R153-E156 IonicContact NH1-OE2 3.19Å; R153-E156 PolarHBondContact NH1-OE2 3.17Å; R153-E156 WeakPolarHBondContact O-CB 3.32Å; R153-E156 PolarHBondContact O-N 3.27Å; R153-E156 VanDerWaalsContact O-N 3.1Å; L154-E156 VanDerWaalsContact C-N 3.33Å; L154-E156 PolarHBondContact O-N 3.28Å; E156-I158 PolarHBondContact O-N 3.12Å; E156-S159 WeakPolarHBondContact CA-OG 3.39Å; E156-S159 PolarHBondContact O-N 3.22Å; E156-S159 PolarHBondContact O-OG 3.18Å; E156-L160 WeakPolarHBondContact O-CB 3.29Å; E156-L160 PolarHBondContact O-N 3.4Å
157	L	90.6	Very high	84.8	Confident	10 Å²	10	59.9 Å²	59.9	5%	0.052	31%	0.311	C	S	.	.	H	α-helix	trans	-57.5	-46.7	176.4	-169.1	74.1	0	0	0	112.1	R153 L154 L160 A161 I179 H182 I183 I372	R153-L157 PolarHBondContact O-N 2.65Å; L154-L157 WeakPolarHBondContact O-CB 3.41Å; L154-L157 PolarHBondContact O-N 3.4Å; L157-L160 PolarHBondContact O-N 3.48Å; L157-A161 WeakPolarHBondContact O-CB 3.23Å; L157-A161 PolarHBondContact O-N 2.95Å; L157-I179 HydrophobicContact CD1-CB 4.2Å; L157-I179 HydrophobicContact CD1-CG1 4Å; L157-I179 HydrophobicContact CD1-CG2 3.96Å; L157-I179 HydrophobicContact CG-CG2 4.36Å; L157-H182 HydrophobicContact CD1-CB 4.32Å; L157-I183 HydrophobicContact CD2-CD1 4.2Å; L157-I183 HydrophobicContact CD2-CG1 3.98Å; L157-I372 HydrophobicContact CD2-CG2 3.56Å
158	I	91.4	Very high	84.5	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.015	33%	0.327	C	S	.	.	H	α-helix	trans	-69	-37.7	178.9	-63.1	166.8	0	0	0	110.8	P39 D40 L154 E156 A161 S162 M375 H379 V380	P39-I158 HydrophobicContact CB-CB 4.38Å; P39-I158 HydrophobicContact CB-CG2 3.99Å; P39-I158 WeakPolarHBondContact O-CD1 3.29Å; P39-I158 WeakPolarHBondContact O-CG2 3.46Å; D40-I158 HydrophobicContact CB-CD1 4.1Å; L154-I158 HydrophobicContact CD1-CD1 3.79Å; L154-I158 HydrophobicContact CD1-CG1 4.1Å; L154-I158 HydrophobicContact CD2-CD1 4.42Å; L154-I158 HydrophobicContact CG-CD1 3.75Å; L154-I158 HydrophobicContact CG-CG1 4.43Å; L154-I158 WeakPolarHBondContact O-CG1 3.19Å; L154-I158 PolarHBondContact O-N 3.45Å; E156-I158 PolarHBondContact O-N 3.12Å; I158-A161 CarbonylContact O-C 3.59Å; I158-A161 PolarHBondContact O-N 3.37Å; I158-S162 PolarHBondContact O-N 3.28Å; I158-M375 HydrophobicContact CD1-CB 4.17Å; I158-H379 HydrophobicContact CG2-CB 3.57Å; I158-V380 HydrophobicContact CG2-CG2 4.15Å
159	S	90.2	Very high	84.5	Confident	48 Å²	48	63.1 Å²	63.1	34%	0.336	33%	0.331	S	S	.	.	H	α-helix	trans	-67.6	-37.2	176.7	72.8	0	0	0	0	113.4	A155 E156 A161 S162 T163	A155-S159 WeakPolarHBondContact O-CB 3.13Å; A155-S159 PolarHBondContact O-N 3.34Å; A155-S159 PolarHBondContact O-OG 3.25Å; E156-S159 WeakPolarHBondContact CA-OG 3.39Å; E156-S159 PolarHBondContact O-N 3.22Å; E156-S159 PolarHBondContact O-OG 3.18Å; S159-A161 VanDerWaalsContact C-N 3.33Å; S159-S162 PolarHBondContact O-N 3.2Å; S159-S162 PolarHBondContact O-OG 3.23Å; S159-T163 PolarHBondContact O-N 2.85Å; S159-T163 PolarHBondContact O-OG1 3Å
160	L	90.6	Very high	84.5	Confident	60 Å²	60	62.9 Å²	62.9	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-43.7	172.6	179.6	62.7	0	0	0	109.9	E156 L157 S162 T163 I175 I178 I179	E156-L160 WeakPolarHBondContact O-CB 3.29Å; E156-L160 PolarHBondContact O-N 3.4Å; L157-L160 PolarHBondContact O-N 3.48Å; L160-S162 VanDerWaalsContact C-N 3.35Å; L160-S162 PolarHBondContact O-N 2.92Å; L160-T163 PolarHBondContact O-N 3.35Å; L160-I175 HydrophobicContact CG-CG2 4.18Å; L160-I178 HydrophobicContact CD2-CG2 3.95Å; L160-I179 HydrophobicContact CD2-CG1 4.32Å
161	A	89.4	Confident	84.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-66.6	-31.8	177.4	0	0	0	0	0	113.3	L157 I158 S159 Q164 I179 L376 V380	L157-A161 WeakPolarHBondContact O-CB 3.23Å; L157-A161 PolarHBondContact O-N 2.95Å; I158-A161 CarbonylContact O-C 3.59Å; I158-A161 PolarHBondContact O-N 3.37Å; S159-A161 VanDerWaalsContact C-N 3.33Å; A161-Q164 WeakPolarHBondContact O-CG 3.37Å; A161-Q164 PolarHBondContact O-NE2 2.9Å; A161-I179 HydrophobicContact CB-CD1 3.6Å; A161-L376 HydrophobicContact CB-CD1 3.46Å; A161-L376 VanDerWaalsContact CB-CD1 3.46Å; A161-V380 HydrophobicContact CB-CG1 4.25Å; A161-V380 HydrophobicContact CB-CG2 3.75Å; A161-V380 WeakPolarHBondContact O-CG1 3.15Å
162	S	87.9	Confident	85.3	Confident	54 Å²	54	65.7 Å²	65.7	38%	0.378	33%	0.333	S	S	.	.	H	α-helix	trans	-73	-31.6	176.6	66.1	0	0	0	0	112.7	I158 S159 L160 Q164 R165	I158-S162 PolarHBondContact O-N 3.28Å; S159-S162 PolarHBondContact O-N 3.2Å; S159-S162 PolarHBondContact O-OG 3.23Å; L160-S162 VanDerWaalsContact C-N 3.35Å; L160-S162 PolarHBondContact O-N 2.92Å; S162-Q164 PolarHBondContact O-N 3.41Å; S162-R165 PolarHBondContact O-N 3.05Å
163	T	87.2	Confident	85.6	Confident	74 Å²	74	68.9 Å²	68.9	45%	0.454	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-25.3	178.7	-55.9	0	0	0	0	112.3	S159 L160 R165 S166 L167	S159-T163 PolarHBondContact O-N 2.85Å; S159-T163 PolarHBondContact O-OG1 3Å; L160-T163 PolarHBondContact O-N 3.35Å; T163-R165 PolarHBondContact O-N 2.83Å; T163-R165 VanDerWaalsContact O-N 3.08Å; T163-S166 PolarHBondContact O-N 3.27Å; T163-S166 PolarHBondContact O-OG 2.93Å; T163-L167 HydrophobicContact CG2-CD1 4.2Å
164	Q	82.8	Confident	85.9	Confident	3 Å²	3	66.4 Å²	66.4	1%	0.014	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-61.6	-21	-179.9	88.5	-175	-96.3	0	0	114.8	A161 S162 S166 L167 R172 I175 I384	A161-Q164 WeakPolarHBondContact O-CG 3.37Å; A161-Q164 PolarHBondContact O-NE2 2.9Å; S162-Q164 PolarHBondContact O-N 3.41Å; Q164-S166 PolarHBondContact O-N 3.46Å; Q164-L167 PolarHBondContact O-N 2.64Å; Q164-R172 HydrophobicContact CB-CG 4.41Å; Q164-R172 HydrophobicContact CG-CG 4.47Å; Q164-I175 HydrophobicContact CB-CD1 4.14Å; Q164-I175 HydrophobicContact CB-CG2 4.3Å; Q164-I384 HydrophobicContact CG-CD1 3.51Å; Q164-I384 HydrophobicContact CG-CG1 4.33Å
165	R	77.3	Confident	85.9	Confident	167 Å²	167	67.2 Å²	67.2	63%	0.63	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-63.9	-24	-177.7	-69.1	-176.3	179.1	171.4	3.1	112.6	S162 T163 H379 V380	S162-R165 PolarHBondContact O-N 3.05Å; T163-R165 PolarHBondContact O-N 2.83Å; T163-R165 VanDerWaalsContact O-N 3.08Å; R165-H379 PolarHBondContact NH2-O 3.06Å; R165-V380 VanDerWaalsContact NH2-C 3.29Å; R165-V380 PolarHBondContact NH2-O 3.33Å
166	S	79	Confident	86.1	Confident	104 Å²	104	66.4 Å²	66.4	73%	0.727	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-98.8	3.2	179.1	57.9	0	0	0	0	113.9	T163 Q164	T163-S166 PolarHBondContact O-N 3.27Å; T163-S166 PolarHBondContact O-OG 2.93Å; Q164-S166 PolarHBondContact O-N 3.46Å
167	L	81.9	Confident	86.3	Confident	69 Å²	69	65 Å²	65	36%	0.361	34%	0.343	S	S	.	.	S	Bend	trans	-103	159.6	-169.2	-81.4	160.8	0	0	0	113	T163 Q164 D171 I175	T163-L167 HydrophobicContact CG2-CD1 4.2Å; Q164-L167 PolarHBondContact O-N 2.64Å; L167-D171 HydrophobicContact CB-CB 4.1Å; L167-D171 HydrophobicContact CD2-CB 3.89Å; L167-D171 HydrophobicContact CG-CB 4.45Å; L167-I175 HydrophobicContact CD1-CD1 3.27Å
168	S	80.4	Confident	86.3	Confident	60 Å²	60	69 Å²	69	42%	0.42	36%	0.364	S	S	.	.			trans	-67.7	163.5	176.6	83.1	0	0	0	0	111.5	C170 D171 R172	S168-C170 VanDerWaalsContact C-N 3.27Å; S168-C170 PolarHBondContact O-N 2.86Å; S168-D171 WeakPolarHBondContact CB-OD2 3.07Å; S168-D171 PolarHBondContact O-N 2.89Å; S168-D171 VanDerWaalsContact OG-CG 3.22Å; S168-D171 PolarHBondContact OG-OD2 3.45Å; S168-R172 WeakPolarHBondContact O-CB 3.2Å; S168-R172 PolarHBondContact O-N 3.22Å
169	R	81.2	Confident	86.4	Confident	222 Å²	222	68.9 Å²	68.9	84%	0.838	36%	0.363	S	S	*	.	H	α-helix	trans	-59.1	-35.8	-179.8	-75.3	-173.8	178.6	175.5	0.8	113.2	S173	R169-S173 PolarHBondContact O-N 2.78Å
170	C	80.5	Confident	86.5	Confident	79 Å²	79	66.6 Å²	66.6	53%	0.534	35%	0.347	S	S	.	.	H	α-helix	trans	-69.1	-49.1	-179.7	-168.8	0	0	0	0	110.4	S168 R172 S173 Q174	S168-C170 VanDerWaalsContact C-N 3.27Å; S168-C170 PolarHBondContact O-N 2.86Å; C170-R172 VanDerWaalsContact C-N 3.28Å; C170-R172 PolarHBondContact O-N 3.2Å; C170-S173 PolarHBondContact O-N 3.11Å; C170-S173 VanDerWaalsContact O-N 3.1Å; C170-S173 PolarHBondContact O-OG 3.45Å; C170-Q174 PolarHBondContact O-N 3.25Å
171	D	84.2	Confident	86.5	Confident	62 Å²	62	69.1 Å²	69.1	33%	0.332	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-36.9	178.7	-53.5	-38.9	0	0	0	111.9	L167 S168 S173 Q174 I175	L167-D171 HydrophobicContact CB-CB 4.1Å; L167-D171 HydrophobicContact CD2-CB 3.89Å; L167-D171 HydrophobicContact CG-CB 4.45Å; S168-D171 WeakPolarHBondContact CB-OD2 3.07Å; S168-D171 PolarHBondContact O-N 2.89Å; S168-D171 VanDerWaalsContact OG-CG 3.22Å; S168-D171 PolarHBondContact OG-OD2 3.45Å; D171-S173 VanDerWaalsContact C-N 3.3Å; D171-S173 PolarHBondContact O-N 3.41Å; D171-Q174 PolarHBondContact O-N 3.47Å; D171-I175 PolarHBondContact O-N 3.11Å
172	R	86.2	Confident	86.6	Confident	68 Å²	68	72.2 Å²	72.2	26%	0.257	37%	0.37	S	S	.	.	H	α-helix	trans	-58	-43.1	175.2	-171.2	177.8	72.3	127.7	11.5	111.8	Q164 S168 C170 Q174 I175 V176 E387	Q164-R172 HydrophobicContact CB-CG 4.41Å; Q164-R172 HydrophobicContact CG-CG 4.47Å; S168-R172 WeakPolarHBondContact O-CB 3.2Å; S168-R172 PolarHBondContact O-N 3.22Å; C170-R172 VanDerWaalsContact C-N 3.28Å; C170-R172 PolarHBondContact O-N 3.2Å; R172-Q174 VanDerWaalsContact C-N 3.34Å; R172-Q174 PolarHBondContact O-N 2.8Å; R172-I175 PolarHBondContact O-N 3.06Å; R172-V176 WeakPolarHBondContact O-CG2 3.36Å; R172-V176 PolarHBondContact O-N 3.24Å; R172-E387 IonicContact CZ-OE1 3.89Å; R172-E387 IonicContact CZ-OE2 3.72Å; R172-E387 IonicContact NE-OE2 3.99Å; R172-E387 VanDerWaalsContact NH1-CD 3.32Å; R172-E387 IonicContact NH1-OE1 2.85Å; R172-E387 PolarHBondContact NH1-OE1 3.32Å; R172-E387 IonicContact NH1-OE2 2.77Å; R172-E387 PolarHBondContact NH1-OE2 2.74Å; R172-E387 IonicContact NH2-OE1 3.89Å; R172-E387 PolarHBondContact NH2-OE1 2.02Å; R172-E387 IonicContact NH2-OE2 3.57Å; R172-E387 PolarHBondContact NH2-OE2 3.12Å
173	S	87.3	Confident	86.7	Confident	69 Å²	69	69.7 Å²	69.7	48%	0.483	35%	0.352	S	S	.	.	H	α-helix	trans	-65.3	-37.4	-180	73.4	0	0	0	0	112.4	R169 C170 D171 V176 D177	R169-S173 PolarHBondContact O-N 2.78Å; C170-S173 PolarHBondContact O-N 3.11Å; C170-S173 VanDerWaalsContact O-N 3.1Å; C170-S173 PolarHBondContact O-OG 3.45Å; D171-S173 VanDerWaalsContact C-N 3.3Å; D171-S173 PolarHBondContact O-N 3.41Å; S173-V176 PolarHBondContact O-N 3.38Å; S173-D177 PolarHBondContact O-N 2.48Å
174	Q	89.9	Confident	86.9	Confident	113 Å²	113	68.5 Å²	68.5	53%	0.528	34%	0.341	S	S	.	.	H	α-helix	trans	-65.8	-43.4	175	-63.8	-178.3	4.5	0	0	111.6	C170 D171 R172 D177 I178	C170-Q174 PolarHBondContact O-N 3.25Å; D171-Q174 PolarHBondContact O-N 3.47Å; R172-Q174 VanDerWaalsContact C-N 3.34Å; R172-Q174 PolarHBondContact O-N 2.8Å; Q174-D177 PolarHBondContact O-N 2.99Å; Q174-I178 VanDerWaalsContact O-CG1 3.28Å; Q174-I178 WeakPolarHBondContact O-CG1 3.43Å; Q174-I178 PolarHBondContact O-N 3.33Å
175	I	90.1	Very high	87.1	Confident	17 Å²	17	72.7 Å²	72.7	9%	0.087	36%	0.361	C	S	.	.	H	α-helix	trans	-62.2	-44.8	176.1	-71.6	177.5	0	0	0	111.2	L160 Q164 L167 D171 R172 D177 I178 I179	L160-I175 HydrophobicContact CG-CG2 4.18Å; Q164-I175 HydrophobicContact CB-CD1 4.14Å; Q164-I175 HydrophobicContact CB-CG2 4.3Å; L167-I175 HydrophobicContact CD1-CD1 3.27Å; D171-I175 PolarHBondContact O-N 3.11Å; R172-I175 PolarHBondContact O-N 3.06Å; I175-D177 VanDerWaalsContact C-N 3.25Å; I175-D177 PolarHBondContact O-N 3.23Å; I175-I178 PolarHBondContact O-N 3.09Å; I175-I179 HydrophobicContact CG2-CD1 3.56Å; I175-I179 HydrophobicContact CG2-CG1 4.3Å; I175-I179 WeakPolarHBondContact O-CB 3.39Å; I175-I179 WeakPolarHBondContact O-CD1 3.21Å; I175-I179 VanDerWaalsContact O-CG1 3.26Å; I175-I179 WeakPolarHBondContact O-CG1 3.36Å; I175-I179 PolarHBondContact O-N 2.91Å
176	V	91.8	Very high	87.5	Confident	9 Å²	9	65.2 Å²	65.2	6%	0.055	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-40.5	175.8	169.1	0	0	0	0	110.7	R172 S173 S180 E387 V388 N391	R172-V176 WeakPolarHBondContact O-CG2 3.36Å; R172-V176 PolarHBondContact O-N 3.24Å; S173-V176 PolarHBondContact O-N 3.38Å; V176-S180 VanDerWaalsContact O-CB 3.28Å; V176-S180 WeakPolarHBondContact O-CB 3.43Å; V176-S180 PolarHBondContact O-N 2.94Å; V176-S180 PolarHBondContact O-OG 2.87Å; V176-E387 HydrophobicContact CG1-CB 4.15Å; V176-E387 HydrophobicContact CG2-CB 4.32Å; V176-V388 HydrophobicContact CG1-CG2 3.99Å; V176-V388 HydrophobicContact CG2-CG2 4.49Å; V176-N391 HydrophobicContact CG1-CB 4.37Å
177	D	92	Very high	87.7	Confident	73 Å²	73	60.5 Å²	60.5	39%	0.39	30%	0.301	S	S	.	.	H	α-helix	trans	-65.3	-46.2	176.6	-163.9	54.2	0	0	0	112.7	S173 Q174 I175 I179 S180 K181 N391	S173-D177 PolarHBondContact O-N 2.48Å; Q174-D177 PolarHBondContact O-N 2.99Å; I175-D177 VanDerWaalsContact C-N 3.25Å; I175-D177 PolarHBondContact O-N 3.23Å; D177-I179 PolarHBondContact O-N 2.77Å; D177-S180 PolarHBondContact O-N 2.77Å; D177-K181 WeakPolarHBondContact O-CB 3.37Å; D177-K181 PolarHBondContact O-N 2.73Å; D177-N391 WeakPolarHBondContact CA-ND2 3.4Å; D177-N391 PolarHBondContact OD1-ND2 2.79Å
178	I	91.6	Very high	87.9	Confident	95 Å²	95	59.7 Å²	59.7	49%	0.487	30%	0.304	S	S	.	.	H	α-helix	trans	-57.5	-48.4	175.6	-67.9	163.9	0	0	0	110.9	L160 Q174 I175 S180 H182	L160-I178 HydrophobicContact CD2-CG2 3.95Å; Q174-I178 VanDerWaalsContact O-CG1 3.28Å; Q174-I178 WeakPolarHBondContact O-CG1 3.43Å; Q174-I178 PolarHBondContact O-N 3.33Å; I175-I178 PolarHBondContact O-N 3.09Å; I178-S180 PolarHBondContact O-N 3.47Å; I178-H182 VanDerWaalsContact O-CB 3.32Å; I178-H182 WeakPolarHBondContact O-CB 3.42Å; I178-H182 PolarHBondContact O-N 3.5Å
179	I	92.6	Very high	87.9	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-46.6	178.1	-69.3	163.5	0	0	0	110.6	L157 L160 A161 I175 D177 H182 I183 V388	L157-I179 HydrophobicContact CD1-CB 4.2Å; L157-I179 HydrophobicContact CD1-CG1 4Å; L157-I179 HydrophobicContact CD1-CG2 3.96Å; L157-I179 HydrophobicContact CG-CG2 4.36Å; L160-I179 HydrophobicContact CD2-CG1 4.32Å; A161-I179 HydrophobicContact CB-CD1 3.6Å; I175-I179 HydrophobicContact CG2-CD1 3.56Å; I175-I179 HydrophobicContact CG2-CG1 4.3Å; I175-I179 WeakPolarHBondContact O-CB 3.39Å; I175-I179 WeakPolarHBondContact O-CD1 3.21Å; I175-I179 VanDerWaalsContact O-CG1 3.26Å; I175-I179 WeakPolarHBondContact O-CG1 3.36Å; I175-I179 PolarHBondContact O-N 2.91Å; D177-I179 PolarHBondContact O-N 2.77Å; I179-H182 PolarHBondContact O-N 3.12Å; I179-I183 HydrophobicContact CG2-CD1 3.83Å; I179-I183 VanDerWaalsContact O-CG1 3.31Å; I179-I183 WeakPolarHBondContact O-CG1 3.49Å; I179-I183 PolarHBondContact O-N 3.27Å; I179-V388 HydrophobicContact CB-CG2 4.42Å; I179-V388 HydrophobicContact CG2-CG1 4.05Å; I179-V388 HydrophobicContact CG2-CG2 3.9Å
180	S	92.7	Very high	87.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-45.3	-177.1	-59.1	0	0	0	0	111.2	V176 D177 I178 I183 Q184	V176-S180 VanDerWaalsContact O-CB 3.28Å; V176-S180 WeakPolarHBondContact O-CB 3.43Å; V176-S180 PolarHBondContact O-N 2.94Å; V176-S180 PolarHBondContact O-OG 2.87Å; D177-S180 PolarHBondContact O-N 2.77Å; I178-S180 PolarHBondContact O-N 3.47Å; S180-I183 PolarHBondContact O-N 3.47Å; S180-Q184 WeakPolarHBondContact O-CB 3.4Å; S180-Q184 VanDerWaalsContact O-CG 3.31Å; S180-Q184 WeakPolarHBondContact O-CG 3.22Å; S180-Q184 PolarHBondContact O-N 3.12Å
181	K	91.7	Very high	87.6	Confident	113 Å²	113	52.1 Å²	52.1	49%	0.491	26%	0.262	S	S	.	.	H	α-helix	trans	-62.8	-45.6	175.8	-176	173.9	175.1	178.6	0	111.4	D177 I183 Q184 E185	D177-K181 WeakPolarHBondContact O-CB 3.37Å; D177-K181 PolarHBondContact O-N 2.73Å; K181-I183 PolarHBondContact O-N 3.47Å; K181-Q184 PolarHBondContact O-N 3.03Å; K181-E185 WeakPolarHBondContact CE-OE1 3.47Å; K181-E185 HydrophobicContact CG-CG 4.28Å; K181-E185 WeakPolarHBondContact CG-OE1 3.33Å; K181-E185 IonicContact NZ-OE1 3.77Å; K181-E185 WeakPolarHBondContact O-CB 3.32Å; K181-E185 WeakPolarHBondContact O-CG 2.93Å; K181-E185 PolarHBondContact O-N 3.37Å
182	H	90.9	Very high	87.3	Confident	66 Å²	66	52 Å²	52	31%	0.306	27%	0.27	S	S	.	.	H	α-helix	trans	-59.6	-45.3	177.8	-173.5	77	0	0	0	112.2	L157 I178 I179 E185 S186	L157-H182 HydrophobicContact CD1-CB 4.32Å; I178-H182 VanDerWaalsContact O-CB 3.32Å; I178-H182 WeakPolarHBondContact O-CB 3.42Å; I178-H182 PolarHBondContact O-N 3.5Å; I179-H182 PolarHBondContact O-N 3.12Å; H182-E185 PolarHBondContact O-N 2.97Å; H182-S186 WeakPolarHBondContact O-CB 3.34Å; H182-S186 PolarHBondContact O-N 3.02Å; H182-S186 PolarHBondContact O-OG 2.86Å
183	I	90.6	Very high	86.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-49	175.8	-68.3	169	0	0	0	110	L157 I179 S180 K181 E185 S186 I187 I372 L373 V388 I392	L157-I183 HydrophobicContact CD2-CD1 4.2Å; L157-I183 HydrophobicContact CD2-CG1 3.98Å; I179-I183 HydrophobicContact CG2-CD1 3.83Å; I179-I183 VanDerWaalsContact O-CG1 3.31Å; I179-I183 WeakPolarHBondContact O-CG1 3.49Å; I179-I183 PolarHBondContact O-N 3.27Å; S180-I183 PolarHBondContact O-N 3.47Å; K181-I183 PolarHBondContact O-N 3.47Å; I183-E185 PolarHBondContact O-N 3Å; I183-S186 PolarHBondContact O-N 3.38Å; I183-S186 PolarHBondContact O-OG 3.4Å; I183-I187 HydrophobicContact CG2-CD1 3.58Å; I183-I187 HydrophobicContact CG2-CG1 4.47Å; I183-I187 WeakPolarHBondContact O-CD1 3.36Å; I183-I187 VanDerWaalsContact O-CG1 3.22Å; I183-I187 WeakPolarHBondContact O-CG1 3.47Å; I183-I187 PolarHBondContact O-N 3.26Å; I183-I372 HydrophobicContact CD1-CG2 4.01Å; I183-I372 HydrophobicContact CG1-CG2 4.11Å; I183-L373 HydrophobicContact CD1-CD2 4.29Å; I183-V388 HydrophobicContact CD1-CG1 4.04Å; I183-I392 HydrophobicContact CB-CD1 4.26Å; I183-I392 HydrophobicContact CD1-CD1 4.3Å; I183-I392 HydrophobicContact CG2-CD1 4Å
184	Q	89.7	Confident	85.4	Confident	49 Å²	49	52.1 Å²	52.1	23%	0.229	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-44.7	180	-74.8	178.3	-28.6	0	0	113.1	S180 K181 I187 A188 I392	S180-Q184 WeakPolarHBondContact O-CB 3.4Å; S180-Q184 VanDerWaalsContact O-CG 3.31Å; S180-Q184 WeakPolarHBondContact O-CG 3.22Å; S180-Q184 PolarHBondContact O-N 3.12Å; K181-Q184 PolarHBondContact O-N 3.03Å; Q184-I187 PolarHBondContact O-N 3.39Å; Q184-A188 WeakPolarHBondContact O-CB 3.2Å; Q184-A188 PolarHBondContact O-N 3.42Å; Q184-I392 HydrophobicContact CG-CG1 4.26Å; Q184-I392 HydrophobicContact CG-CG2 4.04Å; Q184-I392 PolarHBondContact NE2-O 3.02Å
185	E	87.1	Confident	84.2	Confident	92 Å²	92	55.4 Å²	55.4	43%	0.43	28%	0.282	S	S	.	.	H	α-helix	trans	-63.9	-44.6	177.2	-74.2	177	174.8	0	0	111.1	K181 H182 I183 I187 A188 I189	K181-E185 WeakPolarHBondContact CE-OE1 3.47Å; K181-E185 HydrophobicContact CG-CG 4.28Å; K181-E185 WeakPolarHBondContact CG-OE1 3.33Å; K181-E185 IonicContact NZ-OE1 3.77Å; K181-E185 WeakPolarHBondContact O-CB 3.32Å; K181-E185 WeakPolarHBondContact O-CG 2.93Å; K181-E185 PolarHBondContact O-N 3.37Å; H182-E185 PolarHBondContact O-N 2.97Å; I183-E185 PolarHBondContact O-N 3Å; E185-I187 VanDerWaalsContact C-N 3.31Å; E185-I187 PolarHBondContact O-N 3.01Å; E185-A188 PolarHBondContact O-N 3.3Å; E185-A188 VanDerWaalsContact O-N 3.17Å; E185-I189 WeakPolarHBondContact O-CB 3.05Å; E185-I189 VanDerWaalsContact O-CG1 3.26Å; E185-I189 WeakPolarHBondContact O-CG1 3.03Å; E185-I189 PolarHBondContact O-N 3.21Å
186	S	85.3	Confident	82.8	Confident	10 Å²	10	59.4 Å²	59.4	7%	0.07	31%	0.312	C	S	.	.	H	α-helix	trans	-60.1	-41.6	177.3	69.2	0	0	0	0	112.8	I152 H182 I183 I189 Q190	I152-S186 WeakPolarHBondContact CD1-OG 3.13Å; H182-S186 WeakPolarHBondContact O-CB 3.34Å; H182-S186 PolarHBondContact O-N 3.02Å; H182-S186 PolarHBondContact O-OG 2.86Å; I183-S186 PolarHBondContact O-N 3.38Å; I183-S186 PolarHBondContact O-OG 3.4Å; S186-I189 PolarHBondContact O-N 3.22Å; S186-Q190 WeakPolarHBondContact O-CG 3.08Å; S186-Q190 PolarHBondContact O-N 3.45Å
187	I	85.1	Confident	80.9	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-68.7	-40.6	178.1	-66.7	163.3	0	0	0	109.6	I183 Q184 E185 Q190 R191 L365 Q366	I183-I187 HydrophobicContact CG2-CD1 3.58Å; I183-I187 HydrophobicContact CG2-CG1 4.47Å; I183-I187 WeakPolarHBondContact O-CD1 3.36Å; I183-I187 VanDerWaalsContact O-CG1 3.22Å; I183-I187 WeakPolarHBondContact O-CG1 3.47Å; I183-I187 PolarHBondContact O-N 3.26Å; Q184-I187 PolarHBondContact O-N 3.39Å; E185-I187 VanDerWaalsContact C-N 3.31Å; E185-I187 PolarHBondContact O-N 3.01Å; I187-Q190 PolarHBondContact O-N 3.27Å; I187-R191 WeakPolarHBondContact O-CG 3.26Å; I187-R191 PolarHBondContact O-N 3.21Å; I187-L365 HydrophobicContact CD1-CD2 4.17Å; I187-L365 WeakPolarHBondContact CD1-O 2.81Å; I187-Q366 VanDerWaalsContact CG2-OE1 3.3Å
188	A	84.4	Confident	79.1	Confident	53 Å²	53	67.9 Å²	67.9	44%	0.438	34%	0.344	S	S	.	.	H	α-helix	trans	-62.4	-42.2	176.6	0	0	0	0	0	112	Q184 E185 R191 A192	Q184-A188 WeakPolarHBondContact O-CB 3.2Å; Q184-A188 PolarHBondContact O-N 3.42Å; E185-A188 PolarHBondContact O-N 3.3Å; E185-A188 VanDerWaalsContact O-N 3.17Å; A188-R191 WeakPolarHBondContact O-CB 3.39Å; A188-R191 PolarHBondContact O-N 2.95Å; A188-A192 PolarHBondContact O-N 2.84Å
189	I	80.4	Confident	77	Confident	96 Å²	96	72.3 Å²	72.3	49%	0.492	36%	0.363	S	S	.	.	H	α-helix	trans	-61.9	-47.3	175.3	-69.8	166	0	0	0	110.4	E185 S186 R191 A192 F193	E185-I189 WeakPolarHBondContact O-CB 3.05Å; E185-I189 VanDerWaalsContact O-CG1 3.26Å; E185-I189 WeakPolarHBondContact O-CG1 3.03Å; E185-I189 PolarHBondContact O-N 3.21Å; S186-I189 PolarHBondContact O-N 3.22Å; I189-R191 VanDerWaalsContact C-N 3.29Å; I189-R191 PolarHBondContact O-N 3Å; I189-A192 WeakPolarHBondContact O-CB 3.34Å; I189-A192 PolarHBondContact O-N 3.23Å; I189-A192 VanDerWaalsContact O-N 3.1Å; I189-F193 HydrophobicContact CG2-CD2 3.7Å; I189-F193 HydrophobicContact CG2-CE2 3.5Å; I189-F193 VanDerWaalsContact O-CD2 3.28Å; I189-F193 WeakPolarHBondContact O-CD2 3.39Å; I189-F193 PolarHBondContact O-N 3.34Å
190	Q	78.3	Confident	74.7	Confident	20 Å²	20	75.1 Å²	75.1	9%	0.093	39%	0.392	C	S	.	.	H	α-helix	trans	-59.2	-39.5	176.8	-73	178.9	-5.1	0	0	112.3	S150 S186 I187 G194	S150-Q190 PolarHBondContact O-NE2 3.22Å; S186-Q190 WeakPolarHBondContact O-CG 3.08Å; S186-Q190 PolarHBondContact O-N 3.45Å; I187-Q190 PolarHBondContact O-N 3.27Å; Q190-G194 PolarHBondContact O-N 2.69Å; Q190-G194 VanDerWaalsContact O-N 3.16Å
191	R	78.5	Confident	72.5	Confident	85 Å²	85	85.4 Å²	85.4	32%	0.321	43%	0.431	S	S	.	.	H	α-helix	trans	-64.8	-39.7	173.5	-72.3	180	-172.2	147.2	19.6	113.2	I187 A188 I189 G194 K195 K363 C364 Q366	I187-R191 WeakPolarHBondContact O-CG 3.26Å; I187-R191 PolarHBondContact O-N 3.21Å; A188-R191 WeakPolarHBondContact O-CB 3.39Å; A188-R191 PolarHBondContact O-N 2.95Å; I189-R191 VanDerWaalsContact C-N 3.29Å; I189-R191 PolarHBondContact O-N 3Å; R191-G194 PolarHBondContact O-N 2.93Å; R191-K195 PolarHBondContact O-N 3.05Å; R191-K363 PolarHBondContact NH2-O 3.36Å; R191-C364 PolarHBondContact NH2-O 3.43Å; R191-Q366 VanDerWaalsContact CG-OE1 3.24Å; R191-Q366 VanDerWaalsContact NH2-OE1 3.17Å
192	A	76.9	Confident	70.4	Confident	60 Å²	60	89.3 Å²	89.3	50%	0.496	45%	0.448	S	S	.	.	H	α-helix	trans	-64.1	-44.7	179.8	0	0	0	0	0	110.8	A188 I189 G194 K195 S196	A188-A192 PolarHBondContact O-N 2.84Å; I189-A192 WeakPolarHBondContact O-CB 3.34Å; I189-A192 PolarHBondContact O-N 3.23Å; I189-A192 VanDerWaalsContact O-N 3.1Å; A192-G194 VanDerWaalsContact C-N 3.34Å; A192-G194 PolarHBondContact O-N 2.94Å; A192-K195 PolarHBondContact O-N 3.32Å; A192-S196 PolarHBondContact O-N 3.05Å
193	F	70.1	Confident	68.2	Low	119 Å²	119	93.6 Å²	93.6	52%	0.522	47%	0.472	S	S	.	.	H	α-helix	trans	-60.9	-40.2	174.8	-80.9	-67.3	0	0	0	112.8	I189 K195 S196	I189-F193 HydrophobicContact CG2-CD2 3.7Å; I189-F193 HydrophobicContact CG2-CE2 3.5Å; I189-F193 VanDerWaalsContact O-CD2 3.28Å; I189-F193 WeakPolarHBondContact O-CD2 3.39Å; I189-F193 PolarHBondContact O-N 3.34Å; F193-K195 PolarHBondContact O-N 3.14Å; F193-S196 PolarHBondContact O-N 3.35Å
194	G	64.5	Low	66	Low	21 Å²	21	98.8 Å²	98.8	22%	0.216	50%	0.504	C	S	.	.	H	α-helix	trans	-62	-27.9	176.7	0	0	0	0	0	114.3	Q190 R191 A192	Q190-G194 PolarHBondContact O-N 2.69Å; Q190-G194 VanDerWaalsContact O-N 3.16Å; R191-G194 PolarHBondContact O-N 2.93Å; A192-G194 VanDerWaalsContact C-N 3.34Å; A192-G194 PolarHBondContact O-N 2.94Å
195	K	65	Low	64	Low	181 Å²	181	100.9 Å²	100.9	79%	0.787	52%	0.523	S	S	*	.	H	α-helix	trans	-83	-28.4	178.1	-70.6	-176.2	179.2	-176.6	0	113.6	R191 A192 F193	R191-K195 PolarHBondContact O-N 3.05Å; A192-K195 PolarHBondContact O-N 3.32Å; F193-K195 PolarHBondContact O-N 3.14Å
196	S	59.1	Low	62.1	Low	101 Å²	101	103.9 Å²	103.9	71%	0.706	54%	0.535	S	S	*	.	H	α-helix	trans	-83.1	-17.9	-174.3	-164.3	0	0	0	0	114.3	A192 F193 R198	A192-S196 PolarHBondContact O-N 3.05Å; F193-S196 PolarHBondContact O-N 3.35Å; S196-R198 PolarHBondContact O-N 3.33Å; S196-R198 VanDerWaalsContact O-N 3.15Å
197	S	53	Low	60.4	Low	45 Å²	45	108.1 Å²	108.1	32%	0.315	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-76.2	3.5	-170.5	-174.5	0	0	0	0	115.4	H199 E213	S197-H199 PolarHBondContact O-N 2.91Å; S197-E213 WeakPolarHBondContact CB-OE1 3.11Å; S197-E213 PolarHBondContact OG-OE1 3.2Å
198	R	53.1	Low	58.8	Low	215 Å²	215	112.1 Å²	112.1	81%	0.811	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-63.3	-13.8	-174.7	-137.5	177	-161.5	159	3	115	S196	S196-R198 PolarHBondContact O-N 3.33Å; S196-R198 VanDerWaalsContact O-N 3.15Å
199	H	47.9	Very low	57.1	Low	188 Å²	188	110.9 Å²	110.9	87%	0.87	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-118.7	2	-172.5	-87.1	81.7	0	0	0	116.6	S197	S197-H199 PolarHBondContact O-N 2.91Å
200	G	45.5	Very low	55.5	Low	60 Å²	60	111.2 Å²	111.2	62%	0.619	57%	0.57	S	S	*	*			trans	-119.3	34.8	-168.7	0	0	0	0	0	117.1	F202	G200-F202 PolarHBondContact O-N 2.73Å; G200-F202 VanDerWaalsContact O-N 3.12Å
201	R	46.5	Very low	54.5	Low	215 Å²	215	111.7 Å²	111.7	81%	0.811	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	14.2	-155.7	-129.7	-172.8	-62.8	153.7	2.6	118.6
202	F	45.7	Very low	53.5	Low	196 Å²	196	112.5 Å²	112.5	86%	0.86	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	-18.9	-161.1	-138.7	-97	0	0	0	118.4	G200	G200-F202 PolarHBondContact O-N 2.73Å; G200-F202 VanDerWaalsContact O-N 3.12Å
203	I	45.8	Very low	52.4	Low	156 Å²	156	113.3 Å²	113.3	80%	0.8	57%	0.574	S	S	*	*	S	Bend	trans	-133.4	6	-164.1	-52.6	-176.2	0	0	0	115.9
204	T	44.6	Very low	52	Low	109 Å²	109	117.4 Å²	117.4	67%	0.669	59%	0.586	S	S	*	*	S	Bend	trans	-122	125.1	175.8	51.3	0	0	0	0	111.7	F206	T204-F206 PolarHBondContact O-N 2.95Å
205	S	47.2	Very low	52.4	Low	92 Å²	92	116.5 Å²	116.5	64%	0.643	58%	0.576	S	S	*	*			trans	-31.4	119.5	-174.9	-164.7	0	0	0	0	113.1	T207 L208	S205-T207 PolarHBondContact O-N 3.3Å; S205-L208 PolarHBondContact O-N 2.96Å
206	F	47	Very low	53.2	Low	156 Å²	156	109.2 Å²	109.2	68%	0.684	55%	0.545	S	S	*	.	H	α-helix	trans	-49.8	-22.5	-167	-171.8	-98.2	0	0	0	114.8	T204 F210	T204-F206 PolarHBondContact O-N 2.95Å; F206-F210 HydrophobicContact CD1-CE2 4.4Å; F206-F210 HydrophobicContact CD2-CD2 4.37Å; F206-F210 AromaticContact CD2-CE2 3.76Å; F206-F210 HydrophobicContact CD2-CE2 3.76Å; F206-F210 HydrophobicContact CE1-CE2 4.12Å; F206-F210 HydrophobicContact CE2-CD2 4.37Å; F206-F210 AromaticContact CE2-CE2 3.43Å; F206-F210 HydrophobicContact CE2-CE2 3.43Å; F206-F210 VanDerWaalsContact CE2-CE2 3.43Å; F206-F210 AromaticContact CE2-CZ 3.94Å; F206-F210 HydrophobicContact CE2-CZ 3.94Å; F206-F210 HydrophobicContact CG-CD2 4.45Å; F206-F210 HydrophobicContact CG-CE2 4.24Å; F206-F210 HydrophobicContact CZ-CD2 4.44Å; F206-F210 AromaticContact CZ-CE2 3.63Å; F206-F210 HydrophobicContact CZ-CE2 3.63Å; F206-F210 AromaticContact CZ-CZ 3.86Å; F206-F210 HydrophobicContact CZ-CZ 3.86Å; F206-F210 WeakPolarHBondContact O-CD2 3.48Å
207	T	50.9	Low	54.6	Low	98 Å²	98	105.1 Å²	105.1	60%	0.601	51%	0.514	S	S	*	.	H	α-helix	trans	-84.2	-35.8	178.7	47.8	0	0	0	0	113.7	S205 V211	S205-T207 PolarHBondContact O-N 3.3Å; T207-V211 WeakPolarHBondContact O-CG2 3.42Å; T207-V211 PolarHBondContact O-N 3.12Å
208	L	50.7	Low	56.3	Low	88 Å²	88	103 Å²	103	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-80.1	-35.8	-173	-146.5	84	0	0	0	112.2	S205 K212 Y217	S205-L208 PolarHBondContact O-N 2.96Å; L208-K212 PolarHBondContact O-N 2.99Å; L208-Y217 HydrophobicContact CD1-CE2 4.14Å; L208-Y217 HydrophobicContact CD2-CE2 4.32Å; L208-Y217 HydrophobicContact CG-CE2 4.08Å
209	A	48.5	Very low	58.1	Low	28 Å²	28	92.8 Å²	92.8	23%	0.231	46%	0.46	C	S	.	.	H	α-helix	trans	-66.3	-46.5	177.9	0	0	0	0	0	111.7	V211 K212 E213	A209-V211 VanDerWaalsContact C-N 3.27Å; A209-V211 PolarHBondContact O-N 3.38Å; A209-K212 PolarHBondContact O-N 3.43Å; A209-E213 PolarHBondContact O-N 3.1Å
210	F	47.5	Very low	60.1	Low	102 Å²	102	86.5 Å²	86.5	45%	0.447	43%	0.433	S	S	.	.	H	α-helix	trans	-61.9	-34.1	179	-89.9	-96.9	0	0	0	113.2	F206	F206-F210 HydrophobicContact CD1-CE2 4.4Å; F206-F210 HydrophobicContact CD2-CD2 4.37Å; F206-F210 AromaticContact CD2-CE2 3.76Å; F206-F210 HydrophobicContact CD2-CE2 3.76Å; F206-F210 HydrophobicContact CE1-CE2 4.12Å; F206-F210 HydrophobicContact CE2-CD2 4.37Å; F206-F210 AromaticContact CE2-CE2 3.43Å; F206-F210 HydrophobicContact CE2-CE2 3.43Å; F206-F210 VanDerWaalsContact CE2-CE2 3.43Å; F206-F210 AromaticContact CE2-CZ 3.94Å; F206-F210 HydrophobicContact CE2-CZ 3.94Å; F206-F210 HydrophobicContact CG-CD2 4.45Å; F206-F210 HydrophobicContact CG-CE2 4.24Å; F206-F210 HydrophobicContact CZ-CD2 4.44Å; F206-F210 AromaticContact CZ-CE2 3.63Å; F206-F210 HydrophobicContact CZ-CE2 3.63Å; F206-F210 AromaticContact CZ-CZ 3.86Å; F206-F210 HydrophobicContact CZ-CZ 3.86Å; F206-F210 WeakPolarHBondContact O-CD2 3.48Å
211	V	57.4	Low	62.3	Low	30 Å²	30	84.4 Å²	84.4	18%	0.182	41%	0.407	C	S	.	.	H	α-helix	trans	-73.9	-37.7	-179.3	165.1	0	0	0	0	111.6	T207 A209 E213 R214 Y217 I220	T207-V211 WeakPolarHBondContact O-CG2 3.42Å; T207-V211 PolarHBondContact O-N 3.12Å; A209-V211 VanDerWaalsContact C-N 3.27Å; A209-V211 PolarHBondContact O-N 3.38Å; V211-E213 PolarHBondContact O-N 2.83Å; V211-R214 PolarHBondContact O-N 2.98Å; V211-Y217 VanDerWaalsContact CG1-CA 3.5Å; V211-Y217 HydrophobicContact CG1-CD2 4.24Å; V211-I220 HydrophobicContact CB-CD1 4.16Å; V211-I220 HydrophobicContact CG1-CB 4.07Å; V211-I220 HydrophobicContact CG1-CD1 3.61Å; V211-I220 HydrophobicContact CG1-CG1 4.32Å; V211-I220 HydrophobicContact CG1-CG2 4.34Å; V211-I220 HydrophobicContact CG2-CD1 3.48Å; V211-I220 VanDerWaalsContact CG2-CD1 3.48Å
212	K	55.8	Low	64.6	Low	102 Å²	102	74.3 Å²	74.3	44%	0.443	37%	0.369	S	S	.	.	H	α-helix	trans	-62.2	-33.7	177.6	-165.8	171.5	-178.7	174.8	0	112.1	L208 A209 R214	L208-K212 PolarHBondContact O-N 2.99Å; A209-K212 PolarHBondContact O-N 3.43Å; K212-R214 VanDerWaalsContact C-N 3.29Å; K212-R214 PolarHBondContact O-N 2.88Å
213	E	54.5	Low	66.9	Low	78 Å²	78	65.9 Å²	65.9	36%	0.364	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-17.1	-176	-69.1	-178.8	-178	0	0	114.8	S197 A209 V211	S197-E213 WeakPolarHBondContact CB-OE1 3.11Å; S197-E213 PolarHBondContact OG-OE1 3.2Å; A209-E213 PolarHBondContact O-N 3.1Å; V211-E213 PolarHBondContact O-N 2.83Å
214	R	62.9	Low	69.2	Low	205 Å²	205	61 Å²	61	77%	0.774	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	4.6	-175.2	-65.9	-165.1	179.9	-169.6	2.1	115.7	V211 K212 F216 Q366	V211-R214 PolarHBondContact O-N 2.98Å; K212-R214 VanDerWaalsContact C-N 3.29Å; K212-R214 PolarHBondContact O-N 2.88Å; R214-F216 VanDerWaalsContact C-N 3.3Å; R214-Q366 PolarHBondContact O-NE2 2.89Å
215	G	71.5	Confident	71.6	Confident	2 Å²	2	56 Å²	56	2%	0.021	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	40.7	-176	0	0	0	0	0	112.2	D368	G215-D368 VanDerWaalsContact O-CG 3.27Å; G215-D368 PolarHBondContact O-N 3.42Å
216	F	83.2	Confident	73.9	Confident	28 Å²	28	51.9 Å²	51.9	12%	0.123	26%	0.255	C	S	.	.			trans	-130.9	14.2	-178.4	-170	-145.6	0	0	0	111.8	R214 T219 I220 I332 R367 D368	R214-F216 VanDerWaalsContact C-N 3.3Å; F216-T219 VanDerWaalsContact CD2-CB 3.48Å; F216-T219 HydrophobicContact CD2-CG2 4Å; F216-T219 VanDerWaalsContact CE2-CB 3.46Å; F216-T219 HydrophobicContact CE2-CG2 3.47Å; F216-T219 VanDerWaalsContact CE2-CG2 3.47Å; F216-T219 HydrophobicContact CZ-CG2 4.5Å; F216-I220 HydrophobicContact CD1-CD1 3.15Å; F216-I220 HydrophobicContact CD1-CG1 3.43Å; F216-I220 VanDerWaalsContact CD1-CG1 3.43Å; F216-I220 HydrophobicContact CD2-CG1 4.23Å; F216-I220 HydrophobicContact CE1-CD1 3.29Å; F216-I220 HydrophobicContact CE1-CG1 3.24Å; F216-I220 HydrophobicContact CE2-CG1 4.09Å; F216-I220 HydrophobicContact CG-CD1 3.93Å; F216-I220 HydrophobicContact CG-CG1 3.91Å; F216-I220 HydrophobicContact CZ-CD1 4.16Å; F216-I220 HydrophobicContact CZ-CG1 3.58Å; F216-I220 WeakPolarHBondContact O-CB 3.28Å; F216-I220 WeakPolarHBondContact O-CG1 3.43Å; F216-I220 PolarHBondContact O-N 3.11Å; F216-I332 HydrophobicContact CZ-CG1 4.4Å; F216-R367 HydrophobicContact CD2-CB 3.52Å; F216-R367 HydrophobicContact CD2-CG 4.08Å; F216-R367 VanDerWaalsContact CE1-NH1 3.28Å; F216-R367 HydrophobicContact CE2-CB 4.1Å; F216-R367 VanDerWaalsContact CE2-CD 3.5Å; F216-R367 HydrophobicContact CE2-CG 4.44Å; F216-R367 HydrophobicContact CG-CB 4.34Å; F216-D368 VanDerWaalsContact CA-OD1 3.27Å; F216-D368 WeakPolarHBondContact CA-OD1 3.27Å; F216-D368 PolarHBondContact N-OD2 3.42Å
217	Y	86.5	Confident	76.3	Confident	15 Å²	15	49 Å²	49	6%	0.059	25%	0.246	C	C	.	.	H	α-helix	trans	-69.5	-51.5	-173.2	171.8	-89.8	0	0	0	111.8	L146 Q149 L208 V211 T219 I220 L221 D368	L146-Y217 PolarHBondContact O-OH 3Å; L146-Y217 VanDerWaalsContact O-OH 3.12Å; Q149-Y217 HydrophobicContact CB-CE1 4.35Å; Q149-Y217 WeakPolarHBondContact CB-OH 3.47Å; Q149-Y217 PolarHBondContact OE1-OH 3.26Å; L208-Y217 HydrophobicContact CD1-CE2 4.14Å; L208-Y217 HydrophobicContact CD2-CE2 4.32Å; L208-Y217 HydrophobicContact CG-CE2 4.08Å; V211-Y217 VanDerWaalsContact CG1-CA 3.5Å; V211-Y217 HydrophobicContact CG1-CD2 4.24Å; Y217-T219 VanDerWaalsContact C-N 3.27Å; Y217-T219 PolarHBondContact O-N 2.64Å; Y217-I220 PolarHBondContact O-N 2.71Å; Y217-L221 HydrophobicContact CE1-CD2 4.18Å; Y217-L221 WeakPolarHBondContact O-CB 3.4Å; Y217-L221 PolarHBondContact O-N 3.02Å; Y217-D368 PolarHBondContact N-OD1 2.72Å; Y217-D368 PolarHBondContact N-OD2 3.36Å
218	L	89.2	Confident	78.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-40.9	-176.6	-176.1	62.1	0	0	0	110.5	W143 N147 L221 Y222 D368 F371 I372	W143-L218 HydrophobicContact CH2-CD1 3.55Å; W143-L218 HydrophobicContact CH2-CG 4.34Å; W143-L218 HydrophobicContact CZ2-CD1 4.38Å; W143-L218 HydrophobicContact CZ3-CD1 4.06Å; N147-L218 WeakPolarHBondContact OD1-CD1 3.4Å; L218-L221 PolarHBondContact O-N 3.18Å; L218-Y222 WeakPolarHBondContact O-CB 3.37Å; L218-Y222 PolarHBondContact O-N 2.77Å; L218-D368 HydrophobicContact CB-CB 4.36Å; L218-D368 PolarHBondContact N-OD1 3.3Å; L218-D368 PolarHBondContact N-OD2 2.96Å; L218-F371 HydrophobicContact CD2-CD1 3.78Å; L218-F371 HydrophobicContact CD2-CE1 3.91Å; L218-F371 HydrophobicContact CG-CD1 3.85Å; L218-F371 HydrophobicContact CG-CE1 3.78Å; L218-I372 HydrophobicContact CD2-CD1 4.23Å; L218-I372 HydrophobicContact CD2-CG1 3.91Å
219	T	91	Very high	80.7	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-68	-43.5	179.9	-44.7	0	0	0	0	112.2	F216 Y217 Y222 L223 S331 D368 F371	F216-T219 VanDerWaalsContact CD2-CB 3.48Å; F216-T219 HydrophobicContact CD2-CG2 4Å; F216-T219 VanDerWaalsContact CE2-CB 3.46Å; F216-T219 HydrophobicContact CE2-CG2 3.47Å; F216-T219 VanDerWaalsContact CE2-CG2 3.47Å; F216-T219 HydrophobicContact CZ-CG2 4.5Å; Y217-T219 VanDerWaalsContact C-N 3.27Å; Y217-T219 PolarHBondContact O-N 2.64Å; T219-Y222 PolarHBondContact O-N 2.85Å; T219-L223 WeakPolarHBondContact O-CG 3.34Å; T219-L223 PolarHBondContact O-N 3.38Å; T219-S331 VanDerWaalsContact CG2-CB 3.46Å; T219-D368 WeakPolarHBondContact CB-OD1 3.48Å; T219-D368 PolarHBondContact N-OD1 2.85Å; T219-D368 PolarHBondContact OG1-OD1 3.08Å; T219-F371 HydrophobicContact CG2-CB 4.28Å; T219-F371 HydrophobicContact CG2-CD2 4.31Å; T219-F371 HydrophobicContact CG2-CG 4.44Å; T219-F371 WeakPolarHBondContact OG1-CB 3.35Å
220	I	90.4	Very high	83	Confident	56 Å²	56	43.9 Å²	43.9	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-64.1	-43.8	175.4	-77.7	176.6	0	0	0	110.8	V211 F216 Y217 Y222 L223 A224	V211-I220 HydrophobicContact CB-CD1 4.16Å; V211-I220 HydrophobicContact CG1-CB 4.07Å; V211-I220 HydrophobicContact CG1-CD1 3.61Å; V211-I220 HydrophobicContact CG1-CG1 4.32Å; V211-I220 HydrophobicContact CG1-CG2 4.34Å; V211-I220 HydrophobicContact CG2-CD1 3.48Å; V211-I220 VanDerWaalsContact CG2-CD1 3.48Å; F216-I220 HydrophobicContact CD1-CD1 3.15Å; F216-I220 HydrophobicContact CD1-CG1 3.43Å; F216-I220 VanDerWaalsContact CD1-CG1 3.43Å; F216-I220 HydrophobicContact CD2-CG1 4.23Å; F216-I220 HydrophobicContact CE1-CD1 3.29Å; F216-I220 HydrophobicContact CE1-CG1 3.24Å; F216-I220 HydrophobicContact CE2-CG1 4.09Å; F216-I220 HydrophobicContact CG-CD1 3.93Å; F216-I220 HydrophobicContact CG-CG1 3.91Å; F216-I220 HydrophobicContact CZ-CD1 4.16Å; F216-I220 HydrophobicContact CZ-CG1 3.58Å; F216-I220 WeakPolarHBondContact O-CB 3.28Å; F216-I220 WeakPolarHBondContact O-CG1 3.43Å; F216-I220 PolarHBondContact O-N 3.11Å; Y217-I220 PolarHBondContact O-N 2.71Å; I220-Y222 VanDerWaalsContact C-N 3.27Å; I220-Y222 PolarHBondContact O-N 3.07Å; I220-L223 PolarHBondContact O-N 3.08Å; I220-A224 WeakPolarHBondContact O-CB 3.41Å; I220-A224 PolarHBondContact O-N 3.34Å
221	L	92	Very high	85.4	Confident	15 Å²	15	41.1 Å²	41.1	8%	0.079	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-45.4	178.1	174.3	63.3	0	0	0	110.6	W143 L146 N147 Y217 L218 A224 V225	W143-L221 HydrophobicContact CE3-CD2 4.04Å; W143-L221 HydrophobicContact CE3-CG 3.97Å; W143-L221 HydrophobicContact CZ3-CB 4.47Å; W143-L221 HydrophobicContact CZ3-CD2 4.01Å; W143-L221 HydrophobicContact CZ3-CG 3.98Å; L146-L221 HydrophobicContact CB-CD1 3.61Å; L146-L221 HydrophobicContact CB-CD2 3.65Å; L146-L221 HydrophobicContact CB-CG 4.28Å; L146-L221 HydrophobicContact CD1-CD1 3.62Å; L146-L221 HydrophobicContact CG-CD1 4.27Å; N147-L221 HydrophobicContact CB-CD2 4.38Å; Y217-L221 HydrophobicContact CE1-CD2 4.18Å; Y217-L221 WeakPolarHBondContact O-CB 3.4Å; Y217-L221 PolarHBondContact O-N 3.02Å; L218-L221 PolarHBondContact O-N 3.18Å; L221-A224 PolarHBondContact O-N 2.68Å; L221-V225 HydrophobicContact CD1-CG2 4.47Å; L221-V225 WeakPolarHBondContact O-CG2 3.46Å; L221-V225 PolarHBondContact O-N 3.36Å
222	Y	93.6	Very high	87.3	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-43.6	177.9	-172.8	-105	0	0	0	112.2	D45 W143 L218 T219 I220 A224 V225 K226 W327 F371 M375	D45-Y222 PolarHBondContact OD2-OH 3.25Å; W143-Y222 HydrophobicContact CE3-CD2 4.17Å; W143-Y222 AromaticContact CH2-CD2 3.82Å; W143-Y222 HydrophobicContact CH2-CD2 3.82Å; W143-Y222 HydrophobicContact CH2-CG 4.37Å; W143-Y222 HydrophobicContact CZ2-CD2 4.29Å; W143-Y222 AromaticContact CZ3-CD2 3.77Å; W143-Y222 HydrophobicContact CZ3-CD2 3.77Å; W143-Y222 HydrophobicContact CZ3-CG 4.21Å; L218-Y222 WeakPolarHBondContact O-CB 3.37Å; L218-Y222 PolarHBondContact O-N 2.77Å; T219-Y222 PolarHBondContact O-N 2.85Å; I220-Y222 VanDerWaalsContact C-N 3.27Å; I220-Y222 PolarHBondContact O-N 3.07Å; Y222-A224 VanDerWaalsContact C-N 3.31Å; Y222-A224 PolarHBondContact O-N 3.24Å; Y222-V225 PolarHBondContact O-N 3.42Å; Y222-K226 HydrophobicContact CD1-CG 4.24Å; Y222-K226 HydrophobicContact CE1-CD 4.35Å; Y222-K226 HydrophobicContact CE1-CG 4.03Å; Y222-K226 WeakPolarHBondContact O-CG 3.22Å; Y222-K226 PolarHBondContact O-N 3Å; Y222-K226 WeakPolarHBondContact OH-CE 3.33Å; Y222-K226 PolarHBondContact OH-NZ 3.38Å; Y222-W327 HydrophobicContact CD1-CD2 4.38Å; Y222-W327 HydrophobicContact CD1-CE3 4.28Å; Y222-W327 HydrophobicContact CE1-CB 4.48Å; Y222-W327 AromaticContact CE1-CD2 3.53Å; Y222-W327 HydrophobicContact CE1-CD2 3.53Å; Y222-W327 AromaticContact CE1-CE2 3.75Å; Y222-W327 AromaticContact CE1-CE3 3.76Å; Y222-W327 HydrophobicContact CE1-CE3 3.76Å; Y222-W327 AromaticContact CE1-CG 3.84Å; Y222-W327 HydrophobicContact CE1-CG 3.84Å; Y222-W327 HydrophobicContact CE1-CH2 4.37Å; Y222-W327 HydrophobicContact CE1-CZ2 4.17Å; Y222-W327 HydrophobicContact CE1-CZ3 4.17Å; Y222-F371 HydrophobicContact CD1-CD2 4.42Å; Y222-F371 AromaticContact CD1-CE2 3.34Å; Y222-F371 HydrophobicContact CD1-CE2 3.34Å; Y222-F371 AromaticContact CD1-CZ 3.73Å; Y222-F371 HydrophobicContact CD1-CZ 3.73Å; Y222-F371 HydrophobicContact CD2-CE2 4.26Å; Y222-F371 AromaticContact CD2-CZ 3.78Å; Y222-F371 HydrophobicContact CD2-CZ 3.78Å; Y222-F371 AromaticContact CE1-CE2 3.77Å; Y222-F371 HydrophobicContact CE1-CE2 3.77Å; Y222-F371 HydrophobicContact CE1-CZ 4.22Å; Y222-F371 HydrophobicContact CE2-CZ 4.29Å; Y222-F371 AromaticContact CG-CE2 3.58Å; Y222-F371 HydrophobicContact CG-CE2 3.58Å; Y222-F371 AromaticContact CG-CZ 3.44Å; Y222-F371 HydrophobicContact CG-CZ 3.44Å; Y222-F371 VanDerWaalsContact CG-CZ 3.44Å; Y222-M375 HydrophobicContact CD2-CE 4.1Å; Y222-M375 HydrophobicContact CE1-CE 3.84Å; Y222-M375 HydrophobicContact CE2-CE 3.36Å; Y222-M375 WeakPolarHBondContact OH-CE 3.29Å
223	L	94.5	Very high	89.2	Confident	19 Å²	19	35.9 Å²	35.9	10%	0.099	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-37	174.6	-69.3	176.6	0	0	0	112.5	T219 I220 K226 L227 W327 I332	T219-L223 WeakPolarHBondContact O-CG 3.34Å; T219-L223 PolarHBondContact O-N 3.38Å; I220-L223 PolarHBondContact O-N 3.08Å; L223-K226 PolarHBondContact O-N 3.24Å; L223-L227 PolarHBondContact O-N 3.46Å; L223-W327 HydrophobicContact CD2-CB 4.07Å; L223-I332 HydrophobicContact CD1-CD1 4.12Å; L223-I332 HydrophobicContact CD1-CG1 4.02Å
224	A	94.8	Very high	91.1	Very high	53 Å²	53	35.3 Å²	35.3	44%	0.438	19%	0.189	S	C	.	.	H	α-helix	trans	-66.1	-40.2	175.2	0	0	0	0	0	111.7	I220 L221 Y222 L227 L228	I220-A224 WeakPolarHBondContact O-CB 3.41Å; I220-A224 PolarHBondContact O-N 3.34Å; L221-A224 PolarHBondContact O-N 2.68Å; Y222-A224 VanDerWaalsContact C-N 3.31Å; Y222-A224 PolarHBondContact O-N 3.24Å; A224-L227 PolarHBondContact O-N 2.9Å; A224-L228 WeakPolarHBondContact O-CB 3.27Å; A224-L228 PolarHBondContact O-N 3.34Å
225	V	95.2	Very high	92.7	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.024	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-40.4	174	169.4	0	0	0	0	111.1	P139 V142 W143 L221 Y222 L228 Y229	P139-V225 HydrophobicContact CB-CG1 4.28Å; V142-V225 HydrophobicContact CG1-CG2 4.25Å; W143-V225 HydrophobicContact CB-CG1 4.21Å; W143-V225 HydrophobicContact CB-CG2 3.97Å; W143-V225 HydrophobicContact CE3-CG2 4.22Å; L221-V225 HydrophobicContact CD1-CG2 4.47Å; L221-V225 WeakPolarHBondContact O-CG2 3.46Å; L221-V225 PolarHBondContact O-N 3.36Å; Y222-V225 PolarHBondContact O-N 3.42Å; V225-L228 CarbonylContact O-C 3.6Å; V225-L228 WeakPolarHBondContact O-CB 3.45Å; V225-L228 PolarHBondContact O-N 2.92Å; V225-L228 VanDerWaalsContact O-N 3.15Å; V225-Y229 HydrophobicContact CG1-CD2 3.95Å; V225-Y229 HydrophobicContact CG1-CE2 3.64Å; V225-Y229 WeakPolarHBondContact O-CD2 3.32Å; V225-Y229 PolarHBondContact O-N 2.94Å
226	K	96	Very high	93.9	Very high	5 Å²	5	27.1 Å²	27.1	2%	0.022	17%	0.168	C	C	.	.	H	α-helix	trans	-61.9	-42.5	173.8	-69.2	-75	179.7	-177.1	0	112.3	D42 D45 Y222 L223 L228 Y229 L230 N323 F324	D42-K226 IonicContact OD2-NZ 2.72Å; D45-K226 WeakPolarHBondContact OD1-CE 3.34Å; D45-K226 IonicContact OD1-NZ 3.21Å; D45-K226 PolarHBondContact OD1-NZ 3.37Å; D45-K226 WeakPolarHBondContact OD2-CE 3.45Å; D45-K226 IonicContact OD2-NZ 3.19Å; D45-K226 PolarHBondContact OD2-NZ 3.24Å; Y222-K226 HydrophobicContact CD1-CG 4.24Å; Y222-K226 HydrophobicContact CE1-CD 4.35Å; Y222-K226 HydrophobicContact CE1-CG 4.03Å; Y222-K226 WeakPolarHBondContact O-CG 3.22Å; Y222-K226 PolarHBondContact O-N 3Å; Y222-K226 WeakPolarHBondContact OH-CE 3.33Å; Y222-K226 PolarHBondContact OH-NZ 3.38Å; L223-K226 PolarHBondContact O-N 3.24Å; K226-L228 VanDerWaalsContact C-N 3.27Å; K226-L228 PolarHBondContact O-N 3.42Å; K226-Y229 PolarHBondContact O-N 2.91Å; K226-L230 PolarHBondContact O-N 3.1Å; K226-N323 WeakPolarHBondContact CD-OD1 3.44Å; K226-N323 VanDerWaalsContact CE-OD1 3.32Å; K226-N323 WeakPolarHBondContact CE-OD1 3.5Å; K226-N323 PolarHBondContact NZ-OD1 3.14Å; K226-F324 HydrophobicContact CB-CD2 3.71Å
227	L	96.3	Very high	94.4	Very high	95 Å²	95	27.5 Å²	27.5	50%	0.497	17%	0.169	S	C	.	.	H	α-helix	trans	-62.8	-37.3	173.8	-177.3	62.5	0	0	0	111.2	L223 A224 L230 G231 F324	L223-L227 PolarHBondContact O-N 3.46Å; A224-L227 PolarHBondContact O-N 2.9Å; L227-L230 PolarHBondContact O-N 2.98Å; L227-G231 PolarHBondContact O-N 3.46Å; L227-F324 HydrophobicContact CB-CD2 4.48Å; L227-F324 HydrophobicContact CB-CE2 3.91Å; L227-F324 HydrophobicContact CB-CZ 4.35Å; L227-F324 HydrophobicContact CD1-CE1 4.39Å; L227-F324 HydrophobicContact CD1-CE2 4.39Å; L227-F324 HydrophobicContact CD1-CZ 4.05Å
228	L	96.8	Very high	94.7	Very high	67 Å²	67	33.8 Å²	33.8	35%	0.351	20%	0.197	S	C	.	.	H	α-helix	trans	-67.5	-37.1	176	-172.8	62	0	0	0	112.2	L138 P139 V142 A224 V225 K226 N232	L138-L228 HydrophobicContact CD2-CD2 3.92Å; P139-L228 HydrophobicContact CB-CB 4.3Å; P139-L228 HydrophobicContact CB-CD2 3.88Å; P139-L228 HydrophobicContact CB-CG 4Å; P139-L228 HydrophobicContact CG-CD2 4.19Å; P139-L228 HydrophobicContact CG-CG 3.95Å; V142-L228 HydrophobicContact CB-CD2 4.23Å; V142-L228 HydrophobicContact CG1-CD2 4.44Å; V142-L228 HydrophobicContact CG2-CD2 3.9Å; A224-L228 WeakPolarHBondContact O-CB 3.27Å; A224-L228 PolarHBondContact O-N 3.34Å; V225-L228 CarbonylContact O-C 3.6Å; V225-L228 WeakPolarHBondContact O-CB 3.45Å; V225-L228 PolarHBondContact O-N 2.92Å; V225-L228 VanDerWaalsContact O-N 3.15Å; K226-L228 VanDerWaalsContact C-N 3.27Å; K226-L228 PolarHBondContact O-N 3.42Å; L228-N232 VanDerWaalsContact O-CB 3.23Å; L228-N232 WeakPolarHBondContact O-CB 3.02Å; L228-N232 PolarHBondContact O-N 3.02Å
229	Y	96.9	Very high	95	Very high	9 Å²	9	36.5 Å²	36.5	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-45.5	170.4	-80.8	-61.8	0	0	0	112.3	D45 Y49 P139 C140 V225 K226 N232 A233	D45-Y229 HydrophobicContact CB-CE2 4.04Å; D45-Y229 WeakPolarHBondContact OD1-CD2 3.24Å; D45-Y229 WeakPolarHBondContact OD1-CE2 3.26Å; Y49-Y229 WeakPolarHBondContact CD1-OH 3.27Å; P139-Y229 HydrophobicContact CB-CD1 3.75Å; P139-Y229 HydrophobicContact CB-CD2 4.05Å; P139-Y229 HydrophobicContact CB-CE1 3.6Å; P139-Y229 HydrophobicContact CB-CE2 3.93Å; P139-Y229 HydrophobicContact CB-CG 3.96Å; P139-Y229 HydrophobicContact CG-CD1 3.61Å; P139-Y229 HydrophobicContact CG-CE1 3.7Å; P139-Y229 HydrophobicContact CG-CG 4.14Å; C140-Y229 PolarHBondContact N-OH 3.03Å; V225-Y229 HydrophobicContact CG1-CD2 3.95Å; V225-Y229 HydrophobicContact CG1-CE2 3.64Å; V225-Y229 WeakPolarHBondContact O-CD2 3.32Å; V225-Y229 PolarHBondContact O-N 2.94Å; K226-Y229 PolarHBondContact O-N 2.91Å; Y229-N232 PolarHBondContact O-N 2.81Å; Y229-A233 PolarHBondContact O-N 3.4Å
230	L	96.8	Very high	95	Very high	31 Å²	31	36.5 Å²	36.5	16%	0.162	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-46.7	177.2	177.7	60.1	0	0	0	111.5	K226 L227 N232 A233 V234 C321 F324	K226-L230 PolarHBondContact O-N 3.1Å; L227-L230 PolarHBondContact O-N 2.98Å; L230-N232 VanDerWaalsContact C-N 3.3Å; L230-N232 PolarHBondContact O-N 2.87Å; L230-A233 PolarHBondContact O-N 3.47Å; L230-V234 HydrophobicContact CD1-CG2 4.42Å; L230-V234 WeakPolarHBondContact O-CG2 3.4Å; L230-V234 PolarHBondContact O-N 3.25Å; L230-C321 HydrophobicContact CD1-CB 3.94Å; L230-F324 HydrophobicContact CD2-CD1 4.07Å; L230-F324 HydrophobicContact CD2-CG 4.43Å
231	G	97.2	Very high	95.1	Very high	44 Å²	44	35.3 Å²	35.3	45%	0.454	21%	0.205	S	C	.	.	H	α-helix	trans	-61	-39.1	176.2	0	0	0	0	0	112.1	L227 G235	L227-G231 PolarHBondContact O-N 3.46Å; G231-G235 PolarHBondContact O-N 3.38Å
232	N	97.6	Very high	95.1	Very high	22 Å²	22	38.1 Å²	38.1	12%	0.118	23%	0.231	C	C	.	.	H	α-helix	trans	-62.8	-53.3	171.7	179.9	59.4	0	0	0	110.9	F135 F136 L228 Y229 L230 V234 G235 Q236	F135-N232 WeakPolarHBondContact CB-OD1 3.43Å; F136-N232 WeakPolarHBondContact CA-ND2 3.28Å; F136-N232 WeakPolarHBondContact CD1-ND2 3.29Å; F136-N232 WeakPolarHBondContact CE1-ND2 3.31Å; F136-N232 WeakPolarHBondContact CG-ND2 3.21Å; L228-N232 VanDerWaalsContact O-CB 3.23Å; L228-N232 WeakPolarHBondContact O-CB 3.02Å; L228-N232 PolarHBondContact O-N 3.02Å; Y229-N232 PolarHBondContact O-N 2.81Å; L230-N232 VanDerWaalsContact C-N 3.3Å; L230-N232 PolarHBondContact O-N 2.87Å; N232-V234 VanDerWaalsContact C-N 3.25Å; N232-V234 PolarHBondContact O-N 3.06Å; N232-G235 CarbonylContact O-C 3.58Å; N232-G235 WeakPolarHBondContact O-CA 3.24Å; N232-G235 PolarHBondContact O-N 3.2Å; N232-Q236 VanDerWaalsContact O-CG 3.28Å; N232-Q236 WeakPolarHBondContact O-CG 3.31Å; N232-Q236 PolarHBondContact O-N 2.89Å; N232-Q236 PolarHBondContact OD1-NE2 2.98Å
233	A	96.4	Very high	95	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-55	-40.9	-178.8	0	0	0	0	0	112.7	Y229 L230 F237 V316 A317	Y229-A233 PolarHBondContact O-N 3.4Å; L230-A233 PolarHBondContact O-N 3.47Å; A233-F237 WeakPolarHBondContact O-CD2 3.43Å; A233-V316 HydrophobicContact CB-CG1 4.47Å; A233-A317 HydrophobicContact CB-CB 4.12Å
234	V	95.5	Very high	94.7	Very high	66 Å²	66	40.2 Å²	40.2	40%	0.4	24%	0.241	S	C	.	.	H	α-helix	trans	-69.3	-42.8	173.4	172.3	0	0	0	0	111.6	L230 N232 Q236 F237 F238	L230-V234 HydrophobicContact CD1-CG2 4.42Å; L230-V234 WeakPolarHBondContact O-CG2 3.4Å; L230-V234 PolarHBondContact O-N 3.25Å; N232-V234 VanDerWaalsContact C-N 3.25Å; N232-V234 PolarHBondContact O-N 3.06Å; V234-Q236 VanDerWaalsContact C-N 3.27Å; V234-Q236 PolarHBondContact O-N 2.72Å; V234-F237 WeakPolarHBondContact O-CB 3.33Å; V234-F237 PolarHBondContact O-N 3.42Å; V234-F237 VanDerWaalsContact O-N 3.16Å; V234-F238 HydrophobicContact CG1-CD2 4.18Å; V234-F238 HydrophobicContact CG1-CE2 3.65Å; V234-F238 VanDerWaalsContact O-CD2 3.28Å; V234-F238 WeakPolarHBondContact O-CD2 3.5Å
235	G	95.8	Very high	94.3	Very high	32 Å²	32	47.5 Å²	47.5	33%	0.33	26%	0.258	S	S	.	.	H	α-helix	trans	-57.8	-35.2	176.4	0	0	0	0	0	113.8	G231 N232 F237 F238 L239	G231-G235 PolarHBondContact O-N 3.38Å; N232-G235 CarbonylContact O-C 3.58Å; N232-G235 WeakPolarHBondContact O-CA 3.24Å; N232-G235 PolarHBondContact O-N 3.2Å; G235-F237 VanDerWaalsContact C-N 3.32Å; G235-F237 PolarHBondContact O-N 3.47Å; G235-F238 WeakPolarHBondContact O-CB 3.26Å; G235-F238 PolarHBondContact O-N 2.96Å; G235-F238 VanDerWaalsContact O-N 3.13Å; G235-L239 PolarHBondContact O-N 3.34Å
236	Q	95.8	Very high	93.6	Very high	3 Å²	3	48.9 Å²	48.9	1%	0.014	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-35	177.2	-61.8	-64.8	-24.9	0	0	112.3	E132 F135 F136 N232 V234 F238 L239 L240 F313	E132-Q236 VanDerWaalsContact CG-OE1 3.23Å; E132-Q236 PolarHBondContact OE1-OE1 2.9Å; F135-Q236 VanDerWaalsContact CB-NE2 3.28Å; F136-Q236 HydrophobicContact CD2-CG 4.32Å; F136-Q236 HydrophobicContact CE2-CB 4.43Å; F136-Q236 HydrophobicContact CE2-CG 3.5Å; F136-Q236 VanDerWaalsContact CE2-CG 3.5Å; F136-Q236 HydrophobicContact CZ-CB 4.46Å; F136-Q236 HydrophobicContact CZ-CG 3.67Å; N232-Q236 VanDerWaalsContact O-CG 3.28Å; N232-Q236 WeakPolarHBondContact O-CG 3.31Å; N232-Q236 PolarHBondContact O-N 2.89Å; N232-Q236 PolarHBondContact OD1-NE2 2.98Å; V234-Q236 VanDerWaalsContact C-N 3.27Å; V234-Q236 PolarHBondContact O-N 2.72Å; Q236-F238 VanDerWaalsContact C-N 3.32Å; Q236-F238 PolarHBondContact O-N 3.36Å; Q236-L239 PolarHBondContact O-N 3.47Å; Q236-L240 VanDerWaalsContact O-CB 3.28Å; Q236-L240 WeakPolarHBondContact O-CB 3.35Å; Q236-L240 PolarHBondContact O-N 3.32Å; Q236-F313 HydrophobicContact CB-CD2 3.99Å; Q236-F313 HydrophobicContact CB-CE2 3.91Å; Q236-F313 HydrophobicContact CB-CZ 4.44Å
237	F	93.7	Very high	92.9	Very high	36 Å²	36	57 Å²	57	16%	0.158	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-40.3	172.6	-80.2	-79.2	0	0	0	112.1	A233 V234 G235 N241 W310 F313 L314 A317	A233-F237 WeakPolarHBondContact O-CD2 3.43Å; V234-F237 WeakPolarHBondContact O-CB 3.33Å; V234-F237 PolarHBondContact O-N 3.42Å; V234-F237 VanDerWaalsContact O-N 3.16Å; G235-F237 VanDerWaalsContact C-N 3.32Å; G235-F237 PolarHBondContact O-N 3.47Å; F237-N241 VanDerWaalsContact O-CB 3.29Å; F237-N241 WeakPolarHBondContact O-CB 3.49Å; F237-N241 VanDerWaalsContact O-CG 3.22Å; F237-N241 PolarHBondContact O-N 3.34Å; F237-N241 PolarHBondContact O-ND2 2.91Å; F237-N241 VanDerWaalsContact O-ND2 3.15Å; F237-W310 HydrophobicContact CE1-CD2 4.38Å; F237-W310 HydrophobicContact CE1-CG 4.42Å; F237-W310 AromaticContact CE1-NE1 3.9Å; F237-F313 HydrophobicContact CE1-CB 4.45Å; F237-F313 HydrophobicContact CE2-CB 3.88Å; F237-F313 HydrophobicContact CZ-CB 3.84Å; F237-L314 HydrophobicContact CZ-CB 3.99Å; F237-L314 HydrophobicContact CZ-CD1 4.44Å; F237-A317 HydrophobicContact CE2-CB 4.18Å
238	F	93.4	Very high	92.3	Very high	147 Å²	147	58.4 Å²	58.4	65%	0.645	31%	0.306	S	S	*	.	H	α-helix	trans	-67.1	-41.1	175.6	-69.2	-73.6	0	0	0	111.7	V234 G235 Q236 N241 A242	V234-F238 HydrophobicContact CG1-CD2 4.18Å; V234-F238 HydrophobicContact CG1-CE2 3.65Å; V234-F238 VanDerWaalsContact O-CD2 3.28Å; V234-F238 WeakPolarHBondContact O-CD2 3.5Å; G235-F238 WeakPolarHBondContact O-CB 3.26Å; G235-F238 PolarHBondContact O-N 2.96Å; G235-F238 VanDerWaalsContact O-N 3.13Å; Q236-F238 VanDerWaalsContact C-N 3.32Å; Q236-F238 PolarHBondContact O-N 3.36Å; F238-N241 PolarHBondContact O-N 3.04Å; F238-A242 VanDerWaalsContact O-CB 3.28Å; F238-A242 WeakPolarHBondContact O-CB 3.32Å; F238-A242 PolarHBondContact O-N 2.99Å
239	L	94.4	Very high	91.7	Very high	56 Å²	56	59.9 Å²	59.9	29%	0.293	32%	0.318	S	S	.	.	H	α-helix	trans	-62.8	-45.7	177.7	-173.8	64.7	0	0	0	111.5	M128 E132 F135 G235 Q236 A242 F243	M128-L239 HydrophobicContact CE-CG 4.39Å; E132-L239 HydrophobicContact CG-CD2 3.73Å; F135-L239 HydrophobicContact CD2-CD2 4.28Å; F135-L239 HydrophobicContact CE2-CD2 4.26Å; G235-L239 PolarHBondContact O-N 3.34Å; Q236-L239 PolarHBondContact O-N 3.47Å; L239-A242 PolarHBondContact O-N 3Å; L239-F243 VanDerWaalsContact O-CB 3.3Å; L239-F243 WeakPolarHBondContact O-CB 3.26Å; L239-F243 PolarHBondContact O-N 2.9Å
240	L	92.8	Very high	91.4	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-66.8	-40.2	179.3	-176.3	59.7	0	0	0	112.3	M128 Q236 F243 L244 W251 F306 F313	M128-L240 HydrophobicContact CE-CB 4.47Å; M128-L240 HydrophobicContact CE-CD1 3.94Å; Q236-L240 VanDerWaalsContact O-CB 3.28Å; Q236-L240 WeakPolarHBondContact O-CB 3.35Å; Q236-L240 PolarHBondContact O-N 3.32Å; L240-F243 PolarHBondContact O-N 3.37Å; L240-L244 HydrophobicContact CD1-CD1 3.89Å; L240-L244 HydrophobicContact CD1-CG 4.29Å; L240-L244 HydrophobicContact CG-CD1 4.37Å; L240-L244 PolarHBondContact O-N 3.28Å; L240-L244 VanDerWaalsContact O-N 3.1Å; L240-W251 HydrophobicContact CD1-CZ2 4.24Å; L240-W251 HydrophobicContact CD2-CH2 4.01Å; L240-W251 HydrophobicContact CD2-CZ2 3.47Å; L240-W251 VanDerWaalsContact CD2-CZ2 3.47Å; L240-W251 HydrophobicContact CG-CH2 4.4Å; L240-W251 HydrophobicContact CG-CZ2 3.62Å; L240-F306 HydrophobicContact CD1-CD1 3.36Å; L240-F306 HydrophobicContact CD1-CE1 3.52Å; L240-F306 HydrophobicContact CD1-CG 4.36Å; L240-F313 HydrophobicContact CD2-CD2 4.48Å
241	N	92.4	Very high	91.1	Very high	31 Å²	31	63.4 Å²	63.4	17%	0.166	34%	0.337	C	S	.	.	H	α-helix	trans	-65.2	-39.7	173.3	-77.3	-27.4	0	0	0	112.4	F237 F238 F243 Y245 P246 T249 W251	F237-N241 VanDerWaalsContact O-CB 3.29Å; F237-N241 WeakPolarHBondContact O-CB 3.49Å; F237-N241 VanDerWaalsContact O-CG 3.22Å; F237-N241 PolarHBondContact O-N 3.34Å; F237-N241 PolarHBondContact O-ND2 2.91Å; F237-N241 VanDerWaalsContact O-ND2 3.15Å; F238-N241 PolarHBondContact O-N 3.04Å; N241-F243 VanDerWaalsContact C-N 3.34Å; N241-Y245 PolarHBondContact O-N 3.33Å; N241-P246 WeakPolarHBondContact O-CD 3.46Å; N241-T249 PolarHBondContact ND2-O 3.34Å; N241-T249 PolarHBondContact OD1-O 3.28Å; N241-T249 VanDerWaalsContact OD1-O 3.13Å; N241-W251 PolarHBondContact OD1-NE1 2.96Å
242	A	91.1	Very high	90.8	Very high	75 Å²	75	61.3 Å²	61.3	62%	0.62	32%	0.315	S	S	*	.	H	α-helix	trans	-67.5	-35.8	176	0	0	0	0	0	112	F238 L239	F238-A242 VanDerWaalsContact O-CB 3.28Å; F238-A242 WeakPolarHBondContact O-CB 3.32Å; F238-A242 PolarHBondContact O-N 2.99Å; L239-A242 PolarHBondContact O-N 3Å
243	F	91.9	Very high	90.6	Very high	45 Å²	45	63.1 Å²	63.1	20%	0.197	33%	0.327	C	S	.	.	H	α-helix	trans	-73.7	-44.8	-176.9	-178	-102.1	0	0	0	113.6	Y121 W124 V125 M128 L239 L240 N241 F306	Y121-F243 HydrophobicContact CD2-CE1 4.23Å; Y121-F243 HydrophobicContact CG-CE1 4.38Å; Y121-F243 WeakPolarHBondContact O-CZ 3.39Å; W124-F243 HydrophobicContact CB-CE2 3.8Å; W124-F243 HydrophobicContact CB-CZ 4.03Å; V125-F243 HydrophobicContact CG2-CE1 3.83Å; V125-F243 HydrophobicContact CG2-CZ 3.92Å; M128-F243 HydrophobicContact CB-CD2 4.21Å; M128-F243 HydrophobicContact CB-CE2 3.85Å; M128-F243 HydrophobicContact CB-CZ 4.08Å; M128-F243 HydrophobicContact CE-CB 3.96Å; M128-F243 HydrophobicContact CE-CD1 4.11Å; M128-F243 HydrophobicContact CE-CG 4.02Å; M128-F243 HydrophobicContact CG-CD1 4.3Å; M128-F243 HydrophobicContact CG-CD2 3.79Å; M128-F243 HydrophobicContact CG-CE1 4.45Å; M128-F243 HydrophobicContact CG-CE2 3.95Å; M128-F243 HydrophobicContact CG-CG 3.97Å; M128-F243 HydrophobicContact CG-CZ 4.27Å; M128-F243 HydrophobicContact SD-CD1 4.42Å; L239-F243 VanDerWaalsContact O-CB 3.3Å; L239-F243 WeakPolarHBondContact O-CB 3.26Å; L239-F243 PolarHBondContact O-N 2.9Å; L240-F243 PolarHBondContact O-N 3.37Å; N241-F243 VanDerWaalsContact C-N 3.34Å; F243-F306 HydrophobicContact CD1-CZ 4.17Å; F243-F306 HydrophobicContact CE1-CE2 4.44Å; F243-F306 AromaticContact CE1-CZ 3.83Å; F243-F306 HydrophobicContact CE1-CZ 3.83Å
244	L	88.5	Confident	90.3	Very high	22 Å²	22	64.8 Å²	64.8	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-82.3	-17	-178.4	-68.4	173.5	0	0	0	113.5	Y121 L240 W251 F271 F306	Y121-L244 HydrophobicContact CD2-CD2 4.17Å; Y121-L244 HydrophobicContact CE1-CD2 4.48Å; Y121-L244 HydrophobicContact CE2-CD2 4.2Å; Y121-L244 HydrophobicContact CG-CD2 4.37Å; L240-L244 HydrophobicContact CD1-CD1 3.89Å; L240-L244 HydrophobicContact CD1-CG 4.29Å; L240-L244 HydrophobicContact CG-CD1 4.37Å; L240-L244 PolarHBondContact O-N 3.28Å; L240-L244 VanDerWaalsContact O-N 3.1Å; L244-W251 HydrophobicContact CD1-CD2 4.41Å; L244-W251 HydrophobicContact CD1-CH2 3.75Å; L244-W251 HydrophobicContact CD1-CZ2 3.57Å; L244-W251 HydrophobicContact CD1-CZ3 4.24Å; L244-F271 HydrophobicContact CD1-CZ 3.84Å; L244-F271 HydrophobicContact CD2-CE1 3.85Å; L244-F271 HydrophobicContact CD2-CZ 3.81Å; L244-F271 HydrophobicContact CG-CZ 4.48Å; L244-F306 HydrophobicContact CD1-CB 4.42Å; L244-F306 HydrophobicContact CD1-CG 4.29Å; L244-F306 HydrophobicContact CD2-CD2 4.17Å; L244-F306 HydrophobicContact CD2-CE2 4.12Å; L244-F306 HydrophobicContact CD2-CZ 4.5Å
245	Y	85.4	Confident	90.1	Very high	206 Å²	206	62.1 Å²	62.1	81%	0.808	32%	0.322	S	S	*	.			trans	44.3	55	-173.5	-164	-102.7	0	0	0	113.7	N241	N241-Y245 PolarHBondContact O-N 3.33Å
246	P	81.9	Confident	89.8	Confident	32 Å²	32	63.3 Å²	63.3	21%	0.208	32%	0.321	C	S	.	.			trans	-75.1	155.1	-178.6	33	-33.5	0	0	0	111.4	N241 H248 W251	N241-P246 WeakPolarHBondContact O-CD 3.46Å; P246-H248 WeakPolarHBondContact CB-O 3.4Å; P246-H248 VanDerWaalsContact CG-O 3.32Å; P246-H248 WeakPolarHBondContact CG-O 3.23Å; P246-H248 PolarHBondContact O-N 3.21Å; P246-W251 HydrophobicContact CB-CB 3.87Å; P246-W251 HydrophobicContact CB-CG 3.95Å; P246-W251 HydrophobicContact CG-CB 4.33Å; P246-W251 HydrophobicContact CG-CG 3.97Å
247	K	79.9	Confident	89.7	Confident	176 Å²	176	68.4 Å²	68.4	77%	0.765	34%	0.344	S	S	*	.	S	Bend	trans	-58.6	-29	173.2	-66.2	-179.3	-179.5	173.9	0	113
248	H	83.1	Confident	89.6	Confident	124 Å²	124	68.1 Å²	68.1	57%	0.574	34%	0.344	S	S	*	.	S	Bend	trans	-133.1	142.9	-178.7	-56.9	-58.9	0	0	0	111.1	P246 L250 W251	P246-H248 WeakPolarHBondContact CB-O 3.4Å; P246-H248 VanDerWaalsContact CG-O 3.32Å; P246-H248 WeakPolarHBondContact CG-O 3.23Å; P246-H248 PolarHBondContact O-N 3.21Å; H248-L250 VanDerWaalsContact C-N 3.29Å; H248-L250 PolarHBondContact O-N 2.85Å; H248-W251 PolarHBondContact O-N 2.93Å
249	T	85.6	Confident	89.4	Confident	98 Å²	98	65.1 Å²	65.1	60%	0.601	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-22.4	-178.6	53.5	0	0	0	0	113.9	N241	N241-T249 PolarHBondContact ND2-O 3.34Å; N241-T249 PolarHBondContact OD1-O 3.28Å; N241-T249 VanDerWaalsContact OD1-O 3.13Å
250	L	89.5	Confident	89.3	Confident	111 Å²	111	68.5 Å²	68.5	58%	0.581	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	36.6	177.1	-61.9	176.2	0	0	0	111.7	H248 G252 V253 S254 W310	H248-L250 VanDerWaalsContact C-N 3.29Å; H248-L250 PolarHBondContact O-N 2.85Å; L250-G252 PolarHBondContact O-N 3.46Å; L250-G252 VanDerWaalsContact O-N 3.15Å; L250-V253 PolarHBondContact O-N 3.42Å; L250-V253 VanDerWaalsContact O-N 3.08Å; L250-S254 PolarHBondContact O-N 2.99Å; L250-W310 HydrophobicContact CD2-CZ2 4.07Å
251	W	91.4	Very high	89.4	Confident	3 Å²	3	74.6 Å²	74.6	1%	0.011	38%	0.38	C	S	.	.	H	α-helix	trans	-56.1	-29.7	-179.8	59.4	-88.3	0	0	0	113.1	L240 N241 L244 P246 H248 V253 S254 I255 F271 F306 W310	L240-W251 HydrophobicContact CD1-CZ2 4.24Å; L240-W251 HydrophobicContact CD2-CH2 4.01Å; L240-W251 HydrophobicContact CD2-CZ2 3.47Å; L240-W251 VanDerWaalsContact CD2-CZ2 3.47Å; L240-W251 HydrophobicContact CG-CH2 4.4Å; L240-W251 HydrophobicContact CG-CZ2 3.62Å; N241-W251 PolarHBondContact OD1-NE1 2.96Å; L244-W251 HydrophobicContact CD1-CD2 4.41Å; L244-W251 HydrophobicContact CD1-CH2 3.75Å; L244-W251 HydrophobicContact CD1-CZ2 3.57Å; L244-W251 HydrophobicContact CD1-CZ3 4.24Å; P246-W251 HydrophobicContact CB-CB 3.87Å; P246-W251 HydrophobicContact CB-CG 3.95Å; P246-W251 HydrophobicContact CG-CB 4.33Å; P246-W251 HydrophobicContact CG-CG 3.97Å; H248-W251 PolarHBondContact O-N 2.93Å; W251-V253 VanDerWaalsContact C-N 3.27Å; W251-V253 PolarHBondContact O-N 3.42Å; W251-S254 PolarHBondContact O-N 3.5Å; W251-I255 HydrophobicContact CE3-CD1 3.6Å; W251-I255 HydrophobicContact CE3-CG1 4.44Å; W251-I255 HydrophobicContact CZ3-CD1 4.16Å; W251-I255 WeakPolarHBondContact O-CB 2.93Å; W251-I255 VanDerWaalsContact O-CG1 3.29Å; W251-I255 WeakPolarHBondContact O-CG1 3.33Å; W251-I255 PolarHBondContact O-N 2.9Å; W251-F271 HydrophobicContact CZ3-CE2 4.47Å; W251-F306 HydrophobicContact CH2-CB 3.98Å; W251-F306 HydrophobicContact CZ3-CB 4.4Å; W251-W310 AromaticContact CE2-CD1 3.71Å; W251-W310 HydrophobicContact CH2-CB 3.86Å; W251-W310 AromaticContact CH2-CD1 3.94Å; W251-W310 HydrophobicContact CH2-CG 4.19Å; W251-W310 HydrophobicContact CZ2-CB 4.21Å; W251-W310 AromaticContact CZ2-CD1 3.46Å; W251-W310 VanDerWaalsContact CZ2-CD1 3.46Å; W251-W310 HydrophobicContact CZ2-CG 4.16Å; W251-W310 HydrophobicContact CZ3-CB 4.43Å
252	G	91.1	Very high	89.3	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-63.2	-31.9	177.6	0	0	0	0	0	113.7	L250 L256	L250-G252 PolarHBondContact O-N 3.46Å; L250-G252 VanDerWaalsContact O-N 3.15Å; G252-L256 WeakPolarHBondContact O-CB 3.43Å; G252-L256 PolarHBondContact O-N 2.89Å
253	V	92.1	Very high	89.3	Confident	61 Å²	61	75.2 Å²	75.2	37%	0.37	39%	0.386	S	S	.	.	H	α-helix	trans	-75.4	-44.7	173.1	-176.3	0	0	0	0	110.4	L250 W251 L256 Q257 W310 W311	L250-V253 PolarHBondContact O-N 3.42Å; L250-V253 VanDerWaalsContact O-N 3.08Å; W251-V253 VanDerWaalsContact C-N 3.27Å; W251-V253 PolarHBondContact O-N 3.42Å; V253-L256 PolarHBondContact O-N 3.15Å; V253-Q257 WeakPolarHBondContact O-CB 3.47Å; V253-Q257 PolarHBondContact O-N 2.98Å; V253-W310 HydrophobicContact CG2-CH2 3.35Å; V253-W310 HydrophobicContact CG2-CZ2 3.98Å; V253-W310 HydrophobicContact CG2-CZ3 3.93Å; V253-W311 HydrophobicContact CG2-CH2 4.49Å
254	S	90.9	Very high	89.1	Confident	35 Å²	35	78.6 Å²	78.6	25%	0.245	40%	0.402	C	S	.	.	H	α-helix	trans	-59	-50.3	178.9	-165.2	0	0	0	0	111.5	L250 W251 L256 Q257 D258	L250-S254 PolarHBondContact O-N 2.99Å; W251-S254 PolarHBondContact O-N 3.5Å; S254-L256 VanDerWaalsContact C-N 3.31Å; S254-L256 PolarHBondContact O-N 3.45Å; S254-Q257 WeakPolarHBondContact O-CB 3.37Å; S254-Q257 PolarHBondContact O-N 2.93Å; S254-Q257 VanDerWaalsContact O-N 3.11Å; S254-D258 WeakPolarHBondContact O-CB 3.47Å; S254-D258 PolarHBondContact O-N 2.94Å
255	I	90.5	Very high	89.1	Confident	11 Å²	11	78.7 Å²	78.7	6%	0.056	40%	0.401	C	S	.	.	H	α-helix	trans	-62.9	-39	179.9	-66.5	-178.3	0	0	0	111.1	W251 Q257 D258 L259 H270 F271 L307	W251-I255 HydrophobicContact CE3-CD1 3.6Å; W251-I255 HydrophobicContact CE3-CG1 4.44Å; W251-I255 HydrophobicContact CZ3-CD1 4.16Å; W251-I255 WeakPolarHBondContact O-CB 2.93Å; W251-I255 VanDerWaalsContact O-CG1 3.29Å; W251-I255 WeakPolarHBondContact O-CG1 3.33Å; W251-I255 PolarHBondContact O-N 2.9Å; I255-Q257 VanDerWaalsContact C-N 3.34Å; I255-D258 PolarHBondContact O-N 3.01Å; I255-L259 VanDerWaalsContact O-CB 3.29Å; I255-L259 WeakPolarHBondContact O-CB 3.22Å; I255-L259 PolarHBondContact O-N 2.72Å; I255-H270 HydrophobicContact CD1-CB 3.98Å; I255-H270 HydrophobicContact CG1-CB 4.17Å; I255-F271 HydrophobicContact CD1-CD2 3.88Å; I255-F271 HydrophobicContact CD1-CE2 3.64Å; I255-L307 HydrophobicContact CB-CD1 4.43Å; I255-L307 HydrophobicContact CG2-CD1 4.2Å
256	L	91.3	Very high	89.2	Confident	57 Å²	57	73.5 Å²	73.5	30%	0.298	38%	0.384	S	S	.	.	H	α-helix	trans	-64.8	-42.2	175.7	-176.5	64.4	0	0	0	111.1	G252 V253 S254 L259 I260 L307 W311	G252-L256 WeakPolarHBondContact O-CB 3.43Å; G252-L256 PolarHBondContact O-N 2.89Å; V253-L256 PolarHBondContact O-N 3.15Å; S254-L256 VanDerWaalsContact C-N 3.31Å; S254-L256 PolarHBondContact O-N 3.45Å; L256-L259 PolarHBondContact O-N 3.15Å; L256-I260 HydrophobicContact CD1-CD1 4.38Å; L256-I260 HydrophobicContact CG-CD1 3.99Å; L256-I260 WeakPolarHBondContact O-CD1 3.23Å; L256-I260 VanDerWaalsContact O-CG1 3.25Å; L256-I260 WeakPolarHBondContact O-CG1 3.47Å; L256-I260 PolarHBondContact O-N 3.41Å; L256-L307 HydrophobicContact CB-CD1 4.43Å; L256-W311 HydrophobicContact CB-CZ2 4.36Å; L256-W311 HydrophobicContact CD2-CH2 4.22Å; L256-W311 HydrophobicContact CD2-CZ2 3.36Å; L256-W311 HydrophobicContact CG-CZ2 4.48Å
257	Q	92.2	Very high	89.4	Confident	109 Å²	109	79.3 Å²	79.3	51%	0.509	41%	0.409	S	S	.	.	H	α-helix	trans	-63	-46.7	176.6	-176.8	175.6	-14.1	0	0	111.2	V253 S254 I255 L259 I260 H261	V253-Q257 WeakPolarHBondContact O-CB 3.47Å; V253-Q257 PolarHBondContact O-N 2.98Å; S254-Q257 WeakPolarHBondContact O-CB 3.37Å; S254-Q257 PolarHBondContact O-N 2.93Å; S254-Q257 VanDerWaalsContact O-N 3.11Å; I255-Q257 VanDerWaalsContact C-N 3.34Å; Q257-L259 VanDerWaalsContact C-N 3.3Å; Q257-L259 PolarHBondContact O-N 3.08Å; Q257-I260 PolarHBondContact O-N 3.09Å; Q257-H261 PolarHBondContact O-N 3.21Å; Q257-H261 PolarHBondContact O-ND1 3.28Å
258	D	91.3	Very high	89.7	Confident	30 Å²	30	72.2 Å²	72.2	16%	0.16	38%	0.381	C	S	.	.	H	α-helix	trans	-58.1	-44.5	177.1	-66.1	-20.9	0	0	0	110.6	S254 I255 I260 H261 G262 I263	S254-D258 WeakPolarHBondContact O-CB 3.47Å; S254-D258 PolarHBondContact O-N 2.94Å; I255-D258 PolarHBondContact O-N 3.01Å; D258-I260 PolarHBondContact O-N 3.3Å; D258-H261 CarbonylContact O-C 3.53Å; D258-H261 PolarHBondContact O-N 3.31Å; D258-G262 PolarHBondContact O-N 3.45Å; D258-I263 HydrophobicContact CB-CB 4.09Å; D258-I263 PolarHBondContact O-N 3.1Å
259	L	89.7	Confident	89.7	Confident	84 Å²	84	67.3 Å²	67.3	44%	0.44	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-37.2	177.8	-172.7	64.3	0	0	0	112.9	I255 L256 Q257 H261 G262 L307	I255-L259 VanDerWaalsContact O-CB 3.29Å; I255-L259 WeakPolarHBondContact O-CB 3.22Å; I255-L259 PolarHBondContact O-N 2.72Å; L256-L259 PolarHBondContact O-N 3.15Å; Q257-L259 VanDerWaalsContact C-N 3.3Å; Q257-L259 PolarHBondContact O-N 3.08Å; L259-H261 VanDerWaalsContact C-N 3.33Å; L259-G262 PolarHBondContact O-N 3.43Å; L259-L307 HydrophobicContact CD2-CD2 4.42Å
260	I	93.1	Very high	89.7	Confident	127 Å²	127	64.4 Å²	64.4	65%	0.651	34%	0.344	S	S	*	.	H	α-helix	trans	-67.1	-35.4	175.9	-71	165	0	0	0	111.2	L256 Q257 D258 G262	L256-I260 HydrophobicContact CD1-CD1 4.38Å; L256-I260 HydrophobicContact CG-CD1 3.99Å; L256-I260 WeakPolarHBondContact O-CD1 3.23Å; L256-I260 VanDerWaalsContact O-CG1 3.25Å; L256-I260 WeakPolarHBondContact O-CG1 3.47Å; L256-I260 PolarHBondContact O-N 3.41Å; Q257-I260 PolarHBondContact O-N 3.09Å; D258-I260 PolarHBondContact O-N 3.3Å; I260-G262 VanDerWaalsContact C-N 3.3Å
261	H	94.3	Very high	89.7	Confident	130 Å²	130	59.8 Å²	59.8	60%	0.602	32%	0.319	S	S	*	.	H	α-helix	trans	-83.6	-4.2	177.7	-66.8	88.9	0	0	0	113.4	Q257 D258 L259 I263	Q257-H261 PolarHBondContact O-N 3.21Å; Q257-H261 PolarHBondContact O-ND1 3.28Å; D258-H261 CarbonylContact O-C 3.53Å; D258-H261 PolarHBondContact O-N 3.31Å; L259-H261 VanDerWaalsContact C-N 3.33Å; H261-I263 HydrophobicContact CB-CD1 4.28Å; H261-I263 HydrophobicContact CB-CG1 4.21Å
262	G	91.1	Very high	89.8	Confident	58 Å²	58	59.7 Å²	59.7	60%	0.598	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	22.4	-177.7	0	0	0	0	0	114	D258 L259 I260	D258-G262 PolarHBondContact O-N 3.45Å; L259-G262 PolarHBondContact O-N 3.43Å; I260-G262 VanDerWaalsContact C-N 3.3Å
263	I	90.1	Very high	89.9	Confident	61 Å²	61	63.3 Å²	63.3	31%	0.313	33%	0.332	S	S	.	.			trans	-81.7	117.8	174.6	-58.8	173.7	0	0	0	108.3	D258 H261 Q267	D258-I263 HydrophobicContact CB-CB 4.09Å; D258-I263 PolarHBondContact O-N 3.1Å; H261-I263 HydrophobicContact CB-CD1 4.28Å; H261-I263 HydrophobicContact CB-CG1 4.21Å; I263-Q267 HydrophobicContact CG2-CB 3.92Å
264	E	89.1	Confident	90	Very high	116 Å²	116	61.9 Å²	61.9	54%	0.542	32%	0.324	S	S	.	.			trans	-87.6	168.5	-179.4	-60.1	-164.9	-178.7	0	0	112.9	E266 Q267 S268	E264-E266 PolarHBondContact O-N 2.97Å; E264-E266 VanDerWaalsContact O-N 3.09Å; E264-Q267 PolarHBondContact O-N 3Å; E264-S268 PolarHBondContact O-N 3.49Å; E264-S268 PolarHBondContact O-OG 3.01Å
265	W	88.1	Confident	90.1	Very high	24 Å²	24	60.2 Å²	60.2	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-56	-24.7	179.2	61.3	-86.6	0	0	0	113.5	W100 Q267 G269 H270 P272 R273 V274	W100-W265 AromaticContact NE1-CE3 3.8Å; W100-W265 AromaticContact NE1-CZ3 3.65Å; W265-Q267 PolarHBondContact O-N 3.4Å; W265-G269 WeakPolarHBondContact O-CA 3.14Å; W265-G269 PolarHBondContact O-N 3.14Å; W265-H270 WeakPolarHBondContact CB-O 3.24Å; W265-P272 HydrophobicContact CE3-CB 3.79Å; W265-P272 HydrophobicContact CZ3-CB 4.26Å; W265-R273 HydrophobicContact CD2-CB 4.33Å; W265-R273 HydrophobicContact CD2-CG 4.37Å; W265-R273 HydrophobicContact CG-CG 4.35Å; W265-R273 HydrophobicContact CZ2-CB 4.07Å; W265-V274 HydrophobicContact CH2-CB 3.59Å; W265-V274 HydrophobicContact CH2-CG2 3.57Å; W265-V274 HydrophobicContact CZ2-CB 4.5Å; W265-V274 HydrophobicContact CZ2-CG2 4.04Å; W265-V274 HydrophobicContact CZ3-CB 4.08Å; W265-V274 HydrophobicContact CZ3-CG2 4.5Å
266	E	87.7	Confident	90.3	Very high	96 Å²	96	61.2 Å²	61.2	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-60.9	-30.8	177.1	-64.3	-177.2	-172.6	0	0	112.6	W100 E264	W100-E266 WeakPolarHBondContact CZ2-O 3.33Å; E264-E266 PolarHBondContact O-N 2.97Å; E264-E266 VanDerWaalsContact O-N 3.09Å
267	Q	85.2	Confident	90.4	Very high	155 Å²	155	58.6 Å²	58.6	72%	0.724	30%	0.303	S	S	*	.	H	α-helix	trans	-99.4	-40.1	179.9	-62.9	-179.7	15.7	0	0	111.9	I263 E264 W265	I263-Q267 HydrophobicContact CG2-CB 3.92Å; E264-Q267 PolarHBondContact O-N 3Å; W265-Q267 PolarHBondContact O-N 3.4Å
268	S	85.5	Confident	90.4	Very high	27 Å²	27	55 Å²	55	19%	0.189	29%	0.287	C	S	.	.	H	α-helix	trans	-79	-26.4	-176.1	66.9	0	0	0	0	113.3	E264 H270	E264-S268 PolarHBondContact O-N 3.49Å; E264-S268 PolarHBondContact O-OG 3.01Å; S268-H270 PolarHBondContact O-N 2.91Å; S268-H270 PolarHBondContact OG-N 3.4Å
269	G	84.8	Confident	90.4	Very high	21 Å²	21	53.6 Å²	53.6	22%	0.216	28%	0.28	C	S	.	.			trans	69.4	3.8	-171.2	0	0	0	0	0	113.8	W265	W265-G269 WeakPolarHBondContact O-CA 3.14Å; W265-G269 PolarHBondContact O-N 3.14Å
270	H	85.1	Confident	90.5	Very high	37 Å²	37	53.6 Å²	53.6	17%	0.171	28%	0.278	C	S	.	.	S	Bend	trans	-81.1	128.6	175.9	-71.4	-56.5	0	0	0	110.4	I255 W265 S268	I255-H270 HydrophobicContact CD1-CB 3.98Å; I255-H270 HydrophobicContact CG1-CB 4.17Å; W265-H270 WeakPolarHBondContact CB-O 3.24Å; S268-H270 PolarHBondContact O-N 2.91Å; S268-H270 PolarHBondContact OG-N 3.4Å
271	F	90.1	Very high	90.4	Very high	13 Å²	13	48.6 Å²	48.6	6%	0.057	25%	0.253	C	S	.	.	S	Bend	trans	47	60.4	178.9	-62.2	-82.5	0	0	0	114	Y121 L244 W251 I255 N299 N302 E303 F306	Y121-F271 HydrophobicContact CE2-CD1 4.32Å; Y121-F271 HydrophobicContact CE2-CE1 4.13Å; Y121-F271 AromaticContact CZ-CD1 3.99Å; Y121-F271 WeakPolarHBondContact OH-CD1 3.22Å; L244-F271 HydrophobicContact CD1-CZ 3.84Å; L244-F271 HydrophobicContact CD2-CE1 3.85Å; L244-F271 HydrophobicContact CD2-CZ 3.81Å; L244-F271 HydrophobicContact CG-CZ 4.48Å; W251-F271 HydrophobicContact CZ3-CE2 4.47Å; I255-F271 HydrophobicContact CD1-CD2 3.88Å; I255-F271 HydrophobicContact CD1-CE2 3.64Å; F271-N299 WeakPolarHBondContact CA-ND2 3.22Å; F271-N299 WeakPolarHBondContact CD1-OD1 3.34Å; F271-N299 PolarHBondContact O-ND2 3.48Å; F271-N302 HydrophobicContact CD1-CB 4.26Å; F271-N302 HydrophobicContact CE1-CB 4.28Å; F271-E303 HydrophobicContact CB-CB 3.87Å; F271-E303 HydrophobicContact CB-CG 4.06Å; F271-E303 HydrophobicContact CD1-CB 4.37Å; F271-E303 HydrophobicContact CD2-CB 4.25Å; F271-E303 HydrophobicContact CD2-CG 4.09Å; F271-E303 HydrophobicContact CG-CB 3.92Å; F271-E303 HydrophobicContact CG-CG 4.18Å; F271-F306 AromaticContact CE1-CD2 3.76Å; F271-F306 HydrophobicContact CE1-CD2 3.76Å; F271-F306 HydrophobicContact CE1-CE2 4.5Å; F271-F306 HydrophobicContact CZ-CB 3.96Å; F271-F306 AromaticContact CZ-CD2 3.97Å; F271-F306 HydrophobicContact CZ-CD2 3.97Å; F271-F306 HydrophobicContact CZ-CG 4.31Å
272	P	92.3	Very high	90.2	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.013	26%	0.264	C	S	.	.			trans	-64.9	140.9	-176.4	27.6	-34.6	0	0	0	112.7	W100 I119 W265 T275 N299	W100-P272 HydrophobicContact CB-CB 4.13Å; W100-P272 HydrophobicContact CB-CG 3.77Å; W100-P272 HydrophobicContact CD2-CB 4.27Å; W100-P272 HydrophobicContact CG-CB 3.55Å; W100-P272 HydrophobicContact CG-CG 3.69Å; I119-P272 HydrophobicContact CD1-CG 3.32Å; W265-P272 HydrophobicContact CE3-CB 3.79Å; W265-P272 HydrophobicContact CZ3-CB 4.26Å; P272-T275 HydrophobicContact CG-CG2 4.29Å; P272-N299 PolarHBondContact O-ND2 2.83Å
273	R	92.9	Very high	90.1	Very high	76 Å²	76	53.3 Å²	53.3	29%	0.287	26%	0.255	S	S	.	.	S	Bend	trans	-98.1	-13.9	-179	-58.9	-180	-172	161	5.5	112.8	W265 V295 L296 E303	W265-R273 HydrophobicContact CD2-CB 4.33Å; W265-R273 HydrophobicContact CD2-CG 4.37Å; W265-R273 HydrophobicContact CG-CG 4.35Å; W265-R273 HydrophobicContact CZ2-CB 4.07Å; R273-V295 CarbonylContact O-C 3.6Å; R273-V295 WeakPolarHBondContact O-CA 3.36Å; R273-L296 PolarHBondContact O-N 2.94Å; R273-E303 IonicContact CZ-OE2 2.77Å; R273-E303 IonicContact NE-OE2 2.83Å; R273-E303 IonicContact NH2-OE2 2.74Å; R273-E303 PolarHBondContact NH2-OE2 3.24Å
274	V	93.9	Very high	90	Very high	30 Å²	30	59 Å²	59	18%	0.182	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131.3	173.5	179.4	0	0	0	0	107.5	W100 W265 Q293 C294	W100-V274 VanDerWaalsContact CD1-O 3.3Å; W265-V274 HydrophobicContact CH2-CB 3.59Å; W265-V274 HydrophobicContact CH2-CG2 3.57Å; W265-V274 HydrophobicContact CZ2-CB 4.5Å; W265-V274 HydrophobicContact CZ2-CG2 4.04Å; W265-V274 HydrophobicContact CZ3-CB 4.08Å; W265-V274 HydrophobicContact CZ3-CG2 4.5Å; V274-Q293 HydrophobicContact CG1-CG 3.51Å; V274-Q293 VanDerWaalsContact CG1-NE2 3.31Å; V274-C294 WeakPolarHBondContact CA-O 3.2Å
275	T	94	Very high	89.9	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158.1	-179	56.9	0	0	0	0	109.8	T98 Y99 P272 C294	T98-T275 WeakPolarHBondContact CB-OG1 3.24Å; T98-T275 PolarHBondContact OG1-OG1 3.21Å; Y99-T275 CarbonylContact O-C 3.55Å; Y99-T275 WeakPolarHBondContact O-CA 3.26Å; Y99-T275 WeakPolarHBondContact O-CB 3.33Å; P272-T275 HydrophobicContact CG-CG2 4.29Å; T275-C294 PolarHBondContact N-O 3.31Å; T275-C294 PolarHBondContact O-N 3.46Å
276	M	94	Very high	90	Very high	32 Å²	32	61 Å²	61	16%	0.158	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	145.1	174.7	-58.2	-56.6	-69.2	0	0	109.5	T98 Y99 I107 T291 I292 Q293	T98-M276 CarbonylContact C-O 3.6Å; T98-M276 WeakPolarHBondContact CA-O 3.48Å; Y99-M276 HydrophobicContact CD1-CB 4.26Å; Y99-M276 WeakPolarHBondContact CD1-O 3.43Å; Y99-M276 HydrophobicContact CD2-CB 4Å; Y99-M276 HydrophobicContact CE1-CB 3.77Å; Y99-M276 HydrophobicContact CE2-CB 3.49Å; Y99-M276 VanDerWaalsContact CE2-CB 3.49Å; Y99-M276 HydrophobicContact CE2-CG 4.08Å; Y99-M276 HydrophobicContact CG-CB 4.36Å; Y99-M276 PolarHBondContact N-O 2.79Å; Y99-M276 PolarHBondContact O-N 3.44Å; I107-M276 HydrophobicContact CD1-CE 3.98Å; M276-T291 HydrophobicContact CE-CG2 3.64Å; M276-I292 WeakPolarHBondContact CA-O 3.34Å; M276-Q293 HydrophobicContact CE-CB 4.35Å; M276-Q293 HydrophobicContact SD-CB 3.89Å; M276-Q293 HydrophobicContact SD-CG 4.1Å
277	C	94.3	Very high	90.1	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.007	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133	177.1	174.5	0	0	0	0	110.2	C93 T98 T291 I292	C93-C277 WeakPolarHBondContact CA-SG 3.33Å; C93-C277 HydrophobicContact CB-CB 3.67Å; C93-C277 WeakPolarHBondContact CB-SG 3.49Å; C93-C277 WeakPolarHBondContact SG-CB 3.47Å; C93-C277 CovalentContact SG-SG 2.02Å; C93-C277 PolarHBondContact SG-SG 3.35Å; T98-C277 HydrophobicContact CG2-CB 4.27Å; C277-T291 WeakPolarHBondContact O-CA 3.24Å; C277-I292 HydrophobicContact CB-CG1 4.09Å; C277-I292 PolarHBondContact N-O 3.06Å; C277-I292 PolarHBondContact O-N 2.74Å
278	D	92.7	Very high	90.3	Very high	33 Å²	33	57.2 Å²	57.2	18%	0.176	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.5	171.6	-70.6	-27.3	0	0	0	109.8	Y99 R114 R289 Y290 T291	Y99-D278 PolarHBondContact OH-OD1 3.04Å; R114-D278 WeakPolarHBondContact CD-OD2 3.48Å; R114-D278 IonicContact CZ-OD2 3.68Å; R114-D278 IonicContact NE-OD2 3.77Å; R114-D278 VanDerWaalsContact NH1-CG 3.34Å; R114-D278 IonicContact NH1-OD1 3.16Å; R114-D278 PolarHBondContact NH1-OD1 2.9Å; R114-D278 VanDerWaalsContact NH1-OD1 3.16Å; R114-D278 IonicContact NH1-OD2 2.8Å; R114-D278 PolarHBondContact NH1-OD2 3.38Å; D278-R289 IonicContact OD2-CZ 3.55Å; D278-R289 IonicContact OD2-NE 3.6Å; D278-R289 IonicContact OD2-NH2 2.7Å; D278-R289 PolarHBondContact OD2-NH2 2.86Å; D278-Y290 WeakPolarHBondContact CA-O 3.43Å; D278-T291 VanDerWaalsContact OD1-CB 3.27Å; D278-T291 WeakPolarHBondContact OD1-CB 3.29Å; D278-T291 VanDerWaalsContact OD1-CG2 3.31Å; D278-T291 WeakPolarHBondContact OD1-CG2 3.3Å; D278-T291 PolarHBondContact OD1-OG1 3.28Å
279	F	91.4	Very high	90.5	Very high	1 Å²	1	60.4 Å²	60.4	0%	0.004	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.3	170.9	70.2	-84.3	0	0	0	111.3	F81 Y88 A89 Y92 V281 Y290 I292	F81-F279 HydrophobicContact CE2-CE2 4.26Å; F81-F279 AromaticContact CE2-CZ 3.66Å; F81-F279 HydrophobicContact CE2-CZ 3.66Å; F81-F279 HydrophobicContact CZ-CE2 4.28Å; F81-F279 AromaticContact CZ-CZ 3.85Å; F81-F279 HydrophobicContact CZ-CZ 3.85Å; Y88-F279 HydrophobicContact CE1-CD2 4.48Å; A89-F279 HydrophobicContact CB-CE1 4.19Å; A89-F279 HydrophobicContact CB-CZ 4.2Å; Y92-F279 HydrophobicContact CD1-CB 3.3Å; Y92-F279 HydrophobicContact CD1-CG 4.35Å; Y92-F279 HydrophobicContact CE1-CB 3.23Å; Y92-F279 HydrophobicContact CG-CB 4.09Å; F279-V281 HydrophobicContact CD2-CG2 3.9Å; F279-V281 HydrophobicContact CE2-CG2 3.71Å; F279-Y290 HydrophobicContact CD2-CD2 4.37Å; F279-Y290 VanDerWaalsContact CE1-CB 3.47Å; F279-Y290 HydrophobicContact CE1-CG 4.34Å; F279-Y290 AromaticContact CE2-CD2 3.66Å; F279-Y290 HydrophobicContact CE2-CD2 3.66Å; F279-Y290 HydrophobicContact CE2-CG 4.07Å; F279-Y290 AromaticContact CZ-CD2 3.85Å; F279-Y290 HydrophobicContact CZ-CD2 3.85Å; F279-Y290 AromaticContact CZ-CG 3.75Å; F279-Y290 HydrophobicContact CZ-CG 3.75Å; F279-Y290 PolarHBondContact N-O 3.36Å; F279-Y290 PolarHBondContact O-N 2.97Å; F279-I292 HydrophobicContact CD1-CD1 4.23Å; F279-I292 HydrophobicContact CD1-CG1 4.35Å; F279-I292 HydrophobicContact CE1-CD1 3.74Å; F279-I292 HydrophobicContact CE1-CG1 4.01Å; F279-I292 HydrophobicContact CE1-CG2 3.97Å
280	E	90.7	Very high	90.8	Very high	85 Å²	85	62.7 Å²	62.7	40%	0.397	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.6	-174.8	-59.9	179.6	161.5	0	0	110.3	L287 H288 R289	E280-L287 HydrophobicContact CB-CD1 3.79Å; E280-L287 HydrophobicContact CB-CG 4.2Å; E280-H288 CarbonylContact C-O 3.49Å; E280-H288 WeakPolarHBondContact CA-O 3.48Å; E280-R289 HydrophobicContact CG-CB 4.34Å; E280-R289 HydrophobicContact CG-CG 4.28Å
281	V	90.4	Very high	91.2	Very high	22 Å²	22	63.6 Å²	63.6	13%	0.133	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	121.9	175.8	-177.5	0	0	0	0	108.4	W85 F279 H288 Y290	W85-V281 HydrophobicContact CH2-CG1 3.92Å; W85-V281 HydrophobicContact CZ3-CG1 3.89Å; W85-V281 HydrophobicContact CZ3-CG2 4Å; F279-V281 HydrophobicContact CD2-CG2 3.9Å; F279-V281 HydrophobicContact CE2-CG2 3.71Å; V281-H288 PolarHBondContact N-O 3.43Å; V281-H288 PolarHBondContact O-N 3.42Å; V281-Y290 HydrophobicContact CB-CE2 4.27Å; V281-Y290 HydrophobicContact CG2-CD2 4.11Å; V281-Y290 HydrophobicContact CG2-CE2 4Å
282	R	90.6	Very high	91.4	Very high	219 Å²	219	63.3 Å²	63.3	83%	0.826	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	117.6	176.3	-71.8	-179.3	179.5	179.5	0.3	110	L287	R282-L287 HydrophobicContact CG-CD1 3.57Å
283	T	88.1	Confident	91.5	Very high	68 Å²	68	67.6 Å²	67.6	42%	0.417	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	162.4	163.9	59.1	0	0	0	0	108.4	G285 N286 H288	T283-G285 PolarHBondContact O-N 3.45Å; T283-N286 PolarHBondContact N-O 2.84Å; T283-N286 PolarHBondContact O-N 2.93Å; T283-N286 PolarHBondContact OG1-O 3.48Å; T283-H288 PolarHBondContact OG1-CD2 3.45Å; T283-H288 VanDerWaalsContact OG1-CD2 3.27Å; T283-H288 PolarHBondContact OG1-NE2 3.38Å
284	I	88.9	Confident	91.6	Very high	181 Å²	181	64 Å²	64	93%	0.928	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	116	-179.7	-61.8	174.6	0	0	0	108.6	N286	I284-N286 PolarHBondContact O-N 3.34Å
285	G	86.8	Confident	91.6	Very high	76 Å²	76	65.7 Å²	65.7	78%	0.784	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	-12	177.3	0	0	0	0	0	116.1	T283	T283-G285 PolarHBondContact O-N 3.45Å
286	N	89.7	Confident	91.6	Very high	106 Å²	106	65.7 Å²	65.7	57%	0.567	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.1	143.8	-177.8	-72	-44.6	0	0	0	112.7	T283 I284	T283-N286 PolarHBondContact N-O 2.84Å; T283-N286 PolarHBondContact O-N 2.93Å; T283-N286 PolarHBondContact OG1-O 3.48Å; I284-N286 PolarHBondContact O-N 3.34Å
287	L	90	Very high	91.4	Very high	91 Å²	91	66.6 Å²	66.6	48%	0.476	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	110.9	171.3	-174.5	70.9	0	0	0	107.9	E280 R282	E280-L287 HydrophobicContact CB-CD1 3.79Å; E280-L287 HydrophobicContact CB-CG 4.2Å; R282-L287 HydrophobicContact CG-CD1 3.57Å
288	H	89.8	Confident	91.2	Very high	79 Å²	79	66.6 Å²	66.6	37%	0.366	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.5	177.5	-65.2	-76.1	0	0	0	109.6	E280 V281 T283 Y290	E280-H288 CarbonylContact C-O 3.49Å; E280-H288 WeakPolarHBondContact CA-O 3.48Å; V281-H288 PolarHBondContact N-O 3.43Å; V281-H288 PolarHBondContact O-N 3.42Å; T283-H288 PolarHBondContact OG1-CD2 3.45Å; T283-H288 VanDerWaalsContact OG1-CD2 3.27Å; T283-H288 PolarHBondContact OG1-NE2 3.38Å; H288-Y290 HydrophobicContact CB-CE2 3.82Å
289	R	89.7	Confident	91.1	Very high	94 Å²	94	65 Å²	65	36%	0.355	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	129.5	173.4	-174.2	173.3	177.3	177.7	2.4	109.9	D278 E280	D278-R289 IonicContact OD2-CZ 3.55Å; D278-R289 IonicContact OD2-NE 3.6Å; D278-R289 IonicContact OD2-NH2 2.7Å; D278-R289 PolarHBondContact OD2-NH2 2.86Å; E280-R289 HydrophobicContact CG-CB 4.34Å; E280-R289 HydrophobicContact CG-CG 4.28Å
290	Y	92.1	Very high	91.1	Very high	70 Å²	70	69 Å²	69	28%	0.275	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	136	174.7	-66.6	-83.1	0	0	0	109.1	F81 D278 F279 V281 H288	F81-Y290 HydrophobicContact CE1-CE1 4.35Å; F81-Y290 HydrophobicContact CZ-CD1 4.36Å; F81-Y290 HydrophobicContact CZ-CD2 4.5Å; F81-Y290 HydrophobicContact CZ-CE1 4.32Å; F81-Y290 HydrophobicContact CZ-CE2 4.45Å; F81-Y290 HydrophobicContact CZ-CG 4.45Å; D278-Y290 WeakPolarHBondContact CA-O 3.43Å; F279-Y290 HydrophobicContact CD2-CD2 4.37Å; F279-Y290 VanDerWaalsContact CE1-CB 3.47Å; F279-Y290 HydrophobicContact CE1-CG 4.34Å; F279-Y290 AromaticContact CE2-CD2 3.66Å; F279-Y290 HydrophobicContact CE2-CD2 3.66Å; F279-Y290 HydrophobicContact CE2-CG 4.07Å; F279-Y290 AromaticContact CZ-CD2 3.85Å; F279-Y290 HydrophobicContact CZ-CD2 3.85Å; F279-Y290 AromaticContact CZ-CG 3.75Å; F279-Y290 HydrophobicContact CZ-CG 3.75Å; F279-Y290 PolarHBondContact N-O 3.36Å; F279-Y290 PolarHBondContact O-N 2.97Å; V281-Y290 HydrophobicContact CB-CE2 4.27Å; V281-Y290 HydrophobicContact CG2-CD2 4.11Å; V281-Y290 HydrophobicContact CG2-CE2 4Å; H288-Y290 HydrophobicContact CB-CE2 3.82Å
291	T	92.8	Very high	91.1	Very high	56 Å²	56	69.2 Å²	69.2	34%	0.344	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	117	170.6	-59.7	0	0	0	0	107.6	Y99 I107 R114 M276 C277 D278	Y99-T291 WeakPolarHBondContact OH-CG2 3.34Å; I107-T291 HydrophobicContact CD1-CG2 4Å; R114-T291 PolarHBondContact NH1-OG1 3.11Å; M276-T291 HydrophobicContact CE-CG2 3.64Å; C277-T291 WeakPolarHBondContact O-CA 3.24Å; D278-T291 VanDerWaalsContact OD1-CB 3.27Å; D278-T291 WeakPolarHBondContact OD1-CB 3.29Å; D278-T291 VanDerWaalsContact OD1-CG2 3.31Å; D278-T291 WeakPolarHBondContact OD1-CG2 3.3Å; D278-T291 PolarHBondContact OD1-OG1 3.28Å
292	I	94.1	Very high	91.2	Very high	7 Å²	7	68.1 Å²	68.1	4%	0.036	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	152.9	-178.3	61.9	172.9	0	0	0	110.9	C75 V77 A89 M276 C277 F279	C75-I292 HydrophobicContact CB-CD1 3.69Å; V77-I292 HydrophobicContact CG1-CD1 4.13Å; A89-I292 HydrophobicContact CB-CD1 3.96Å; M276-I292 WeakPolarHBondContact CA-O 3.34Å; C277-I292 HydrophobicContact CB-CG1 4.09Å; C277-I292 PolarHBondContact N-O 3.06Å; C277-I292 PolarHBondContact O-N 2.74Å; F279-I292 HydrophobicContact CD1-CD1 4.23Å; F279-I292 HydrophobicContact CD1-CG1 4.35Å; F279-I292 HydrophobicContact CE1-CD1 3.74Å; F279-I292 HydrophobicContact CE1-CG1 4.01Å; F279-I292 HydrophobicContact CE1-CG2 3.97Å
293	Q	94.9	Very high	91.3	Very high	92 Å²	92	58.5 Å²	58.5	43%	0.43	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	130.8	176.8	-178.6	177.5	-30	0	0	109.7	W76 V274 M276	W76-Q293 HydrophobicContact CB-CB 4.5Å; W76-Q293 WeakPolarHBondContact CB-O 3.38Å; W76-Q293 PolarHBondContact N-O 2.88Å; V274-Q293 HydrophobicContact CG1-CG 3.51Å; V274-Q293 VanDerWaalsContact CG1-NE2 3.31Å; M276-Q293 HydrophobicContact CE-CB 4.35Å; M276-Q293 HydrophobicContact SD-CB 3.89Å; M276-Q293 HydrophobicContact SD-CG 4.1Å
294	C	95.3	Very high	91.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135.9	-177.4	-59.7	0	0	0	0	111.9	I73 Q74 C75 V274 T275	I73-C294 HydrophobicContact CD1-CB 3.59Å; I73-C294 HydrophobicContact CG1-CB 3.68Å; Q74-C294 CarbonylContact O-C 3.51Å; Q74-C294 VanDerWaalsContact O-CA 3.31Å; Q74-C294 WeakPolarHBondContact O-CA 3.33Å; C75-C294 HydrophobicContact CB-CB 4.09Å; C75-C294 WeakPolarHBondContact CB-SG 3.3Å; C75-C294 WeakPolarHBondContact SG-CB 3.5Å; C75-C294 CovalentContact SG-SG 2.05Å; C75-C294 PolarHBondContact SG-SG 2.98Å; V274-C294 WeakPolarHBondContact CA-O 3.2Å; T275-C294 PolarHBondContact N-O 3.31Å; T275-C294 PolarHBondContact O-N 3.46Å
295	V	94.1	Very high	91.8	Very high	66 Å²	66	51.7 Å²	51.7	40%	0.4	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	119.7	173.3	-177.8	0	0	0	0	109	I73 Q74 R273 M297	I73-V295 WeakPolarHBondContact CA-O 3.32Å; Q74-V295 PolarHBondContact N-O 3.31Å; Q74-V295 PolarHBondContact O-N 3.38Å; R273-V295 CarbonylContact O-C 3.6Å; R273-V295 WeakPolarHBondContact O-CA 3.36Å; V295-M297 HydrophobicContact CG1-CG 4.41Å; V295-M297 PolarHBondContact O-N 3.28Å
296	L	92.2	Very high	92.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.233	C	C	.	.			trans	-101.2	79	-176	-167.9	66.7	0	0	0	110.4	I73 Y122 R273 I298 N299	I73-L296 HydrophobicContact CB-CD1 4.33Å; I73-L296 HydrophobicContact CD1-CD1 4.35Å; I73-L296 HydrophobicContact CG1-CD1 4.31Å; Y122-L296 HydrophobicContact CD1-CD2 3.63Å; Y122-L296 HydrophobicContact CD2-CD1 4.43Å; Y122-L296 HydrophobicContact CE1-CD1 4.45Å; Y122-L296 HydrophobicContact CE1-CD2 3.67Å; Y122-L296 HydrophobicContact CE2-CD1 4.28Å; Y122-L296 HydrophobicContact CG-CD2 4.2Å; R273-L296 PolarHBondContact O-N 2.94Å; L296-I298 HydrophobicContact CD1-CG2 3.63Å; L296-I298 HydrophobicContact CD2-CG2 4.46Å; L296-I298 HydrophobicContact CG-CG2 3.74Å; L296-I298 PolarHBondContact O-N 2.89Å; L296-N299 HydrophobicContact CD2-CB 3.94Å; L296-N299 HydrophobicContact CG-CB 4.11Å; L296-N299 PolarHBondContact O-N 2.96Å; L296-N299 VanDerWaalsContact O-N 3.09Å
297	M	90.6	Very high	92.3	Very high	52 Å²	52	44 Å²	44	26%	0.256	21%	0.211	S	C	.	.	H	α-helix	trans	-59	-32.2	-177.6	-71	-178	-87.8	0	0	113.3	Q71 P72 Q74 V295 N299 M300	Q71-M297 HydrophobicContact CB-CE 4.26Å; Q71-M297 WeakPolarHBondContact O-CE 3.33Å; P72-M297 PolarHBondContact O-N 2.7Å; Q74-M297 HydrophobicContact CB-CE 4.49Å; Q74-M297 HydrophobicContact CG-CE 3.72Å; V295-M297 HydrophobicContact CG1-CG 4.41Å; V295-M297 PolarHBondContact O-N 3.28Å; M297-N299 PolarHBondContact O-N 3.39Å; M297-M300 PolarHBondContact O-N 2.93Å
298	I	89.9	Confident	92.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-28.5	179.2	-168.6	165.9	0	0	0	112.2	I63 Q67 L296 M300 F301 N302	I63-I298 HydrophobicContact CG2-CD1 4.18Å; I63-I298 HydrophobicContact CG2-CG1 4.46Å; Q67-I298 HydrophobicContact CB-CD1 3.86Å; Q67-I298 HydrophobicContact CG-CD1 4.14Å; L296-I298 HydrophobicContact CD1-CG2 3.63Å; L296-I298 HydrophobicContact CD2-CG2 4.46Å; L296-I298 HydrophobicContact CG-CG2 3.74Å; L296-I298 PolarHBondContact O-N 2.89Å; I298-M300 VanDerWaalsContact C-N 3.29Å; I298-M300 PolarHBondContact O-N 2.94Å; I298-F301 WeakPolarHBondContact O-CB 3.35Å; I298-F301 PolarHBondContact O-N 3.29Å; I298-F301 VanDerWaalsContact O-N 3.09Å; I298-N302 PolarHBondContact O-N 3.02Å; I298-N302 VanDerWaalsContact O-N 3.09Å
299	N	91.9	Very high	92.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-72.2	-26.4	-175	-140.4	20.2	0	0	0	113.3	Y121 F271 P272 L296 M297 F301 N302 E303	Y121-N299 PolarHBondContact OH-ND2 3.29Å; Y121-N299 PolarHBondContact OH-OD1 3.28Å; F271-N299 WeakPolarHBondContact CA-ND2 3.22Å; F271-N299 WeakPolarHBondContact CD1-OD1 3.34Å; F271-N299 PolarHBondContact O-ND2 3.48Å; P272-N299 PolarHBondContact O-ND2 2.83Å; L296-N299 HydrophobicContact CD2-CB 3.94Å; L296-N299 HydrophobicContact CG-CB 4.11Å; L296-N299 PolarHBondContact O-N 2.96Å; L296-N299 VanDerWaalsContact O-N 3.09Å; M297-N299 PolarHBondContact O-N 3.39Å; N299-F301 PolarHBondContact O-N 2.93Å; N299-N302 PolarHBondContact O-N 2.96Å; N299-E303 WeakPolarHBondContact O-CB 3.24Å; N299-E303 PolarHBondContact O-N 3.44Å
300	M	90.4	Very high	93.1	Very high	84 Å²	84	36.5 Å²	36.5	41%	0.414	18%	0.176	S	C	.	.	H	α-helix	trans	-60	-37.9	170.8	-175	-178.9	70.9	0	0	111.4	M297 I298 K304	M297-M300 PolarHBondContact O-N 2.93Å; I298-M300 VanDerWaalsContact C-N 3.29Å; I298-M300 PolarHBondContact O-N 2.94Å; M300-K304 WeakPolarHBondContact O-CG 3.33Å
301	F	91.1	Very high	93.3	Very high	90 Å²	90	37.6 Å²	37.6	40%	0.395	18%	0.179	S	C	.	.	H	α-helix	trans	-74.6	-41.8	176.5	-67.9	-86.4	0	0	0	111.5	K66 I298 N299 E303 K304 A305	K66-F301 HydrophobicContact CD-CE2 4.27Å; K66-F301 HydrophobicContact CG-CD2 4.29Å; K66-F301 HydrophobicContact CG-CE2 4.31Å; I298-F301 WeakPolarHBondContact O-CB 3.35Å; I298-F301 PolarHBondContact O-N 3.29Å; I298-F301 VanDerWaalsContact O-N 3.09Å; N299-F301 PolarHBondContact O-N 2.93Å; F301-E303 PolarHBondContact O-N 3.44Å; F301-K304 PolarHBondContact O-N 3.04Å; F301-A305 WeakPolarHBondContact O-CB 3.41Å; F301-A305 PolarHBondContact O-N 3.4Å
302	N	92.8	Very high	93.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.2	-44.5	177.6	-69.3	-18.6	0	0	0	111.7	F271 I298 N299 K304 A305 F306	F271-N302 HydrophobicContact CD1-CB 4.26Å; F271-N302 HydrophobicContact CE1-CB 4.28Å; I298-N302 PolarHBondContact O-N 3.02Å; I298-N302 VanDerWaalsContact O-N 3.09Å; N299-N302 PolarHBondContact O-N 2.96Å; N302-K304 VanDerWaalsContact C-N 3.31Å; N302-K304 PolarHBondContact O-N 2.95Å; N302-A305 PolarHBondContact O-N 3.16Å; N302-F306 HydrophobicContact CB-CD2 4.08Å; N302-F306 HydrophobicContact CB-CE2 4.18Å; N302-F306 WeakPolarHBondContact O-CB 3.43Å; N302-F306 VanDerWaalsContact O-CD2 3.23Å; N302-F306 WeakPolarHBondContact O-CD2 3.5Å; N302-F306 PolarHBondContact O-N 3.22Å
303	E	91.9	Very high	93.6	Very high	17 Å²	17	37.4 Å²	37.4	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-52.3	-50	176	-172.2	-156	134.3	0	0	111	F271 R273 N299 F301 L307	F271-E303 HydrophobicContact CB-CB 3.87Å; F271-E303 HydrophobicContact CB-CG 4.06Å; F271-E303 HydrophobicContact CD1-CB 4.37Å; F271-E303 HydrophobicContact CD2-CB 4.25Å; F271-E303 HydrophobicContact CD2-CG 4.09Å; F271-E303 HydrophobicContact CG-CB 3.92Å; F271-E303 HydrophobicContact CG-CG 4.18Å; R273-E303 IonicContact CZ-OE2 2.77Å; R273-E303 IonicContact NE-OE2 2.83Å; R273-E303 IonicContact NH2-OE2 2.74Å; R273-E303 PolarHBondContact NH2-OE2 3.24Å; N299-E303 WeakPolarHBondContact O-CB 3.24Å; N299-E303 PolarHBondContact O-N 3.44Å; F301-E303 PolarHBondContact O-N 3.44Å; E303-L307 WeakPolarHBondContact O-CB 3.28Å; E303-L307 PolarHBondContact O-N 2.99Å
304	K	92.4	Very high	93.6	Very high	96 Å²	96	35.7 Å²	35.7	42%	0.417	17%	0.165	S	C	.	.	H	α-helix	trans	-71.1	-40	-178.8	-57.3	-46.6	179.1	-164.6	0	112.5	M300 F301 N302 F308	M300-K304 WeakPolarHBondContact O-CG 3.33Å; F301-K304 PolarHBondContact O-N 3.04Å; N302-K304 VanDerWaalsContact C-N 3.31Å; N302-K304 PolarHBondContact O-N 2.95Å; K304-F308 WeakPolarHBondContact O-CB 2.89Å; K304-F308 PolarHBondContact O-N 3.3Å; K304-F308 VanDerWaalsContact O-N 3.09Å
305	A	94.2	Very high	93.7	Very high	9 Å²	9	39.7 Å²	39.7	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-63.8	-50.8	178.2	0	0	0	0	0	111.5	L59 I63 F301 N302 F308 L309	L59-A305 HydrophobicContact CD2-CB 4.21Å; I63-A305 HydrophobicContact CD1-CB 4.1Å; F301-A305 WeakPolarHBondContact O-CB 3.41Å; F301-A305 PolarHBondContact O-N 3.4Å; N302-A305 PolarHBondContact O-N 3.16Å; A305-F308 PolarHBondContact O-N 3.15Å; A305-L309 WeakPolarHBondContact O-CB 3.38Å; A305-L309 VanDerWaalsContact O-CG 3.3Å; A305-L309 WeakPolarHBondContact O-CG 3.45Å; A305-L309 PolarHBondContact O-N 2.94Å
306	F	94.4	Very high	93.8	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-70.3	-36.6	-177.9	-75.5	-59.6	0	0	0	112.9	V125 M128 L129 L240 F243 L244 W251 F271 N302 F308 L309 W310	V125-F306 HydrophobicContact CB-CZ 4.42Å; V125-F306 HydrophobicContact CG1-CE2 3.94Å; V125-F306 HydrophobicContact CG1-CZ 3.78Å; V125-F306 HydrophobicContact CG2-CE2 3.79Å; V125-F306 HydrophobicContact CG2-CZ 3.92Å; M128-F306 HydrophobicContact CE-CE1 4.45Å; M128-F306 HydrophobicContact SD-CE1 4.32Å; L129-F306 HydrophobicContact CD2-CE1 4.37Å; L240-F306 HydrophobicContact CD1-CD1 3.36Å; L240-F306 HydrophobicContact CD1-CE1 3.52Å; L240-F306 HydrophobicContact CD1-CG 4.36Å; F243-F306 HydrophobicContact CD1-CZ 4.17Å; F243-F306 HydrophobicContact CE1-CE2 4.44Å; F243-F306 AromaticContact CE1-CZ 3.83Å; F243-F306 HydrophobicContact CE1-CZ 3.83Å; L244-F306 HydrophobicContact CD1-CB 4.42Å; L244-F306 HydrophobicContact CD1-CG 4.29Å; L244-F306 HydrophobicContact CD2-CD2 4.17Å; L244-F306 HydrophobicContact CD2-CE2 4.12Å; L244-F306 HydrophobicContact CD2-CZ 4.5Å; W251-F306 HydrophobicContact CH2-CB 3.98Å; W251-F306 HydrophobicContact CZ3-CB 4.4Å; F271-F306 AromaticContact CE1-CD2 3.76Å; F271-F306 HydrophobicContact CE1-CD2 3.76Å; F271-F306 HydrophobicContact CE1-CE2 4.5Å; F271-F306 HydrophobicContact CZ-CB 3.96Å; F271-F306 AromaticContact CZ-CD2 3.97Å; F271-F306 HydrophobicContact CZ-CD2 3.97Å; F271-F306 HydrophobicContact CZ-CG 4.31Å; N302-F306 HydrophobicContact CB-CD2 4.08Å; N302-F306 HydrophobicContact CB-CE2 4.18Å; N302-F306 WeakPolarHBondContact O-CB 3.43Å; N302-F306 VanDerWaalsContact O-CD2 3.23Å; N302-F306 WeakPolarHBondContact O-CD2 3.5Å; N302-F306 PolarHBondContact O-N 3.22Å; F306-F308 VanDerWaalsContact C-N 3.34Å; F306-F308 PolarHBondContact O-N 3.27Å; F306-L309 HydrophobicContact CD1-CD1 4.31Å; F306-L309 PolarHBondContact O-N 2.98Å; F306-W310 WeakPolarHBondContact O-CB 3.17Å; F306-W310 PolarHBondContact O-N 2.88Å
307	L	93.5	Very high	94.1	Very high	20 Å²	20	37.3 Å²	37.3	11%	0.105	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-46.4	172.6	-176.2	63.1	0	0	0	110.8	I255 L256 L259 E303 W310 W311	I255-L307 HydrophobicContact CB-CD1 4.43Å; I255-L307 HydrophobicContact CG2-CD1 4.2Å; L256-L307 HydrophobicContact CB-CD1 4.43Å; L259-L307 HydrophobicContact CD2-CD2 4.42Å; E303-L307 WeakPolarHBondContact O-CB 3.28Å; E303-L307 PolarHBondContact O-N 2.99Å; L307-W310 PolarHBondContact O-N 3.04Å; L307-W311 VanDerWaalsContact O-CD1 3.23Å; L307-W311 PolarHBondContact O-N 2.89Å
308	F	95.6	Very high	94.4	Very high	97 Å²	97	38.8 Å²	38.8	43%	0.425	19%	0.185	S	C	.	.	H	α-helix	trans	-60.6	-47.2	175.2	169.9	-100.5	0	0	0	112.2	I55 K304 A305 F306 W310 W311 W312	I55-F308 HydrophobicContact CG2-CE1 3.74Å; K304-F308 WeakPolarHBondContact O-CB 2.89Å; K304-F308 PolarHBondContact O-N 3.3Å; K304-F308 VanDerWaalsContact O-N 3.09Å; A305-F308 PolarHBondContact O-N 3.15Å; F306-F308 VanDerWaalsContact C-N 3.34Å; F306-F308 PolarHBondContact O-N 3.27Å; F308-W310 VanDerWaalsContact C-N 3.34Å; F308-W310 PolarHBondContact O-N 3.41Å; F308-W311 PolarHBondContact O-N 3.32Å; F308-W312 HydrophobicContact CE1-CB 4.38Å; F308-W312 HydrophobicContact CE2-CE3 4.44Å; F308-W312 HydrophobicContact CZ-CB 4.37Å; F308-W312 HydrophobicContact CZ-CD2 4.3Å; F308-W312 HydrophobicContact CZ-CE3 4.02Å; F308-W312 HydrophobicContact CZ-CG 4.45Å; F308-W312 WeakPolarHBondContact O-CB 3.1Å; F308-W312 PolarHBondContact O-N 2.94Å
309	L	96.1	Very high	94.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-38.7	-179.2	-74.6	175.2	0	0	0	112.8	I55 L56 L59 L129 A305 F306 W311 W312 F313	I55-L309 HydrophobicContact CG2-CD2 4.21Å; L56-L309 HydrophobicContact CD2-CD1 3.92Å; L56-L309 HydrophobicContact CD2-CD2 3.6Å; L56-L309 HydrophobicContact CD2-CG 4.42Å; L56-L309 HydrophobicContact CG-CD2 4.42Å; L59-L309 HydrophobicContact CD1-CD1 3.94Å; L59-L309 HydrophobicContact CD1-CD2 3.75Å; L59-L309 HydrophobicContact CD1-CG 3.84Å; L129-L309 HydrophobicContact CD2-CD1 3.45Å; L129-L309 VanDerWaalsContact CD2-CD1 3.45Å; A305-L309 WeakPolarHBondContact O-CB 3.38Å; A305-L309 VanDerWaalsContact O-CG 3.3Å; A305-L309 WeakPolarHBondContact O-CG 3.45Å; A305-L309 PolarHBondContact O-N 2.94Å; F306-L309 HydrophobicContact CD1-CD1 4.31Å; F306-L309 PolarHBondContact O-N 2.98Å; L309-W311 PolarHBondContact O-N 3.35Å; L309-W312 PolarHBondContact O-N 3.17Å; L309-F313 HydrophobicContact CD2-CE1 4.27Å; L309-F313 HydrophobicContact CD2-CZ 4.3Å; L309-F313 WeakPolarHBondContact O-CB 3.27Å; L309-F313 VanDerWaalsContact O-CG 3.25Å; L309-F313 WeakPolarHBondContact O-CG 3.4Å; L309-F313 PolarHBondContact O-N 2.72Å
310	W	95.3	Very high	95	Very high	10 Å²	10	40 Å²	40	4%	0.038	20%	0.195	C	C	.	.	H	α-helix	trans	-59.7	-48.3	178	-170.8	95.9	0	0	0	111.7	F237 L250 W251 V253 F306 L307 F308 L314	F237-W310 HydrophobicContact CE1-CD2 4.38Å; F237-W310 HydrophobicContact CE1-CG 4.42Å; F237-W310 AromaticContact CE1-NE1 3.9Å; L250-W310 HydrophobicContact CD2-CZ2 4.07Å; W251-W310 AromaticContact CE2-CD1 3.71Å; W251-W310 HydrophobicContact CH2-CB 3.86Å; W251-W310 AromaticContact CH2-CD1 3.94Å; W251-W310 HydrophobicContact CH2-CG 4.19Å; W251-W310 HydrophobicContact CZ2-CB 4.21Å; W251-W310 AromaticContact CZ2-CD1 3.46Å; W251-W310 VanDerWaalsContact CZ2-CD1 3.46Å; W251-W310 HydrophobicContact CZ2-CG 4.16Å; W251-W310 HydrophobicContact CZ3-CB 4.43Å; V253-W310 HydrophobicContact CG2-CH2 3.35Å; V253-W310 HydrophobicContact CG2-CZ2 3.98Å; V253-W310 HydrophobicContact CG2-CZ3 3.93Å; F306-W310 WeakPolarHBondContact O-CB 3.17Å; F306-W310 PolarHBondContact O-N 2.88Å; L307-W310 PolarHBondContact O-N 3.04Å; F308-W310 VanDerWaalsContact C-N 3.34Å; F308-W310 PolarHBondContact O-N 3.41Å; W310-L314 HydrophobicContact CH2-CD2 4.36Å; W310-L314 HydrophobicContact CZ3-CD2 4.1Å; W310-L314 PolarHBondContact O-N 3.2Å; W310-L314 VanDerWaalsContact O-N 3.15Å
311	W	95.5	Very high	95.3	Very high	92 Å²	92	38.6 Å²	38.6	35%	0.348	19%	0.192	S	C	.	.	H	α-helix	trans	-69	-37.6	176.9	-72.5	104.2	0	0	0	112.3	V253 L256 L307 F308 L309 L314 V315	V253-W311 HydrophobicContact CG2-CH2 4.49Å; L256-W311 HydrophobicContact CB-CZ2 4.36Å; L256-W311 HydrophobicContact CD2-CH2 4.22Å; L256-W311 HydrophobicContact CD2-CZ2 3.36Å; L256-W311 HydrophobicContact CG-CZ2 4.48Å; L307-W311 VanDerWaalsContact O-CD1 3.23Å; L307-W311 PolarHBondContact O-N 2.89Å; F308-W311 PolarHBondContact O-N 3.32Å; L309-W311 PolarHBondContact O-N 3.35Å; W311-L314 HydrophobicContact CE3-CD2 3.96Å; W311-L314 HydrophobicContact CZ3-CD2 3.94Å; W311-L314 WeakPolarHBondContact O-CB 3.45Å; W311-L314 PolarHBondContact O-N 3Å; W311-V315 WeakPolarHBondContact O-CG2 3.25Å; W311-V315 PolarHBondContact O-N 2.89Å; W311-V315 VanDerWaalsContact O-N 3.13Å
312	W	97	Very high	95.6	Very high	58 Å²	58	41.4 Å²	41.4	22%	0.22	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-47.9	176	-177.9	-97.8	0	0	0	111.7	L47 T52 I55 F308 L309 L314 V315 V316	L47-W312 HydrophobicContact CD1-CH2 3.97Å; L47-W312 HydrophobicContact CD1-CZ2 3.76Å; T52-W312 PolarHBondContact OG1-NE1 2.84Å; I55-W312 HydrophobicContact CD1-CD2 4.07Å; I55-W312 HydrophobicContact CD1-CE3 4.43Å; I55-W312 HydrophobicContact CD1-CH2 3.87Å; I55-W312 HydrophobicContact CD1-CZ2 3.45Å; I55-W312 VanDerWaalsContact CD1-CZ2 3.45Å; I55-W312 HydrophobicContact CD1-CZ3 4.34Å; F308-W312 HydrophobicContact CE1-CB 4.38Å; F308-W312 HydrophobicContact CE2-CE3 4.44Å; F308-W312 HydrophobicContact CZ-CB 4.37Å; F308-W312 HydrophobicContact CZ-CD2 4.3Å; F308-W312 HydrophobicContact CZ-CE3 4.02Å; F308-W312 HydrophobicContact CZ-CG 4.45Å; F308-W312 WeakPolarHBondContact O-CB 3.1Å; F308-W312 PolarHBondContact O-N 2.94Å; L309-W312 PolarHBondContact O-N 3.17Å; W312-L314 PolarHBondContact O-N 2.99Å; W312-V315 PolarHBondContact O-N 3.34Å; W312-V315 VanDerWaalsContact O-N 3.14Å; W312-V316 WeakPolarHBondContact O-CG2 3.38Å; W312-V316 PolarHBondContact O-N 3.1Å
313	F	96.2	Very high	95.8	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-61.8	-32.5	176.5	-68.7	-14.1	0	0	0	112.2	T52 L56 F136 Q236 F237 L240 L309 V316 A317	T52-F313 HydrophobicContact CG2-CD1 4.22Å; T52-F313 HydrophobicContact CG2-CE1 3.73Å; L56-F313 HydrophobicContact CD1-CE1 4.29Å; L56-F313 HydrophobicContact CD1-CZ 4.25Å; L56-F313 HydrophobicContact CD2-CE1 4.39Å; L56-F313 HydrophobicContact CD2-CZ 3.98Å; F136-F313 HydrophobicContact CE2-CD1 4.11Å; F136-F313 AromaticContact CE2-CE1 3.44Å; F136-F313 HydrophobicContact CE2-CE1 3.44Å; F136-F313 VanDerWaalsContact CE2-CE1 3.44Å; F136-F313 AromaticContact CE2-CZ 3.78Å; F136-F313 HydrophobicContact CE2-CZ 3.78Å; F136-F313 AromaticContact CZ-CD1 3.82Å; F136-F313 HydrophobicContact CZ-CD1 3.82Å; F136-F313 AromaticContact CZ-CE1 3.64Å; F136-F313 HydrophobicContact CZ-CE1 3.64Å; F136-F313 HydrophobicContact CZ-CZ 4.3Å; Q236-F313 HydrophobicContact CB-CD2 3.99Å; Q236-F313 HydrophobicContact CB-CE2 3.91Å; Q236-F313 HydrophobicContact CB-CZ 4.44Å; F237-F313 HydrophobicContact CE1-CB 4.45Å; F237-F313 HydrophobicContact CE2-CB 3.88Å; F237-F313 HydrophobicContact CZ-CB 3.84Å; L240-F313 HydrophobicContact CD2-CD2 4.48Å; L309-F313 HydrophobicContact CD2-CE1 4.27Å; L309-F313 HydrophobicContact CD2-CZ 4.3Å; L309-F313 WeakPolarHBondContact O-CB 3.27Å; L309-F313 VanDerWaalsContact O-CG 3.25Å; L309-F313 WeakPolarHBondContact O-CG 3.4Å; L309-F313 PolarHBondContact O-N 2.72Å; F313-V316 PolarHBondContact O-N 3.37Å; F313-A317 VanDerWaalsContact O-CB 3.26Å; F313-A317 WeakPolarHBondContact O-CB 3.39Å; F313-A317 PolarHBondContact O-N 3.24Å
314	L	95.6	Very high	96	Very high	56 Å²	56	43.5 Å²	43.5	29%	0.293	22%	0.215	S	C	.	.	H	α-helix	trans	-63.3	-46.9	173.8	-176.7	63.3	0	0	0	111.1	F237 W310 W311 W312 V316 A317 I318	F237-L314 HydrophobicContact CZ-CB 3.99Å; F237-L314 HydrophobicContact CZ-CD1 4.44Å; W310-L314 HydrophobicContact CH2-CD2 4.36Å; W310-L314 HydrophobicContact CZ3-CD2 4.1Å; W310-L314 PolarHBondContact O-N 3.2Å; W310-L314 VanDerWaalsContact O-N 3.15Å; W311-L314 HydrophobicContact CE3-CD2 3.96Å; W311-L314 HydrophobicContact CZ3-CD2 3.94Å; W311-L314 WeakPolarHBondContact O-CB 3.45Å; W311-L314 PolarHBondContact O-N 3Å; W312-L314 PolarHBondContact O-N 2.99Å; L314-V316 PolarHBondContact O-N 2.73Å; L314-A317 PolarHBondContact O-N 2.91Å; L314-I318 HydrophobicContact CD1-CD1 4.11Å; L314-I318 HydrophobicContact CD1-CG1 4.48Å; L314-I318 HydrophobicContact CG-CD1 4Å; L314-I318 VanDerWaalsContact O-CG1 3.28Å; L314-I318 WeakPolarHBondContact O-CG1 3.26Å; L314-I318 PolarHBondContact O-N 3.16Å
315	V	96.5	Very high	96.2	Very high	85 Å²	85	42.3 Å²	42.3	52%	0.515	22%	0.215	S	C	.	.	H	α-helix	trans	-60.8	-45.1	176	173.7	0	0	0	0	110.9	W311 W312 I318 A319	W311-V315 WeakPolarHBondContact O-CG2 3.25Å; W311-V315 PolarHBondContact O-N 2.89Å; W311-V315 VanDerWaalsContact O-N 3.13Å; W312-V315 PolarHBondContact O-N 3.34Å; W312-V315 VanDerWaalsContact O-N 3.14Å; V315-I318 PolarHBondContact O-N 3.41Å; V315-A319 VanDerWaalsContact O-CB 3.24Å; V315-A319 WeakPolarHBondContact O-CB 3.22Å; V315-A319 PolarHBondContact O-N 3.36Å
316	V	97.5	Very high	96.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.3	-42.9	178.1	177	0	0	0	0	111.4	L47 F136 A233 W312 F313 L314 A319 T320	L47-V316 HydrophobicContact CD2-CG2 4.26Å; L47-V316 HydrophobicContact CG-CG2 4.18Å; F136-V316 HydrophobicContact CE1-CG1 4.12Å; A233-V316 HydrophobicContact CB-CG1 4.47Å; W312-V316 WeakPolarHBondContact O-CG2 3.38Å; W312-V316 PolarHBondContact O-N 3.1Å; F313-V316 PolarHBondContact O-N 3.37Å; L314-V316 PolarHBondContact O-N 2.73Å; V316-A319 PolarHBondContact O-N 2.94Å; V316-T320 HydrophobicContact CG1-CG2 4.16Å; V316-T320 WeakPolarHBondContact O-CB 3.44Å; V316-T320 VanDerWaalsContact O-CG2 3.24Å; V316-T320 WeakPolarHBondContact O-CG2 3.29Å; V316-T320 PolarHBondContact O-N 3.49Å; V316-T320 PolarHBondContact O-OG1 3.13Å
317	A	96.9	Very high	96.3	Very high	16 Å²	16	48 Å²	48	13%	0.132	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-43.6	178.3	0	0	0	0	0	112.1	A233 F237 F313 L314 T320 C321	A233-A317 HydrophobicContact CB-CB 4.12Å; F237-A317 HydrophobicContact CE2-CB 4.18Å; F313-A317 VanDerWaalsContact O-CB 3.26Å; F313-A317 WeakPolarHBondContact O-CB 3.39Å; F313-A317 PolarHBondContact O-N 3.24Å; L314-A317 PolarHBondContact O-N 2.91Å; A317-T320 WeakPolarHBondContact CA-OG1 3.3Å; A317-T320 PolarHBondContact O-OG1 2.89Å; A317-T320 VanDerWaalsContact O-OG1 3.06Å; A317-C321 WeakPolarHBondContact O-CB 3.34Å; A317-C321 PolarHBondContact O-N 3.48Å
318	I	97.4	Very high	96.4	Very high	83 Å²	83	48.7 Å²	48.7	43%	0.426	24%	0.241	S	C	.	.	H	α-helix	trans	-64	-48.5	176.6	-68.2	169	0	0	0	110.5	L314 V315 C321 F322	L314-I318 HydrophobicContact CD1-CD1 4.11Å; L314-I318 HydrophobicContact CD1-CG1 4.48Å; L314-I318 HydrophobicContact CG-CD1 4Å; L314-I318 VanDerWaalsContact O-CG1 3.28Å; L314-I318 WeakPolarHBondContact O-CG1 3.26Å; L314-I318 PolarHBondContact O-N 3.16Å; V315-I318 PolarHBondContact O-N 3.41Å; I318-C321 PolarHBondContact O-N 2.82Å; I318-F322 HydrophobicContact CG2-CD2 3.67Å; I318-F322 HydrophobicContact CG2-CE2 3.4Å; I318-F322 WeakPolarHBondContact O-CD2 3.28Å; I318-F322 PolarHBondContact O-N 3.3Å
319	A	97.4	Very high	96.3	Very high	21 Å²	21	49.1 Å²	49.1	17%	0.174	25%	0.247	C	C	.	.	H	α-helix	trans	-60.8	-47	179.8	0	0	0	0	0	112.2	I44 L47 V315 V316 N323	I44-A319 HydrophobicContact CD1-CB 4.21Å; I44-A319 HydrophobicContact CG2-CB 4.18Å; L47-A319 HydrophobicContact CD2-CB 3.92Å; V315-A319 VanDerWaalsContact O-CB 3.24Å; V315-A319 WeakPolarHBondContact O-CB 3.22Å; V315-A319 PolarHBondContact O-N 3.36Å; V316-A319 PolarHBondContact O-N 2.94Å; A319-N323 VanDerWaalsContact O-CB 3.24Å; A319-N323 WeakPolarHBondContact O-CB 3.36Å; A319-N323 PolarHBondContact O-N 3.33Å
320	T	97	Very high	96.2	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-35.4	177.7	52.5	0	0	0	0	112.3	I44 S48 V316 A317 N323 F324	I44-T320 HydrophobicContact CG2-CG2 3.99Å; S48-T320 VanDerWaalsContact OG-CG2 3.31Å; S48-T320 WeakPolarHBondContact OG-CG2 3.49Å; V316-T320 HydrophobicContact CG1-CG2 4.16Å; V316-T320 WeakPolarHBondContact O-CB 3.44Å; V316-T320 VanDerWaalsContact O-CG2 3.24Å; V316-T320 WeakPolarHBondContact O-CG2 3.29Å; V316-T320 PolarHBondContact O-N 3.49Å; V316-T320 PolarHBondContact O-OG1 3.13Å; A317-T320 WeakPolarHBondContact CA-OG1 3.3Å; A317-T320 PolarHBondContact O-OG1 2.89Å; A317-T320 VanDerWaalsContact O-OG1 3.06Å; T320-N323 PolarHBondContact O-N 2.9Å; T320-F324 WeakPolarHBondContact O-CB 3.34Å; T320-F324 PolarHBondContact O-N 3.15Å
321	C	97.5	Very high	95.9	Very high	53 Å²	53	49 Å²	49	36%	0.358	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-53.8	174.2	-177.1	0	0	0	0	111.7	L230 A317 I318 N323 F324 V325	L230-C321 HydrophobicContact CD1-CB 3.94Å; A317-C321 WeakPolarHBondContact O-CB 3.34Å; A317-C321 PolarHBondContact O-N 3.48Å; I318-C321 PolarHBondContact O-N 2.82Å; C321-N323 PolarHBondContact O-N 3.14Å; C321-F324 PolarHBondContact O-N 3.29Å; C321-V325 WeakPolarHBondContact O-CG2 3.47Å; C321-V325 PolarHBondContact O-N 2.82Å
322	F	97.4	Very high	95.6	Very high	150 Å²	150	48.3 Å²	48.3	66%	0.658	25%	0.25	S	S	*	.	H	α-helix	trans	-58.4	-39.2	176.6	-76.2	-58.6	0	0	0	112	I318 V325 Y326	I318-F322 HydrophobicContact CG2-CD2 3.67Å; I318-F322 HydrophobicContact CG2-CE2 3.4Å; I318-F322 WeakPolarHBondContact O-CD2 3.28Å; I318-F322 PolarHBondContact O-N 3.3Å; F322-V325 PolarHBondContact O-N 2.89Å; F322-Y326 WeakPolarHBondContact O-CB 3.28Å; F322-Y326 PolarHBondContact O-N 3.34Å
323	N	96.5	Very high	95.3	Very high	15 Å²	15	47.7 Å²	47.7	8%	0.08	26%	0.255	C	S	.	.	H	α-helix	trans	-66.5	-43.3	178.6	-165.7	-96.4	0	0	0	112.6	D42 I44 K226 A319 T320 C321 Y326 W327	D42-N323 PolarHBondContact OD2-ND2 3.17Å; D42-N323 PolarHBondContact OD2-OD1 3.36Å; I44-N323 HydrophobicContact CB-CB 3.99Å; I44-N323 HydrophobicContact CG1-CB 4.07Å; I44-N323 WeakPolarHBondContact CG1-ND2 3.5Å; I44-N323 HydrophobicContact CG2-CB 3.79Å; K226-N323 WeakPolarHBondContact CD-OD1 3.44Å; K226-N323 VanDerWaalsContact CE-OD1 3.32Å; K226-N323 WeakPolarHBondContact CE-OD1 3.5Å; K226-N323 PolarHBondContact NZ-OD1 3.14Å; A319-N323 VanDerWaalsContact O-CB 3.24Å; A319-N323 WeakPolarHBondContact O-CB 3.36Å; A319-N323 PolarHBondContact O-N 3.33Å; T320-N323 PolarHBondContact O-N 2.9Å; C321-N323 PolarHBondContact O-N 3.14Å; N323-Y326 PolarHBondContact O-N 3.13Å; N323-W327 VanDerWaalsContact O-CD1 3.3Å; N323-W327 PolarHBondContact O-N 3.31Å; N323-W327 VanDerWaalsContact OD1-CD1 3.22Å
324	F	96.8	Very high	95	Very high	46 Å²	46	50.2 Å²	50.2	20%	0.202	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-45.7	174.7	173.7	-109.7	0	0	0	111.5	K226 L227 L230 T320 C321 Y326 W327 T328	K226-F324 HydrophobicContact CB-CD2 3.71Å; L227-F324 HydrophobicContact CB-CD2 4.48Å; L227-F324 HydrophobicContact CB-CE2 3.91Å; L227-F324 HydrophobicContact CB-CZ 4.35Å; L227-F324 HydrophobicContact CD1-CE1 4.39Å; L227-F324 HydrophobicContact CD1-CE2 4.39Å; L227-F324 HydrophobicContact CD1-CZ 4.05Å; L230-F324 HydrophobicContact CD2-CD1 4.07Å; L230-F324 HydrophobicContact CD2-CG 4.43Å; T320-F324 WeakPolarHBondContact O-CB 3.34Å; T320-F324 PolarHBondContact O-N 3.15Å; C321-F324 PolarHBondContact O-N 3.29Å; F324-Y326 PolarHBondContact O-N 3.21Å; F324-W327 PolarHBondContact O-N 3.24Å; F324-T328 VanDerWaalsContact O-CB 3.24Å; F324-T328 WeakPolarHBondContact O-CB 3.28Å; F324-T328 PolarHBondContact O-N 2.9Å; F324-T328 PolarHBondContact O-OG1 3.45Å
325	V	96.5	Very high	94.8	Very high	71 Å²	71	57.5 Å²	57.5	43%	0.43	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-46.6	176.3	175.5	0	0	0	0	110.7	C321 F322 T328 L329	C321-V325 WeakPolarHBondContact O-CG2 3.47Å; C321-V325 PolarHBondContact O-N 2.82Å; F322-V325 PolarHBondContact O-N 2.89Å; V325-T328 PolarHBondContact O-N 3.3Å; V325-L329 HydrophobicContact CG1-CD1 3.9Å; V325-L329 HydrophobicContact CG1-CG 4.35Å; V325-L329 WeakPolarHBondContact O-CB 3.46Å; V325-L329 VanDerWaalsContact O-CG 3.31Å; V325-L329 WeakPolarHBondContact O-CG 3.3Å; V325-L329 PolarHBondContact O-N 2.98Å
326	Y	95.5	Very high	94.6	Very high	124 Å²	124	57.4 Å²	57.4	49%	0.486	29%	0.29	S	S	.	.	H	α-helix	trans	-56.4	-53.4	176.7	170.7	-95.1	0	0	0	111.8	F322 N323 F324 T328 L329 A330	F322-Y326 WeakPolarHBondContact O-CB 3.28Å; F322-Y326 PolarHBondContact O-N 3.34Å; N323-Y326 PolarHBondContact O-N 3.13Å; F324-Y326 PolarHBondContact O-N 3.21Å; Y326-T328 VanDerWaalsContact C-N 3.33Å; Y326-T328 PolarHBondContact O-N 2.92Å; Y326-L329 PolarHBondContact O-N 3.37Å; Y326-A330 WeakPolarHBondContact O-CB 3.47Å; Y326-A330 PolarHBondContact O-N 2.9Å
327	W	95.4	Very high	94.4	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.015	29%	0.291	C	S	.	.	H	α-helix	trans	-66.5	-34.4	-178.2	-82.6	104.7	0	0	0	112.6	D42 Y222 L223 N323 F324 S331 F371 R374 M375 L378	D42-W327 PolarHBondContact OD2-NE1 3.31Å; Y222-W327 HydrophobicContact CD1-CD2 4.38Å; Y222-W327 HydrophobicContact CD1-CE3 4.28Å; Y222-W327 HydrophobicContact CE1-CB 4.48Å; Y222-W327 AromaticContact CE1-CD2 3.53Å; Y222-W327 HydrophobicContact CE1-CD2 3.53Å; Y222-W327 AromaticContact CE1-CE2 3.75Å; Y222-W327 AromaticContact CE1-CE3 3.76Å; Y222-W327 HydrophobicContact CE1-CE3 3.76Å; Y222-W327 AromaticContact CE1-CG 3.84Å; Y222-W327 HydrophobicContact CE1-CG 3.84Å; Y222-W327 HydrophobicContact CE1-CH2 4.37Å; Y222-W327 HydrophobicContact CE1-CZ2 4.17Å; Y222-W327 HydrophobicContact CE1-CZ3 4.17Å; L223-W327 HydrophobicContact CD2-CB 4.07Å; N323-W327 VanDerWaalsContact O-CD1 3.3Å; N323-W327 PolarHBondContact O-N 3.31Å; N323-W327 VanDerWaalsContact OD1-CD1 3.22Å; F324-W327 PolarHBondContact O-N 3.24Å; W327-S331 WeakPolarHBondContact O-CB 3.29Å; W327-S331 PolarHBondContact O-N 2.88Å; W327-S331 PolarHBondContact O-OG 3.01Å; W327-F371 HydrophobicContact CE3-CD2 4.34Å; W327-F371 HydrophobicContact CE3-CE2 4.13Å; W327-F371 HydrophobicContact CH2-CE2 4.26Å; W327-F371 AromaticContact CZ3-CD2 3.81Å; W327-F371 HydrophobicContact CZ3-CD2 3.81Å; W327-F371 AromaticContact CZ3-CE2 3.64Å; W327-F371 HydrophobicContact CZ3-CE2 3.64Å; W327-R374 HydrophobicContact CH2-CG 4.15Å; W327-R374 HydrophobicContact CZ3-CG 4.15Å; W327-M375 HydrophobicContact CH2-CE 3.76Å; W327-M375 HydrophobicContact CH2-CG 4.17Å; W327-M375 HydrophobicContact CH2-SD 3.7Å; W327-M375 HydrophobicContact CZ2-CE 3.96Å; W327-M375 HydrophobicContact CZ2-SD 4.08Å; W327-M375 HydrophobicContact CZ3-CE 4.44Å; W327-L378 HydrophobicContact CZ2-CD2 4.23Å
328	T	94.5	Very high	94.2	Very high	36 Å²	36	57.3 Å²	57.3	22%	0.221	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-50	175.3	-60.9	0	0	0	0	110.8	F324 V325 Y326 S331 I332	F324-T328 VanDerWaalsContact O-CB 3.24Å; F324-T328 WeakPolarHBondContact O-CB 3.28Å; F324-T328 PolarHBondContact O-N 2.9Å; F324-T328 PolarHBondContact O-OG1 3.45Å; V325-T328 PolarHBondContact O-N 3.3Å; Y326-T328 VanDerWaalsContact C-N 3.33Å; Y326-T328 PolarHBondContact O-N 2.92Å; T328-S331 PolarHBondContact O-N 3.13Å; T328-I332 HydrophobicContact CG2-CD1 3.66Å; T328-I332 HydrophobicContact CG2-CG1 4.42Å; T328-I332 WeakPolarHBondContact O-CB 3.45Å; T328-I332 WeakPolarHBondContact O-CG1 3.29Å; T328-I332 PolarHBondContact O-N 3.43Å
329	L	94.3	Very high	94.1	Very high	105 Å²	105	60.3 Å²	60.3	55%	0.55	30%	0.295	S	S	.	.	H	α-helix	trans	-64	-43	177.4	-67.7	176.1	0	0	0	111.8	V325 Y326 S331 S333	V325-L329 HydrophobicContact CG1-CD1 3.9Å; V325-L329 HydrophobicContact CG1-CG 4.35Å; V325-L329 WeakPolarHBondContact O-CB 3.46Å; V325-L329 VanDerWaalsContact O-CG 3.31Å; V325-L329 WeakPolarHBondContact O-CG 3.3Å; V325-L329 PolarHBondContact O-N 2.98Å; Y326-L329 PolarHBondContact O-N 3.37Å; L329-S331 VanDerWaalsContact C-N 3.32Å; L329-S331 PolarHBondContact O-N 3.15Å; L329-S333 WeakPolarHBondContact O-CB 3.37Å; L329-S333 PolarHBondContact O-N 3.16Å
330	A	92.8	Very high	93.9	Very high	4 Å²	4	60.3 Å²	60.3	3%	0.033	29%	0.291	C	S	.	.	H	α-helix	trans	-58.8	-39.4	176.9	0	0	0	0	0	113.7	Y326 L337	Y326-A330 WeakPolarHBondContact O-CB 3.47Å; Y326-A330 PolarHBondContact O-N 2.9Å; A330-L337 VanDerWaalsContact O-CD2 3.29Å; A330-L337 WeakPolarHBondContact O-CD2 3.46Å
331	S	90.4	Very high	93.8	Very high	5 Å²	5	60 Å²	60	4%	0.035	29%	0.289	C	S	.	.	H	α-helix	trans	-97.4	-31.9	-168.2	-59	0	0	0	0	113.9	T219 W327 T328 L329	T219-S331 VanDerWaalsContact CG2-CB 3.46Å; W327-S331 WeakPolarHBondContact O-CB 3.29Å; W327-S331 PolarHBondContact O-N 2.88Å; W327-S331 PolarHBondContact O-OG 3.01Å; T328-S331 PolarHBondContact O-N 3.13Å; L329-S331 VanDerWaalsContact C-N 3.32Å; L329-S331 PolarHBondContact O-N 3.15Å
332	I	88.7	Confident	93.6	Very high	77 Å²	77	57.9 Å²	57.9	40%	0.395	28%	0.275	S	S	.	.	H	α-helix	trans	-92.2	-39.5	-176.6	-59.9	-177.9	0	0	0	111.3	F216 L223 T328 S334 R367	F216-I332 HydrophobicContact CZ-CG1 4.4Å; L223-I332 HydrophobicContact CD1-CD1 4.12Å; L223-I332 HydrophobicContact CD1-CG1 4.02Å; T328-I332 HydrophobicContact CG2-CD1 3.66Å; T328-I332 HydrophobicContact CG2-CG1 4.42Å; T328-I332 WeakPolarHBondContact O-CB 3.45Å; T328-I332 WeakPolarHBondContact O-CG1 3.29Å; T328-I332 PolarHBondContact O-N 3.43Å; I332-S334 PolarHBondContact O-N 3.35Å; I332-S334 VanDerWaalsContact O-N 3.12Å; I332-R367 PolarHBondContact O-NH2 3.41Å
333	S	90.8	Very high	93.3	Very high	44 Å²	44	54.9 Å²	54.9	31%	0.308	26%	0.262	S	S	.	.			trans	-71.6	110	-174.6	-176.1	0	0	0	0	111	L329 R335 Q336 L337	L329-S333 WeakPolarHBondContact O-CB 3.37Å; L329-S333 PolarHBondContact O-N 3.16Å; S333-R335 PolarHBondContact O-N 2.85Å; S333-R335 VanDerWaalsContact O-N 3.1Å; S333-Q336 PolarHBondContact O-N 3.47Å; S333-L337 WeakPolarHBondContact O-CG 3.41Å; S333-L337 PolarHBondContact O-N 3.36Å
334	S	89.2	Confident	93.2	Very high	54 Å²	54	54.3 Å²	54.3	38%	0.378	26%	0.259	S	S	.	.	H	α-helix	trans	-54.1	-31.7	174.2	-57.6	0	0	0	0	112.2	I332 V338	I332-S334 PolarHBondContact O-N 3.35Å; I332-S334 VanDerWaalsContact O-N 3.12Å; S334-V338 WeakPolarHBondContact O-CB 3.37Å; S334-V338 VanDerWaalsContact O-CG2 3.23Å; S334-V338 WeakPolarHBondContact O-CG2 3.48Å; S334-V338 PolarHBondContact O-N 3.28Å
335	R	92.5	Very high	92.9	Very high	209 Å²	209	52.1 Å²	52.1	79%	0.789	25%	0.249	S	C	*	.	H	α-helix	trans	-65.8	-44.7	175.8	-175.4	178.5	171.6	176.6	-2.2	111.8	S333 V338 Y339	S333-R335 PolarHBondContact O-N 2.85Å; S333-R335 VanDerWaalsContact O-N 3.1Å; R335-V338 PolarHBondContact O-N 3.48Å; R335-Y339 WeakPolarHBondContact O-CB 3.23Å; R335-Y339 PolarHBondContact O-N 2.9Å
336	Q	92.5	Very high	92.6	Very high	83 Å²	83	56 Å²	56	39%	0.388	26%	0.256	S	S	.	.	H	α-helix	trans	-68.8	-37.4	178.4	-68.8	-64.1	-15	0	0	112	S333 Y339 F340	S333-Q336 PolarHBondContact O-N 3.47Å; Q336-Y339 PolarHBondContact O-N 3.3Å; Q336-F340 WeakPolarHBondContact O-CB 3.18Å; Q336-F340 PolarHBondContact O-N 3.09Å
337	L	92.6	Very high	92.3	Very high	5 Å²	5	56.1 Å²	56.1	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-48.9	174.1	-72.4	179.4	0	0	0	112	A330 S333 I341 L362 R367 L370	A330-L337 VanDerWaalsContact O-CD2 3.29Å; A330-L337 WeakPolarHBondContact O-CD2 3.46Å; S333-L337 WeakPolarHBondContact O-CG 3.41Å; S333-L337 PolarHBondContact O-N 3.36Å; L337-I341 PolarHBondContact O-N 3.33Å; L337-L362 HydrophobicContact CB-CD2 4.44Å; L337-L362 HydrophobicContact CD1-CD2 4.24Å; L337-R367 HydrophobicContact CD1-CG 3.96Å; L337-L370 HydrophobicContact CB-CD1 3.75Å; L337-L370 HydrophobicContact CD1-CD1 4.13Å; L337-L370 HydrophobicContact CD2-CB 3.91Å; L337-L370 HydrophobicContact CD2-CD1 3.74Å; L337-L370 HydrophobicContact CD2-CG 4.46Å; L337-L370 HydrophobicContact CG-CD1 4.07Å
338	V	93.4	Very high	92	Very high	10 Å²	10	58.7 Å²	58.7	6%	0.061	28%	0.277	C	S	.	.	H	α-helix	trans	-68.1	-41.1	177.3	174.7	0	0	0	0	111.1	S334 R335 F340 I341 A342 V357 K358 A361 L362	S334-V338 WeakPolarHBondContact O-CB 3.37Å; S334-V338 VanDerWaalsContact O-CG2 3.23Å; S334-V338 WeakPolarHBondContact O-CG2 3.48Å; S334-V338 PolarHBondContact O-N 3.28Å; R335-V338 PolarHBondContact O-N 3.48Å; V338-F340 VanDerWaalsContact C-N 3.35Å; V338-F340 PolarHBondContact O-N 3.28Å; V338-I341 PolarHBondContact O-N 3.44Å; V338-A342 VanDerWaalsContact O-CB 3.23Å; V338-A342 WeakPolarHBondContact O-CB 3.41Å; V338-A342 PolarHBondContact O-N 2.93Å; V338-V357 HydrophobicContact CG1-CG1 4.24Å; V338-K358 HydrophobicContact CG1-CB 4.37Å; V338-K358 HydrophobicContact CG2-CB 4.21Å; V338-K358 HydrophobicContact CG2-CG 4.14Å; V338-A361 HydrophobicContact CG2-CB 4.32Å; V338-L362 HydrophobicContact CG2-CD1 4.28Å; V338-L362 HydrophobicContact CG2-CD2 4.5Å; V338-L362 HydrophobicContact CG2-CG 4.18Å
339	Y	93.5	Very high	91.7	Very high	146 Å²	146	60 Å²	60	57%	0.573	30%	0.297	S	S	*	.	H	α-helix	trans	-60.2	-42.9	177.3	178	-98.6	0	0	0	112.3	R335 Q336 I341 A342 K343	R335-Y339 WeakPolarHBondContact O-CB 3.23Å; R335-Y339 PolarHBondContact O-N 2.9Å; Q336-Y339 PolarHBondContact O-N 3.3Å; Y339-I341 PolarHBondContact O-N 3.35Å; Y339-A342 PolarHBondContact O-N 3.48Å; Y339-K343 PolarHBondContact O-N 3.41Å
340	F	93.9	Very high	91.2	Very high	20 Å²	20	57 Å²	57	9%	0.088	28%	0.282	C	S	.	.	H	α-helix	trans	-57.1	-48.2	176.6	175.2	-103.5	0	0	0	111.8	Q336 V338 K343 Y344 L373 R374	Q336-F340 WeakPolarHBondContact O-CB 3.18Å; Q336-F340 PolarHBondContact O-N 3.09Å; V338-F340 VanDerWaalsContact C-N 3.35Å; V338-F340 PolarHBondContact O-N 3.28Å; F340-K343 WeakPolarHBondContact O-CB 3.33Å; F340-K343 PolarHBondContact O-N 3.04Å; F340-Y344 HydrophobicContact CD1-CE2 4.38Å; F340-Y344 AromaticContact CD2-CE2 3.98Å; F340-Y344 HydrophobicContact CD2-CE2 3.98Å; F340-Y344 AromaticContact CE1-CE2 3.97Å; F340-Y344 HydrophobicContact CE1-CE2 3.97Å; F340-Y344 AromaticContact CE2-CE2 3.54Å; F340-Y344 HydrophobicContact CE2-CE2 3.54Å; F340-Y344 HydrophobicContact CG-CE2 4.38Å; F340-Y344 AromaticContact CZ-CE2 3.53Å; F340-Y344 HydrophobicContact CZ-CE2 3.53Å; F340-Y344 WeakPolarHBondContact O-CD2 3.36Å; F340-L373 HydrophobicContact CE1-CB 4.09Å; F340-R374 HydrophobicContact CE1-CB 4.45Å; F340-R374 HydrophobicContact CE2-CB 4.49Å; F340-R374 HydrophobicContact CE2-CG 4.41Å; F340-R374 HydrophobicContact CZ-CB 4.12Å
341	I	94.1	Very high	90.7	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-70.4	-40.6	177.1	-63.8	-58	0	0	0	112	L337 V338 Y339 K343 Y344 T345 V357 F360 A361 L365 L370 L373 I389	L337-I341 PolarHBondContact O-N 3.33Å; V338-I341 PolarHBondContact O-N 3.44Å; Y339-I341 PolarHBondContact O-N 3.35Å; I341-K343 PolarHBondContact O-N 3.5Å; I341-Y344 PolarHBondContact O-N 2.82Å; I341-T345 HydrophobicContact CG2-CG2 3.81Å; I341-T345 PolarHBondContact O-N 2.68Å; I341-T345 PolarHBondContact O-OG1 3.35Å; I341-V357 HydrophobicContact CB-CG1 4.32Å; I341-V357 HydrophobicContact CG2-CG1 3.93Å; I341-F360 HydrophobicContact CG2-CD1 3.94Å; I341-F360 HydrophobicContact CG2-CE1 4.16Å; I341-A361 HydrophobicContact CB-CB 4.36Å; I341-A361 HydrophobicContact CG1-CB 4.07Å; I341-L365 HydrophobicContact CD1-CD1 4.04Å; I341-L365 HydrophobicContact CG1-CD1 4.46Å; I341-L370 HydrophobicContact CD1-CD2 3.47Å; I341-L370 VanDerWaalsContact CD1-CD2 3.47Å; I341-L370 HydrophobicContact CG1-CD2 3.27Å; I341-L373 HydrophobicContact CD1-CD1 4.14Å; I341-I389 HydrophobicContact CD1-CD1 3.93Å; I341-I389 HydrophobicContact CD1-CG1 4.44Å
342	A	93.3	Very high	90.2	Very high	8 Å²	8	63.7 Å²	63.7	7%	0.066	32%	0.318	C	S	.	.	H	α-helix	trans	-57.9	-33.5	178.3	0	0	0	0	0	112.2	V338 Y339 T345 R346 V357	V338-A342 VanDerWaalsContact O-CB 3.23Å; V338-A342 WeakPolarHBondContact O-CB 3.41Å; V338-A342 PolarHBondContact O-N 2.93Å; Y339-A342 PolarHBondContact O-N 3.48Å; A342-T345 WeakPolarHBondContact CA-OG1 3.16Å; A342-T345 PolarHBondContact O-OG1 3.1Å; A342-R346 VanDerWaalsContact O-CB 3.28Å; A342-R346 WeakPolarHBondContact O-CB 3.32Å; A342-R346 WeakPolarHBondContact O-CD 3.28Å; A342-R346 WeakPolarHBondContact O-CG 3.44Å; A342-R346 PolarHBondContact O-N 3.37Å; A342-R346 VanDerWaalsContact O-N 3.11Å; A342-V357 HydrophobicContact CB-CG1 4.06Å
343	K	92.8	Very high	90.1	Very high	86 Å²	86	62.3 Å²	62.3	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-56.4	-52	172.4	-178.7	-171	167	-162.8	0	110.7	Y339 F340 I341 I347 D382	Y339-K343 PolarHBondContact O-N 3.41Å; F340-K343 WeakPolarHBondContact O-CB 3.33Å; F340-K343 PolarHBondContact O-N 3.04Å; I341-K343 PolarHBondContact O-N 3.5Å; K343-I347 HydrophobicContact CG-CD1 4.07Å; K343-I347 WeakPolarHBondContact O-CD1 3.31Å; K343-I347 VanDerWaalsContact O-CG1 3.22Å; K343-I347 WeakPolarHBondContact O-CG1 3.15Å; K343-I347 PolarHBondContact O-N 3.09Å; K343-D382 IonicContact NZ-OD2 2.72Å; K343-D382 PolarHBondContact NZ-OD2 3.11Å
344	Y	93.2	Very high	90	Very high	4 Å²	4	65.4 Å²	65.4	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-72.1	-41.8	-178.5	-61.8	-80	0	0	0	112.9	F340 I341 R346 I347 L348 S377 D382 T385 A386 I389	F340-Y344 HydrophobicContact CD1-CE2 4.38Å; F340-Y344 AromaticContact CD2-CE2 3.98Å; F340-Y344 HydrophobicContact CD2-CE2 3.98Å; F340-Y344 AromaticContact CE1-CE2 3.97Å; F340-Y344 HydrophobicContact CE1-CE2 3.97Å; F340-Y344 AromaticContact CE2-CE2 3.54Å; F340-Y344 HydrophobicContact CE2-CE2 3.54Å; F340-Y344 HydrophobicContact CG-CE2 4.38Å; F340-Y344 AromaticContact CZ-CE2 3.53Å; F340-Y344 HydrophobicContact CZ-CE2 3.53Å; F340-Y344 WeakPolarHBondContact O-CD2 3.36Å; I341-Y344 PolarHBondContact O-N 2.82Å; Y344-R346 VanDerWaalsContact C-N 3.31Å; Y344-R346 PolarHBondContact O-N 2.88Å; Y344-I347 PolarHBondContact O-N 3.14Å; Y344-L348 WeakPolarHBondContact O-CB 3.5Å; Y344-L348 WeakPolarHBondContact O-CD1 3.41Å; Y344-L348 VanDerWaalsContact O-CG 3.27Å; Y344-L348 WeakPolarHBondContact O-CG 3.49Å; Y344-L348 PolarHBondContact O-N 3.42Å; Y344-S377 PolarHBondContact OH-OG 3.37Å; Y344-D382 HydrophobicContact CE1-CB 4.07Å; Y344-D382 PolarHBondContact OH-OD1 3.48Å; Y344-T385 HydrophobicContact CE1-CG2 4.42Å; Y344-A386 HydrophobicContact CD1-CB 3.82Å; Y344-A386 HydrophobicContact CE1-CB 4.46Å; Y344-I389 HydrophobicContact CD1-CD1 4.33Å; Y344-I389 HydrophobicContact CD2-CD1 3.47Å; Y344-I389 VanDerWaalsContact CD2-CD1 3.47Å; Y344-I389 HydrophobicContact CE2-CD1 4.07Å; Y344-I389 HydrophobicContact CG-CD1 3.63Å
345	T	90.5	Very high	90	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-65.9	-34.4	-177.9	60.4	0	0	0	0	112.5	I341 A342 G349 I350 V357 W393	I341-T345 HydrophobicContact CG2-CG2 3.81Å; I341-T345 PolarHBondContact O-N 2.68Å; I341-T345 PolarHBondContact O-OG1 3.35Å; A342-T345 WeakPolarHBondContact CA-OG1 3.16Å; A342-T345 PolarHBondContact O-OG1 3.1Å; T345-G349 PolarHBondContact O-N 3.16Å; T345-G349 VanDerWaalsContact O-N 3.17Å; T345-I350 PolarHBondContact O-N 3.06Å; T345-V357 HydrophobicContact CG2-CG2 4.36Å; T345-W393 HydrophobicContact CG2-CE3 4.48Å; T345-W393 HydrophobicContact CG2-CZ3 4.49Å
346	R	90.1	Very high	89.9	Confident	153 Å²	153	61.3 Å²	61.3	58%	0.577	31%	0.31	S	S	*	.	H	α-helix	trans	-68.8	-45.5	174.3	-72.9	174.7	-176.6	175.6	0.2	112.1	A342 Y344 L348 G349	A342-R346 VanDerWaalsContact O-CB 3.28Å; A342-R346 WeakPolarHBondContact O-CB 3.32Å; A342-R346 WeakPolarHBondContact O-CD 3.28Å; A342-R346 WeakPolarHBondContact O-CG 3.44Å; A342-R346 PolarHBondContact O-N 3.37Å; A342-R346 VanDerWaalsContact O-N 3.11Å; Y344-R346 VanDerWaalsContact C-N 3.31Å; Y344-R346 PolarHBondContact O-N 2.88Å; R346-L348 VanDerWaalsContact C-N 3.28Å; R346-L348 PolarHBondContact O-N 3.27Å; R346-G349 PolarHBondContact O-N 3.46Å
347	I	89.5	Confident	89.8	Confident	125 Å²	125	57.6 Å²	57.6	64%	0.641	29%	0.293	S	S	*	.	H	α-helix	trans	-62.3	-38.4	178.5	-69.1	167.2	0	0	0	111.1	K343 Y344 G349	K343-I347 HydrophobicContact CG-CD1 4.07Å; K343-I347 WeakPolarHBondContact O-CD1 3.31Å; K343-I347 VanDerWaalsContact O-CG1 3.22Å; K343-I347 WeakPolarHBondContact O-CG1 3.15Å; K343-I347 PolarHBondContact O-N 3.09Å; Y344-I347 PolarHBondContact O-N 3.14Å; I347-G349 VanDerWaalsContact C-N 3.33Å
348	L	89.4	Confident	89.8	Confident	59 Å²	59	61.3 Å²	61.3	31%	0.309	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-6	-179.7	-65.5	167	0	0	0	114	Y344 R346 I350 A386 K390	Y344-L348 WeakPolarHBondContact O-CB 3.5Å; Y344-L348 WeakPolarHBondContact O-CD1 3.41Å; Y344-L348 VanDerWaalsContact O-CG 3.27Å; Y344-L348 WeakPolarHBondContact O-CG 3.49Å; Y344-L348 PolarHBondContact O-N 3.42Å; R346-L348 VanDerWaalsContact C-N 3.28Å; R346-L348 PolarHBondContact O-N 3.27Å; L348-I350 VanDerWaalsContact C-N 3.27Å; L348-I350 HydrophobicContact CB-CD1 3.68Å; L348-I350 HydrophobicContact CB-CG1 3.71Å; L348-I350 HydrophobicContact CD1-CD1 3.66Å; L348-I350 HydrophobicContact CG-CD1 4.35Å; L348-I350 PolarHBondContact O-N 2.79Å; L348-A386 HydrophobicContact CD1-CB 3.98Å; L348-A386 VanDerWaalsContact CD1-O 3.3Å; L348-A386 WeakPolarHBondContact CD1-O 3.3Å; L348-A386 HydrophobicContact CD2-CB 4.17Å; L348-A386 HydrophobicContact CG-CB 4.32Å; L348-K390 HydrophobicContact CD1-CB 4.15Å
349	G	87.4	Confident	89.6	Confident	62 Å²	62	66.2 Å²	66.2	64%	0.639	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	25.7	-177.1	0	0	0	0	0	114.6	T345 R346 I347	T345-G349 PolarHBondContact O-N 3.16Å; T345-G349 VanDerWaalsContact O-N 3.17Å; R346-G349 PolarHBondContact O-N 3.46Å; I347-G349 VanDerWaalsContact C-N 3.33Å
350	I	84.4	Confident	89.5	Confident	43 Å²	43	59.3 Å²	59.3	22%	0.221	30%	0.3	C	S	.	.	S	Bend	trans	-79.7	-49.3	-173.4	-66	171.1	0	0	0	111.8	T345 L348 K390 W393	T345-I350 PolarHBondContact O-N 3.06Å; L348-I350 VanDerWaalsContact C-N 3.27Å; L348-I350 HydrophobicContact CB-CD1 3.68Å; L348-I350 HydrophobicContact CB-CG1 3.71Å; L348-I350 HydrophobicContact CD1-CD1 3.66Å; L348-I350 HydrophobicContact CG-CD1 4.35Å; L348-I350 PolarHBondContact O-N 2.79Å; I350-K390 HydrophobicContact CD1-CB 3.96Å; I350-K390 HydrophobicContact CD1-CG 3.9Å; I350-W393 HydrophobicContact CG2-CB 4.47Å; I350-W393 HydrophobicContact CG2-CD2 3.62Å; I350-W393 VanDerWaalsContact CG2-CE2 3.42Å; I350-W393 HydrophobicContact CG2-CE3 4.46Å; I350-W393 HydrophobicContact CG2-CG 3.56Å; I350-W393 HydrophobicContact CG2-CZ2 4.13Å
351	S	82	Confident	89.4	Confident	17 Å²	17	58.4 Å²	58.4	12%	0.119	30%	0.296	C	S	.	.			trans	-157	133.9	179.4	179.9	0	0	0	0	110.5	S353	S351-S353 PolarHBondContact OG-N 3.13Å
352	N	80.2	Confident	89.2	Confident	133 Å²	133	61 Å²	61	71%	0.711	31%	0.309	S	S	*	.			trans	-99.5	-8.4	173.3	-68.7	-32	0	0	0	112.5	H354	N352-H354 PolarHBondContact O-N 3.49Å
353	S	87.9	Confident	88.8	Confident	48 Å²	48	67.7 Å²	67.7	34%	0.336	34%	0.337	S	S	.	.			trans	-74.9	116.6	-178.8	173.4	0	0	0	0	110.7	S351 E355 D356 V357	S351-S353 PolarHBondContact OG-N 3.13Å; S353-E355 VanDerWaalsContact C-N 3.26Å; S353-E355 PolarHBondContact O-N 3.32Å; S353-D356 WeakPolarHBondContact CB-OD2 3.44Å; S353-D356 PolarHBondContact O-N 3.41Å; S353-D356 PolarHBondContact OG-OD2 3.25Å; S353-V357 WeakPolarHBondContact O-CG2 3.25Å; S353-V357 PolarHBondContact O-N 3.37Å; S353-V357 VanDerWaalsContact O-N 3.14Å
354	H	88.8	Confident	88.6	Confident	109 Å²	109	64.8 Å²	64.8	51%	0.505	33%	0.327	S	S	.	.	H	α-helix	trans	-59.8	-36.5	179.3	179.8	-95.4	0	0	0	112.3	N352 K358	N352-H354 PolarHBondContact O-N 3.49Å; H354-K358 WeakPolarHBondContact O-CB 3.5Å; H354-K358 PolarHBondContact O-N 3.09Å
355	E	88.8	Confident	88.4	Confident	110 Å²	110	64.6 Å²	64.6	51%	0.514	33%	0.326	S	S	.	.	H	α-helix	trans	-70.7	-37.7	-179.3	-70.9	-54.8	131.2	0	0	112.6	S353 K358 R359	S353-E355 VanDerWaalsContact C-N 3.26Å; S353-E355 PolarHBondContact O-N 3.32Å; E355-K358 PolarHBondContact O-N 3.21Å; E355-K358 IonicContact OE1-NZ 2.77Å; E355-K358 IonicContact OE2-NZ 2.77Å; E355-R359 VanDerWaalsContact O-CB 3.26Å; E355-R359 WeakPolarHBondContact O-CB 3.4Å; E355-R359 PolarHBondContact O-N 2.89Å
356	D	89.2	Confident	88.2	Confident	67 Å²	67	66 Å²	66	36%	0.358	33%	0.333	S	S	.	.	H	α-helix	trans	-68.1	-43.7	176.8	-62.6	-36	0	0	0	110.9	S353 K358 R359 F360 W393	S353-D356 WeakPolarHBondContact CB-OD2 3.44Å; S353-D356 PolarHBondContact O-N 3.41Å; S353-D356 PolarHBondContact OG-OD2 3.25Å; D356-K358 VanDerWaalsContact C-N 3.35Å; D356-K358 PolarHBondContact O-N 3.49Å; D356-R359 PolarHBondContact O-N 3.09Å; D356-F360 VanDerWaalsContact O-CB 3.31Å; D356-F360 WeakPolarHBondContact O-CB 3.37Å; D356-F360 PolarHBondContact O-N 3.15Å; D356-W393 HydrophobicContact CB-CH2 4.01Å
357	V	91.4	Very high	88.2	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.03	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-43.6	175.6	175.8	0	0	0	0	111	V338 I341 A342 T345 S353 F360 A361	V338-V357 HydrophobicContact CG1-CG1 4.24Å; I341-V357 HydrophobicContact CB-CG1 4.32Å; I341-V357 HydrophobicContact CG2-CG1 3.93Å; A342-V357 HydrophobicContact CB-CG1 4.06Å; T345-V357 HydrophobicContact CG2-CG2 4.36Å; S353-V357 WeakPolarHBondContact O-CG2 3.25Å; S353-V357 PolarHBondContact O-N 3.37Å; S353-V357 VanDerWaalsContact O-N 3.14Å; V357-F360 PolarHBondContact O-N 3.36Å; V357-A361 VanDerWaalsContact O-CB 3.28Å; V357-A361 WeakPolarHBondContact O-CB 3.13Å; V357-A361 PolarHBondContact O-N 2.83Å
358	K	91.8	Very high	88.2	Confident	82 Å²	82	56.2 Å²	56.2	36%	0.357	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-43	176.8	178.9	-178	173.2	-167.4	0	111.9	V338 H354 E355 D356 L362	V338-K358 HydrophobicContact CG1-CB 4.37Å; V338-K358 HydrophobicContact CG2-CB 4.21Å; V338-K358 HydrophobicContact CG2-CG 4.14Å; H354-K358 WeakPolarHBondContact O-CB 3.5Å; H354-K358 PolarHBondContact O-N 3.09Å; E355-K358 PolarHBondContact O-N 3.21Å; E355-K358 IonicContact OE1-NZ 2.77Å; E355-K358 IonicContact OE2-NZ 2.77Å; D356-K358 VanDerWaalsContact C-N 3.35Å; D356-K358 PolarHBondContact O-N 3.49Å; K358-L362 HydrophobicContact CG-CD1 3.94Å; K358-L362 WeakPolarHBondContact O-CB 3.18Å; K358-L362 PolarHBondContact O-N 3.33Å
359	R	90.1	Very high	88.3	Confident	113 Å²	113	53.4 Å²	53.4	43%	0.426	27%	0.273	S	S	.	.	H	α-helix	trans	-64.2	-44.7	176.9	-175.2	173.6	178.5	-177	-0.9	111	E355 D356 K363 C364 L400	E355-R359 VanDerWaalsContact O-CB 3.26Å; E355-R359 WeakPolarHBondContact O-CB 3.4Å; E355-R359 PolarHBondContact O-N 2.89Å; D356-R359 PolarHBondContact O-N 3.09Å; R359-K363 HydrophobicContact CG-CD 4.16Å; R359-K363 WeakPolarHBondContact O-CA 3.2Å; R359-K363 VanDerWaalsContact O-CB 3.25Å; R359-K363 WeakPolarHBondContact O-CB 3.41Å; R359-K363 PolarHBondContact O-N 3.38Å; R359-C364 PolarHBondContact O-N 3.37Å; R359-L400 HydrophobicContact CG-CD2 4.16Å
360	F	91.3	Very high	88.6	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.009	24%	0.243	C	C	.	.	I	π-helix	trans	-61.8	-51.6	176.1	176.9	-105.9	0	0	0	111.6	I341 D356 V357 C364 L365 I389 I392 W393 T396	I341-F360 HydrophobicContact CG2-CD1 3.94Å; I341-F360 HydrophobicContact CG2-CE1 4.16Å; D356-F360 VanDerWaalsContact O-CB 3.31Å; D356-F360 WeakPolarHBondContact O-CB 3.37Å; D356-F360 PolarHBondContact O-N 3.15Å; V357-F360 PolarHBondContact O-N 3.36Å; F360-C364 HydrophobicContact CD2-CB 4.04Å; F360-C364 CarbonylContact O-C 3.58Å; F360-C364 WeakPolarHBondContact O-CA 3.45Å; F360-C364 WeakPolarHBondContact O-CB 3.43Å; F360-C364 PolarHBondContact O-N 3.3Å; F360-L365 HydrophobicContact CD1-CD1 3.92Å; F360-L365 HydrophobicContact CE1-CD1 3.34Å; F360-L365 HydrophobicContact CE1-CG 4.15Å; F360-L365 HydrophobicContact CZ-CD1 3.71Å; F360-L365 HydrophobicContact CZ-CG 4.09Å; F360-L365 PolarHBondContact O-N 2.99Å; F360-I389 HydrophobicContact CE1-CG2 4.33Å; F360-I392 HydrophobicContact CE2-CG2 3.93Å; F360-I392 HydrophobicContact CZ-CB 4.35Å; F360-I392 HydrophobicContact CZ-CG2 3.82Å; F360-W393 HydrophobicContact CB-CE3 3.88Å; F360-W393 HydrophobicContact CB-CH2 4.23Å; F360-W393 HydrophobicContact CB-CZ3 3.37Å; F360-W393 AromaticContact CD1-CE3 3.5Å; F360-W393 HydrophobicContact CD1-CE3 3.5Å; F360-W393 AromaticContact CD1-CZ3 3.69Å; F360-W393 HydrophobicContact CD1-CZ3 3.69Å; F360-W393 HydrophobicContact CD2-CD2 4.41Å; F360-W393 AromaticContact CD2-CE3 3.6Å; F360-W393 HydrophobicContact CD2-CE3 3.6Å; F360-W393 HydrophobicContact CD2-CZ3 4.02Å; F360-W393 AromaticContact CE1-CE3 3.83Å; F360-W393 HydrophobicContact CE1-CE3 3.83Å; F360-W393 HydrophobicContact CE1-CZ3 4.44Å; F360-W393 HydrophobicContact CE2-CB 4.24Å; F360-W393 AromaticContact CE2-CE3 3.94Å; F360-W393 HydrophobicContact CE2-CE3 3.94Å; F360-W393 AromaticContact CG-CE3 3.37Å; F360-W393 HydrophobicContact CG-CE3 3.37Å; F360-W393 AromaticContact CG-CZ3 3.42Å; F360-W393 HydrophobicContact CG-CZ3 3.42Å; F360-W393 VanDerWaalsContact CG-CZ3 3.42Å; F360-W393 HydrophobicContact CZ-CB 4.17Å; F360-W393 HydrophobicContact CZ-CE3 4.04Å; F360-T396 WeakPolarHBondContact CE2-OG1 3.41Å
361	A	92	Very high	89	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-61.4	-53.2	-179.7	0	0	0	0	0	112.3	V338 I341 V357 Q366 L370	V338-A361 HydrophobicContact CG2-CB 4.32Å; I341-A361 HydrophobicContact CB-CB 4.36Å; I341-A361 HydrophobicContact CG1-CB 4.07Å; V357-A361 VanDerWaalsContact O-CB 3.28Å; V357-A361 WeakPolarHBondContact O-CB 3.13Å; V357-A361 PolarHBondContact O-N 2.83Å; A361-Q366 PolarHBondContact O-N 3.41Å; A361-Q366 VanDerWaalsContact O-N 3.15Å; A361-L370 HydrophobicContact CB-CD1 4.19Å; A361-L370 HydrophobicContact CB-CD2 4.35Å
362	L	88.9	Confident	89.5	Confident	55 Å²	55	48 Å²	48	29%	0.288	23%	0.228	S	C	.	.	I	π-helix	trans	-86.3	-34.8	-170.1	-60	179.8	0	0	0	113.9	L337 V338 K358	L337-L362 HydrophobicContact CB-CD2 4.44Å; L337-L362 HydrophobicContact CD1-CD2 4.24Å; V338-L362 HydrophobicContact CG2-CD1 4.28Å; V338-L362 HydrophobicContact CG2-CD2 4.5Å; V338-L362 HydrophobicContact CG2-CG 4.18Å; K358-L362 HydrophobicContact CG-CD1 3.94Å; K358-L362 WeakPolarHBondContact O-CB 3.18Å; K358-L362 PolarHBondContact O-N 3.33Å
363	K	85.5	Confident	90.2	Very high	149 Å²	149	41.6 Å²	41.6	65%	0.648	19%	0.194	S	C	*	.	I	π-helix	trans	-95.9	-36.7	-179.5	-58.5	-168.2	-176.2	176.4	0	113	R191 R359	R191-K363 PolarHBondContact NH2-O 3.36Å; R359-K363 HydrophobicContact CG-CD 4.16Å; R359-K363 WeakPolarHBondContact O-CA 3.2Å; R359-K363 VanDerWaalsContact O-CB 3.25Å; R359-K363 WeakPolarHBondContact O-CB 3.41Å; R359-K363 PolarHBondContact O-N 3.38Å
364	C	87.9	Confident	90.5	Very high	24 Å²	24	40.4 Å²	40.4	16%	0.162	18%	0.182	C	C	.	.	I	π-helix	trans	-95.7	-36.7	-172.4	-159.6	0	0	0	0	114.2	R191 R359 F360 T396	R191-C364 PolarHBondContact NH2-O 3.43Å; R359-C364 PolarHBondContact O-N 3.37Å; F360-C364 HydrophobicContact CD2-CB 4.04Å; F360-C364 CarbonylContact O-C 3.58Å; F360-C364 WeakPolarHBondContact O-CA 3.45Å; F360-C364 WeakPolarHBondContact O-CB 3.43Å; F360-C364 PolarHBondContact O-N 3.3Å; C364-T396 WeakPolarHBondContact SG-CG2 3.35Å
365	L	89.2	Confident	90.7	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	16%	0.158	C	C	.	.	I	π-helix	trans	-91.7	-30.2	173	-76.9	167	0	0	0	112.4	I187 I341 F360 G369 L370 L373 I392	I187-L365 HydrophobicContact CD1-CD2 4.17Å; I187-L365 WeakPolarHBondContact CD1-O 2.81Å; I341-L365 HydrophobicContact CD1-CD1 4.04Å; I341-L365 HydrophobicContact CG1-CD1 4.46Å; F360-L365 HydrophobicContact CD1-CD1 3.92Å; F360-L365 HydrophobicContact CE1-CD1 3.34Å; F360-L365 HydrophobicContact CE1-CG 4.15Å; F360-L365 HydrophobicContact CZ-CD1 3.71Å; F360-L365 HydrophobicContact CZ-CG 4.09Å; F360-L365 PolarHBondContact O-N 2.99Å; L365-G369 VanDerWaalsContact O-CA 3.31Å; L365-G369 WeakPolarHBondContact O-CA 3.09Å; L365-G369 PolarHBondContact O-N 3.4Å; L365-L370 HydrophobicContact CB-CD2 4.19Å; L365-L370 HydrophobicContact CB-CG 4.11Å; L365-L370 HydrophobicContact CD1-CD2 3.86Å; L365-L373 HydrophobicContact CD1-CD1 3.67Å; L365-L373 HydrophobicContact CD2-CD1 3.87Å; L365-L373 HydrophobicContact CG-CD1 4.41Å; L365-I392 HydrophobicContact CD2-CD1 4.3Å; L365-I392 HydrophobicContact CD2-CG2 4.03Å
366	Q	87.5	Confident	90.9	Very high	29 Å²	29	30 Å²	30	14%	0.136	13%	0.134	C	C	.	.	H	α-helix	trans	56	-179.6	-169.2	-64.2	172.2	-87.2	0	0	111.7	I187 R191 R214 A361 L370	I187-Q366 VanDerWaalsContact CG2-OE1 3.3Å; R191-Q366 VanDerWaalsContact CG-OE1 3.24Å; R191-Q366 VanDerWaalsContact NH2-OE1 3.17Å; R214-Q366 PolarHBondContact O-NE2 2.89Å; A361-Q366 PolarHBondContact O-N 3.41Å; A361-Q366 VanDerWaalsContact O-N 3.15Å; Q366-L370 WeakPolarHBondContact O-CG 3.38Å; Q366-L370 PolarHBondContact O-N 3.39Å
367	R	90	Very high	91.2	Very high	72 Å²	72	27.9 Å²	27.9	27%	0.272	13%	0.125	S	C	.	.	H	α-helix	trans	-68.5	-41.7	-175.7	-67.3	-175.5	173	-176.7	-6.4	112.1	F216 I332 L337 G369 L370 F371	F216-R367 HydrophobicContact CD2-CB 3.52Å; F216-R367 HydrophobicContact CD2-CG 4.08Å; F216-R367 VanDerWaalsContact CE1-NH1 3.28Å; F216-R367 HydrophobicContact CE2-CB 4.1Å; F216-R367 VanDerWaalsContact CE2-CD 3.5Å; F216-R367 HydrophobicContact CE2-CG 4.44Å; F216-R367 HydrophobicContact CG-CB 4.34Å; I332-R367 PolarHBondContact O-NH2 3.41Å; L337-R367 HydrophobicContact CD1-CG 3.96Å; R367-G369 PolarHBondContact O-N 2.89Å; R367-L370 PolarHBondContact O-N 3.12Å; R367-F371 WeakPolarHBondContact O-CB 3.36Å; R367-F371 PolarHBondContact O-N 2.88Å
368	D	89.6	Confident	91.2	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-40.6	179.1	-72.5	-11.9	0	0	0	112.3	G215 F216 Y217 L218 T219 L370 F371 I372	G215-D368 VanDerWaalsContact O-CG 3.27Å; G215-D368 PolarHBondContact O-N 3.42Å; F216-D368 VanDerWaalsContact CA-OD1 3.27Å; F216-D368 WeakPolarHBondContact CA-OD1 3.27Å; F216-D368 PolarHBondContact N-OD2 3.42Å; Y217-D368 PolarHBondContact N-OD1 2.72Å; Y217-D368 PolarHBondContact N-OD2 3.36Å; L218-D368 HydrophobicContact CB-CB 4.36Å; L218-D368 PolarHBondContact N-OD1 3.3Å; L218-D368 PolarHBondContact N-OD2 2.96Å; T219-D368 WeakPolarHBondContact CB-OD1 3.48Å; T219-D368 PolarHBondContact N-OD1 2.85Å; T219-D368 PolarHBondContact OG1-OD1 3.08Å; D368-L370 VanDerWaalsContact C-N 3.33Å; D368-L370 PolarHBondContact O-N 2.83Å; D368-F371 WeakPolarHBondContact O-CB 3.26Å; D368-F371 PolarHBondContact O-N 3.48Å; D368-I372 WeakPolarHBondContact O-CD1 3.37Å; D368-I372 VanDerWaalsContact O-CG1 3.25Å; D368-I372 WeakPolarHBondContact O-CG1 3.1Å; D368-I372 PolarHBondContact O-N 2.88Å
369	G	91.1	Very high	91.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.6	-39.5	174	0	0	0	0	0	112.8	L365 R367 I372 L373	L365-G369 VanDerWaalsContact O-CA 3.31Å; L365-G369 WeakPolarHBondContact O-CA 3.09Å; L365-G369 PolarHBondContact O-N 3.4Å; R367-G369 PolarHBondContact O-N 2.89Å; G369-I372 PolarHBondContact O-N 2.96Å; G369-L373 VanDerWaalsContact O-CG 3.31Å; G369-L373 WeakPolarHBondContact O-CG 3.4Å; G369-L373 PolarHBondContact O-N 3.31Å
370	L	93.1	Very high	91.2	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-68.7	-36.3	175.4	-67	172.7	0	0	0	112.8	L337 I341 A361 L365 Q366 R367 D368 L373 R374	L337-L370 HydrophobicContact CB-CD1 3.75Å; L337-L370 HydrophobicContact CD1-CD1 4.13Å; L337-L370 HydrophobicContact CD2-CB 3.91Å; L337-L370 HydrophobicContact CD2-CD1 3.74Å; L337-L370 HydrophobicContact CD2-CG 4.46Å; L337-L370 HydrophobicContact CG-CD1 4.07Å; I341-L370 HydrophobicContact CD1-CD2 3.47Å; I341-L370 VanDerWaalsContact CD1-CD2 3.47Å; I341-L370 HydrophobicContact CG1-CD2 3.27Å; A361-L370 HydrophobicContact CB-CD1 4.19Å; A361-L370 HydrophobicContact CB-CD2 4.35Å; L365-L370 HydrophobicContact CB-CD2 4.19Å; L365-L370 HydrophobicContact CB-CG 4.11Å; L365-L370 HydrophobicContact CD1-CD2 3.86Å; Q366-L370 WeakPolarHBondContact O-CG 3.38Å; Q366-L370 PolarHBondContact O-N 3.39Å; R367-L370 PolarHBondContact O-N 3.12Å; D368-L370 VanDerWaalsContact C-N 3.33Å; D368-L370 PolarHBondContact O-N 2.83Å; L370-L373 PolarHBondContact O-N 3.37Å; L370-R374 WeakPolarHBondContact O-CB 3.32Å; L370-R374 PolarHBondContact O-N 3.5Å
371	F	93.2	Very high	91.2	Very high	5 Å²	5	26 Å²	26	2%	0.022	13%	0.131	C	C	.	.	H	α-helix	trans	-62	-46.9	173.3	171.9	-100.3	0	0	0	111.2	W143 L154 L218 T219 Y222 W327 R367 D368 L373 R374 M375	W143-F371 HydrophobicContact CH2-CE1 4.25Å; W143-F371 HydrophobicContact CH2-CZ 4.31Å; L154-F371 HydrophobicContact CD2-CE1 3.99Å; L218-F371 HydrophobicContact CD2-CD1 3.78Å; L218-F371 HydrophobicContact CD2-CE1 3.91Å; L218-F371 HydrophobicContact CG-CD1 3.85Å; L218-F371 HydrophobicContact CG-CE1 3.78Å; T219-F371 HydrophobicContact CG2-CB 4.28Å; T219-F371 HydrophobicContact CG2-CD2 4.31Å; T219-F371 HydrophobicContact CG2-CG 4.44Å; T219-F371 WeakPolarHBondContact OG1-CB 3.35Å; Y222-F371 HydrophobicContact CD1-CD2 4.42Å; Y222-F371 AromaticContact CD1-CE2 3.34Å; Y222-F371 HydrophobicContact CD1-CE2 3.34Å; Y222-F371 AromaticContact CD1-CZ 3.73Å; Y222-F371 HydrophobicContact CD1-CZ 3.73Å; Y222-F371 HydrophobicContact CD2-CE2 4.26Å; Y222-F371 AromaticContact CD2-CZ 3.78Å; Y222-F371 HydrophobicContact CD2-CZ 3.78Å; Y222-F371 AromaticContact CE1-CE2 3.77Å; Y222-F371 HydrophobicContact CE1-CE2 3.77Å; Y222-F371 HydrophobicContact CE1-CZ 4.22Å; Y222-F371 HydrophobicContact CE2-CZ 4.29Å; Y222-F371 AromaticContact CG-CE2 3.58Å; Y222-F371 HydrophobicContact CG-CE2 3.58Å; Y222-F371 AromaticContact CG-CZ 3.44Å; Y222-F371 HydrophobicContact CG-CZ 3.44Å; Y222-F371 VanDerWaalsContact CG-CZ 3.44Å; W327-F371 HydrophobicContact CE3-CD2 4.34Å; W327-F371 HydrophobicContact CE3-CE2 4.13Å; W327-F371 HydrophobicContact CH2-CE2 4.26Å; W327-F371 AromaticContact CZ3-CD2 3.81Å; W327-F371 HydrophobicContact CZ3-CD2 3.81Å; W327-F371 AromaticContact CZ3-CE2 3.64Å; W327-F371 HydrophobicContact CZ3-CE2 3.64Å; R367-F371 WeakPolarHBondContact O-CB 3.36Å; R367-F371 PolarHBondContact O-N 2.88Å; D368-F371 WeakPolarHBondContact O-CB 3.26Å; D368-F371 PolarHBondContact O-N 3.48Å; F371-L373 PolarHBondContact O-N 3.49Å; F371-R374 PolarHBondContact O-N 3.01Å; F371-M375 HydrophobicContact CE1-CG 4.12Å; F371-M375 HydrophobicContact CE2-CE 3.83Å; F371-M375 HydrophobicContact CE2-CG 4.11Å; F371-M375 HydrophobicContact CZ-CE 3.55Å; F371-M375 HydrophobicContact CZ-CG 3.84Å; F371-M375 PolarHBondContact O-N 2.86Å
372	I	92.8	Very high	91.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.5	-45.2	177.1	-65.1	160.7	0	0	0	110.9	I152 L154 L157 I183 L218 D368 G369 R374 M375 L376	I152-I372 HydrophobicContact CD1-CD1 3.55Å; I152-I372 HydrophobicContact CG2-CD1 3.97Å; L154-I372 HydrophobicContact CD1-CB 4.46Å; L154-I372 HydrophobicContact CD1-CG1 4.23Å; L154-I372 HydrophobicContact CD1-CG2 4.02Å; L157-I372 HydrophobicContact CD2-CG2 3.56Å; I183-I372 HydrophobicContact CD1-CG2 4.01Å; I183-I372 HydrophobicContact CG1-CG2 4.11Å; L218-I372 HydrophobicContact CD2-CD1 4.23Å; L218-I372 HydrophobicContact CD2-CG1 3.91Å; D368-I372 WeakPolarHBondContact O-CD1 3.37Å; D368-I372 VanDerWaalsContact O-CG1 3.25Å; D368-I372 WeakPolarHBondContact O-CG1 3.1Å; D368-I372 PolarHBondContact O-N 2.88Å; G369-I372 PolarHBondContact O-N 2.96Å; I372-R374 VanDerWaalsContact C-N 3.31Å; I372-R374 PolarHBondContact O-N 3.01Å; I372-M375 PolarHBondContact O-N 3.1Å; I372-L376 WeakPolarHBondContact O-CB 3.47Å; I372-L376 PolarHBondContact O-N 2.88Å
373	L	94.1	Very high	91.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.2	-35.3	177.5	-71.4	171.2	0	0	0	112.5	I183 F340 I341 L365 G369 L370 F371 L376 S377 T385 V388 I389	I183-L373 HydrophobicContact CD1-CD2 4.29Å; F340-L373 HydrophobicContact CE1-CB 4.09Å; I341-L373 HydrophobicContact CD1-CD1 4.14Å; L365-L373 HydrophobicContact CD1-CD1 3.67Å; L365-L373 HydrophobicContact CD2-CD1 3.87Å; L365-L373 HydrophobicContact CG-CD1 4.41Å; G369-L373 VanDerWaalsContact O-CG 3.31Å; G369-L373 WeakPolarHBondContact O-CG 3.4Å; G369-L373 PolarHBondContact O-N 3.31Å; L370-L373 PolarHBondContact O-N 3.37Å; F371-L373 PolarHBondContact O-N 3.49Å; L373-L376 PolarHBondContact O-N 3.42Å; L373-S377 WeakPolarHBondContact O-CB 3.31Å; L373-S377 PolarHBondContact O-N 3.25Å; L373-T385 HydrophobicContact CD2-CG2 4.47Å; L373-T385 WeakPolarHBondContact O-CG2 2.95Å; L373-V388 HydrophobicContact CD2-CG1 3.87Å; L373-I389 HydrophobicContact CD1-CD1 4.42Å; L373-I389 HydrophobicContact CD1-CG1 3.9Å; L373-I389 HydrophobicContact CD2-CG1 3.99Å
374	R	94.4	Very high	91.5	Very high	22 Å²	22	25.6 Å²	25.6	8%	0.083	14%	0.135	C	C	.	.	H	α-helix	trans	-68.3	-41.5	174.8	-171.6	173.2	-66.1	-131.5	5.3	111.8	W327 F340 L370 F371 I372 L376 S377 L378	W327-R374 HydrophobicContact CH2-CG 4.15Å; W327-R374 HydrophobicContact CZ3-CG 4.15Å; F340-R374 HydrophobicContact CE1-CB 4.45Å; F340-R374 HydrophobicContact CE2-CB 4.49Å; F340-R374 HydrophobicContact CE2-CG 4.41Å; F340-R374 HydrophobicContact CZ-CB 4.12Å; L370-R374 WeakPolarHBondContact O-CB 3.32Å; L370-R374 PolarHBondContact O-N 3.5Å; F371-R374 PolarHBondContact O-N 3.01Å; I372-R374 VanDerWaalsContact C-N 3.31Å; I372-R374 PolarHBondContact O-N 3.01Å; R374-L376 VanDerWaalsContact C-N 3.33Å; R374-S377 WeakPolarHBondContact O-CB 3.23Å; R374-S377 PolarHBondContact O-N 2.95Å; R374-L378 PolarHBondContact O-N 3.13Å
375	M	93.1	Very high	91.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-41	172.8	-78.2	-63.8	-162.7	0	0	112	L154 I158 Y222 W327 F371 I372 S377 L378 H379	L154-M375 HydrophobicContact CD1-CB 4.47Å; L154-M375 HydrophobicContact CD2-CG 4.27Å; I158-M375 HydrophobicContact CD1-CB 4.17Å; Y222-M375 HydrophobicContact CD2-CE 4.1Å; Y222-M375 HydrophobicContact CE1-CE 3.84Å; Y222-M375 HydrophobicContact CE2-CE 3.36Å; Y222-M375 WeakPolarHBondContact OH-CE 3.29Å; W327-M375 HydrophobicContact CH2-CE 3.76Å; W327-M375 HydrophobicContact CH2-CG 4.17Å; W327-M375 HydrophobicContact CH2-SD 3.7Å; W327-M375 HydrophobicContact CZ2-CE 3.96Å; W327-M375 HydrophobicContact CZ2-SD 4.08Å; W327-M375 HydrophobicContact CZ3-CE 4.44Å; F371-M375 HydrophobicContact CE1-CG 4.12Å; F371-M375 HydrophobicContact CE2-CE 3.83Å; F371-M375 HydrophobicContact CE2-CG 4.11Å; F371-M375 HydrophobicContact CZ-CE 3.55Å; F371-M375 HydrophobicContact CZ-CG 3.84Å; F371-M375 PolarHBondContact O-N 2.86Å; I372-M375 PolarHBondContact O-N 3.1Å; M375-S377 PolarHBondContact O-N 3.2Å; M375-L378 PolarHBondContact O-N 2.05Å; M375-L378 HydrophobicContact SD-CD2 4.46Å; M375-H379 PolarHBondContact O-CD2 2.81Å; M375-H379 VanDerWaalsContact O-CD2 3.24Å; M375-H379 PolarHBondContact O-N 2.96Å; M375-H379 VanDerWaalsContact O-N 3.15Å
376	L	93.6	Very high	91.9	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-60.3	-45.1	174.5	-173.1	67	0	0	0	111.7	A161 I372 L373 R374 L378 H379 V380 V388	A161-L376 HydrophobicContact CB-CD1 3.46Å; A161-L376 VanDerWaalsContact CB-CD1 3.46Å; I372-L376 WeakPolarHBondContact O-CB 3.47Å; I372-L376 PolarHBondContact O-N 2.88Å; L373-L376 PolarHBondContact O-N 3.42Å; R374-L376 VanDerWaalsContact C-N 3.33Å; L376-L378 VanDerWaalsContact C-N 3.33Å; L376-L378 PolarHBondContact O-N 3.23Å; L376-H379 PolarHBondContact O-N 2.75Å; L376-V380 HydrophobicContact CD1-CB 4.07Å; L376-V380 HydrophobicContact CD1-CG2 3.79Å; L376-V380 WeakPolarHBondContact O-CB 3.44Å; L376-V380 PolarHBondContact O-N 3.21Å; L376-V388 HydrophobicContact CD2-CB 4.27Å; L376-V388 HydrophobicContact CD2-CG1 4.36Å; L376-V388 HydrophobicContact CD2-CG2 4.03Å
377	S	93.7	Very high	92.2	Very high	23 Å²	23	25.7 Å²	25.7	16%	0.161	14%	0.135	C	C	.	.	H	α-helix	trans	-58.1	-43.3	174.8	158.8	0	0	0	0	112.1	Y344 L373 R374 M375 G381 D382 T385	Y344-S377 PolarHBondContact OH-OG 3.37Å; L373-S377 WeakPolarHBondContact O-CB 3.31Å; L373-S377 PolarHBondContact O-N 3.25Å; R374-S377 WeakPolarHBondContact O-CB 3.23Å; R374-S377 PolarHBondContact O-N 2.95Å; M375-S377 PolarHBondContact O-N 3.2Å; S377-G381 VanDerWaalsContact O-CA 3.26Å; S377-G381 WeakPolarHBondContact O-CA 3.22Å; S377-G381 PolarHBondContact O-N 3.33Å; S377-G381 VanDerWaalsContact O-N 3.12Å; S377-D382 PolarHBondContact OG-OD1 2.81Å; S377-T385 WeakPolarHBondContact CA-OG1 3.46Å; S377-T385 PolarHBondContact N-OG1 3.39Å
378	L	92.7	Very high	92.3	Very high	87 Å²	87	22.2 Å²	22.2	46%	0.455	12%	0.122	S	C	.	.	H	α-helix	trans	-64.4	-42.1	-178.5	-173.5	65	0	0	0	112.9	W327 R374 M375 L376	W327-L378 HydrophobicContact CZ2-CD2 4.23Å; R374-L378 PolarHBondContact O-N 3.13Å; M375-L378 PolarHBondContact O-N 2.05Å; M375-L378 HydrophobicContact SD-CD2 4.46Å; L376-L378 VanDerWaalsContact C-N 3.33Å; L376-L378 PolarHBondContact O-N 3.23Å
379	H	91.7	Very high	92.5	Very high	44 Å²	44	22.2 Å²	22.2	20%	0.204	12%	0.122	C	C	.	.	H	α-helix	trans	-93	-39	-173.6	-71.1	-65.4	0	0	0	114.3	P39 D41 I158 R165 M375 L376	P39-H379 PolarHBondContact O-CD2 2.77Å; P39-H379 PolarHBondContact O-CE1 3.02Å; P39-H379 VanDerWaalsContact O-CG 3.29Å; P39-H379 PolarHBondContact O-ND1 3.33Å; P39-H379 PolarHBondContact O-NE2 3.23Å; P39-H379 VanDerWaalsContact O-NE2 3.08Å; D41-H379 PolarHBondContact O-CE1 3.44Å; D41-H379 PolarHBondContact O-NE2 2.82Å; D41-H379 VanDerWaalsContact O-NE2 3.09Å; I158-H379 HydrophobicContact CG2-CB 3.57Å; R165-H379 PolarHBondContact NH2-O 3.06Å; M375-H379 PolarHBondContact O-CD2 2.81Å; M375-H379 VanDerWaalsContact O-CD2 3.24Å; M375-H379 PolarHBondContact O-N 2.96Å; M375-H379 VanDerWaalsContact O-N 3.15Å; L376-H379 PolarHBondContact O-N 2.75Å
380	V	90.7	Very high	92.6	Very high	5 Å²	5	27 Å²	27	3%	0.03	14%	0.143	C	C	.	.	H	α-helix	trans	-103.9	-24.4	-169.1	-176.4	0	0	0	0	111.4	I158 A161 R165 L376 I384	I158-V380 HydrophobicContact CG2-CG2 4.15Å; A161-V380 HydrophobicContact CB-CG1 4.25Å; A161-V380 HydrophobicContact CB-CG2 3.75Å; A161-V380 WeakPolarHBondContact O-CG1 3.15Å; R165-V380 VanDerWaalsContact NH2-C 3.29Å; R165-V380 PolarHBondContact NH2-O 3.33Å; L376-V380 HydrophobicContact CD1-CB 4.07Å; L376-V380 HydrophobicContact CD1-CG2 3.79Å; L376-V380 WeakPolarHBondContact O-CB 3.44Å; L376-V380 PolarHBondContact O-N 3.21Å; V380-I384 HydrophobicContact CG1-CB 3.85Å; V380-I384 HydrophobicContact CG1-CD1 3.24Å; V380-I384 HydrophobicContact CG1-CG1 4.08Å; V380-I384 HydrophobicContact CG1-CG2 3.75Å
381	G	90.9	Very high	92.6	Very high	25 Å²	25	28.3 Å²	28.3	26%	0.258	15%	0.15	S	C	.	.			trans	104.2	170.1	176.4	0	0	0	0	0	113.6	S377 T385	S377-G381 VanDerWaalsContact O-CA 3.26Å; S377-G381 WeakPolarHBondContact O-CA 3.22Å; S377-G381 PolarHBondContact O-N 3.33Å; S377-G381 VanDerWaalsContact O-N 3.12Å; G381-T385 PolarHBondContact O-N 3.08Å; G381-T385 PolarHBondContact O-OG1 2.95Å
382	D	91.7	Very high	92.6	Very high	68 Å²	68	28.1 Å²	28.1	36%	0.364	15%	0.149	S	C	.	.	H	α-helix	trans	-71.3	-34	-170.7	-84.4	-9.2	0	0	0	114	K343 Y344 S377 I384 T385 A386	K343-D382 IonicContact NZ-OD2 2.72Å; K343-D382 PolarHBondContact NZ-OD2 3.11Å; Y344-D382 HydrophobicContact CE1-CB 4.07Å; Y344-D382 PolarHBondContact OH-OD1 3.48Å; S377-D382 PolarHBondContact OG-OD1 2.81Å; D382-I384 PolarHBondContact O-N 3.45Å; D382-T385 PolarHBondContact O-N 3.41Å; D382-A386 WeakPolarHBondContact O-CB 3.29Å; D382-A386 PolarHBondContact O-N 3.06Å
383	L	89.7	Confident	92.5	Very high	116 Å²	116	30.1 Å²	30.1	61%	0.607	16%	0.157	S	C	*	.	H	α-helix	trans	-60.5	-48.8	-177.2	177.9	63.9	0	0	0	112.2	A386 E387	L383-A386 WeakPolarHBondContact O-CB 3.48Å; L383-A386 PolarHBondContact O-N 2.91Å; L383-E387 PolarHBondContact O-N 3.21Å; L383-E387 VanDerWaalsContact O-N 3.14Å
384	I	90.5	Very high	92.3	Very high	12 Å²	12	34.1 Å²	34.1	6%	0.062	18%	0.177	C	C	.	.	H	α-helix	trans	-69.7	-41.3	-177.3	-67.6	168.7	0	0	0	110	Q164 V380 D382 A386 E387 V388	Q164-I384 HydrophobicContact CG-CD1 3.51Å; Q164-I384 HydrophobicContact CG-CG1 4.33Å; V380-I384 HydrophobicContact CG1-CB 3.85Å; V380-I384 HydrophobicContact CG1-CD1 3.24Å; V380-I384 HydrophobicContact CG1-CG1 4.08Å; V380-I384 HydrophobicContact CG1-CG2 3.75Å; D382-I384 PolarHBondContact O-N 3.45Å; I384-A386 VanDerWaalsContact C-N 3.25Å; I384-A386 PolarHBondContact O-N 3.19Å; I384-E387 PolarHBondContact O-N 2.87Å; I384-V388 WeakPolarHBondContact O-CG2 3.1Å; I384-V388 PolarHBondContact O-N 3.23Å
385	T	93.4	Very high	92	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.5	-39.6	176.2	-54.1	0	0	0	0	110.9	Y344 L373 S377 G381 D382 V388 I389	Y344-T385 HydrophobicContact CE1-CG2 4.42Å; L373-T385 HydrophobicContact CD2-CG2 4.47Å; L373-T385 WeakPolarHBondContact O-CG2 2.95Å; S377-T385 WeakPolarHBondContact CA-OG1 3.46Å; S377-T385 PolarHBondContact N-OG1 3.39Å; G381-T385 PolarHBondContact O-N 3.08Å; G381-T385 PolarHBondContact O-OG1 2.95Å; D382-T385 PolarHBondContact O-N 3.41Å; T385-V388 PolarHBondContact O-N 2.89Å; T385-I389 HydrophobicContact CG2-CD1 3.94Å; T385-I389 HydrophobicContact CG2-CG1 4.5Å; T385-I389 WeakPolarHBondContact O-CB 3.44Å; T385-I389 VanDerWaalsContact O-CG1 3.24Å; T385-I389 WeakPolarHBondContact O-CG1 3.42Å; T385-I389 PolarHBondContact O-N 3.24Å
386	A	93.3	Very high	91.5	Very high	11 Å²	11	36.7 Å²	36.7	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-43.8	175.1	0	0	0	0	0	112	Y344 L348 D382 L383 I384 I389 K390	Y344-A386 HydrophobicContact CD1-CB 3.82Å; Y344-A386 HydrophobicContact CE1-CB 4.46Å; L348-A386 HydrophobicContact CD1-CB 3.98Å; L348-A386 VanDerWaalsContact CD1-O 3.3Å; L348-A386 WeakPolarHBondContact CD1-O 3.3Å; L348-A386 HydrophobicContact CD2-CB 4.17Å; L348-A386 HydrophobicContact CG-CB 4.32Å; D382-A386 WeakPolarHBondContact O-CB 3.29Å; D382-A386 PolarHBondContact O-N 3.06Å; L383-A386 WeakPolarHBondContact O-CB 3.48Å; L383-A386 PolarHBondContact O-N 2.91Å; I384-A386 VanDerWaalsContact C-N 3.25Å; I384-A386 PolarHBondContact O-N 3.19Å; A386-I389 PolarHBondContact O-N 2.94Å; A386-K390 WeakPolarHBondContact O-CB 3.47Å; A386-K390 PolarHBondContact O-N 3.15Å
387	E	91.9	Very high	90.3	Very high	45 Å²	45	37.5 Å²	37.5	21%	0.21	20%	0.201	C	C	.	.	H	α-helix	trans	-64.1	-42.4	177.1	-70.7	178.7	-173	0	0	112.5	R172 V176 L383 I384 K390 N391	R172-E387 IonicContact CZ-OE1 3.89Å; R172-E387 IonicContact CZ-OE2 3.72Å; R172-E387 IonicContact NE-OE2 3.99Å; R172-E387 VanDerWaalsContact NH1-CD 3.32Å; R172-E387 IonicContact NH1-OE1 2.85Å; R172-E387 PolarHBondContact NH1-OE1 3.32Å; R172-E387 IonicContact NH1-OE2 2.77Å; R172-E387 PolarHBondContact NH1-OE2 2.74Å; R172-E387 IonicContact NH2-OE1 3.89Å; R172-E387 PolarHBondContact NH2-OE1 2.02Å; R172-E387 IonicContact NH2-OE2 3.57Å; R172-E387 PolarHBondContact NH2-OE2 3.12Å; V176-E387 HydrophobicContact CG1-CB 4.15Å; V176-E387 HydrophobicContact CG2-CB 4.32Å; L383-E387 PolarHBondContact O-N 3.21Å; L383-E387 VanDerWaalsContact O-N 3.14Å; I384-E387 PolarHBondContact O-N 2.87Å; E387-K390 WeakPolarHBondContact O-CB 3.41Å; E387-K390 PolarHBondContact O-N 3.05Å; E387-N391 PolarHBondContact O-N 2.75Å
388	V	93.7	Very high	88.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-45.9	174.5	171.8	0	0	0	0	110.7	V176 I179 I183 L373 L376 I384 T385 K390 N391 I392	V176-V388 HydrophobicContact CG1-CG2 3.99Å; V176-V388 HydrophobicContact CG2-CG2 4.49Å; I179-V388 HydrophobicContact CB-CG2 4.42Å; I179-V388 HydrophobicContact CG2-CG1 4.05Å; I179-V388 HydrophobicContact CG2-CG2 3.9Å; I183-V388 HydrophobicContact CD1-CG1 4.04Å; L373-V388 HydrophobicContact CD2-CG1 3.87Å; L376-V388 HydrophobicContact CD2-CB 4.27Å; L376-V388 HydrophobicContact CD2-CG1 4.36Å; L376-V388 HydrophobicContact CD2-CG2 4.03Å; I384-V388 WeakPolarHBondContact O-CG2 3.1Å; I384-V388 PolarHBondContact O-N 3.23Å; T385-V388 PolarHBondContact O-N 2.89Å; V388-K390 VanDerWaalsContact C-N 3.3Å; V388-K390 PolarHBondContact O-N 2.89Å; V388-N391 PolarHBondContact O-N 2.81Å; V388-I392 HydrophobicContact CG1-CD1 3.74Å; V388-I392 HydrophobicContact CG1-CG1 4.36Å; V388-I392 VanDerWaalsContact O-CG1 3.26Å; V388-I392 WeakPolarHBondContact O-CG1 3.41Å; V388-I392 PolarHBondContact O-N 3.24Å
389	I	93.9	Very high	86.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.4	-42.7	176.4	-71.1	167.9	0	0	0	110.8	I341 Y344 F360 L373 T385 A386 I392 W393	I341-I389 HydrophobicContact CD1-CD1 3.93Å; I341-I389 HydrophobicContact CD1-CG1 4.44Å; Y344-I389 HydrophobicContact CD1-CD1 4.33Å; Y344-I389 HydrophobicContact CD2-CD1 3.47Å; Y344-I389 VanDerWaalsContact CD2-CD1 3.47Å; Y344-I389 HydrophobicContact CE2-CD1 4.07Å; Y344-I389 HydrophobicContact CG-CD1 3.63Å; F360-I389 HydrophobicContact CE1-CG2 4.33Å; L373-I389 HydrophobicContact CD1-CD1 4.42Å; L373-I389 HydrophobicContact CD1-CG1 3.9Å; L373-I389 HydrophobicContact CD2-CG1 3.99Å; T385-I389 HydrophobicContact CG2-CD1 3.94Å; T385-I389 HydrophobicContact CG2-CG1 4.5Å; T385-I389 WeakPolarHBondContact O-CB 3.44Å; T385-I389 VanDerWaalsContact O-CG1 3.24Å; T385-I389 WeakPolarHBondContact O-CG1 3.42Å; T385-I389 PolarHBondContact O-N 3.24Å; A386-I389 PolarHBondContact O-N 2.94Å; I389-I392 PolarHBondContact O-N 3.31Å; I389-W393 WeakPolarHBondContact O-CB 2.94Å; I389-W393 PolarHBondContact O-N 3.09Å
390	K	92.9	Very high	85	Confident	100 Å²	100	47.3 Å²	47.3	44%	0.435	24%	0.241	S	C	.	.	H	α-helix	trans	-60.3	-48	176.8	-175.4	177.5	177.2	-178.5	0	111.7	L348 I350 A386 E387 V388 W393 I394	L348-K390 HydrophobicContact CD1-CB 4.15Å; I350-K390 HydrophobicContact CD1-CB 3.96Å; I350-K390 HydrophobicContact CD1-CG 3.9Å; A386-K390 WeakPolarHBondContact O-CB 3.47Å; A386-K390 PolarHBondContact O-N 3.15Å; E387-K390 WeakPolarHBondContact O-CB 3.41Å; E387-K390 PolarHBondContact O-N 3.05Å; V388-K390 VanDerWaalsContact C-N 3.3Å; V388-K390 PolarHBondContact O-N 2.89Å; K390-W393 WeakPolarHBondContact O-CB 3.33Å; K390-W393 PolarHBondContact O-N 3.31Å; K390-I394 HydrophobicContact CG-CD1 3.92Å; K390-I394 WeakPolarHBondContact O-CG1 3.46Å; K390-I394 PolarHBondContact O-N 3.5Å
391	N	92.2	Very high	82.9	Confident	30 Å²	30	55.2 Å²	55.2	16%	0.16	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-44.9	-179.3	-167.1	2.3	0	0	0	111	V176 D177 E387 V388 W393 I394 N395	V176-N391 HydrophobicContact CG1-CB 4.37Å; D177-N391 WeakPolarHBondContact CA-ND2 3.4Å; D177-N391 PolarHBondContact OD1-ND2 2.79Å; E387-N391 PolarHBondContact O-N 2.75Å; V388-N391 PolarHBondContact O-N 2.81Å; N391-W393 VanDerWaalsContact C-N 3.29Å; N391-W393 PolarHBondContact O-N 2.77Å; N391-I394 PolarHBondContact O-N 2.86Å; N391-N395 WeakPolarHBondContact O-CB 3.47Å; N391-N395 PolarHBondContact O-N 3.26Å; N391-N395 PolarHBondContact OD1-ND2 3.23Å
392	I	93.2	Very high	80.2	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-41	174.9	-64.1	172.4	0	0	0	111	I183 Q184 F360 L365 V388 I389 T396	I183-I392 HydrophobicContact CB-CD1 4.26Å; I183-I392 HydrophobicContact CD1-CD1 4.3Å; I183-I392 HydrophobicContact CG2-CD1 4Å; Q184-I392 HydrophobicContact CG-CG1 4.26Å; Q184-I392 HydrophobicContact CG-CG2 4.04Å; Q184-I392 PolarHBondContact NE2-O 3.02Å; F360-I392 HydrophobicContact CE2-CG2 3.93Å; F360-I392 HydrophobicContact CZ-CB 4.35Å; F360-I392 HydrophobicContact CZ-CG2 3.82Å; L365-I392 HydrophobicContact CD2-CD1 4.3Å; L365-I392 HydrophobicContact CD2-CG2 4.03Å; V388-I392 HydrophobicContact CG1-CD1 3.74Å; V388-I392 HydrophobicContact CG1-CG1 4.36Å; V388-I392 VanDerWaalsContact O-CG1 3.26Å; V388-I392 WeakPolarHBondContact O-CG1 3.41Å; V388-I392 PolarHBondContact O-N 3.24Å; I389-I392 PolarHBondContact O-N 3.31Å; I392-T396 HydrophobicContact CG2-CG2 4.4Å; I392-T396 WeakPolarHBondContact O-CB 3.32Å; I392-T396 VanDerWaalsContact O-CG2 3.24Å; I392-T396 WeakPolarHBondContact O-CG2 3.5Å; I392-T396 PolarHBondContact O-N 3.01Å; I392-T396 VanDerWaalsContact O-N 3.08Å; I392-T396 PolarHBondContact O-OG1 2.92Å
393	W	91.7	Very high	77.2	Confident	41 Å²	41	61.5 Å²	61.5	16%	0.155	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-50.1	177.1	-178.1	-80.4	0	0	0	112	T345 I350 D356 F360 I389 K390 N391 N395 T396 G397	T345-W393 HydrophobicContact CG2-CE3 4.48Å; T345-W393 HydrophobicContact CG2-CZ3 4.49Å; I350-W393 HydrophobicContact CG2-CB 4.47Å; I350-W393 HydrophobicContact CG2-CD2 3.62Å; I350-W393 VanDerWaalsContact CG2-CE2 3.42Å; I350-W393 HydrophobicContact CG2-CE3 4.46Å; I350-W393 HydrophobicContact CG2-CG 3.56Å; I350-W393 HydrophobicContact CG2-CZ2 4.13Å; D356-W393 HydrophobicContact CB-CH2 4.01Å; F360-W393 HydrophobicContact CB-CE3 3.88Å; F360-W393 HydrophobicContact CB-CH2 4.23Å; F360-W393 HydrophobicContact CB-CZ3 3.37Å; F360-W393 AromaticContact CD1-CE3 3.5Å; F360-W393 HydrophobicContact CD1-CE3 3.5Å; F360-W393 AromaticContact CD1-CZ3 3.69Å; F360-W393 HydrophobicContact CD1-CZ3 3.69Å; F360-W393 HydrophobicContact CD2-CD2 4.41Å; F360-W393 AromaticContact CD2-CE3 3.6Å; F360-W393 HydrophobicContact CD2-CE3 3.6Å; F360-W393 HydrophobicContact CD2-CZ3 4.02Å; F360-W393 AromaticContact CE1-CE3 3.83Å; F360-W393 HydrophobicContact CE1-CE3 3.83Å; F360-W393 HydrophobicContact CE1-CZ3 4.44Å; F360-W393 HydrophobicContact CE2-CB 4.24Å; F360-W393 AromaticContact CE2-CE3 3.94Å; F360-W393 HydrophobicContact CE2-CE3 3.94Å; F360-W393 AromaticContact CG-CE3 3.37Å; F360-W393 HydrophobicContact CG-CE3 3.37Å; F360-W393 AromaticContact CG-CZ3 3.42Å; F360-W393 HydrophobicContact CG-CZ3 3.42Å; F360-W393 VanDerWaalsContact CG-CZ3 3.42Å; F360-W393 HydrophobicContact CZ-CB 4.17Å; F360-W393 HydrophobicContact CZ-CE3 4.04Å; I389-W393 WeakPolarHBondContact O-CB 2.94Å; I389-W393 PolarHBondContact O-N 3.09Å; K390-W393 WeakPolarHBondContact O-CB 3.33Å; K390-W393 PolarHBondContact O-N 3.31Å; N391-W393 VanDerWaalsContact C-N 3.29Å; N391-W393 PolarHBondContact O-N 2.77Å; W393-N395 VanDerWaalsContact C-N 3.34Å; W393-N395 PolarHBondContact O-N 3.06Å; W393-T396 WeakPolarHBondContact CA-OG1 3.38Å; W393-T396 CarbonylContact O-C 3.54Å; W393-T396 PolarHBondContact O-N 2.77Å; W393-T396 VanDerWaalsContact O-N 3.16Å; W393-T396 PolarHBondContact O-OG1 2.97Å; W393-G397 PolarHBondContact O-N 3.23Å
394	I	89.5	Confident	74.8	Confident	84 Å²	84	62.3 Å²	62.3	43%	0.431	32%	0.319	S	S	.	.	H	α-helix	trans	-59.5	-47.1	-179.4	-68	166.6	0	0	0	110.5	K390 N391 T396 G397	K390-I394 HydrophobicContact CG-CD1 3.92Å; K390-I394 WeakPolarHBondContact O-CG1 3.46Å; K390-I394 PolarHBondContact O-N 3.5Å; N391-I394 PolarHBondContact O-N 2.86Å; I394-T396 PolarHBondContact O-N 2.74Å; I394-G397 PolarHBondContact O-N 3.33Å
395	N	87.5	Confident	72	Confident	64 Å²	64	69.7 Å²	69.7	34%	0.342	35%	0.353	S	S	.	.	H	α-helix	trans	-67.2	-22.2	-179.5	-70	-12.5	0	0	0	113.3	N391 W393	N391-N395 WeakPolarHBondContact O-CB 3.47Å; N391-N395 PolarHBondContact O-N 3.26Å; N391-N395 PolarHBondContact OD1-ND2 3.23Å; W393-N395 VanDerWaalsContact C-N 3.34Å; W393-N395 PolarHBondContact O-N 3.06Å
396	T	83.1	Confident	69.1	Low	13 Å²	13	72.2 Å²	72.2	8%	0.08	38%	0.379	C	S	.	.	H	α-helix	trans	-97.6	-25.2	177.5	52.9	0	0	0	0	113.2	F360 C364 I392 W393 I394 H398 K399 L400	F360-T396 WeakPolarHBondContact CE2-OG1 3.41Å; C364-T396 WeakPolarHBondContact SG-CG2 3.35Å; I392-T396 HydrophobicContact CG2-CG2 4.4Å; I392-T396 WeakPolarHBondContact O-CB 3.32Å; I392-T396 VanDerWaalsContact O-CG2 3.24Å; I392-T396 WeakPolarHBondContact O-CG2 3.5Å; I392-T396 PolarHBondContact O-N 3.01Å; I392-T396 VanDerWaalsContact O-N 3.08Å; I392-T396 PolarHBondContact O-OG1 2.92Å; W393-T396 WeakPolarHBondContact CA-OG1 3.38Å; W393-T396 CarbonylContact O-C 3.54Å; W393-T396 PolarHBondContact O-N 2.77Å; W393-T396 VanDerWaalsContact O-N 3.16Å; W393-T396 PolarHBondContact O-OG1 2.97Å; I394-T396 PolarHBondContact O-N 2.74Å; T396-H398 VanDerWaalsContact C-N 3.27Å; T396-H398 PolarHBondContact O-N 2.95Å; T396-K399 WeakPolarHBondContact O-CA 3.43Å; T396-K399 WeakPolarHBondContact O-CB 3.39Å; T396-K399 PolarHBondContact O-N 3Å; T396-L400 WeakPolarHBondContact O-CD1 3.25Å; T396-L400 PolarHBondContact O-N 2.85Å
397	G	69	Low	66.5	Low	17 Å²	17	78.8 Å²	78.8	18%	0.175	41%	0.412	C	S	.	.	H	α-helix	trans	-58.9	-36.8	176.5	0	0	0	0	0	112.6	W393 I394 K399 L400 H401	W393-G397 PolarHBondContact O-N 3.23Å; I394-G397 PolarHBondContact O-N 3.33Å; G397-K399 PolarHBondContact O-N 2.87Å; G397-K399 VanDerWaalsContact O-N 3.12Å; G397-L400 PolarHBondContact O-N 3.22Å; G397-H401 PolarHBondContact O-N 2.7Å
398	H	57	Low	64.2	Low	153 Å²	153	83.8 Å²	83.8	71%	0.708	44%	0.436	S	S	*	.	H	α-helix	trans	-56.8	-25.8	170.5	-86.1	-78.3	0	0	0	113.5	T396	T396-H398 VanDerWaalsContact C-N 3.27Å; T396-H398 PolarHBondContact O-N 2.95Å
399	K	56.2	Low	61.9	Low	165 Å²	165	89 Å²	89	72%	0.717	46%	0.464	S	S	*	.	H	α-helix	trans	-94.3	-15.2	178.1	-59.7	-177.5	-178.8	177.5	0	113.5	T396 G397	T396-K399 WeakPolarHBondContact O-CA 3.43Å; T396-K399 WeakPolarHBondContact O-CB 3.39Å; T396-K399 PolarHBondContact O-N 3Å; G397-K399 PolarHBondContact O-N 2.87Å; G397-K399 VanDerWaalsContact O-N 3.12Å
400	L	52	Low	59.8	Low	43 Å²	43	92.6 Å²	92.6	23%	0.225	49%	0.489	C	S	.	.	H	α-helix	trans	-87.6	-23.4	179.6	-96.6	96.9	0	0	0	113.7	R359 T396 G397	R359-L400 HydrophobicContact CG-CD2 4.16Å; T396-L400 WeakPolarHBondContact O-CD1 3.25Å; T396-L400 PolarHBondContact O-N 2.85Å; G397-L400 PolarHBondContact O-N 3.22Å
401	H	46.8	Very low	57.6	Low	171 Å²	171	96.5 Å²	96.5	79%	0.792	50%	0.501	S	S	*	.	S	Bend	trans	-88.6	0.4	179.8	-79.7	-76.6	0	0	0	115.1	G397 P403	G397-H401 PolarHBondContact O-N 2.7Å; H401-P403 VanDerWaalsContact O-CD 3.31Å; H401-P403 WeakPolarHBondContact O-CD 3.38Å
402	I	34.2	Very low	55.8	Low	119 Å²	119	99.6 Å²	99.6	61%	0.61	52%	0.517	S	S	*	.	S	Bend	trans	-85.5	112.9	171.7	-55	171.3	0	0	0	107.6	V404	I402-V404 PolarHBondContact O-N 2.8Å
403	P	30	Very low	53.9	Low	105 Å²	105	106.5 Å²	106.5	68%	0.682	55%	0.549	S	S	*	.			trans	-59.8	133.1	172	23.9	-29.9	0	0	0	108.7	H401 H405	H401-P403 VanDerWaalsContact O-CD 3.31Å; H401-P403 WeakPolarHBondContact O-CD 3.38Å; P403-H405 PolarHBondContact O-N 3.16Å
404	V	38.3	Very low	52.1	Low	133 Å²	133	110.5 Å²	110.5	81%	0.806	57%	0.571	S	S	*	*			trans	-69.4	82.6	171.5	-179	0	0	0	0	107.1	I402	I402-V404 PolarHBondContact O-N 2.8Å
405	H	32.5	Very low	50.8	Low	167 Å²	167	112.2 Å²	112.2	77%	0.773	58%	0.577	S	S	*	*			trans	-72.5	127.6	154.1	-105.5	2.8	0	0	0	107.5	P403	P403-H405 PolarHBondContact O-N 3.16Å
406	G	32.8	Very low	49.8	Very low	54 Å²	54	114.1 Å²	114.1	56%	0.557	59%	0.587	S	S	*	*			trans	-62	137.9	-165.2	0	0	0	0	0	112.7	E408	G406-E408 PolarHBondContact O-N 3.43Å
407	N	39.1	Very low	48.5	Very low	148 Å²	148	120.4 Å²	120.4	79%	0.791	62%	0.615	S	S	*	*	S	Bend	trans	52.7	-12.2	150	-84.9	-7.4	0	0	0	122
408	E	43.1	Very low	48.1	Very low	150 Å²	150	129.1 Å²	129.1	70%	0.701	64%	0.643	S	S	*	*	S	Bend	trans	-92.2	-43.8	-178.1	-74.4	-177.4	152.5	0	0	112.5	G406 S410 R411 L412	G406-E408 PolarHBondContact O-N 3.43Å; E408-S410 PolarHBondContact O-N 2.55Å; E408-R411 WeakPolarHBondContact O-CB 3.45Å; E408-R411 PolarHBondContact O-N 3.36Å; E408-R411 VanDerWaalsContact O-N 3.16Å; E408-L412 PolarHBondContact O-N 3.5Å
409	D	45.7	Very low	48.4	Very low	110 Å²	110	125.9 Å²	125.9	59%	0.588	64%	0.642	S	S	*	*	H	α-helix	trans	-70	-31.3	-175.8	-75.6	-24.2	0	0	0	114.2	R411 Q413	D409-R411 VanDerWaalsContact C-N 3.34Å; D409-Q413 WeakPolarHBondContact O-CG 3.35Å; D409-Q413 PolarHBondContact O-N 3.17Å
410	S	49.3	Very low	48.5	Very low	76 Å²	76	126 Å²	126	53%	0.531	64%	0.643	S	S	.	*	H	α-helix	trans	-74.6	-26.5	175.4	-61.1	0	0	0	0	112.5	E408 M414	E408-S410 PolarHBondContact O-N 2.55Å; S410-M414 WeakPolarHBondContact O-CB 3.11Å; S410-M414 WeakPolarHBondContact O-CE 3.35Å; S410-M414 PolarHBondContact O-N 2.99Å
411	R	46.5	Very low	48.4	Very low	182 Å²	182	129 Å²	129	69%	0.687	66%	0.663	S	S	*	*	H	α-helix	trans	-73.2	-46.4	171.6	-111.3	-178.9	174.7	-178	-3.1	110.2	E408 D409 Q413 M414 E415	E408-R411 WeakPolarHBondContact O-CB 3.45Å; E408-R411 PolarHBondContact O-N 3.36Å; E408-R411 VanDerWaalsContact O-N 3.16Å; D409-R411 VanDerWaalsContact C-N 3.34Å; R411-Q413 PolarHBondContact O-N 2.92Å; R411-M414 PolarHBondContact O-N 3.01Å; R411-E415 WeakPolarHBondContact O-CB 3.31Å; R411-E415 WeakPolarHBondContact O-CG 3.27Å; R411-E415 PolarHBondContact O-N 3.27Å
412	L	54.2	Low	48.3	Very low	94 Å²	94	125.9 Å²	125.9	49%	0.492	66%	0.658	S	S	.	*	H	α-helix	trans	-61.4	-39.8	176.2	-101.4	121.4	0	0	0	113	E408 E415 L416	E408-L412 PolarHBondContact O-N 3.5Å; L412-E415 PolarHBondContact O-N 3.27Å; L412-L416 HydrophobicContact CD2-CD1 4.46Å; L412-L416 WeakPolarHBondContact O-CB 3.35Å; L412-L416 PolarHBondContact O-N 3.25Å
413	Q	54	Low	49	Very low	148 Å²	148	125.5 Å²	125.5	69%	0.692	67%	0.666	S	S	*	*	H	α-helix	trans	-70.5	-34.4	175.7	-76.1	-166.4	-10.1	0	0	113.3	D409 R411 H417	D409-Q413 WeakPolarHBondContact O-CG 3.35Å; D409-Q413 PolarHBondContact O-N 3.17Å; R411-Q413 PolarHBondContact O-N 2.92Å; Q413-H417 WeakPolarHBondContact O-CB 3.45Å; Q413-H417 PolarHBondContact O-N 3.36Å
414	M	52.9	Low	49.9	Very low	125 Å²	125	127.4 Å²	127.4	62%	0.616	67%	0.67	S	S	*	*	H	α-helix	trans	-71.7	-35.3	172.7	-85.2	-172.6	-105.4	0	0	112.4	S410 R411 H417 R418	S410-M414 WeakPolarHBondContact O-CB 3.11Å; S410-M414 WeakPolarHBondContact O-CE 3.35Å; S410-M414 PolarHBondContact O-N 2.99Å; R411-M414 PolarHBondContact O-N 3.01Å; M414-H417 PolarHBondContact O-N 2.87Å; M414-R418 VanDerWaalsContact O-CB 3.29Å; M414-R418 WeakPolarHBondContact O-CB 3.5Å; M414-R418 PolarHBondContact O-N 2.76Å
415	E	63.9	Low	49.7	Very low	120 Å²	120	132.2 Å²	132.2	56%	0.561	69%	0.691	S	S	*	*	H	α-helix	trans	-70.9	-39.6	175.1	-75.2	179.7	175	0	0	111.8	R411 L412 H417 R418 A419	R411-E415 WeakPolarHBondContact O-CB 3.31Å; R411-E415 WeakPolarHBondContact O-CG 3.27Å; R411-E415 PolarHBondContact O-N 3.27Å; L412-E415 PolarHBondContact O-N 3.27Å; E415-H417 PolarHBondContact O-N 3.33Å; E415-R418 PolarHBondContact O-N 3.49Å; E415-A419 WeakPolarHBondContact O-CB 3.44Å; E415-A419 PolarHBondContact O-N 2.93Å
416	L	64.8	Low	50.6	Low	103 Å²	103	130.5 Å²	130.5	54%	0.539	69%	0.687	S	S	.	*	H	α-helix	trans	-65.7	-35.2	172.2	-107.3	99.5	0	0	0	112.9	L412 K420	L412-L416 HydrophobicContact CD2-CD1 4.46Å; L412-L416 WeakPolarHBondContact O-CB 3.35Å; L412-L416 PolarHBondContact O-N 3.25Å; L416-K420 PolarHBondContact O-N 3.12Å
417	H	55.7	Low	51.5	Low	146 Å²	146	134.5 Å²	134.5	68%	0.676	69%	0.694	S	S	*	*	H	α-helix	trans	-73.2	-31.3	175.1	-118.3	-70	0	0	0	112.3	Q413 M414 E415	Q413-H417 WeakPolarHBondContact O-CB 3.45Å; Q413-H417 PolarHBondContact O-N 3.36Å; M414-H417 PolarHBondContact O-N 2.87Å; E415-H417 PolarHBondContact O-N 3.33Å
418	R	60.7	Low	52.2	Low	199 Å²	199	133.8 Å²	133.8	75%	0.751	69%	0.689	S	S	*	*	H	α-helix	trans	-75.4	-29.6	175.2	-156.6	-178.1	-73.4	175.8	-4.3	112	M414 E415 K420	M414-R418 VanDerWaalsContact O-CB 3.29Å; M414-R418 WeakPolarHBondContact O-CB 3.5Å; M414-R418 PolarHBondContact O-N 2.76Å; E415-R418 PolarHBondContact O-N 3.49Å; R418-K420 VanDerWaalsContact C-N 3.34Å
419	A	63.2	Low	52.8	Low	85 Å²	85	132.8 Å²	132.8	70%	0.702	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-10.9	175.7	0	0	0	0	0	114.6	E415	E415-A419 WeakPolarHBondContact O-CB 3.44Å; E415-A419 PolarHBondContact O-N 2.93Å
420	K	58.7	Low	53.2	Low	168 Å²	168	134.3 Å²	134.3	73%	0.73	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	4	178.3	-82.8	-176.4	177.2	-178.7	0	114.7	L416 R418 P422	L416-K420 PolarHBondContact O-N 3.12Å; R418-K420 VanDerWaalsContact C-N 3.34Å; K420-P422 WeakPolarHBondContact O-CD 3.35Å
421	V	50	Low	53.5	Low	105 Å²	105	138.1 Å²	138.1	64%	0.636	71%	0.705	S	S	*	*	S	Bend	trans	-97.4	108.4	170	-176.8	0	0	0	0	107.5	S423	V421-S423 PolarHBondContact O-N 3.05Å
422	P	45.7	Very low	54	Low	106 Å²	106	135 Å²	135	69%	0.688	71%	0.707	S	S	*	*			trans	-63.4	122.7	167.8	26.8	-30.5	0	0	0	107.7	K420 N424	K420-P422 WeakPolarHBondContact O-CD 3.35Å; P422-N424 VanDerWaalsContact C-N 3.34Å; P422-N424 PolarHBondContact O-N 3.37Å
423	S	49	Very low	53.9	Low	111 Å²	111	138.2 Å²	138.2	78%	0.776	72%	0.723	S	S	*	*			trans	-64	97.7	164.5	51.3	0	0	0	0	107.7	V421	V421-S423 PolarHBondContact O-N 3.05Å
424	N	48.2	Very low	53.9	Low	146 Å²	146	137.3 Å²	137.3	78%	0.781	73%	0.726	S	S	*	*			trans	-85.3	118.5	152.3	-84.6	-3.3	0	0	0	106.1	P422	P422-N424 VanDerWaalsContact C-N 3.34Å; P422-N424 PolarHBondContact O-N 3.37Å
425	D	34.7	Very low	54	Low	234 Å²	234	138.5 Å²	138.5	100%	1.251	74%	0.736	S	S	*	*			trans	73.3	0	177.4	-55.7	-23.7	0	0	0	118.9

Retrieved 425 of 425 residues in 351.3 ms (Link to these results)

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