A0A5K4FD69_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FD69, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 469 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	51.7	Low	54.1	Low	212 Å²	212	112.5 Å²	112.5	100%	1.044	62%	0.621	S	S	*	*				0	-19.8	0	-74.5	-176.1	-133.8	0	0	113.1	A3 C4	M1-A3 PolarHBondContact O-N 3.3Å; M1-C4 PolarHBondContact O-N 3.45Å
2	E	53.3	Low	54.1	Low	179 Å²	179	111.4 Å²	111.4	84%	0.836	61%	0.613	S	S	*	*	H	α-helix	trans	-68.1	-31.4	-176.4	-68.5	172.3	154.3	0	0	115	C4 H5	E2-C4 VanDerWaalsContact C-N 3.31Å; E2-C4 PolarHBondContact O-N 3.46Å; E2-H5 PolarHBondContact O-N 3.18Å
3	A	53.4	Low	53.9	Low	79 Å²	79	114.1 Å²	114.1	65%	0.653	62%	0.615	S	S	*	*	H	α-helix	trans	-65.7	-28.3	179.4	0	0	0	0	0	114.1	M1	M1-A3 PolarHBondContact O-N 3.3Å
4	C	48.9	Very low	54.1	Low	87 Å²	87	112.9 Å²	112.9	59%	0.588	61%	0.608	S	S	*	*	H	α-helix	trans	-75.6	-31.5	178.7	-73	0	0	0	0	112.7	M1 E2 I8	M1-C4 PolarHBondContact O-N 3.45Å; E2-C4 VanDerWaalsContact C-N 3.31Å; E2-C4 PolarHBondContact O-N 3.46Å; C4-I8 WeakPolarHBondContact O-CD1 3.17Å; C4-I8 WeakPolarHBondContact O-CG1 3.33Å; C4-I8 PolarHBondContact O-N 3.48Å
5	H	52.8	Low	54.6	Low	135 Å²	135	110.5 Å²	110.5	63%	0.625	60%	0.599	S	S	*	*	H	α-helix	trans	-70.9	-32.2	179.5	-81.5	-91.1	0	0	0	112.5	E2 S9	E2-H5 PolarHBondContact O-N 3.18Å; H5-S9 WeakPolarHBondContact O-CB 3.44Å; H5-S9 PolarHBondContact O-N 3.27Å; H5-S9 VanDerWaalsContact O-N 3.15Å; H5-S9 PolarHBondContact O-OG 3.22Å
6	A	55.4	Low	55.3	Low	41 Å²	41	109.9 Å²	109.9	34%	0.339	60%	0.596	S	S	.	*	H	α-helix	trans	-65	-50.6	174.6	0	0	0	0	0	111.3	I8 S9 Y10	A6-I8 VanDerWaalsContact C-N 3.33Å; A6-I8 PolarHBondContact O-N 3.41Å; A6-S9 PolarHBondContact O-N 3.24Å; A6-S9 VanDerWaalsContact O-N 3.1Å; A6-Y10 HydrophobicContact CB-CD2 4.49Å; A6-Y10 HydrophobicContact CB-CE2 4.35Å; A6-Y10 WeakPolarHBondContact O-CD2 3.41Å; A6-Y10 PolarHBondContact O-N 3.23Å
7	N	55.7	Low	56.2	Low	122 Å²	122	105.4 Å²	105.4	65%	0.652	57%	0.574	S	S	*	*	H	α-helix	trans	-63.1	-36.1	-178	-77.2	-8.5	0	0	0	113.2	G11	N7-G11 PolarHBondContact O-N 3.35Å
8	I	58.7	Low	57.2	Low	103 Å²	103	104.7 Å²	104.7	53%	0.528	57%	0.57	S	S	.	*	H	α-helix	trans	-68.4	-38.5	175.6	-65.5	167.3	0	0	0	110.7	C4 A6 G11 L12	C4-I8 WeakPolarHBondContact O-CD1 3.17Å; C4-I8 WeakPolarHBondContact O-CG1 3.33Å; C4-I8 PolarHBondContact O-N 3.48Å; A6-I8 VanDerWaalsContact C-N 3.33Å; A6-I8 PolarHBondContact O-N 3.41Å; I8-G11 PolarHBondContact O-N 3.32Å; I8-L12 HydrophobicContact CG2-CD1 3.81Å; I8-L12 HydrophobicContact CG2-CG 4.4Å; I8-L12 WeakPolarHBondContact O-CB 3.24Å; I8-L12 WeakPolarHBondContact O-CG 3.46Å; I8-L12 PolarHBondContact O-N 3.13Å
9	S	56.7	Low	58.3	Low	75 Å²	75	106.5 Å²	106.5	52%	0.524	57%	0.572	S	S	.	*	H	α-helix	trans	-68.1	-41.4	178	-57.6	0	0	0	0	112.1	H5 A6 F13	H5-S9 WeakPolarHBondContact O-CB 3.44Å; H5-S9 PolarHBondContact O-N 3.27Å; H5-S9 VanDerWaalsContact O-N 3.15Å; H5-S9 PolarHBondContact O-OG 3.22Å; A6-S9 PolarHBondContact O-N 3.24Å; A6-S9 VanDerWaalsContact O-N 3.1Å; S9-F13 VanDerWaalsContact O-CB 3.23Å; S9-F13 WeakPolarHBondContact O-CB 3.39Å; S9-F13 PolarHBondContact O-N 3.23Å
10	Y	52.1	Low	59.2	Low	167 Å²	167	105 Å²	105	66%	0.655	57%	0.566	S	S	*	*	H	α-helix	trans	-65.9	-39.1	173.3	-74.7	-71.4	0	0	0	112	A6 N14	A6-Y10 HydrophobicContact CB-CD2 4.49Å; A6-Y10 HydrophobicContact CB-CE2 4.35Å; A6-Y10 WeakPolarHBondContact O-CD2 3.41Å; A6-Y10 PolarHBondContact O-N 3.23Å; Y10-N14 WeakPolarHBondContact O-CB 3.49Å; Y10-N14 PolarHBondContact O-N 2.79Å
11	G	56.1	Low	60.2	Low	37 Å²	37	104.3 Å²	104.3	38%	0.381	56%	0.563	S	S	.	*	H	α-helix	trans	-62.4	-48.2	174.7	0	0	0	0	0	112.7	N7 I8 N14 T15	N7-G11 PolarHBondContact O-N 3.35Å; I8-G11 PolarHBondContact O-N 3.32Å; G11-N14 PolarHBondContact O-N 2.78Å; G11-T15 WeakPolarHBondContact O-CG2 3.39Å; G11-T15 PolarHBondContact O-N 3.31Å; G11-T15 PolarHBondContact O-OG1 2.62Å
12	L	54.5	Low	61.6	Low	100 Å²	100	99.2 Å²	99.2	52%	0.524	54%	0.54	S	S	.	.	H	α-helix	trans	-66.9	-37.4	178	-76.7	168.6	0	0	0	112.6	I8 T15 N16	I8-L12 HydrophobicContact CG2-CD1 3.81Å; I8-L12 HydrophobicContact CG2-CG 4.4Å; I8-L12 WeakPolarHBondContact O-CB 3.24Å; I8-L12 WeakPolarHBondContact O-CG 3.46Å; I8-L12 PolarHBondContact O-N 3.13Å; L12-T15 VanDerWaalsContact CA-OG1 3.28Å; L12-T15 WeakPolarHBondContact CA-OG1 3.3Å; L12-T15 PolarHBondContact O-N 3.07Å; L12-T15 PolarHBondContact O-OG1 2.96Å; L12-N16 WeakPolarHBondContact O-CB 3.15Å; L12-N16 PolarHBondContact O-N 3.11Å; L12-N16 PolarHBondContact O-ND2 3.45Å
13	F	51.8	Low	62.9	Low	146 Å²	146	95 Å²	95	64%	0.64	52%	0.523	S	S	*	.	H	α-helix	trans	-66.7	-43.4	175.8	-171.4	-96.2	0	0	0	111.4	S9 N16 S17	S9-F13 VanDerWaalsContact O-CB 3.23Å; S9-F13 WeakPolarHBondContact O-CB 3.39Å; S9-F13 PolarHBondContact O-N 3.23Å; F13-N16 PolarHBondContact O-N 3.04Å; F13-S17 WeakPolarHBondContact O-CB 3.43Å; F13-S17 PolarHBondContact O-N 2.99Å; F13-S17 PolarHBondContact O-OG 3.39Å
14	N	56.5	Low	64.3	Low	97 Å²	97	95.5 Å²	95.5	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-64.3	-42.4	174.6	-90.3	3.7	0	0	0	112	Y10 G11 N16 S17 N18	Y10-N14 WeakPolarHBondContact O-CB 3.49Å; Y10-N14 PolarHBondContact O-N 2.79Å; G11-N14 PolarHBondContact O-N 2.78Å; N14-N16 VanDerWaalsContact C-N 3.34Å; N14-N16 PolarHBondContact O-N 2.86Å; N14-S17 WeakPolarHBondContact CA-OG 3.45Å; N14-S17 PolarHBondContact O-N 3.2Å; N14-S17 PolarHBondContact O-OG 3.04Å; N14-N18 WeakPolarHBondContact O-CB 3.35Å; N14-N18 VanDerWaalsContact O-CG 3.3Å; N14-N18 PolarHBondContact O-N 3.49Å; N14-N18 PolarHBondContact O-ND2 3Å
15	T	61.2	Low	65.9	Low	78 Å²	78	95.7 Å²	95.7	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-39.2	176.5	51.5	0	0	0	0	112.2	G11 L12 F19	G11-T15 WeakPolarHBondContact O-CG2 3.39Å; G11-T15 PolarHBondContact O-N 3.31Å; G11-T15 PolarHBondContact O-OG1 2.62Å; L12-T15 VanDerWaalsContact CA-OG1 3.28Å; L12-T15 WeakPolarHBondContact CA-OG1 3.3Å; L12-T15 PolarHBondContact O-N 3.07Å; L12-T15 PolarHBondContact O-OG1 2.96Å; T15-F19 VanDerWaalsContact O-CB 3.31Å; T15-F19 WeakPolarHBondContact O-CB 3.47Å; T15-F19 PolarHBondContact O-N 3.29Å
16	N	65.8	Low	67.3	Low	101 Å²	101	94.7 Å²	94.7	54%	0.54	51%	0.511	S	S	.	.	H	α-helix	trans	-66.9	-41.4	175.9	-71.8	-14.4	0	0	0	111.3	L12 F13 N14 F19 T20	L12-N16 WeakPolarHBondContact O-CB 3.15Å; L12-N16 PolarHBondContact O-N 3.11Å; L12-N16 PolarHBondContact O-ND2 3.45Å; F13-N16 PolarHBondContact O-N 3.04Å; N14-N16 VanDerWaalsContact C-N 3.34Å; N14-N16 PolarHBondContact O-N 2.86Å; N16-F19 PolarHBondContact O-N 3.02Å; N16-T20 WeakPolarHBondContact O-CB 3.26Å; N16-T20 WeakPolarHBondContact O-CG2 3.19Å; N16-T20 PolarHBondContact O-N 3.05Å; N16-T20 PolarHBondContact O-OG1 3.46Å
17	S	71.3	Confident	68.5	Low	33 Å²	33	96.2 Å²	96.2	23%	0.231	52%	0.516	C	S	.	.	H	α-helix	trans	-63.8	-43	177.6	73.9	0	0	0	0	112.4	F13 N14 T20 N21	F13-S17 WeakPolarHBondContact O-CB 3.43Å; F13-S17 PolarHBondContact O-N 2.99Å; F13-S17 PolarHBondContact O-OG 3.39Å; N14-S17 WeakPolarHBondContact CA-OG 3.45Å; N14-S17 PolarHBondContact O-N 3.2Å; N14-S17 PolarHBondContact O-OG 3.04Å; S17-T20 WeakPolarHBondContact CA-OG1 3.41Å; S17-T20 PolarHBondContact O-N 3.32Å; S17-T20 PolarHBondContact O-OG1 3.46Å; S17-N21 WeakPolarHBondContact O-CB 3.3Å; S17-N21 PolarHBondContact O-N 2.81Å; S17-N21 PolarHBondContact O-ND2 3.11Å
18	N	73.5	Confident	69.8	Low	93 Å²	93	95.9 Å²	95.9	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-45.5	176.6	-70.6	-17	0	0	0	111	N14 T20 N21 D22	N14-N18 WeakPolarHBondContact O-CB 3.35Å; N14-N18 VanDerWaalsContact O-CG 3.3Å; N14-N18 PolarHBondContact O-N 3.49Å; N14-N18 PolarHBondContact O-ND2 3Å; N18-T20 PolarHBondContact O-N 3.41Å; N18-N21 PolarHBondContact O-N 3.41Å; N18-D22 PolarHBondContact O-N 3.05Å
19	F	77.4	Confident	70.8	Confident	138 Å²	138	95.1 Å²	95.1	61%	0.605	51%	0.509	S	S	*	.	H	α-helix	trans	-62.3	-41.5	176.9	-176.2	-100.9	0	0	0	112.6	T15 N16 D22 L23	T15-F19 VanDerWaalsContact O-CB 3.31Å; T15-F19 WeakPolarHBondContact O-CB 3.47Å; T15-F19 PolarHBondContact O-N 3.29Å; N16-F19 PolarHBondContact O-N 3.02Å; F19-D22 PolarHBondContact O-N 3.11Å; F19-L23 PolarHBondContact O-N 2.92Å
20	T	77.1	Confident	71.9	Confident	76 Å²	76	97.4 Å²	97.4	47%	0.466	51%	0.511	S	S	.	.	H	α-helix	trans	-65.1	-39.8	174.8	50.9	0	0	0	0	112.1	N16 S17 N18 L23 V24	N16-T20 WeakPolarHBondContact O-CB 3.26Å; N16-T20 WeakPolarHBondContact O-CG2 3.19Å; N16-T20 PolarHBondContact O-N 3.05Å; N16-T20 PolarHBondContact O-OG1 3.46Å; S17-T20 WeakPolarHBondContact CA-OG1 3.41Å; S17-T20 PolarHBondContact O-N 3.32Å; S17-T20 PolarHBondContact O-OG1 3.46Å; N18-T20 PolarHBondContact O-N 3.41Å; T20-L23 PolarHBondContact O-N 2.9Å; T20-V24 WeakPolarHBondContact O-CB 3.12Å; T20-V24 VanDerWaalsContact O-CG2 3.22Å; T20-V24 WeakPolarHBondContact O-CG2 3.36Å; T20-V24 PolarHBondContact O-N 3.16Å
21	N	80.6	Confident	73.1	Confident	91 Å²	91	92.7 Å²	92.7	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-65.9	-40.2	177.2	-71.1	-29.1	0	0	0	111.5	S17 N18 V24 N25	S17-N21 WeakPolarHBondContact O-CB 3.3Å; S17-N21 PolarHBondContact O-N 2.81Å; S17-N21 PolarHBondContact O-ND2 3.11Å; N18-N21 PolarHBondContact O-N 3.41Å; N21-V24 PolarHBondContact O-N 3.08Å; N21-N25 WeakPolarHBondContact O-CB 3.33Å; N21-N25 VanDerWaalsContact O-CG 3.22Å; N21-N25 PolarHBondContact O-N 3.22Å; N21-N25 PolarHBondContact O-ND2 2.72Å
22	D	80.4	Confident	74.3	Confident	105 Å²	105	95.7 Å²	95.7	56%	0.561	51%	0.507	S	S	*	.	H	α-helix	trans	-66.3	-41.6	176.9	-71.7	-22	0	0	0	111.9	N18 F19 N25 L26	N18-D22 PolarHBondContact O-N 3.05Å; F19-D22 PolarHBondContact O-N 3.11Å; D22-N25 PolarHBondContact O-N 3.49Å; D22-L26 WeakPolarHBondContact O-CB 3.45Å; D22-L26 PolarHBondContact O-N 3.27Å
23	L	80.7	Confident	75.5	Confident	92 Å²	92	95.8 Å²	95.8	48%	0.482	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-40.5	175.3	-174.2	66.8	0	0	0	112	F19 T20 L26 T27	F19-L23 PolarHBondContact O-N 2.92Å; T20-L23 PolarHBondContact O-N 2.9Å; L23-L26 PolarHBondContact O-N 2.9Å; L23-T27 WeakPolarHBondContact O-CB 3.37Å; L23-T27 WeakPolarHBondContact O-CG2 3.12Å; L23-T27 PolarHBondContact O-N 2.92Å; L23-T27 PolarHBondContact O-OG1 3.47Å
24	V	82.6	Confident	76.8	Confident	89 Å²	89	94.3 Å²	94.3	54%	0.539	50%	0.499	S	S	.	.	H	α-helix	trans	-63.8	-42.1	174.2	170	0	0	0	0	110.8	T20 N21 T27 K28	T20-V24 WeakPolarHBondContact O-CB 3.12Å; T20-V24 VanDerWaalsContact O-CG2 3.22Å; T20-V24 WeakPolarHBondContact O-CG2 3.36Å; T20-V24 PolarHBondContact O-N 3.16Å; N21-V24 PolarHBondContact O-N 3.08Å; V24-T27 WeakPolarHBondContact CA-OG1 3.31Å; V24-T27 PolarHBondContact O-OG1 3.47Å; V24-K28 VanDerWaalsContact O-CB 3.25Å; V24-K28 WeakPolarHBondContact O-CB 3.47Å; V24-K28 PolarHBondContact O-N 3.36Å
25	N	83.1	Confident	78	Confident	90 Å²	90	91.6 Å²	91.6	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-41.4	174.7	-75.2	-24.7	0	0	0	111.8	N21 D22 K28 V29	N21-N25 WeakPolarHBondContact O-CB 3.33Å; N21-N25 VanDerWaalsContact O-CG 3.22Å; N21-N25 PolarHBondContact O-N 3.22Å; N21-N25 PolarHBondContact O-ND2 2.72Å; D22-N25 PolarHBondContact O-N 3.49Å; N25-K28 PolarHBondContact O-N 3.47Å; N25-V29 WeakPolarHBondContact O-CB 3.41Å; N25-V29 VanDerWaalsContact O-CG2 3.24Å; N25-V29 WeakPolarHBondContact O-CG2 3.29Å; N25-V29 PolarHBondContact O-N 2.95Å
26	L	82	Confident	79.2	Confident	114 Å²	114	93.9 Å²	93.9	60%	0.597	49%	0.493	S	S	*	.	H	α-helix	trans	-66	-46.1	179.6	-164.2	75.2	0	0	0	111.8	D22 L23 K28 V29 E30	D22-L26 WeakPolarHBondContact O-CB 3.45Å; D22-L26 PolarHBondContact O-N 3.27Å; L23-L26 PolarHBondContact O-N 2.9Å; L26-K28 VanDerWaalsContact C-N 3.3Å; L26-K28 PolarHBondContact O-N 2.94Å; L26-V29 PolarHBondContact O-N 3.41Å; L26-E30 WeakPolarHBondContact O-CB 3Å; L26-E30 PolarHBondContact O-N 3Å
27	T	81.2	Confident	80.1	Confident	73 Å²	73	96.9 Å²	96.9	45%	0.448	50%	0.497	S	S	.	.	H	α-helix	trans	-64	-36.4	175.9	51.6	0	0	0	0	111.8	L23 V24 E30 S31	L23-T27 WeakPolarHBondContact O-CB 3.37Å; L23-T27 WeakPolarHBondContact O-CG2 3.12Å; L23-T27 PolarHBondContact O-N 2.92Å; L23-T27 PolarHBondContact O-OG1 3.47Å; V24-T27 WeakPolarHBondContact CA-OG1 3.31Å; V24-T27 PolarHBondContact O-OG1 3.47Å; T27-E30 PolarHBondContact O-N 2.95Å; T27-S31 WeakPolarHBondContact O-CB 3.22Å; T27-S31 PolarHBondContact O-N 3.04Å; T27-S31 PolarHBondContact O-OG 3.45Å
28	K	82.6	Confident	80.7	Confident	116 Å²	116	99.4 Å²	99.4	50%	0.504	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-48.3	173	-173	177.5	177.4	-177	0	111.5	V24 N25 L26 E30 S31 E32	V24-K28 VanDerWaalsContact O-CB 3.25Å; V24-K28 WeakPolarHBondContact O-CB 3.47Å; V24-K28 PolarHBondContact O-N 3.36Å; N25-K28 PolarHBondContact O-N 3.47Å; L26-K28 VanDerWaalsContact C-N 3.3Å; L26-K28 PolarHBondContact O-N 2.94Å; K28-E30 VanDerWaalsContact C-N 3.32Å; K28-E30 PolarHBondContact O-N 2.91Å; K28-S31 PolarHBondContact O-N 2.78Å; K28-S31 PolarHBondContact O-OG 3.27Å; K28-E32 WeakPolarHBondContact CE-OE1 3.42Å; K28-E32 WeakPolarHBondContact O-CG 3.39Å; K28-E32 PolarHBondContact O-N 3.16Å
29	V	80.7	Confident	81.3	Confident	87 Å²	87	101 Å²	101	53%	0.527	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-42	176	170.2	0	0	0	0	111.2	N25 L26 E32 M33	N25-V29 WeakPolarHBondContact O-CB 3.41Å; N25-V29 VanDerWaalsContact O-CG2 3.24Å; N25-V29 WeakPolarHBondContact O-CG2 3.29Å; N25-V29 PolarHBondContact O-N 2.95Å; L26-V29 PolarHBondContact O-N 3.41Å; V29-E32 PolarHBondContact O-N 3.43Å; V29-M33 WeakPolarHBondContact O-CB 3.12Å; V29-M33 PolarHBondContact O-N 3.35Å
30	E	78.6	Confident	81.9	Confident	123 Å²	123	96.3 Å²	96.3	58%	0.575	49%	0.491	S	S	*	.	H	α-helix	trans	-63.5	-41.8	175.7	-171.6	175.7	-176.8	0	0	111.7	L26 T27 K28 F34	L26-E30 WeakPolarHBondContact O-CB 3Å; L26-E30 PolarHBondContact O-N 3Å; T27-E30 PolarHBondContact O-N 2.95Å; K28-E30 VanDerWaalsContact C-N 3.32Å; K28-E30 PolarHBondContact O-N 2.91Å; E30-F34 VanDerWaalsContact O-CB 3.24Å; E30-F34 WeakPolarHBondContact O-CB 3.14Å; E30-F34 PolarHBondContact O-N 3.01Å
31	S	78.4	Confident	82.5	Confident	67 Å²	67	97.1 Å²	97.1	47%	0.469	49%	0.492	S	S	.	.	H	α-helix	trans	-66.9	-42.2	177.6	76.2	0	0	0	0	112.9	T27 K28 F34 S35	T27-S31 WeakPolarHBondContact O-CB 3.22Å; T27-S31 PolarHBondContact O-N 3.04Å; T27-S31 PolarHBondContact O-OG 3.45Å; K28-S31 PolarHBondContact O-N 2.78Å; K28-S31 PolarHBondContact O-OG 3.27Å; S31-F34 PolarHBondContact O-N 2.95Å; S31-S35 PolarHBondContact O-N 3.39Å; S31-S35 PolarHBondContact O-OG 3.22Å
32	E	81.3	Confident	82.8	Confident	100 Å²	100	94.7 Å²	94.7	47%	0.467	48%	0.479	S	S	.	.	H	α-helix	trans	-66.8	-47	177	-73.2	-178.9	-178.5	0	0	110.1	K28 V29 F34 S35 E36	K28-E32 WeakPolarHBondContact CE-OE1 3.42Å; K28-E32 WeakPolarHBondContact O-CG 3.39Å; K28-E32 PolarHBondContact O-N 3.16Å; V29-E32 PolarHBondContact O-N 3.43Å; E32-F34 VanDerWaalsContact C-N 3.33Å; E32-F34 PolarHBondContact O-N 3.35Å; E32-S35 WeakPolarHBondContact CA-OG 3.48Å; E32-S35 PolarHBondContact O-N 3.1Å; E32-S35 VanDerWaalsContact O-N 3.15Å; E32-S35 PolarHBondContact O-OG 3.13Å; E32-E36 WeakPolarHBondContact O-CG 3.34Å; E32-E36 PolarHBondContact O-N 3.18Å
33	M	78.2	Confident	83.3	Confident	103 Å²	103	94.9 Å²	94.9	51%	0.507	48%	0.479	S	S	.	.	H	α-helix	trans	-57.5	-47.3	175.3	-177.9	176.9	66.7	0	0	110.7	V29 S35 E36 W37	V29-M33 WeakPolarHBondContact O-CB 3.12Å; V29-M33 PolarHBondContact O-N 3.35Å; M33-S35 VanDerWaalsContact C-N 3.34Å; M33-S35 PolarHBondContact O-N 3.48Å; M33-E36 PolarHBondContact O-N 2.8Å; M33-W37 VanDerWaalsContact CG-CD1 3.49Å; M33-W37 PolarHBondContact O-N 3.2Å
34	F	80.3	Confident	83.8	Confident	115 Å²	115	95 Å²	95	50%	0.504	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-39.1	177.5	-172.4	-115.5	0	0	0	112.5	E30 S31 E32 R38	E30-F34 VanDerWaalsContact O-CB 3.24Å; E30-F34 WeakPolarHBondContact O-CB 3.14Å; E30-F34 PolarHBondContact O-N 3.01Å; S31-F34 PolarHBondContact O-N 2.95Å; E32-F34 VanDerWaalsContact C-N 3.33Å; E32-F34 PolarHBondContact O-N 3.35Å; F34-R38 HydrophobicContact CE1-CG 4.48Å; F34-R38 VanDerWaalsContact CZ-NH2 3.31Å; F34-R38 WeakPolarHBondContact O-CB 3.27Å; F34-R38 VanDerWaalsContact O-CG 3.31Å; F34-R38 WeakPolarHBondContact O-CG 3.41Å; F34-R38 PolarHBondContact O-N 3.39Å
35	S	81.5	Confident	84.2	Confident	39 Å²	39	91.8 Å²	91.8	27%	0.273	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-44.3	175	63.8	0	0	0	0	112.3	S31 E32 M33 W37 R38 F39	S31-S35 PolarHBondContact O-N 3.39Å; S31-S35 PolarHBondContact O-OG 3.22Å; E32-S35 WeakPolarHBondContact CA-OG 3.48Å; E32-S35 PolarHBondContact O-N 3.1Å; E32-S35 VanDerWaalsContact O-N 3.15Å; E32-S35 PolarHBondContact O-OG 3.13Å; M33-S35 VanDerWaalsContact C-N 3.34Å; M33-S35 PolarHBondContact O-N 3.48Å; S35-W37 PolarHBondContact O-N 3.17Å; S35-R38 WeakPolarHBondContact O-CB 3.41Å; S35-R38 PolarHBondContact O-N 2.95Å; S35-R38 VanDerWaalsContact O-N 3.17Å; S35-F39 WeakPolarHBondContact O-CD2 3.17Å; S35-F39 PolarHBondContact O-N 3.44Å
36	E	85.2	Confident	84.5	Confident	126 Å²	126	88.9 Å²	88.9	59%	0.589	44%	0.443	S	S	*	.	H	α-helix	trans	-62.5	-45.1	178.8	-71.2	-55.7	131.6	0	0	111.4	E32 M33 R38 F39 A40	E32-E36 WeakPolarHBondContact O-CG 3.34Å; E32-E36 PolarHBondContact O-N 3.18Å; M33-E36 PolarHBondContact O-N 2.8Å; E36-R38 VanDerWaalsContact C-N 3.33Å; E36-R38 PolarHBondContact O-N 3.09Å; E36-F39 PolarHBondContact O-N 2.95Å; E36-A40 WeakPolarHBondContact O-CB 3.4Å; E36-A40 PolarHBondContact O-N 3.32Å
37	W	85.1	Confident	85	Confident	164 Å²	164	86.5 Å²	86.5	62%	0.621	44%	0.436	S	S	*	.	H	α-helix	trans	-61.5	-41.2	174.3	-67.8	119.8	0	0	0	111.9	M33 S35 A40 L41	M33-W37 VanDerWaalsContact CG-CD1 3.49Å; M33-W37 PolarHBondContact O-N 3.2Å; S35-W37 PolarHBondContact O-N 3.17Å; W37-A40 PolarHBondContact O-N 2.95Å; W37-L41 VanDerWaalsContact O-CB 3.26Å; W37-L41 WeakPolarHBondContact O-CB 3.4Å; W37-L41 WeakPolarHBondContact O-CG 3.28Å; W37-L41 PolarHBondContact O-N 3.39Å
38	R	84.2	Confident	85.5	Confident	87 Å²	87	87.4 Å²	87.4	33%	0.328	44%	0.437	S	S	.	.	H	α-helix	trans	-62.8	-43.9	175.8	-80	-176.7	168.8	-136.6	-3.2	112	F34 S35 E36 N42 S468	F34-R38 HydrophobicContact CE1-CG 4.48Å; F34-R38 VanDerWaalsContact CZ-NH2 3.31Å; F34-R38 WeakPolarHBondContact O-CB 3.27Å; F34-R38 VanDerWaalsContact O-CG 3.31Å; F34-R38 WeakPolarHBondContact O-CG 3.41Å; F34-R38 PolarHBondContact O-N 3.39Å; S35-R38 WeakPolarHBondContact O-CB 3.41Å; S35-R38 PolarHBondContact O-N 2.95Å; S35-R38 VanDerWaalsContact O-N 3.17Å; E36-R38 VanDerWaalsContact C-N 3.33Å; E36-R38 PolarHBondContact O-N 3.09Å; R38-N42 WeakPolarHBondContact O-CB 3.24Å; R38-N42 VanDerWaalsContact O-CG 3.3Å; R38-N42 PolarHBondContact O-N 3.32Å; R38-N42 PolarHBondContact O-ND2 3.39Å; R38-N42 VanDerWaalsContact O-ND2 3.12Å; R38-S468 PolarHBondContact NH1-OG 2.8Å; R38-S468 VanDerWaalsContact NH1-OG 3.08Å; R38-S468 PolarHBondContact NH2-OG 3.45Å; R38-S468 VanDerWaalsContact NH2-OG 3.13Å
39	F	86.4	Confident	85.7	Confident	126 Å²	126	82.6 Å²	82.6	55%	0.553	42%	0.417	S	S	*	.	H	α-helix	trans	-63.9	-47.6	176.3	-73	-61.7	0	0	0	111.5	S35 E36 L41 N42 I43	S35-F39 WeakPolarHBondContact O-CD2 3.17Å; S35-F39 PolarHBondContact O-N 3.44Å; E36-F39 PolarHBondContact O-N 2.95Å; F39-L41 PolarHBondContact O-N 3.17Å; F39-N42 PolarHBondContact O-N 3.02Å; F39-I43 WeakPolarHBondContact O-CG1 3.43Å; F39-I43 PolarHBondContact O-N 3.38Å
40	A	89.6	Confident	86.3	Confident	40 Å²	40	82.4 Å²	82.4	33%	0.331	41%	0.411	S	S	.	.	H	α-helix	trans	-59.5	-45.5	176.9	0	0	0	0	0	112	E36 W37 I43 I44	E36-A40 WeakPolarHBondContact O-CB 3.4Å; E36-A40 PolarHBondContact O-N 3.32Å; W37-A40 PolarHBondContact O-N 2.95Å; A40-I43 PolarHBondContact O-N 2.81Å; A40-I44 VanDerWaalsContact O-CG1 3.27Å; A40-I44 WeakPolarHBondContact O-CG1 3.43Å; A40-I44 PolarHBondContact O-N 3.12Å
41	L	90	Very high	86.9	Confident	93 Å²	93	80.7 Å²	80.7	49%	0.487	41%	0.406	S	S	.	.	H	α-helix	trans	-60.9	-46.6	175.5	-74	173.2	0	0	0	111.4	W37 F39 I43 I44 I45	W37-L41 VanDerWaalsContact O-CB 3.26Å; W37-L41 WeakPolarHBondContact O-CB 3.4Å; W37-L41 WeakPolarHBondContact O-CG 3.28Å; W37-L41 PolarHBondContact O-N 3.39Å; F39-L41 PolarHBondContact O-N 3.17Å; L41-I43 VanDerWaalsContact C-N 3.32Å; L41-I43 PolarHBondContact O-N 3.03Å; L41-I44 PolarHBondContact O-N 2.94Å; L41-I45 HydrophobicContact CB-CD1 4.42Å; L41-I45 WeakPolarHBondContact O-CB 3.35Å; L41-I45 WeakPolarHBondContact O-CD1 3.38Å; L41-I45 WeakPolarHBondContact O-CG1 3.41Å; L41-I45 PolarHBondContact O-N 3.36Å
42	N	86.9	Confident	87.5	Confident	40 Å²	40	78.5 Å²	78.5	21%	0.214	39%	0.39	C	S	.	.	H	α-helix	trans	-58.8	-42.4	176.9	-80	-37.6	0	0	0	112	R38 F39 I45 I46 Q103 N465	R38-N42 WeakPolarHBondContact O-CB 3.24Å; R38-N42 VanDerWaalsContact O-CG 3.3Å; R38-N42 PolarHBondContact O-N 3.32Å; R38-N42 PolarHBondContact O-ND2 3.39Å; R38-N42 VanDerWaalsContact O-ND2 3.12Å; F39-N42 PolarHBondContact O-N 3.02Å; N42-I45 PolarHBondContact O-N 3.46Å; N42-I46 WeakPolarHBondContact O-CB 3.36Å; N42-I46 WeakPolarHBondContact O-CD1 3.34Å; N42-I46 VanDerWaalsContact O-CG1 3.24Å; N42-I46 WeakPolarHBondContact O-CG1 3.05Å; N42-I46 PolarHBondContact O-N 3.47Å; N42-Q103 PolarHBondContact OD1-NE2 2.95Å; N42-N465 PolarHBondContact OD1-ND2 2.74Å
43	I	91	Very high	87.9	Confident	109 Å²	109	74.4 Å²	74.4	56%	0.559	38%	0.375	S	S	*	.	H	α-helix	trans	-62.4	-44.9	175.7	-68.5	167.4	0	0	0	111	F39 A40 L41 I45 I46 S47	F39-I43 WeakPolarHBondContact O-CG1 3.43Å; F39-I43 PolarHBondContact O-N 3.38Å; A40-I43 PolarHBondContact O-N 2.81Å; L41-I43 VanDerWaalsContact C-N 3.32Å; L41-I43 PolarHBondContact O-N 3.03Å; I43-I45 PolarHBondContact O-N 3.28Å; I43-I46 PolarHBondContact O-N 3.01Å; I43-S47 WeakPolarHBondContact O-CB 3.44Å; I43-S47 PolarHBondContact O-N 2.91Å; I43-S47 PolarHBondContact O-OG 3.29Å
44	I	91.8	Very high	88.7	Confident	94 Å²	94	74.7 Å²	74.7	48%	0.482	38%	0.378	S	S	.	.	H	α-helix	trans	-60.8	-46.4	177	-69.1	164.7	0	0	0	110.3	A40 L41 S47 L48	A40-I44 VanDerWaalsContact O-CG1 3.27Å; A40-I44 WeakPolarHBondContact O-CG1 3.43Å; A40-I44 PolarHBondContact O-N 3.12Å; L41-I44 PolarHBondContact O-N 2.94Å; I44-S47 PolarHBondContact O-N 2.77Å; I44-L48 HydrophobicContact CG2-CD1 3.96Å; I44-L48 HydrophobicContact CG2-CG 4.42Å; I44-L48 WeakPolarHBondContact O-CB 3.49Å; I44-L48 VanDerWaalsContact O-CG 3.3Å; I44-L48 WeakPolarHBondContact O-CG 3.31Å; I44-L48 PolarHBondContact O-N 3.49Å
45	I	89.4	Confident	89.3	Confident	21 Å²	21	76.2 Å²	76.2	11%	0.108	38%	0.384	C	S	.	.	H	α-helix	trans	-62.2	-47.5	-179.8	-69.5	156.3	0	0	0	111.1	L41 N42 I43 S47 L48 Q49 H461	L41-I45 HydrophobicContact CB-CD1 4.42Å; L41-I45 WeakPolarHBondContact O-CB 3.35Å; L41-I45 WeakPolarHBondContact O-CD1 3.38Å; L41-I45 WeakPolarHBondContact O-CG1 3.41Å; L41-I45 PolarHBondContact O-N 3.36Å; N42-I45 PolarHBondContact O-N 3.46Å; I43-I45 PolarHBondContact O-N 3.28Å; I45-S47 VanDerWaalsContact C-N 3.32Å; I45-S47 PolarHBondContact O-N 2.79Å; I45-L48 PolarHBondContact O-N 2.9Å; I45-Q49 VanDerWaalsContact O-CG 3.28Å; I45-Q49 WeakPolarHBondContact O-CG 3.38Å; I45-Q49 PolarHBondContact O-N 3.31Å; I45-H461 WeakPolarHBondContact CD1-CE1 3.44Å; I45-H461 WeakPolarHBondContact CD1-NE2 3.48Å
46	I	90.4	Very high	89.7	Confident	30 Å²	30	75.6 Å²	75.6	15%	0.154	38%	0.378	C	S	.	.	H	α-helix	trans	-60.5	-44.5	176.6	-70.2	163.8	0	0	0	110.2	N42 I43 L48 Q49 I50 I100 Q103 V104	N42-I46 WeakPolarHBondContact O-CB 3.36Å; N42-I46 WeakPolarHBondContact O-CD1 3.34Å; N42-I46 VanDerWaalsContact O-CG1 3.24Å; N42-I46 WeakPolarHBondContact O-CG1 3.05Å; N42-I46 PolarHBondContact O-N 3.47Å; I43-I46 PolarHBondContact O-N 3.01Å; I46-L48 VanDerWaalsContact C-N 3.35Å; I46-L48 PolarHBondContact O-N 3.04Å; I46-Q49 WeakPolarHBondContact O-CB 3.22Å; I46-Q49 PolarHBondContact O-N 2.87Å; I46-I50 HydrophobicContact CG2-CD1 3.81Å; I46-I50 HydrophobicContact CG2-CG1 4.43Å; I46-I50 WeakPolarHBondContact O-CG1 3.26Å; I46-I50 PolarHBondContact O-N 3.22Å; I46-I100 HydrophobicContact CG2-CG2 4.16Å; I46-Q103 HydrophobicContact CD1-CB 4.48Å; I46-Q103 HydrophobicContact CD1-CG 3.92Å; I46-Q103 HydrophobicContact CG1-CB 4.21Å; I46-Q103 HydrophobicContact CG1-CG 3.65Å; I46-V104 HydrophobicContact CD1-CG2 3.9Å
47	S	92.2	Very high	90.1	Very high	64 Å²	64	74.1 Å²	74.1	45%	0.448	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-43	178.4	-58.8	0	0	0	0	112	I43 I44 I45 I50 L51	I43-S47 WeakPolarHBondContact O-CB 3.44Å; I43-S47 PolarHBondContact O-N 2.91Å; I43-S47 PolarHBondContact O-OG 3.29Å; I44-S47 PolarHBondContact O-N 2.77Å; I45-S47 VanDerWaalsContact C-N 3.32Å; I45-S47 PolarHBondContact O-N 2.79Å; S47-I50 PolarHBondContact O-N 3.44Å; S47-L51 WeakPolarHBondContact O-CB 3.34Å; S47-L51 PolarHBondContact O-N 3.48Å
48	L	91	Very high	90.5	Very high	92 Å²	92	68.1 Å²	68.1	48%	0.482	36%	0.358	S	S	.	.	H	α-helix	trans	-66.6	-36	175.4	-70.9	173.9	0	0	0	112.4	I44 I45 I46 S52	I44-L48 HydrophobicContact CG2-CD1 3.96Å; I44-L48 HydrophobicContact CG2-CG 4.42Å; I44-L48 WeakPolarHBondContact O-CB 3.49Å; I44-L48 VanDerWaalsContact O-CG 3.3Å; I44-L48 WeakPolarHBondContact O-CG 3.31Å; I44-L48 PolarHBondContact O-N 3.49Å; I45-L48 PolarHBondContact O-N 2.9Å; I46-L48 VanDerWaalsContact C-N 3.35Å; I46-L48 PolarHBondContact O-N 3.04Å; L48-S52 VanDerWaalsContact O-CB 3.3Å; L48-S52 WeakPolarHBondContact O-CB 3.48Å; L48-S52 PolarHBondContact O-N 2.86Å; L48-S52 PolarHBondContact O-OG 3.15Å
49	Q	88	Confident	91	Very high	15 Å²	15	65.9 Å²	65.9	7%	0.07	36%	0.362	C	S	.	.	H	α-helix	trans	-67.7	-42.9	175.7	-74	171	29.9	0	0	112.2	I45 I46 S52 G53 F99 I100	I45-Q49 VanDerWaalsContact O-CG 3.28Å; I45-Q49 WeakPolarHBondContact O-CG 3.38Å; I45-Q49 PolarHBondContact O-N 3.31Å; I46-Q49 WeakPolarHBondContact O-CB 3.22Å; I46-Q49 PolarHBondContact O-N 2.87Å; Q49-S52 WeakPolarHBondContact CA-OG 3.33Å; Q49-S52 PolarHBondContact O-OG 2.91Å; Q49-G53 PolarHBondContact O-N 3.22Å; Q49-F99 VanDerWaalsContact OE1-CD1 3.23Å; Q49-I100 HydrophobicContact CB-CD1 4.27Å; Q49-I100 HydrophobicContact CB-CG1 3.98Å
50	I	92.3	Very high	91.3	Very high	82 Å²	82	60.8 Å²	60.8	42%	0.421	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-48.8	175	-67.9	166.8	0	0	0	109.7	I46 S47 S52 G53 I54 I100	I46-I50 HydrophobicContact CG2-CD1 3.81Å; I46-I50 HydrophobicContact CG2-CG1 4.43Å; I46-I50 WeakPolarHBondContact O-CG1 3.26Å; I46-I50 PolarHBondContact O-N 3.22Å; S47-I50 PolarHBondContact O-N 3.44Å; I50-S52 PolarHBondContact O-N 3.25Å; I50-G53 PolarHBondContact O-N 2.95Å; I50-I54 HydrophobicContact CG2-CD1 4.07Å; I50-I54 WeakPolarHBondContact O-CG1 3.48Å; I50-I54 PolarHBondContact O-N 3.29Å; I50-I100 HydrophobicContact CG1-CD1 3.82Å
51	L	92.8	Very high	91.5	Very high	88 Å²	88	62.4 Å²	62.4	46%	0.461	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-48.2	-179.8	-175.9	64.1	0	0	0	111.8	S47 G53 I54 F55	S47-L51 WeakPolarHBondContact O-CB 3.34Å; S47-L51 PolarHBondContact O-N 3.48Å; L51-G53 VanDerWaalsContact C-N 3.35Å; L51-G53 PolarHBondContact O-N 2.95Å; L51-I54 PolarHBondContact O-N 3.48Å; L51-F55 HydrophobicContact CD1-CD2 4.09Å; L51-F55 HydrophobicContact CD1-CE2 3.56Å; L51-F55 HydrophobicContact CD1-CZ 4.46Å; L51-F55 HydrophobicContact CD2-CE2 4.28Å; L51-F55 HydrophobicContact CG-CD2 3.96Å; L51-F55 HydrophobicContact CG-CE2 3.69Å; L51-F55 WeakPolarHBondContact O-CD2 3.36Å; L51-F55 PolarHBondContact O-N 3.33Å; L51-F55 VanDerWaalsContact O-N 3.1Å
52	S	90.1	Very high	91.7	Very high	20 Å²	20	63.8 Å²	63.8	14%	0.14	35%	0.351	C	S	.	.	H	α-helix	trans	-62.6	-41	176	58.2	0	0	0	0	111.7	L48 Q49 I50 I54 F55 I56	L48-S52 VanDerWaalsContact O-CB 3.3Å; L48-S52 WeakPolarHBondContact O-CB 3.48Å; L48-S52 PolarHBondContact O-N 2.86Å; L48-S52 PolarHBondContact O-OG 3.15Å; Q49-S52 WeakPolarHBondContact CA-OG 3.33Å; Q49-S52 PolarHBondContact O-OG 2.91Å; I50-S52 PolarHBondContact O-N 3.25Å; S52-I54 VanDerWaalsContact C-N 3.33Å; S52-I54 PolarHBondContact O-N 3.26Å; S52-F55 PolarHBondContact O-N 3.25Å; S52-F55 VanDerWaalsContact O-N 3.15Å; S52-I56 WeakPolarHBondContact O-CB 3.32Å; S52-I56 WeakPolarHBondContact O-CG1 3.32Å; S52-I56 PolarHBondContact O-N 3.29Å
53	G	89.9	Confident	91.9	Very high	14 Å²	14	63.3 Å²	63.3	14%	0.144	35%	0.352	C	S	.	.	H	α-helix	trans	-56.5	-44	175	0	0	0	0	0	113	Q49 I50 L51 I56 F57	Q49-G53 PolarHBondContact O-N 3.22Å; I50-G53 PolarHBondContact O-N 2.95Å; L51-G53 VanDerWaalsContact C-N 3.35Å; L51-G53 PolarHBondContact O-N 2.95Å; G53-I56 PolarHBondContact O-N 3.38Å; G53-F57 VanDerWaalsContact O-CB 3.29Å; G53-F57 WeakPolarHBondContact O-CB 3.44Å; G53-F57 PolarHBondContact O-N 3.48Å
54	I	93.6	Very high	92	Very high	110 Å²	110	60 Å²	60	56%	0.564	34%	0.336	S	S	*	.	H	α-helix	trans	-62.1	-45.9	175.4	-66	165.1	0	0	0	111	I50 L51 S52 F57 G58	I50-I54 HydrophobicContact CG2-CD1 4.07Å; I50-I54 WeakPolarHBondContact O-CG1 3.48Å; I50-I54 PolarHBondContact O-N 3.29Å; L51-I54 PolarHBondContact O-N 3.48Å; S52-I54 VanDerWaalsContact C-N 3.33Å; S52-I54 PolarHBondContact O-N 3.26Å; I54-F57 PolarHBondContact O-N 3.26Å; I54-G58 PolarHBondContact O-N 2.95Å
55	F	93	Very high	92	Very high	146 Å²	146	58 Å²	58	64%	0.64	33%	0.329	S	S	*	.	H	α-helix	trans	-64.8	-41.6	178.4	-81.1	-64.3	0	0	0	112.9	L51 S52 G59	L51-F55 HydrophobicContact CD1-CD2 4.09Å; L51-F55 HydrophobicContact CD1-CE2 3.56Å; L51-F55 HydrophobicContact CD1-CZ 4.46Å; L51-F55 HydrophobicContact CD2-CE2 4.28Å; L51-F55 HydrophobicContact CG-CD2 3.96Å; L51-F55 HydrophobicContact CG-CE2 3.69Å; L51-F55 WeakPolarHBondContact O-CD2 3.36Å; L51-F55 PolarHBondContact O-N 3.33Å; L51-F55 VanDerWaalsContact O-N 3.1Å; S52-F55 PolarHBondContact O-N 3.25Å; S52-F55 VanDerWaalsContact O-N 3.15Å; F55-G59 WeakPolarHBondContact O-CA 3.21Å; F55-G59 PolarHBondContact O-N 3.44Å
56	I	91.2	Very high	92	Very high	27 Å²	27	58.6 Å²	58.6	14%	0.138	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-48.1	178	-64.8	168	0	0	0	109.3	S52 G53 N60 D88 A92 L96 L451	S52-I56 WeakPolarHBondContact O-CB 3.32Å; S52-I56 WeakPolarHBondContact O-CG1 3.32Å; S52-I56 PolarHBondContact O-N 3.29Å; G53-I56 PolarHBondContact O-N 3.38Å; I56-N60 WeakPolarHBondContact CG2-ND2 3.45Å; I56-N60 WeakPolarHBondContact O-CB 3.25Å; I56-N60 PolarHBondContact O-N 3.1Å; I56-N60 PolarHBondContact O-ND2 3.28Å; I56-D88 HydrophobicContact CG2-CB 4.44Å; I56-A92 HydrophobicContact CB-CB 4.41Å; I56-A92 HydrophobicContact CG2-CB 3.88Å; I56-L96 HydrophobicContact CD1-CD1 4.08Å; I56-L451 HydrophobicContact CD1-CD2 3.69Å; I56-L451 HydrophobicContact CG1-CD2 3.66Å; I56-L451 HydrophobicContact CG2-CD2 4.12Å
57	F	93.5	Very high	92	Very high	95 Å²	95	58.2 Å²	58.2	42%	0.417	34%	0.337	S	S	.	.	H	α-helix	trans	-60	-55.4	178.2	-178.2	-92.4	0	0	0	111.5	G53 I54 G59 L61 L89 A92 V93	G53-F57 VanDerWaalsContact O-CB 3.29Å; G53-F57 WeakPolarHBondContact O-CB 3.44Å; G53-F57 PolarHBondContact O-N 3.48Å; I54-F57 PolarHBondContact O-N 3.26Å; F57-G59 PolarHBondContact O-N 3.49Å; F57-L61 HydrophobicContact CE1-CD2 3.96Å; F57-L61 HydrophobicContact CZ-CD2 4.3Å; F57-L61 VanDerWaalsContact O-CB 3.22Å; F57-L61 WeakPolarHBondContact O-CB 3.4Å; F57-L61 PolarHBondContact O-N 2.81Å; F57-L89 HydrophobicContact CD2-CD2 3.94Å; F57-L89 HydrophobicContact CE2-CD2 4.33Å; F57-L89 HydrophobicContact CG-CD2 4.4Å; F57-L89 WeakPolarHBondContact O-CD2 3.28Å; F57-A92 HydrophobicContact CB-CB 4.27Å; F57-V93 HydrophobicContact CD2-CG2 3.92Å; F57-V93 HydrophobicContact CE2-CG2 3.82Å
58	G	93.4	Very high	91.8	Very high	37 Å²	37	57.8 Å²	57.8	38%	0.381	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-43.3	-178.4	0	0	0	0	0	113	I54 L62	I54-G58 PolarHBondContact O-N 2.95Å; G58-L62 VanDerWaalsContact O-CB 3.23Å; G58-L62 WeakPolarHBondContact O-CB 3.34Å; G58-L62 PolarHBondContact O-N 3.22Å
59	G	93.8	Very high	91.7	Very high	40 Å²	40	58.5 Å²	58.5	41%	0.412	35%	0.345	S	S	.	.	H	α-helix	trans	-64.8	-43.9	-179.4	0	0	0	0	0	113	F55 F57 A63	F55-G59 WeakPolarHBondContact O-CA 3.21Å; F55-G59 PolarHBondContact O-N 3.44Å; F57-G59 PolarHBondContact O-N 3.49Å; G59-A63 PolarHBondContact O-N 3Å
60	N	93.2	Very high	91.5	Very high	19 Å²	19	60.7 Å²	60.7	10%	0.102	36%	0.36	C	S	.	.	H	α-helix	trans	-74.8	-36	178.9	-70.8	-62.7	0	0	0	112.4	I56 L62 A63 I64 A85 D88 L89	I56-N60 WeakPolarHBondContact CG2-ND2 3.45Å; I56-N60 WeakPolarHBondContact O-CB 3.25Å; I56-N60 PolarHBondContact O-N 3.1Å; I56-N60 PolarHBondContact O-ND2 3.28Å; N60-L62 VanDerWaalsContact C-N 3.32Å; N60-L62 PolarHBondContact O-N 3.27Å; N60-A63 PolarHBondContact O-N 2.75Å; N60-I64 WeakPolarHBondContact O-CG1 3.28Å; N60-I64 PolarHBondContact O-N 2.78Å; N60-A85 HydrophobicContact CB-CB 4.12Å; N60-D88 VanDerWaalsContact ND2-CB 3.26Å; N60-D88 WeakPolarHBondContact ND2-CB 3.24Å; N60-L89 HydrophobicContact CB-CD2 3.79Å; N60-L89 HydrophobicContact CB-CG 3.67Å
61	L	94.3	Very high	90.8	Very high	75 Å²	75	65.3 Å²	65.3	39%	0.393	38%	0.377	S	S	.	.	H	α-helix	trans	-62.8	-41.6	172.9	-175.2	63.1	0	0	0	111.3	F57 I64 S65 L89	F57-L61 HydrophobicContact CE1-CD2 3.96Å; F57-L61 HydrophobicContact CZ-CD2 4.3Å; F57-L61 VanDerWaalsContact O-CB 3.22Å; F57-L61 WeakPolarHBondContact O-CB 3.4Å; F57-L61 PolarHBondContact O-N 2.81Å; L61-I64 PolarHBondContact O-N 3.12Å; L61-S65 VanDerWaalsContact O-CB 3.28Å; L61-S65 WeakPolarHBondContact O-CB 3.39Å; L61-S65 PolarHBondContact O-N 3.38Å; L61-S65 PolarHBondContact O-OG 2.92Å; L61-L89 HydrophobicContact CB-CD2 4.29Å
62	L	94.2	Very high	89.5	Confident	121 Å²	121	64.1 Å²	64.1	63%	0.634	39%	0.386	S	S	*	.	H	α-helix	trans	-62.6	-42.4	174.2	-179.1	65.2	0	0	0	111.4	G58 N60 S65 A66	G58-L62 VanDerWaalsContact O-CB 3.23Å; G58-L62 WeakPolarHBondContact O-CB 3.34Å; G58-L62 PolarHBondContact O-N 3.22Å; N60-L62 VanDerWaalsContact C-N 3.32Å; N60-L62 PolarHBondContact O-N 3.27Å; L62-S65 PolarHBondContact O-N 2.77Å; L62-A66 VanDerWaalsContact O-CB 3.24Å; L62-A66 WeakPolarHBondContact O-CB 3.13Å; L62-A66 PolarHBondContact O-N 3.32Å
63	A	91.5	Very high	88.3	Confident	30 Å²	30	66.5 Å²	66.5	25%	0.248	40%	0.397	C	S	.	.	H	α-helix	trans	-60.5	-46.1	177.6	0	0	0	0	0	112	G59 N60 A66 V67 A85	G59-A63 PolarHBondContact O-N 3Å; N60-A63 PolarHBondContact O-N 2.75Å; A63-A66 PolarHBondContact O-N 2.89Å; A63-V67 WeakPolarHBondContact O-CG2 3.35Å; A63-V67 PolarHBondContact O-N 3.48Å; A63-A85 HydrophobicContact CB-CB 4.25Å
64	I	91.7	Very high	87.4	Confident	41 Å²	41	72.4 Å²	72.4	21%	0.21	42%	0.415	C	S	.	.	H	α-helix	trans	-63.1	-46.4	175.6	-64.6	179.6	0	0	0	110.6	N60 L61 A66 V67 A68 V82 A85 L89	N60-I64 WeakPolarHBondContact O-CG1 3.28Å; N60-I64 PolarHBondContact O-N 2.78Å; L61-I64 PolarHBondContact O-N 3.12Å; I64-A66 PolarHBondContact O-N 3.4Å; I64-V67 PolarHBondContact O-N 3.02Å; I64-A68 WeakPolarHBondContact O-CB 3.23Å; I64-A68 PolarHBondContact O-N 3.31Å; I64-V82 HydrophobicContact CG1-CG1 4.49Å; I64-A85 HydrophobicContact CD1-CB 4.11Å; I64-A85 HydrophobicContact CG1-CB 3.68Å; I64-L89 HydrophobicContact CD1-CD1 3.42Å; I64-L89 VanDerWaalsContact CD1-CD1 3.42Å
65	S	92.4	Very high	86.7	Confident	50 Å²	50	70.2 Å²	70.2	35%	0.35	41%	0.409	S	S	.	.	H	α-helix	trans	-62.7	-40.2	-179.7	-60.2	0	0	0	0	112.2	L61 L62 V67 A68 T69	L61-S65 VanDerWaalsContact O-CB 3.28Å; L61-S65 WeakPolarHBondContact O-CB 3.39Å; L61-S65 PolarHBondContact O-N 3.38Å; L61-S65 PolarHBondContact O-OG 2.92Å; L62-S65 PolarHBondContact O-N 2.77Å; S65-V67 PolarHBondContact O-N 3Å; S65-A68 PolarHBondContact O-N 2.92Å; S65-T69 WeakPolarHBondContact O-CB 3.22Å; S65-T69 VanDerWaalsContact O-CG2 3.26Å; S65-T69 WeakPolarHBondContact O-CG2 3.43Å; S65-T69 PolarHBondContact O-N 3.05Å; S65-T69 PolarHBondContact O-OG1 2.64Å
66	A	90.8	Very high	86.3	Confident	35 Å²	35	64.3 Å²	64.3	29%	0.289	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-42.8	178	0	0	0	0	0	111.8	L62 A63 I64 T69 T70	L62-A66 VanDerWaalsContact O-CB 3.24Å; L62-A66 WeakPolarHBondContact O-CB 3.13Å; L62-A66 PolarHBondContact O-N 3.32Å; A63-A66 PolarHBondContact O-N 2.89Å; I64-A66 PolarHBondContact O-N 3.4Å; A66-T69 PolarHBondContact O-OG1 2.95Å; A66-T70 WeakPolarHBondContact O-CB 3.44Å; A66-T70 PolarHBondContact O-N 3.06Å; A66-T70 PolarHBondContact O-OG1 3Å
67	V	89.2	Confident	86	Confident	22 Å²	22	63.8 Å²	63.8	13%	0.133	38%	0.381	C	S	.	.	H	α-helix	trans	-69	-38.4	175.8	173.7	0	0	0	0	111.3	A63 I64 S65 D78 V82	A63-V67 WeakPolarHBondContact O-CG2 3.35Å; A63-V67 PolarHBondContact O-N 3.48Å; I64-V67 PolarHBondContact O-N 3.02Å; S65-V67 PolarHBondContact O-N 3Å; V67-D78 HydrophobicContact CG1-CB 3.97Å; V67-D78 HydrophobicContact CG2-CB 4.24Å; V67-V82 HydrophobicContact CB-CG2 3.84Å; V67-V82 HydrophobicContact CG1-CG2 3.59Å; V67-V82 HydrophobicContact CG2-CG2 4.1Å
68	A	87.8	Confident	85.7	Confident	55 Å²	55	60.3 Å²	60.3	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-66.7	-44.9	179.2	0	0	0	0	0	112.3	I64 S65 R74	I64-A68 WeakPolarHBondContact O-CB 3.23Å; I64-A68 PolarHBondContact O-N 3.31Å; S65-A68 PolarHBondContact O-N 2.92Å; A68-R74 PolarHBondContact O-NH2 2.87Å
69	T	88.8	Confident	85.6	Confident	106 Å²	106	60.7 Å²	60.7	65%	0.65	36%	0.36	S	S	*	.	H	α-helix	trans	-77.2	-37.9	-176.4	53.1	0	0	0	0	112.7	S65 A66 K71	S65-T69 WeakPolarHBondContact O-CB 3.22Å; S65-T69 VanDerWaalsContact O-CG2 3.26Å; S65-T69 WeakPolarHBondContact O-CG2 3.43Å; S65-T69 PolarHBondContact O-N 3.05Å; S65-T69 PolarHBondContact O-OG1 2.64Å; A66-T69 PolarHBondContact O-OG1 2.95Å; T69-K71 PolarHBondContact O-N 3.03Å
70	T	84.9	Confident	85.5	Confident	61 Å²	61	59 Å²	59	37%	0.374	34%	0.341	S	S	.	.			trans	-88.1	104.3	-173.4	-51.7	0	0	0	0	111.2	A66 G72 L73	A66-T70 WeakPolarHBondContact O-CB 3.44Å; A66-T70 PolarHBondContact O-N 3.06Å; A66-T70 PolarHBondContact O-OG1 3Å; T70-G72 PolarHBondContact O-N 3.32Å; T70-G72 VanDerWaalsContact O-N 3.07Å; T70-L73 HydrophobicContact CG2-CB 4.2Å; T70-L73 HydrophobicContact CG2-CD1 3.86Å; T70-L73 HydrophobicContact CG2-CG 3.66Å; T70-L73 PolarHBondContact O-N 2.79Å
71	K	76.3	Confident	85.5	Confident	179 Å²	179	61.3 Å²	61.3	78%	0.778	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-53.8	-31.6	176.2	-67.7	-179	-178.2	175.4	0	113	T69 L73	T69-K71 PolarHBondContact O-N 3.03Å; K71-L73 VanDerWaalsContact C-N 3.34Å
72	G	66.6	Low	85.4	Confident	63 Å²	63	59.8 Å²	59.8	65%	0.649	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-72.6	-18.4	177.8	0	0	0	0	0	115.4	T70	T70-G72 PolarHBondContact O-N 3.32Å; T70-G72 VanDerWaalsContact O-N 3.07Å
73	L	64.2	Low	85.5	Confident	71 Å²	71	54.4 Å²	54.4	37%	0.372	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-100.1	26.9	179.4	-63.4	174.9	0	0	0	112	T70 K71 C75 D78	T70-L73 HydrophobicContact CG2-CB 4.2Å; T70-L73 HydrophobicContact CG2-CD1 3.86Å; T70-L73 HydrophobicContact CG2-CG 3.66Å; T70-L73 PolarHBondContact O-N 2.79Å; K71-L73 VanDerWaalsContact C-N 3.34Å; L73-C75 VanDerWaalsContact C-N 3.3Å; L73-D78 WeakPolarHBondContact O-CB 3.22Å
74	R	71.3	Confident	85.6	Confident	138 Å²	138	54 Å²	54	52%	0.521	31%	0.313	S	S	.	.			trans	-99.8	37.9	175.9	-63	-177.2	-178.9	179.5	-1.5	111.5	A68	A68-R74 PolarHBondContact O-NH2 2.87Å
75	C	79.5	Confident	85.7	Confident	64 Å²	64	52.2 Å²	52.2	43%	0.432	30%	0.304	S	S	.	.	S	Bend	trans	-77	165.5	173.6	-63.5	0	0	0	0	110.5	L73 T77 D78	L73-C75 VanDerWaalsContact C-N 3.3Å; C75-T77 PolarHBondContact O-N 2.93Å; C75-D78 VanDerWaalsContact CA-OD2 3.31Å; C75-D78 WeakPolarHBondContact CA-OD2 3.34Å; C75-D78 WeakPolarHBondContact CB-OD2 3.06Å; C75-D78 PolarHBondContact N-OD2 3.34Å; C75-D78 PolarHBondContact O-N 3.38Å; C75-D78 VanDerWaalsContact O-N 3.16Å
76	I	84	Confident	85.9	Confident	22 Å²	22	53.6 Å²	53.6	11%	0.113	31%	0.307	C	S	.	.	H	α-helix	trans	-64.1	-32.6	179.8	-67.6	168.1	0	0	0	111	D78 L79 R155 R157 A160	I76-D78 VanDerWaalsContact C-N 3.29Å; I76-D78 PolarHBondContact O-N 3.42Å; I76-L79 WeakPolarHBondContact O-CB 3.28Å; I76-L79 PolarHBondContact O-N 3.48Å; I76-R155 HydrophobicContact CB-CG 4.11Å; I76-R155 HydrophobicContact CD1-CG 3.65Å; I76-R155 VanDerWaalsContact CD1-O 3.3Å; I76-R155 WeakPolarHBondContact CD1-O 3.45Å; I76-R155 HydrophobicContact CG1-CG 4.46Å; I76-R155 HydrophobicContact CG2-CG 3.94Å; I76-R157 HydrophobicContact CD1-CG 4.48Å; I76-R157 HydrophobicContact CG1-CG 4Å; I76-A160 HydrophobicContact CG2-CB 3.68Å
77	T	84.7	Confident	86	Confident	16 Å²	16	52 Å²	52	10%	0.098	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-38	174.8	-48.5	0	0	0	0	112.3	C75 L79 Y80 I81 R141	C75-T77 PolarHBondContact O-N 2.93Å; T77-L79 PolarHBondContact O-N 2.9Å; T77-Y80 PolarHBondContact O-N 3.18Å; T77-Y80 VanDerWaalsContact O-N 3.1Å; T77-I81 PolarHBondContact O-N 3.21Å; T77-R141 PolarHBondContact OG1-NH2 3.46Å
78	D	88	Confident	86.3	Confident	21 Å²	21	51.3 Å²	51.3	11%	0.112	29%	0.289	C	S	.	.	H	α-helix	trans	-68.5	-22.1	-176	-53.1	-50.3	0	0	0	111.7	V67 L73 C75 I76 Y80 I81 V82	V67-D78 HydrophobicContact CG1-CB 3.97Å; V67-D78 HydrophobicContact CG2-CB 4.24Å; L73-D78 WeakPolarHBondContact O-CB 3.22Å; C75-D78 VanDerWaalsContact CA-OD2 3.31Å; C75-D78 WeakPolarHBondContact CA-OD2 3.34Å; C75-D78 WeakPolarHBondContact CB-OD2 3.06Å; C75-D78 PolarHBondContact N-OD2 3.34Å; C75-D78 PolarHBondContact O-N 3.38Å; C75-D78 VanDerWaalsContact O-N 3.16Å; I76-D78 VanDerWaalsContact C-N 3.29Å; I76-D78 PolarHBondContact O-N 3.42Å; D78-Y80 VanDerWaalsContact C-N 3.34Å; D78-Y80 PolarHBondContact O-N 3.24Å; D78-I81 PolarHBondContact O-N 2.86Å; D78-V82 WeakPolarHBondContact O-CG2 3.35Å; D78-V82 PolarHBondContact O-N 3.31Å
79	L	91.2	Very high	86.5	Confident	45 Å²	45	49.7 Å²	49.7	24%	0.236	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-38.4	172.2	-63.3	175.6	0	0	0	112.3	I76 T77 I81 S83 R157 A160 F161 I164	I76-L79 WeakPolarHBondContact O-CB 3.28Å; I76-L79 PolarHBondContact O-N 3.48Å; T77-L79 PolarHBondContact O-N 2.9Å; L79-I81 VanDerWaalsContact C-N 3.35Å; L79-S83 WeakPolarHBondContact O-CB 3.33Å; L79-S83 PolarHBondContact O-N 2.91Å; L79-R157 HydrophobicContact CD1-CB 4.43Å; L79-R157 HydrophobicContact CD1-CG 4.22Å; L79-A160 HydrophobicContact CD1-CB 4.15Å; L79-F161 HydrophobicContact CD1-CE2 4.34Å; L79-F161 HydrophobicContact CD1-CZ 4.31Å; L79-F161 HydrophobicContact CD2-CZ 4.4Å; L79-I164 HydrophobicContact CB-CD1 4.09Å
80	Y	91.6	Very high	86.8	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.016	26%	0.256	C	S	.	.	H	α-helix	trans	-69.2	-36.8	176.5	-61.6	-72.9	0	0	0	111.6	T77 D78 S83 L84 C136 I137 D140 A160 M163 I164	T77-Y80 PolarHBondContact O-N 3.18Å; T77-Y80 VanDerWaalsContact O-N 3.1Å; D78-Y80 VanDerWaalsContact C-N 3.34Å; D78-Y80 PolarHBondContact O-N 3.24Å; Y80-S83 PolarHBondContact O-N 3.44Å; Y80-L84 WeakPolarHBondContact O-CB 3.44Å; Y80-L84 PolarHBondContact O-N 2.84Å; Y80-C136 HydrophobicContact CD1-CB 4.05Å; Y80-C136 HydrophobicContact CE1-CB 4.06Å; Y80-I137 HydrophobicContact CG-CG1 4.27Å; Y80-D140 HydrophobicContact CD2-CB 4.48Å; Y80-D140 HydrophobicContact CE2-CB 3.87Å; Y80-A160 HydrophobicContact CE1-CB 4.42Å; Y80-A160 HydrophobicContact CE2-CB 4.21Å; Y80-M163 HydrophobicContact CE1-CB 3.95Å; Y80-M163 HydrophobicContact CE1-CE 4.27Å; Y80-M163 PolarHBondContact OH-SD 2.89Å; Y80-I164 HydrophobicContact CD1-CD1 3.99Å; Y80-I164 HydrophobicContact CD1-CG1 3.67Å; Y80-I164 HydrophobicContact CE1-CD1 4.37Å; Y80-I164 HydrophobicContact CE1-CG1 3.94Å
81	I	91.8	Very high	87.1	Confident	69 Å²	69	44.8 Å²	44.8	35%	0.354	24%	0.241	S	C	.	.	H	α-helix	trans	-64.5	-44.4	176.9	-61	175.1	0	0	0	110	T77 D78 L79 L84 A85	T77-I81 PolarHBondContact O-N 3.21Å; D78-I81 PolarHBondContact O-N 2.86Å; L79-I81 VanDerWaalsContact C-N 3.35Å; I81-L84 PolarHBondContact O-N 3.1Å; I81-A85 WeakPolarHBondContact O-CB 3.31Å; I81-A85 PolarHBondContact O-N 3.38Å
82	V	93.4	Very high	87.9	Confident	43 Å²	43	36.8 Å²	36.8	26%	0.261	21%	0.208	S	C	.	.	H	α-helix	trans	-63.7	-42	176.3	172.2	0	0	0	0	111.5	I64 V67 D78 A85 L86	I64-V82 HydrophobicContact CG1-CG1 4.49Å; V67-V82 HydrophobicContact CB-CG2 3.84Å; V67-V82 HydrophobicContact CG1-CG2 3.59Å; V67-V82 HydrophobicContact CG2-CG2 4.1Å; D78-V82 WeakPolarHBondContact O-CG2 3.35Å; D78-V82 PolarHBondContact O-N 3.31Å; V82-A85 PolarHBondContact O-N 2.91Å; V82-L86 WeakPolarHBondContact O-CB 3.39Å; V82-L86 PolarHBondContact O-N 2.91Å
83	S	95	Very high	89.1	Confident	8 Å²	8	37.5 Å²	37.5	6%	0.056	20%	0.199	C	C	.	.	H	α-helix	trans	-62.4	-43	176.6	-179.1	0	0	0	0	112.3	L79 Y80 L86 A87 N133 I164 W168	L79-S83 WeakPolarHBondContact O-CB 3.33Å; L79-S83 PolarHBondContact O-N 2.91Å; Y80-S83 PolarHBondContact O-N 3.44Å; S83-L86 PolarHBondContact O-N 3.48Å; S83-A87 PolarHBondContact O-N 3.24Å; S83-A87 VanDerWaalsContact O-N 3.09Å; S83-N133 VanDerWaalsContact CB-OD1 3.31Å; S83-N133 WeakPolarHBondContact CB-OD1 3.33Å; S83-N133 PolarHBondContact OG-ND2 3.29Å; S83-N133 PolarHBondContact OG-OD1 3.29Å; S83-I164 VanDerWaalsContact OG-CG2 3.24Å; S83-I164 WeakPolarHBondContact OG-CG2 3.41Å; S83-W168 PolarHBondContact OG-NE1 3.49Å; S83-W168 VanDerWaalsContact OG-NE1 3.14Å
84	L	93.8	Very high	90.5	Very high	22 Å²	22	37.1 Å²	37.1	12%	0.115	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-50.4	174.7	179.9	61	0	0	0	111.3	Y80 I81 L86 A87 D88 S130 N133 I134 I137	Y80-L84 WeakPolarHBondContact O-CB 3.44Å; Y80-L84 PolarHBondContact O-N 2.84Å; I81-L84 PolarHBondContact O-N 3.1Å; L84-L86 PolarHBondContact O-N 3.44Å; L84-A87 WeakPolarHBondContact O-CB 3.37Å; L84-A87 PolarHBondContact O-N 2.99Å; L84-D88 PolarHBondContact O-N 2.95Å; L84-S130 WeakPolarHBondContact CD1-O 3.49Å; L84-N133 HydrophobicContact CB-CB 4.13Å; L84-N133 HydrophobicContact CD1-CB 3.98Å; L84-I134 HydrophobicContact CD1-CD1 4.46Å; L84-I134 HydrophobicContact CD1-CG1 3.97Å; L84-I134 HydrophobicContact CD2-CG1 4.03Å; L84-I137 HydrophobicContact CB-CD1 4.49Å; L84-I137 HydrophobicContact CD2-CD1 3.89Å
85	A	95	Very high	91.5	Very high	3 Å²	3	30.9 Å²	30.9	3%	0.025	17%	0.174	C	C	.	.	H	α-helix	trans	-60.8	-35	179	0	0	0	0	0	112.3	N60 A63 I64 I81 V82 L89	N60-A85 HydrophobicContact CB-CB 4.12Å; A63-A85 HydrophobicContact CB-CB 4.25Å; I64-A85 HydrophobicContact CD1-CB 4.11Å; I64-A85 HydrophobicContact CG1-CB 3.68Å; I81-A85 WeakPolarHBondContact O-CB 3.31Å; I81-A85 PolarHBondContact O-N 3.38Å; V82-A85 PolarHBondContact O-N 2.91Å; A85-L89 WeakPolarHBondContact O-CB 3.32Å; A85-L89 VanDerWaalsContact O-CG 3.28Å; A85-L89 WeakPolarHBondContact O-CG 3.47Å; A85-L89 PolarHBondContact O-N 3.31Å
86	L	95.5	Very high	92	Very high	79 Å²	79	29.2 Å²	29.2	41%	0.414	16%	0.161	S	C	.	.	H	α-helix	trans	-64.7	-44	173.8	-179.5	63.9	0	0	0	111.7	V82 S83 L84 L89 L90	V82-L86 WeakPolarHBondContact O-CB 3.39Å; V82-L86 PolarHBondContact O-N 2.91Å; S83-L86 PolarHBondContact O-N 3.48Å; L84-L86 PolarHBondContact O-N 3.44Å; L86-L89 PolarHBondContact O-N 3.37Å; L86-L90 HydrophobicContact CG-CD1 4.41Å; L86-L90 VanDerWaalsContact O-CG 3.31Å; L86-L90 WeakPolarHBondContact O-CG 3.29Å; L86-L90 PolarHBondContact O-N 3.02Å
87	A	94.4	Very high	92.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.7	-46.1	176.5	0	0	0	0	0	111.5	S83 L84 L89 L90 V91 A129 S130 W168	S83-A87 PolarHBondContact O-N 3.24Å; S83-A87 VanDerWaalsContact O-N 3.09Å; L84-A87 WeakPolarHBondContact O-CB 3.37Å; L84-A87 PolarHBondContact O-N 2.99Å; A87-L89 PolarHBondContact O-N 3.03Å; A87-L90 PolarHBondContact O-N 3Å; A87-V91 WeakPolarHBondContact O-CG2 3.44Å; A87-V91 PolarHBondContact O-N 3.21Å; A87-A129 HydrophobicContact CB-CB 4.41Å; A87-S130 WeakPolarHBondContact CB-OG 3.33Å; A87-W168 HydrophobicContact CB-CH2 3.93Å; A87-W168 HydrophobicContact CB-CZ2 4.06Å
88	D	93.8	Very high	92.5	Very high	8 Å²	8	32.7 Å²	32.7	4%	0.043	18%	0.18	C	C	.	.	H	α-helix	trans	-66.7	-34.7	178.5	-69.3	-41.1	0	0	0	112.7	I56 N60 L84 V91 A92	I56-D88 HydrophobicContact CG2-CB 4.44Å; N60-D88 VanDerWaalsContact ND2-CB 3.26Å; N60-D88 WeakPolarHBondContact ND2-CB 3.24Å; L84-D88 PolarHBondContact O-N 2.95Å; D88-V91 PolarHBondContact O-N 2.99Å; D88-A92 PolarHBondContact O-N 3.14Å
89	L	93.1	Very high	92.5	Very high	22 Å²	22	32.9 Å²	32.9	12%	0.115	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-43.2	171.8	-80.5	178.6	0	0	0	111.9	F57 N60 L61 I64 A85 L86 A87 V91 A92 V93	F57-L89 HydrophobicContact CD2-CD2 3.94Å; F57-L89 HydrophobicContact CE2-CD2 4.33Å; F57-L89 HydrophobicContact CG-CD2 4.4Å; F57-L89 WeakPolarHBondContact O-CD2 3.28Å; N60-L89 HydrophobicContact CB-CD2 3.79Å; N60-L89 HydrophobicContact CB-CG 3.67Å; L61-L89 HydrophobicContact CB-CD2 4.29Å; I64-L89 HydrophobicContact CD1-CD1 3.42Å; I64-L89 VanDerWaalsContact CD1-CD1 3.42Å; A85-L89 WeakPolarHBondContact O-CB 3.32Å; A85-L89 VanDerWaalsContact O-CG 3.28Å; A85-L89 WeakPolarHBondContact O-CG 3.47Å; A85-L89 PolarHBondContact O-N 3.31Å; L86-L89 PolarHBondContact O-N 3.37Å; A87-L89 PolarHBondContact O-N 3.03Å; L89-V91 VanDerWaalsContact C-N 3.29Å; L89-V91 PolarHBondContact O-N 3.34Å; L89-A92 PolarHBondContact O-N 3.46Å; L89-A92 VanDerWaalsContact O-N 3.17Å; L89-V93 WeakPolarHBondContact O-CG2 3.45Å; L89-V93 PolarHBondContact O-N 2.71Å
90	L	94.3	Very high	92.3	Very high	56 Å²	56	32.2 Å²	32.2	29%	0.293	18%	0.176	S	C	.	.	H	α-helix	trans	-63.5	-37.6	177.1	-69.9	170.8	0	0	0	111	L86 A87 V93 L94 L126 W168	L86-L90 HydrophobicContact CG-CD1 4.41Å; L86-L90 VanDerWaalsContact O-CG 3.31Å; L86-L90 WeakPolarHBondContact O-CG 3.29Å; L86-L90 PolarHBondContact O-N 3.02Å; A87-L90 PolarHBondContact O-N 3Å; L90-V93 PolarHBondContact O-N 3.11Å; L90-L94 HydrophobicContact CB-CD1 4.45Å; L90-L94 HydrophobicContact CD2-CD1 4.04Å; L90-L94 VanDerWaalsContact O-CB 3.25Å; L90-L94 WeakPolarHBondContact O-CB 3.32Å; L90-L94 WeakPolarHBondContact O-CG 3.46Å; L90-L94 PolarHBondContact O-N 2.67Å; L90-L126 HydrophobicContact CB-CD1 3.87Å; L90-L126 HydrophobicContact CB-CD2 3.73Å; L90-L126 HydrophobicContact CB-CG 4.45Å; L90-L126 HydrophobicContact CD1-CD2 3.85Å; L90-L126 HydrophobicContact CG-CD2 4.46Å; L90-W168 HydrophobicContact CD1-CH2 4.05Å
91	V	92.4	Very high	92.2	Very high	8 Å²	8	36.2 Å²	36.2	5%	0.048	20%	0.196	C	C	.	.	I	π-helix	trans	-61.1	-47.7	171.3	175	0	0	0	0	110.6	A87 D88 L89 V93 I95 L96 L126	A87-V91 WeakPolarHBondContact O-CG2 3.44Å; A87-V91 PolarHBondContact O-N 3.21Å; D88-V91 PolarHBondContact O-N 2.99Å; L89-V91 VanDerWaalsContact C-N 3.29Å; L89-V91 PolarHBondContact O-N 3.34Å; V91-V93 VanDerWaalsContact C-N 3.29Å; V91-V93 PolarHBondContact O-N 3.1Å; V91-I95 HydrophobicContact CG1-CB 4.15Å; V91-I95 HydrophobicContact CG1-CG1 4.44Å; V91-I95 WeakPolarHBondContact O-CA 3.14Å; V91-I95 WeakPolarHBondContact O-CB 3.44Å; V91-I95 PolarHBondContact O-N 2.83Å; V91-L96 HydrophobicContact CG1-CG 4.48Å; V91-L96 PolarHBondContact O-N 2.87Å; V91-L126 HydrophobicContact CG2-CB 3.63Å; V91-L126 HydrophobicContact CG2-CD1 4.34Å
92	A	91.5	Very high	91.9	Very high	11 Å²	11	34.8 Å²	34.8	9%	0.091	19%	0.186	C	C	.	.	I	π-helix	trans	-63.3	-33.2	-178.3	0	0	0	0	0	113.7	I56 F57 D88 L89 L96 P97	I56-A92 HydrophobicContact CB-CB 4.41Å; I56-A92 HydrophobicContact CG2-CB 3.88Å; F57-A92 HydrophobicContact CB-CB 4.27Å; D88-A92 PolarHBondContact O-N 3.14Å; L89-A92 PolarHBondContact O-N 3.46Å; L89-A92 VanDerWaalsContact O-N 3.17Å; A92-L96 HydrophobicContact CB-CD1 4.23Å; A92-P97 WeakPolarHBondContact O-CD 3.39Å
93	V	93.5	Very high	91.4	Very high	77 Å²	77	34 Å²	34	47%	0.467	18%	0.18	S	C	.	.	I	π-helix	trans	-89.2	-43.6	-178	174.8	0	0	0	0	112.2	F57 L89 L90 V91 P97	F57-V93 HydrophobicContact CD2-CG2 3.92Å; F57-V93 HydrophobicContact CE2-CG2 3.82Å; L89-V93 WeakPolarHBondContact O-CG2 3.45Å; L89-V93 PolarHBondContact O-N 2.71Å; L90-V93 PolarHBondContact O-N 3.11Å; V91-V93 VanDerWaalsContact C-N 3.29Å; V91-V93 PolarHBondContact O-N 3.1Å; V93-P97 WeakPolarHBondContact O-CD 3.27Å; V93-P97 WeakPolarHBondContact O-CG 3.3Å
94	L	92.8	Very high	91.1	Very high	63 Å²	63	37.9 Å²	37.9	33%	0.33	20%	0.203	S	C	.	.	I	π-helix	trans	-95.4	-37.1	-170.7	-57.6	175.2	0	0	0	112.5	L90 H98 L122 L126	L90-L94 HydrophobicContact CB-CD1 4.45Å; L90-L94 HydrophobicContact CD2-CD1 4.04Å; L90-L94 VanDerWaalsContact O-CB 3.25Å; L90-L94 WeakPolarHBondContact O-CB 3.32Å; L90-L94 WeakPolarHBondContact O-CG 3.46Å; L90-L94 PolarHBondContact O-N 2.67Å; L94-H98 PolarHBondContact O-ND1 3.39Å; L94-L122 HydrophobicContact CB-CD2 3.94Å; L94-L122 HydrophobicContact CD1-CD2 3.98Å; L94-L126 HydrophobicContact CD1-CD1 4.48Å
95	I	91.2	Very high	90.8	Very high	7 Å²	7	43 Å²	43	4%	0.036	22%	0.222	C	C	.	.	I	π-helix	trans	-93.7	-52.4	-171.9	-53.6	-53.6	0	0	0	111.3	V91 H98 F99 W119 L122 N123 L126	V91-I95 HydrophobicContact CG1-CB 4.15Å; V91-I95 HydrophobicContact CG1-CG1 4.44Å; V91-I95 WeakPolarHBondContact O-CA 3.14Å; V91-I95 WeakPolarHBondContact O-CB 3.44Å; V91-I95 PolarHBondContact O-N 2.83Å; I95-H98 PolarHBondContact O-N 3.41Å; I95-F99 WeakPolarHBondContact O-CB 3.42Å; I95-F99 PolarHBondContact O-N 3.47Å; I95-W119 HydrophobicContact CG2-CZ2 4.38Å; I95-L122 HydrophobicContact CD1-CB 4.29Å; I95-L122 HydrophobicContact CD1-CD2 3.99Å; I95-L122 HydrophobicContact CD1-CG 3.96Å; I95-N123 HydrophobicContact CD1-CB 3.95Å; I95-N123 HydrophobicContact CG1-CB 4.45Å; I95-N123 HydrophobicContact CG2-CB 4.23Å; I95-L126 HydrophobicContact CD1-CD1 4.21Å; I95-L126 HydrophobicContact CG1-CD1 3.94Å
96	L	90.2	Very high	90.2	Very high	30 Å²	30	45.7 Å²	45.7	16%	0.157	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-44.2	-172.1	-63.6	-176.8	0	0	0	114.2	I56 V91 A92 H98 F99 I100	I56-L96 HydrophobicContact CD1-CD1 4.08Å; V91-L96 HydrophobicContact CG1-CG 4.48Å; V91-L96 PolarHBondContact O-N 2.87Å; A92-L96 HydrophobicContact CB-CD1 4.23Å; L96-H98 VanDerWaalsContact C-N 3.34Å; L96-H98 PolarHBondContact O-N 3.29Å; L96-F99 WeakPolarHBondContact O-CB 3.06Å; L96-F99 PolarHBondContact O-N 3.43Å; L96-I100 WeakPolarHBondContact O-CG1 3.47Å; L96-I100 PolarHBondContact O-N 3.17Å
97	P	91.3	Very high	89.5	Confident	54 Å²	54	45.4 Å²	45.4	35%	0.351	25%	0.246	S	C	.	.	H	α-helix	trans	-65.2	-39.2	-179	-24.2	37.2	0	0	0	112.2	A92 V93 F99 I100 M101	A92-P97 WeakPolarHBondContact O-CD 3.39Å; V93-P97 WeakPolarHBondContact O-CD 3.27Å; V93-P97 WeakPolarHBondContact O-CG 3.3Å; P97-F99 VanDerWaalsContact C-N 3.32Å; P97-I100 PolarHBondContact O-N 2.91Å; P97-M101 VanDerWaalsContact O-CG 3.25Å; P97-M101 WeakPolarHBondContact O-CG 3.47Å; P97-M101 PolarHBondContact O-N 2.79Å
98	H	88.6	Confident	88.9	Confident	56 Å²	56	45.8 Å²	45.8	26%	0.259	25%	0.247	S	C	.	.	H	α-helix	trans	-67.5	-35.8	177	-71.9	70.1	0	0	0	111.6	L94 I95 L96 M101 R102 Y110 W119	L94-H98 PolarHBondContact O-ND1 3.39Å; I95-H98 PolarHBondContact O-N 3.41Å; L96-H98 VanDerWaalsContact C-N 3.34Å; L96-H98 PolarHBondContact O-N 3.29Å; H98-M101 PolarHBondContact O-N 3.37Å; H98-R102 WeakPolarHBondContact O-CB 3.2Å; H98-R102 PolarHBondContact O-N 2.89Å; H98-Y110 AromaticContact CD2-CE2 3.37Å; H98-Y110 WeakPolarHBondContact CD2-CE2 3.37Å; H98-Y110 AromaticContact CD2-CZ 3.52Å; H98-Y110 PolarHBondContact CD2-OH 3.22Å; H98-Y110 AromaticContact NE2-CE2 3.96Å; H98-Y110 AromaticContact NE2-CZ 3.65Å; H98-Y110 PolarHBondContact NE2-OH 2.9Å; H98-W119 VanDerWaalsContact CB-NE1 3.28Å; H98-W119 AromaticContact CG-CD1 3.99Å
99	F	87.1	Confident	88.3	Confident	25 Å²	25	47 Å²	47	11%	0.11	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-46.4	173.6	-167.4	-95.3	0	0	0	111.6	Q49 I95 L96 P97 R102 Q103 W119 F462	Q49-F99 VanDerWaalsContact OE1-CD1 3.23Å; I95-F99 WeakPolarHBondContact O-CB 3.42Å; I95-F99 PolarHBondContact O-N 3.47Å; L96-F99 WeakPolarHBondContact O-CB 3.06Å; L96-F99 PolarHBondContact O-N 3.43Å; P97-F99 VanDerWaalsContact C-N 3.32Å; F99-R102 PolarHBondContact O-N 2.94Å; F99-Q103 PolarHBondContact O-N 3.07Å; F99-W119 HydrophobicContact CB-CZ2 4.15Å; F99-W119 AromaticContact CD2-CH2 3.96Å; F99-W119 HydrophobicContact CD2-CH2 3.96Å; F99-W119 HydrophobicContact CD2-CZ2 4.01Å; F99-F462 HydrophobicContact CD2-CD2 4.44Å; F99-F462 AromaticContact CE2-CD2 3.49Å; F99-F462 HydrophobicContact CE2-CD2 3.49Å; F99-F462 VanDerWaalsContact CE2-CD2 3.49Å; F99-F462 HydrophobicContact CE2-CE2 4.03Å; F99-F462 HydrophobicContact CE2-CG 4.43Å; F99-F462 HydrophobicContact CZ-CD2 4.04Å
100	I	88.7	Confident	87.9	Confident	31 Å²	31	50.3 Å²	50.3	16%	0.159	27%	0.267	C	S	.	.	H	α-helix	trans	-61.8	-46	176	-67	160.8	0	0	0	110.5	I46 Q49 I50 L96 P97 R102 Q103 V104	I46-I100 HydrophobicContact CG2-CG2 4.16Å; Q49-I100 HydrophobicContact CB-CD1 4.27Å; Q49-I100 HydrophobicContact CB-CG1 3.98Å; I50-I100 HydrophobicContact CG1-CD1 3.82Å; L96-I100 WeakPolarHBondContact O-CG1 3.47Å; L96-I100 PolarHBondContact O-N 3.17Å; P97-I100 PolarHBondContact O-N 2.91Å; I100-R102 PolarHBondContact O-N 2.85Å; I100-Q103 WeakPolarHBondContact O-CB 3.41Å; I100-Q103 PolarHBondContact O-N 3.44Å; I100-Q103 VanDerWaalsContact O-N 3.1Å; I100-V104 HydrophobicContact CG2-CG2 4.24Å; I100-V104 WeakPolarHBondContact O-CG2 3.37Å; I100-V104 PolarHBondContact O-N 3.14Å
101	M	89.6	Confident	87	Confident	89 Å²	89	54.5 Å²	54.5	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-56.9	-49.8	176.6	-72.2	-66.4	-168.9	0	0	111.1	P97 H98 Q103 V104 Y105 P109	P97-M101 VanDerWaalsContact O-CG 3.25Å; P97-M101 WeakPolarHBondContact O-CG 3.47Å; P97-M101 PolarHBondContact O-N 2.79Å; H98-M101 PolarHBondContact O-N 3.37Å; M101-Q103 PolarHBondContact O-N 2.69Å; M101-V104 PolarHBondContact O-N 2.91Å; M101-V104 VanDerWaalsContact O-N 3.11Å; M101-Y105 HydrophobicContact CB-CD2 4.46Å; M101-Y105 WeakPolarHBondContact O-CD2 3.34Å; M101-Y105 PolarHBondContact O-N 3.37Å; M101-Y105 HydrophobicContact SD-CE2 4.05Å; M101-P109 HydrophobicContact CB-CG 4.32Å
102	R	84.3	Confident	86.6	Confident	38 Å²	38	56 Å²	56	14%	0.143	30%	0.296	C	S	.	.	H	α-helix	trans	-57.4	-37.6	176.2	-175.1	-176.9	-178	-85.1	7.8	112.4	H98 F99 I100 G106 W108 C191	H98-R102 WeakPolarHBondContact O-CB 3.2Å; H98-R102 PolarHBondContact O-N 2.89Å; F99-R102 PolarHBondContact O-N 2.94Å; I100-R102 PolarHBondContact O-N 2.85Å; R102-G106 PolarHBondContact O-N 3.03Å; R102-W108 HydrophobicContact CB-CE3 4.5Å; R102-W108 HydrophobicContact CG-CE3 4.41Å; R102-C191 PolarHBondContact NH2-O 3.09Å
103	Q	84.3	Confident	85.9	Confident	28 Å²	28	59 Å²	59	13%	0.131	31%	0.308	C	S	.	.	H	α-helix	trans	-69.3	-38.7	177.1	-169	70.2	14.6	0	0	112.3	N42 I46 F99 I100 M101 N465	N42-Q103 PolarHBondContact OD1-NE2 2.95Å; I46-Q103 HydrophobicContact CD1-CB 4.48Å; I46-Q103 HydrophobicContact CD1-CG 3.92Å; I46-Q103 HydrophobicContact CG1-CB 4.21Å; I46-Q103 HydrophobicContact CG1-CG 3.65Å; F99-Q103 PolarHBondContact O-N 3.07Å; I100-Q103 WeakPolarHBondContact O-CB 3.41Å; I100-Q103 PolarHBondContact O-N 3.44Å; I100-Q103 VanDerWaalsContact O-N 3.1Å; M101-Q103 PolarHBondContact O-N 2.69Å; Q103-N465 PolarHBondContact NE2-ND2 3.48Å
104	V	88.4	Confident	85.3	Confident	88 Å²	88	61.4 Å²	61.4	53%	0.533	31%	0.314	S	S	.	.	H	α-helix	trans	-68.2	-45	179.1	170.2	0	0	0	0	111.3	I46 I100 M101	I46-V104 HydrophobicContact CD1-CG2 3.9Å; I100-V104 HydrophobicContact CG2-CG2 4.24Å; I100-V104 WeakPolarHBondContact O-CG2 3.37Å; I100-V104 PolarHBondContact O-N 3.14Å; M101-V104 PolarHBondContact O-N 2.91Å; M101-V104 VanDerWaalsContact O-N 3.11Å
105	Y	86.9	Confident	84.9	Confident	131 Å²	131	62.1 Å²	62.1	51%	0.514	32%	0.318	S	S	.	.	H	α-helix	trans	-77.2	-21.4	179.4	-71.8	-73.5	0	0	0	113.2	M101 H107 P109	M101-Y105 HydrophobicContact CB-CD2 4.46Å; M101-Y105 WeakPolarHBondContact O-CD2 3.34Å; M101-Y105 PolarHBondContact O-N 3.37Å; M101-Y105 HydrophobicContact SD-CE2 4.05Å; Y105-H107 PolarHBondContact O-CD2 3.45Å; Y105-H107 PolarHBondContact O-N 3.47Å; Y105-H107 VanDerWaalsContact O-N 3.11Å; Y105-P109 HydrophobicContact CD2-CB 3.5Å; Y105-P109 HydrophobicContact CD2-CG 4.02Å; Y105-P109 HydrophobicContact CE2-CB 3.79Å; Y105-P109 HydrophobicContact CE2-CG 4.39Å; Y105-P109 HydrophobicContact CG-CB 4.05Å
106	G	81.7	Confident	84.5	Confident	59 Å²	59	62.5 Å²	62.5	61%	0.608	32%	0.321	S	S	*	.	S	Bend	trans	73.1	-9.7	-172	0	0	0	0	0	114.1	R102	R102-G106 PolarHBondContact O-N 3.03Å
107	H	81	Confident	84.1	Confident	73 Å²	73	62.3 Å²	62.3	34%	0.338	32%	0.32	S	S	.	.	S	Bend	trans	-133.5	172	175.6	68.2	88.1	0	0	0	110.7	Y105 P109 G189	Y105-H107 PolarHBondContact O-CD2 3.45Å; Y105-H107 PolarHBondContact O-N 3.47Å; Y105-H107 VanDerWaalsContact O-N 3.11Å; H107-P109 WeakPolarHBondContact O-CD 3.34Å; H107-G189 CarbonylContact C-O 3.54Å; H107-G189 VanDerWaalsContact CA-O 3.3Å; H107-G189 WeakPolarHBondContact CA-O 3.3Å; H107-G189 VanDerWaalsContact CB-O 3.27Å; H107-G189 WeakPolarHBondContact CB-O 3.29Å
108	W	82.3	Confident	83.8	Confident	8 Å²	8	66.6 Å²	66.6	3%	0.03	33%	0.33	C	S	.	.			trans	-70.4	115.9	171	-174.6	-116.5	0	0	0	110	R102 Y110 S112 L115 C116 W119 G189 C191	R102-W108 HydrophobicContact CB-CE3 4.5Å; R102-W108 HydrophobicContact CG-CE3 4.41Å; W108-Y110 HydrophobicContact CD2-CD2 4.14Å; W108-Y110 AromaticContact CE2-CD2 3.59Å; W108-Y110 HydrophobicContact CE3-CD2 4.48Å; W108-Y110 AromaticContact CH2-CD2 3.84Å; W108-Y110 HydrophobicContact CH2-CD2 3.84Å; W108-Y110 HydrophobicContact CH2-CE2 4.02Å; W108-Y110 AromaticContact CZ2-CD2 3.43Å; W108-Y110 HydrophobicContact CZ2-CD2 3.43Å; W108-Y110 VanDerWaalsContact CZ2-CD2 3.43Å; W108-Y110 HydrophobicContact CZ2-CE2 4.07Å; W108-Y110 HydrophobicContact CZ2-CG 4.37Å; W108-Y110 HydrophobicContact CZ3-CD2 4.35Å; W108-Y110 HydrophobicContact CZ3-CE2 4.46Å; W108-Y110 PolarHBondContact O-N 3.42Å; W108-S112 PolarHBondContact NE1-O 2.87Å; W108-S112 VanDerWaalsContact NE1-O 3.15Å; W108-L115 HydrophobicContact CZ2-CB 4.14Å; W108-C116 HydrophobicContact CZ2-CB 4.39Å; W108-W119 HydrophobicContact CH2-CB 3.7Å; W108-W119 AromaticContact CH2-CD2 3.82Å; W108-W119 HydrophobicContact CH2-CD2 3.82Å; W108-W119 HydrophobicContact CH2-CE3 4.07Å; W108-W119 AromaticContact CH2-CG 3.65Å; W108-W119 HydrophobicContact CH2-CG 3.65Å; W108-W119 HydrophobicContact CZ2-CB 4.23Å; W108-W119 AromaticContact CZ3-CD2 3.91Å; W108-W119 HydrophobicContact CZ3-CD2 3.91Å; W108-W119 AromaticContact CZ3-CE3 3.9Å; W108-W119 HydrophobicContact CZ3-CE3 3.9Å; W108-W119 HydrophobicContact CZ3-CG 4.23Å; W108-W119 HydrophobicContact CZ3-CZ3 4.4Å; W108-G189 PolarHBondContact N-O 3.2Å; W108-C191 HydrophobicContact CB-CB 3.8Å; W108-C191 HydrophobicContact CD2-CB 3.79Å; W108-C191 HydrophobicContact CE3-CB 3.91Å; W108-C191 HydrophobicContact CG-CB 3.78Å
109	P	81.4	Confident	83.7	Confident	34 Å²	34	64.5 Å²	64.5	22%	0.221	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-17.5	-168.1	30.2	-35.6	0	0	0	114.1	M101 Y105 H107 E111	M101-P109 HydrophobicContact CB-CG 4.32Å; Y105-P109 HydrophobicContact CD2-CB 3.5Å; Y105-P109 HydrophobicContact CD2-CG 4.02Å; Y105-P109 HydrophobicContact CE2-CB 3.79Å; Y105-P109 HydrophobicContact CE2-CG 4.39Å; Y105-P109 HydrophobicContact CG-CB 4.05Å; H107-P109 WeakPolarHBondContact O-CD 3.34Å; P109-E111 VanDerWaalsContact C-N 3.32Å
110	Y	83.5	Confident	83.4	Confident	91 Å²	91	64.8 Å²	64.8	36%	0.357	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-8.3	-176.1	-56.8	-75.8	0	0	0	113.3	H98 W108 S112 L115	H98-Y110 AromaticContact CD2-CE2 3.37Å; H98-Y110 WeakPolarHBondContact CD2-CE2 3.37Å; H98-Y110 AromaticContact CD2-CZ 3.52Å; H98-Y110 PolarHBondContact CD2-OH 3.22Å; H98-Y110 AromaticContact NE2-CE2 3.96Å; H98-Y110 AromaticContact NE2-CZ 3.65Å; H98-Y110 PolarHBondContact NE2-OH 2.9Å; W108-Y110 HydrophobicContact CD2-CD2 4.14Å; W108-Y110 AromaticContact CE2-CD2 3.59Å; W108-Y110 HydrophobicContact CE3-CD2 4.48Å; W108-Y110 AromaticContact CH2-CD2 3.84Å; W108-Y110 HydrophobicContact CH2-CD2 3.84Å; W108-Y110 HydrophobicContact CH2-CE2 4.02Å; W108-Y110 AromaticContact CZ2-CD2 3.43Å; W108-Y110 HydrophobicContact CZ2-CD2 3.43Å; W108-Y110 VanDerWaalsContact CZ2-CD2 3.43Å; W108-Y110 HydrophobicContact CZ2-CE2 4.07Å; W108-Y110 HydrophobicContact CZ2-CG 4.37Å; W108-Y110 HydrophobicContact CZ3-CD2 4.35Å; W108-Y110 HydrophobicContact CZ3-CE2 4.46Å; W108-Y110 PolarHBondContact O-N 3.42Å; Y110-S112 WeakPolarHBondContact O-CB 3.43Å; Y110-S112 PolarHBondContact O-N 2.87Å; Y110-L115 HydrophobicContact CD1-CD1 4.31Å; Y110-L115 HydrophobicContact CG-CD1 4.1Å
111	E	77.2	Confident	83.2	Confident	144 Å²	144	63.5 Å²	63.5	67%	0.673	32%	0.316	S	S	*	.			trans	48.6	14.7	-177.2	-63.3	-179.8	-174	0	0	114.9	P109	P109-E111 VanDerWaalsContact C-N 3.32Å
112	S	82.5	Confident	83.2	Confident	39 Å²	39	60.3 Å²	60.3	27%	0.273	30%	0.301	S	S	.	.			trans	-109.7	120.8	-175.6	173	0	0	0	0	109.6	W108 Y110 L115 C116	W108-S112 PolarHBondContact NE1-O 2.87Å; W108-S112 VanDerWaalsContact NE1-O 3.15Å; Y110-S112 WeakPolarHBondContact O-CB 3.43Å; Y110-S112 PolarHBondContact O-N 2.87Å; S112-L115 PolarHBondContact O-N 2.85Å; S112-L115 PolarHBondContact OG-N 3.14Å; S112-C116 PolarHBondContact O-N 3.18Å; S112-C116 VanDerWaalsContact O-N 3.15Å
113	H	77.4	Confident	83.3	Confident	75 Å²	75	60.3 Å²	60.3	35%	0.347	30%	0.304	S	S	.	.	H	α-helix	trans	-60.9	-44.6	175.5	-179.5	-105.7	0	0	0	112.2	L115 C116 I117 H184	H113-L115 PolarHBondContact O-N 3.39Å; H113-C116 WeakPolarHBondContact O-CB 3.31Å; H113-C116 PolarHBondContact O-N 2.76Å; H113-C116 VanDerWaalsContact O-N 3.11Å; H113-I117 WeakPolarHBondContact CE1-CD1 3.35Å; H113-I117 PolarHBondContact O-N 3.29Å; H113-H184 AromaticContact CE1-CD2 3.82Å; H113-H184 AromaticContact CE1-CG 3.44Å; H113-H184 VanDerWaalsContact CE1-CG 3.44Å; H113-H184 AromaticContact CE1-ND1 3.78Å; H113-H184 WeakPolarHBondContact NE2-CB 3.37Å; H113-H184 AromaticContact NE2-CD2 3.89Å; H113-H184 AromaticContact NE2-CG 3.06Å; H113-H184 AromaticContact NE2-ND1 3.18Å; H113-H184 PolarHBondContact NE2-ND1 3.06Å; H113-H184 VanDerWaalsContact NE2-ND1 3.18Å
114	E	81.4	Confident	83.3	Confident	126 Å²	126	61 Å²	61	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-64.1	-40.2	-179.4	-57.7	-48	125.8	0	0	111.9	C116 I117 Y118	E114-C116 VanDerWaalsContact C-N 3.3Å; E114-C116 PolarHBondContact O-N 3.37Å; E114-I117 PolarHBondContact O-N 2.85Å; E114-Y118 VanDerWaalsContact O-CB 3.27Å; E114-Y118 WeakPolarHBondContact O-CB 3.27Å; E114-Y118 PolarHBondContact O-N 2.84Å
115	L	85	Confident	83.4	Confident	79 Å²	79	58.6 Å²	58.6	41%	0.414	29%	0.291	S	S	.	.	H	α-helix	trans	-65.8	-34.6	174.9	-70	178.3	0	0	0	112.1	W108 Y110 S112 H113 W119	W108-L115 HydrophobicContact CZ2-CB 4.14Å; Y110-L115 HydrophobicContact CD1-CD1 4.31Å; Y110-L115 HydrophobicContact CG-CD1 4.1Å; S112-L115 PolarHBondContact O-N 2.85Å; S112-L115 PolarHBondContact OG-N 3.14Å; H113-L115 PolarHBondContact O-N 3.39Å; L115-W119 WeakPolarHBondContact O-CB 3.48Å; L115-W119 PolarHBondContact O-N 3.19Å
116	C	82.8	Confident	83.6	Confident	14 Å²	14	52.4 Å²	52.4	10%	0.095	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-50.1	174	170.9	0	0	0	0	111.4	W108 S112 H113 E114 Y118 W119 L120 C191	W108-C116 HydrophobicContact CZ2-CB 4.39Å; S112-C116 PolarHBondContact O-N 3.18Å; S112-C116 VanDerWaalsContact O-N 3.15Å; H113-C116 WeakPolarHBondContact O-CB 3.31Å; H113-C116 PolarHBondContact O-N 2.76Å; H113-C116 VanDerWaalsContact O-N 3.11Å; E114-C116 VanDerWaalsContact C-N 3.3Å; E114-C116 PolarHBondContact O-N 3.37Å; C116-Y118 VanDerWaalsContact C-N 3.31Å; C116-Y118 PolarHBondContact O-N 2.88Å; C116-W119 PolarHBondContact O-N 3.43Å; C116-L120 WeakPolarHBondContact O-CB 3.45Å; C116-L120 PolarHBondContact O-N 3.43Å; C116-C191 WeakPolarHBondContact CA-SG 3.31Å; C116-C191 HydrophobicContact CB-CB 3.8Å; C116-C191 WeakPolarHBondContact CB-SG 3.25Å; C116-C191 WeakPolarHBondContact SG-CA 3.41Å; C116-C191 WeakPolarHBondContact SG-CB 3.35Å; C116-C191 CovalentContact SG-SG 2.02Å; C116-C191 PolarHBondContact SG-SG 3.47Å
117	I	80.1	Confident	83.9	Confident	26 Å²	26	50.8 Å²	50.8	13%	0.133	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-47.6	177.2	-65.7	175.2	0	0	0	110.1	H113 E114 L120 S121 H184	H113-I117 WeakPolarHBondContact CE1-CD1 3.35Å; H113-I117 PolarHBondContact O-N 3.29Å; E114-I117 PolarHBondContact O-N 2.85Å; I117-L120 PolarHBondContact O-N 2.97Å; I117-S121 WeakPolarHBondContact O-CB 3.47Å; I117-S121 PolarHBondContact O-N 3.3Å; I117-S121 PolarHBondContact O-OG 3.05Å; I117-H184 VanDerWaalsContact CD1-CE1 3.42Å; I117-H184 WeakPolarHBondContact CD1-CE1 3.26Å; I117-H184 WeakPolarHBondContact CD1-NE2 3.41Å; I117-H184 VanDerWaalsContact CG1-CE1 3.46Å; I117-H184 WeakPolarHBondContact CG1-CE1 3.39Å
118	Y	85.2	Confident	84.2	Confident	144 Å²	144	48 Å²	48	57%	0.565	23%	0.234	S	C	*	.	H	α-helix	trans	-58.8	-50.3	179.5	174	-99.8	0	0	0	111.5	E114 C116 L120 S121 L122	E114-Y118 VanDerWaalsContact O-CB 3.27Å; E114-Y118 WeakPolarHBondContact O-CB 3.27Å; E114-Y118 PolarHBondContact O-N 2.84Å; C116-Y118 VanDerWaalsContact C-N 3.31Å; C116-Y118 PolarHBondContact O-N 2.88Å; Y118-L120 VanDerWaalsContact C-N 3.35Å; Y118-L120 PolarHBondContact O-N 3.35Å; Y118-S121 PolarHBondContact O-N 2.89Å; Y118-L122 HydrophobicContact CE1-CD2 3.97Å; Y118-L122 WeakPolarHBondContact O-CB 3.46Å; Y118-L122 PolarHBondContact O-N 2.91Å
119	W	86.2	Confident	84.7	Confident	12 Å²	12	47.6 Å²	47.6	5%	0.045	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-41.8	-178.7	175	78.1	0	0	0	112.3	I95 H98 F99 W108 L115 C116 L122 N123 F462	I95-W119 HydrophobicContact CG2-CZ2 4.38Å; H98-W119 VanDerWaalsContact CB-NE1 3.28Å; H98-W119 AromaticContact CG-CD1 3.99Å; F99-W119 HydrophobicContact CB-CZ2 4.15Å; F99-W119 AromaticContact CD2-CH2 3.96Å; F99-W119 HydrophobicContact CD2-CH2 3.96Å; F99-W119 HydrophobicContact CD2-CZ2 4.01Å; W108-W119 HydrophobicContact CH2-CB 3.7Å; W108-W119 AromaticContact CH2-CD2 3.82Å; W108-W119 HydrophobicContact CH2-CD2 3.82Å; W108-W119 HydrophobicContact CH2-CE3 4.07Å; W108-W119 AromaticContact CH2-CG 3.65Å; W108-W119 HydrophobicContact CH2-CG 3.65Å; W108-W119 HydrophobicContact CZ2-CB 4.23Å; W108-W119 AromaticContact CZ3-CD2 3.91Å; W108-W119 HydrophobicContact CZ3-CD2 3.91Å; W108-W119 AromaticContact CZ3-CE3 3.9Å; W108-W119 HydrophobicContact CZ3-CE3 3.9Å; W108-W119 HydrophobicContact CZ3-CG 4.23Å; W108-W119 HydrophobicContact CZ3-CZ3 4.4Å; L115-W119 WeakPolarHBondContact O-CB 3.48Å; L115-W119 PolarHBondContact O-N 3.19Å; C116-W119 PolarHBondContact O-N 3.43Å; W119-L122 PolarHBondContact O-N 2.86Å; W119-N123 WeakPolarHBondContact O-CB 3.32Å; W119-N123 PolarHBondContact O-N 2.91Å; W119-F462 HydrophobicContact CH2-CE2 4.45Å
120	L	81.7	Confident	85.2	Confident	31 Å²	31	46.2 Å²	46.2	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-69.9	-41.6	179.9	-172.4	49	0	0	0	112.2	C116 I117 Y118 N123 L124 I193	C116-L120 WeakPolarHBondContact O-CB 3.45Å; C116-L120 PolarHBondContact O-N 3.43Å; I117-L120 PolarHBondContact O-N 2.97Å; Y118-L120 VanDerWaalsContact C-N 3.35Å; Y118-L120 PolarHBondContact O-N 3.35Å; L120-N123 PolarHBondContact O-N 3.01Å; L120-L124 PolarHBondContact O-N 3.49Å; L120-I193 HydrophobicContact CD1-CD1 4.34Å; L120-I193 HydrophobicContact CD1-CG1 4.2Å; L120-I193 HydrophobicContact CD2-CB 4.38Å; L120-I193 HydrophobicContact CD2-CD1 4.05Å; L120-I193 HydrophobicContact CD2-CG1 3.23Å; L120-I193 HydrophobicContact CG-CD1 4.09Å; L120-I193 HydrophobicContact CG-CG1 3.83Å
121	S	84.8	Confident	85.4	Confident	5 Å²	5	43.6 Å²	43.6	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-49	171.9	-62.3	0	0	0	0	110.7	I117 Y118 N123 L124 F125 M175 I179	I117-S121 WeakPolarHBondContact O-CB 3.47Å; I117-S121 PolarHBondContact O-N 3.3Å; I117-S121 PolarHBondContact O-OG 3.05Å; Y118-S121 PolarHBondContact O-N 2.89Å; S121-N123 VanDerWaalsContact C-N 3.34Å; S121-N123 PolarHBondContact O-N 3.24Å; S121-L124 PolarHBondContact O-N 3.41Å; S121-F125 WeakPolarHBondContact O-CB 3.42Å; S121-F125 PolarHBondContact O-N 2.94Å; S121-M175 VanDerWaalsContact CB-SD 3.59Å; S121-M175 VanDerWaalsContact O-CG 3.22Å; S121-M175 WeakPolarHBondContact O-CG 3.5Å; S121-I179 WeakPolarHBondContact OG-CG1 3.25Å
122	L	89.2	Confident	86	Confident	21 Å²	21	39 Å²	39	11%	0.11	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-41.5	178.6	-176.3	68.2	0	0	0	111.8	L94 I95 Y118 W119 F125 L126	L94-L122 HydrophobicContact CB-CD2 3.94Å; L94-L122 HydrophobicContact CD1-CD2 3.98Å; I95-L122 HydrophobicContact CD1-CB 4.29Å; I95-L122 HydrophobicContact CD1-CD2 3.99Å; I95-L122 HydrophobicContact CD1-CG 3.96Å; Y118-L122 HydrophobicContact CE1-CD2 3.97Å; Y118-L122 WeakPolarHBondContact O-CB 3.46Å; Y118-L122 PolarHBondContact O-N 2.91Å; W119-L122 PolarHBondContact O-N 2.86Å; L122-F125 HydrophobicContact CD1-CD1 4.2Å; L122-F125 PolarHBondContact O-N 3.31Å; L122-L126 HydrophobicContact CD1-CD1 4.01Å; L122-L126 HydrophobicContact CD1-CG 4.12Å; L122-L126 HydrophobicContact CD2-CD1 4.46Å; L122-L126 HydrophobicContact CG-CD1 3.87Å; L122-L126 HydrophobicContact CG-CG 4.32Å; L122-L126 WeakPolarHBondContact O-CB 3.44Å; L122-L126 WeakPolarHBondContact O-CG 3.4Å; L122-L126 PolarHBondContact O-N 3.38Å
123	N	87.3	Confident	86.4	Confident	38 Å²	38	37.1 Å²	37.1	20%	0.203	18%	0.182	C	C	.	.	H	α-helix	trans	-58.6	-48.8	174.3	178.1	42.8	0	0	0	111.1	I95 W119 L120 S121 F125 L126 C127	I95-N123 HydrophobicContact CD1-CB 3.95Å; I95-N123 HydrophobicContact CG1-CB 4.45Å; I95-N123 HydrophobicContact CG2-CB 4.23Å; W119-N123 WeakPolarHBondContact O-CB 3.32Å; W119-N123 PolarHBondContact O-N 2.91Å; L120-N123 PolarHBondContact O-N 3.01Å; S121-N123 VanDerWaalsContact C-N 3.34Å; S121-N123 PolarHBondContact O-N 3.24Å; N123-F125 VanDerWaalsContact C-N 3.33Å; N123-F125 PolarHBondContact O-N 3.48Å; N123-L126 PolarHBondContact O-N 2.89Å; N123-C127 VanDerWaalsContact O-CB 3.26Å; N123-C127 WeakPolarHBondContact O-CB 3.4Å; N123-C127 PolarHBondContact O-N 2.94Å; N123-C127 PolarHBondContact O-SG 3.35Å; N123-C127 PolarHBondContact OD1-SG 2.91Å
124	L	83.9	Confident	87	Confident	44 Å²	44	35.2 Å²	35.2	23%	0.23	17%	0.174	C	C	.	.	H	α-helix	trans	-62.2	-42.2	178.2	-177.7	58.2	0	0	0	111.7	L120 S121 S128 V174 P178	L120-L124 PolarHBondContact O-N 3.49Å; S121-L124 PolarHBondContact O-N 3.41Å; L124-S128 WeakPolarHBondContact O-CB 3.32Å; L124-S128 PolarHBondContact O-N 2.84Å; L124-V174 HydrophobicContact CD1-CG1 4.07Å; L124-V174 HydrophobicContact CD2-CG1 4.33Å; L124-V174 WeakPolarHBondContact CD2-O 3.47Å; L124-V174 HydrophobicContact CG-CG1 4.12Å; L124-P178 HydrophobicContact CD2-CG 3.65Å
125	F	89.8	Confident	87.3	Confident	37 Å²	37	29.9 Å²	29.9	16%	0.162	15%	0.15	C	C	.	.	H	α-helix	trans	-60.5	-52.8	176.4	170.2	-114.7	0	0	0	112.5	S121 L122 N123 S128 A129 W168 F172 M175	S121-F125 WeakPolarHBondContact O-CB 3.42Å; S121-F125 PolarHBondContact O-N 2.94Å; L122-F125 HydrophobicContact CD1-CD1 4.2Å; L122-F125 PolarHBondContact O-N 3.31Å; N123-F125 VanDerWaalsContact C-N 3.33Å; N123-F125 PolarHBondContact O-N 3.48Å; F125-S128 PolarHBondContact O-N 3.41Å; F125-A129 WeakPolarHBondContact O-CB 3.34Å; F125-A129 PolarHBondContact O-N 2.89Å; F125-W168 HydrophobicContact CE1-CE3 4.03Å; F125-W168 AromaticContact CE1-CZ3 3.82Å; F125-W168 HydrophobicContact CE1-CZ3 3.82Å; F125-W168 HydrophobicContact CE2-CE3 4.11Å; F125-W168 AromaticContact CZ-CE3 3.47Å; F125-W168 HydrophobicContact CZ-CE3 3.47Å; F125-W168 VanDerWaalsContact CZ-CE3 3.47Å; F125-W168 AromaticContact CZ-CZ3 3.77Å; F125-W168 HydrophobicContact CZ-CZ3 3.77Å; F125-F172 HydrophobicContact CD2-CB 4.14Å; F125-F172 HydrophobicContact CE2-CB 3.87Å; F125-F172 HydrophobicContact CE2-CD2 4.35Å; F125-M175 HydrophobicContact CB-CB 4.12Å; F125-M175 HydrophobicContact CB-CG 4.29Å; F125-M175 HydrophobicContact CB-SD 3.66Å; F125-M175 HydrophobicContact CG-SD 4.35Å
126	L	91.8	Very high	87.6	Confident	1 Å²	1	27 Å²	27	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-70.6	-39.1	-175.5	-67.3	175	0	0	0	112.5	L90 V91 L94 I95 L122 N123 A129 S130 W168	L90-L126 HydrophobicContact CB-CD1 3.87Å; L90-L126 HydrophobicContact CB-CD2 3.73Å; L90-L126 HydrophobicContact CB-CG 4.45Å; L90-L126 HydrophobicContact CD1-CD2 3.85Å; L90-L126 HydrophobicContact CG-CD2 4.46Å; V91-L126 HydrophobicContact CG2-CB 3.63Å; V91-L126 HydrophobicContact CG2-CD1 4.34Å; L94-L126 HydrophobicContact CD1-CD1 4.48Å; I95-L126 HydrophobicContact CD1-CD1 4.21Å; I95-L126 HydrophobicContact CG1-CD1 3.94Å; L122-L126 HydrophobicContact CD1-CD1 4.01Å; L122-L126 HydrophobicContact CD1-CG 4.12Å; L122-L126 HydrophobicContact CD2-CD1 4.46Å; L122-L126 HydrophobicContact CG-CD1 3.87Å; L122-L126 HydrophobicContact CG-CG 4.32Å; L122-L126 WeakPolarHBondContact O-CB 3.44Å; L122-L126 WeakPolarHBondContact O-CG 3.4Å; L122-L126 PolarHBondContact O-N 3.38Å; N123-L126 PolarHBondContact O-N 2.89Å; L126-A129 PolarHBondContact O-N 3.04Å; L126-S130 PolarHBondContact O-N 3.26Å; L126-S130 PolarHBondContact O-OG 2.94Å; L126-W168 HydrophobicContact CD2-CH2 4.49Å; L126-W168 HydrophobicContact CD2-CZ3 4.18Å
127	C	87.9	Confident	88	Confident	24 Å²	24	27.2 Å²	27.2	16%	0.162	14%	0.137	C	C	.	.	H	α-helix	trans	-64.1	-44.7	173.7	-70	0	0	0	0	111	N123 A129 S130 I131	N123-C127 VanDerWaalsContact O-CB 3.26Å; N123-C127 WeakPolarHBondContact O-CB 3.4Å; N123-C127 PolarHBondContact O-N 2.94Å; N123-C127 PolarHBondContact O-SG 3.35Å; N123-C127 PolarHBondContact OD1-SG 2.91Å; C127-A129 VanDerWaalsContact C-N 3.32Å; C127-A129 PolarHBondContact O-N 2.78Å; C127-S130 PolarHBondContact O-N 3.48Å; C127-I131 WeakPolarHBondContact O-CG1 3.44Å; C127-I131 PolarHBondContact O-N 3.17Å
128	S	87.2	Confident	88.4	Confident	15 Å²	15	26 Å²	26	11%	0.105	13%	0.131	C	C	.	.	H	α-helix	trans	-60.3	-42.4	174.2	-179	0	0	0	0	111.4	L124 F125 S130 I131 L132 S171	L124-S128 WeakPolarHBondContact O-CB 3.32Å; L124-S128 PolarHBondContact O-N 2.84Å; F125-S128 PolarHBondContact O-N 3.41Å; S128-S130 VanDerWaalsContact C-N 3.31Å; S128-S130 PolarHBondContact O-N 3.35Å; S128-I131 PolarHBondContact O-N 3.45Å; S128-L132 WeakPolarHBondContact O-CB 3.45Å; S128-L132 WeakPolarHBondContact O-CG 3.31Å; S128-L132 PolarHBondContact O-N 3.47Å; S128-S171 PolarHBondContact O-OG 3.47Å; S128-S171 WeakPolarHBondContact OG-CA 3.22Å; S128-S171 WeakPolarHBondContact OG-CB 3.06Å; S128-S171 PolarHBondContact OG-OG 3.5Å; S128-S171 VanDerWaalsContact OG-OG 3.09Å
129	A	91.8	Very high	88.5	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62	-41.7	178.9	0	0	0	0	0	111.1	A87 F125 L126 C127 L132 N133 W168 S171	A87-A129 HydrophobicContact CB-CB 4.41Å; F125-A129 WeakPolarHBondContact O-CB 3.34Å; F125-A129 PolarHBondContact O-N 2.89Å; L126-A129 PolarHBondContact O-N 3.04Å; C127-A129 VanDerWaalsContact C-N 3.32Å; C127-A129 PolarHBondContact O-N 2.78Å; A129-L132 PolarHBondContact O-N 3.41Å; A129-N133 WeakPolarHBondContact O-CB 3.35Å; A129-N133 PolarHBondContact O-N 2.94Å; A129-N133 PolarHBondContact O-ND2 2.79Å; A129-W168 HydrophobicContact CB-CD2 4.28Å; A129-W168 HydrophobicContact CB-CE3 3.86Å; A129-W168 HydrophobicContact CB-CH2 4.27Å; A129-W168 HydrophobicContact CB-CZ3 3.87Å; A129-S171 WeakPolarHBondContact CA-OG 3.22Å; A129-S171 PolarHBondContact N-OG 3.42Å
130	S	91.7	Very high	88.6	Confident	5 Å²	5	20.5 Å²	20.5	4%	0.035	11%	0.113	C	C	.	.	H	α-helix	trans	-62.5	-46.7	177.3	-54.8	0	0	0	0	111.4	L84 A87 L126 C127 S128 N133 I134	L84-S130 WeakPolarHBondContact CD1-O 3.49Å; A87-S130 WeakPolarHBondContact CB-OG 3.33Å; L126-S130 PolarHBondContact O-N 3.26Å; L126-S130 PolarHBondContact O-OG 2.94Å; C127-S130 PolarHBondContact O-N 3.48Å; S128-S130 VanDerWaalsContact C-N 3.31Å; S128-S130 PolarHBondContact O-N 3.35Å; S130-N133 PolarHBondContact O-N 3.33Å; S130-I134 WeakPolarHBondContact O-CG1 3.34Å; S130-I134 PolarHBondContact O-N 3.48Å; S130-I134 VanDerWaalsContact O-N 3.08Å
131	I	88.1	Confident	88.9	Confident	36 Å²	36	19.3 Å²	19.3	19%	0.185	11%	0.106	C	C	.	.	H	α-helix	trans	-61.8	-48.1	176.3	-67.1	169.1	0	0	0	111.3	C127 S128 N133 I134 C135 P211 F452	C127-I131 WeakPolarHBondContact O-CG1 3.44Å; C127-I131 PolarHBondContact O-N 3.17Å; S128-I131 PolarHBondContact O-N 3.45Å; I131-N133 VanDerWaalsContact C-N 3.31Å; I131-N133 PolarHBondContact O-N 3.37Å; I131-I134 WeakPolarHBondContact O-CB 3.47Å; I131-I134 PolarHBondContact O-N 2.92Å; I131-I134 VanDerWaalsContact O-N 3.14Å; I131-C135 PolarHBondContact O-N 2.85Å; I131-C135 PolarHBondContact O-SG 3.47Å; I131-P211 HydrophobicContact CG2-CB 3.69Å; I131-P211 HydrophobicContact CG2-CG 4.18Å; I131-F452 HydrophobicContact CD1-CE2 4.03Å; I131-F452 HydrophobicContact CG1-CE2 4.32Å
132	L	89.8	Confident	88.8	Confident	47 Å²	47	21.9 Å²	21.9	25%	0.246	12%	0.116	C	C	.	.	H	α-helix	trans	-66.6	-32.8	-179.2	-69.3	-173.7	0	0	0	112.1	S128 A129 C135 C136 A167 A170 S171	S128-L132 WeakPolarHBondContact O-CB 3.45Å; S128-L132 WeakPolarHBondContact O-CG 3.31Å; S128-L132 PolarHBondContact O-N 3.47Å; A129-L132 PolarHBondContact O-N 3.41Å; L132-C135 WeakPolarHBondContact O-CB 3.4Å; L132-C135 PolarHBondContact O-N 3.44Å; L132-C136 PolarHBondContact O-N 3.04Å; L132-C136 PolarHBondContact O-SG 2.86Å; L132-A167 HydrophobicContact CB-CB 3.75Å; L132-A167 WeakPolarHBondContact CD1-O 3.25Å; L132-A170 HydrophobicContact CD1-CB 3.54Å; L132-S171 WeakPolarHBondContact CD1-OG 3.35Å
133	N	92	Very high	88.6	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.5	-41.9	170.7	-84.1	-71.5	0	0	0	111.8	S83 L84 A129 S130 I131 C135 C136 I137	S83-N133 VanDerWaalsContact CB-OD1 3.31Å; S83-N133 WeakPolarHBondContact CB-OD1 3.33Å; S83-N133 PolarHBondContact OG-ND2 3.29Å; S83-N133 PolarHBondContact OG-OD1 3.29Å; L84-N133 HydrophobicContact CB-CB 4.13Å; L84-N133 HydrophobicContact CD1-CB 3.98Å; A129-N133 WeakPolarHBondContact O-CB 3.35Å; A129-N133 PolarHBondContact O-N 2.94Å; A129-N133 PolarHBondContact O-ND2 2.79Å; S130-N133 PolarHBondContact O-N 3.33Å; I131-N133 VanDerWaalsContact C-N 3.31Å; I131-N133 PolarHBondContact O-N 3.37Å; N133-C135 VanDerWaalsContact C-N 3.31Å; N133-C135 PolarHBondContact O-N 3.02Å; N133-C136 WeakPolarHBondContact O-CB 3.06Å; N133-C136 PolarHBondContact O-N 3.42Å; N133-I137 WeakPolarHBondContact O-CG1 3.28Å; N133-I137 PolarHBondContact O-N 2.98Å
134	I	88.9	Confident	88.5	Confident	35 Å²	35	19.8 Å²	19.8	18%	0.179	11%	0.105	C	C	.	.	H	α-helix	trans	-61.2	-41.3	173.2	-67	168.4	0	0	0	110.9	L84 S130 I131 I137 S138 V215	L84-I134 HydrophobicContact CD1-CD1 4.46Å; L84-I134 HydrophobicContact CD1-CG1 3.97Å; L84-I134 HydrophobicContact CD2-CG1 4.03Å; S130-I134 WeakPolarHBondContact O-CG1 3.34Å; S130-I134 PolarHBondContact O-N 3.48Å; S130-I134 VanDerWaalsContact O-N 3.08Å; I131-I134 WeakPolarHBondContact O-CB 3.47Å; I131-I134 PolarHBondContact O-N 2.92Å; I131-I134 VanDerWaalsContact O-N 3.14Å; I134-I137 PolarHBondContact O-N 3.34Å; I134-S138 WeakPolarHBondContact O-CB 3.4Å; I134-S138 PolarHBondContact O-N 3.22Å; I134-S138 PolarHBondContact O-OG 3.44Å; I134-V215 HydrophobicContact CG2-CG1 4.34Å; I134-V215 HydrophobicContact CG2-CG2 4.3Å
135	C	88.5	Confident	88.3	Confident	13 Å²	13	17.9 Å²	17.9	9%	0.088	9%	0.094	C	C	.	.	H	α-helix	trans	-61.5	-44.6	173.8	-70	0	0	0	0	111.5	I131 L132 N133 I137 S138 V139	I131-C135 PolarHBondContact O-N 2.85Å; I131-C135 PolarHBondContact O-SG 3.47Å; L132-C135 WeakPolarHBondContact O-CB 3.4Å; L132-C135 PolarHBondContact O-N 3.44Å; N133-C135 VanDerWaalsContact C-N 3.31Å; N133-C135 PolarHBondContact O-N 3.02Å; C135-I137 PolarHBondContact O-N 3.17Å; C135-S138 PolarHBondContact O-N 2.84Å; C135-V139 WeakPolarHBondContact O-CB 3.43Å; C135-V139 VanDerWaalsContact O-CG2 3.32Å; C135-V139 WeakPolarHBondContact O-CG2 3.34Å; C135-V139 PolarHBondContact O-N 3.37Å
136	C	90.4	Very high	87.7	Confident	18 Å²	18	17.5 Å²	17.5	12%	0.122	9%	0.094	C	C	.	.	H	α-helix	trans	-60.3	-44	176.1	-72.2	0	0	0	0	112.2	Y80 L132 N133 V139 D140 M163	Y80-C136 HydrophobicContact CD1-CB 4.05Å; Y80-C136 HydrophobicContact CE1-CB 4.06Å; L132-C136 PolarHBondContact O-N 3.04Å; L132-C136 PolarHBondContact O-SG 2.86Å; N133-C136 WeakPolarHBondContact O-CB 3.06Å; N133-C136 PolarHBondContact O-N 3.42Å; C136-V139 PolarHBondContact O-N 3.08Å; C136-D140 WeakPolarHBondContact O-CB 3.49Å; C136-D140 PolarHBondContact O-N 2.79Å; C136-M163 HydrophobicContact CB-CE 4.15Å
137	I	91	Very high	87.2	Confident	20 Å²	20	21.4 Å²	21.4	10%	0.103	11%	0.11	C	C	.	.	H	α-helix	trans	-58.3	-50.7	173.8	-67.1	165.5	0	0	0	109.5	Y80 L84 N133 I134 C135 V139 D140 R141	Y80-I137 HydrophobicContact CG-CG1 4.27Å; L84-I137 HydrophobicContact CB-CD1 4.49Å; L84-I137 HydrophobicContact CD2-CD1 3.89Å; N133-I137 WeakPolarHBondContact O-CG1 3.28Å; N133-I137 PolarHBondContact O-N 2.98Å; I134-I137 PolarHBondContact O-N 3.34Å; C135-I137 PolarHBondContact O-N 3.17Å; I137-V139 VanDerWaalsContact C-N 3.33Å; I137-V139 PolarHBondContact O-N 2.86Å; I137-D140 PolarHBondContact O-N 3.03Å; I137-R141 HydrophobicContact CG2-CG 4.22Å; I137-R141 VanDerWaalsContact O-CG 3.28Å; I137-R141 WeakPolarHBondContact O-CG 3.41Å; I137-R141 PolarHBondContact O-N 2.9Å
138	S	88.4	Confident	86.6	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.4	-43.3	-178.2	-57.9	0	0	0	0	112	I134 C135 Y142 Y219	I134-S138 WeakPolarHBondContact O-CB 3.4Å; I134-S138 PolarHBondContact O-N 3.22Å; I134-S138 PolarHBondContact O-OG 3.44Å; C135-S138 PolarHBondContact O-N 2.84Å; S138-Y142 VanDerWaalsContact O-CB 3.29Å; S138-Y142 WeakPolarHBondContact O-CB 3.37Å; S138-Y142 PolarHBondContact O-N 2.99Å; S138-Y219 WeakPolarHBondContact OG-CE2 3.44Å
139	V	87.3	Confident	86.2	Confident	33 Å²	33	23.3 Å²	23.3	20%	0.2	12%	0.116	C	C	.	.	H	α-helix	trans	-64	-48.1	175.2	168.7	0	0	0	0	110.8	C135 C136 I137 R141 Y142 I143 M163 I218	C135-V139 WeakPolarHBondContact O-CB 3.43Å; C135-V139 VanDerWaalsContact O-CG2 3.32Å; C135-V139 WeakPolarHBondContact O-CG2 3.34Å; C135-V139 PolarHBondContact O-N 3.37Å; C136-V139 PolarHBondContact O-N 3.08Å; I137-V139 VanDerWaalsContact C-N 3.33Å; I137-V139 PolarHBondContact O-N 2.86Å; V139-R141 PolarHBondContact O-N 3.31Å; V139-Y142 WeakPolarHBondContact O-CB 3.29Å; V139-Y142 PolarHBondContact O-N 2.98Å; V139-Y142 VanDerWaalsContact O-N 3.14Å; V139-I143 HydrophobicContact CG1-CD1 3.48Å; V139-I143 VanDerWaalsContact CG1-CD1 3.48Å; V139-I143 HydrophobicContact CG1-CG1 4.38Å; V139-I143 WeakPolarHBondContact O-CD1 3.13Å; V139-I143 VanDerWaalsContact O-CG1 3.25Å; V139-I143 WeakPolarHBondContact O-CG1 3.37Å; V139-I143 PolarHBondContact O-N 3.32Å; V139-M163 HydrophobicContact CB-CE 4.43Å; V139-M163 HydrophobicContact CG1-CE 4.12Å; V139-I218 HydrophobicContact CG2-CD1 4.38Å
140	D	89.4	Confident	85.6	Confident	7 Å²	7	27 Å²	27	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-56.3	-48.6	177.4	175.7	84.2	0	0	0	111.4	Y80 C136 I137 Y142 I143 A144 Y151	Y80-D140 HydrophobicContact CD2-CB 4.48Å; Y80-D140 HydrophobicContact CE2-CB 3.87Å; C136-D140 WeakPolarHBondContact O-CB 3.49Å; C136-D140 PolarHBondContact O-N 2.79Å; I137-D140 PolarHBondContact O-N 3.03Å; D140-Y142 PolarHBondContact O-N 3.14Å; D140-I143 PolarHBondContact O-N 3.27Å; D140-A144 WeakPolarHBondContact O-CB 3.44Å; D140-A144 PolarHBondContact O-N 2.93Å; D140-Y151 VanDerWaalsContact OD1-CE2 3.26Å; D140-Y151 WeakPolarHBondContact OD1-CE2 3.41Å; D140-Y151 PolarHBondContact OD1-OH 2.95Å; D140-Y151 PolarHBondContact OD2-OH 3.16Å
141	R	87.3	Confident	85.1	Confident	6 Å²	6	27.1 Å²	27.1	2%	0.023	13%	0.132	C	C	.	.	H	α-helix	trans	-60.4	-44.5	174.8	-62.6	-57.5	87.8	-173.5	-16	111.6	T77 I137 V139 I143 A144 I145 Y151 I222 E438 T441	T77-R141 PolarHBondContact OG1-NH2 3.46Å; I137-R141 HydrophobicContact CG2-CG 4.22Å; I137-R141 VanDerWaalsContact O-CG 3.28Å; I137-R141 WeakPolarHBondContact O-CG 3.41Å; I137-R141 PolarHBondContact O-N 2.9Å; V139-R141 PolarHBondContact O-N 3.31Å; R141-I143 VanDerWaalsContact C-N 3.32Å; R141-I143 PolarHBondContact O-N 2.81Å; R141-A144 PolarHBondContact O-N 3.41Å; R141-I145 WeakPolarHBondContact O-CB 3.35Å; R141-I145 VanDerWaalsContact O-CG1 3.27Å; R141-I145 WeakPolarHBondContact O-CG1 3.48Å; R141-I145 PolarHBondContact O-N 2.9Å; R141-Y151 PolarHBondContact NH2-OH 3.02Å; R141-I222 HydrophobicContact CB-CD1 4.24Å; R141-E438 VanDerWaalsContact CD-OE2 3.22Å; R141-E438 WeakPolarHBondContact CD-OE2 3.33Å; R141-E438 IonicContact CZ-OE1 3.02Å; R141-E438 IonicContact CZ-OE2 2.79Å; R141-E438 IonicContact NE-OE2 3.12Å; R141-E438 PolarHBondContact NE-OE2 2.96Å; R141-E438 VanDerWaalsContact NE-OE2 3.12Å; R141-E438 IonicContact NH1-OE1 2.78Å; R141-E438 PolarHBondContact NH1-OE1 3.47Å; R141-E438 IonicContact NH1-OE2 2.75Å; R141-E438 PolarHBondContact NH1-OE2 3.33Å; R141-E438 IonicContact NH2-OE1 2.77Å; R141-E438 PolarHBondContact NH2-OE1 3.45Å; R141-E438 IonicContact NH2-OE2 3.27Å; R141-E438 PolarHBondContact NH2-OE2 2.89Å; R141-T441 PolarHBondContact NH1-OG1 3.27Å
142	Y	83.6	Confident	84.6	Confident	59 Å²	59	28.1 Å²	28.1	23%	0.231	14%	0.137	C	C	.	.	H	α-helix	trans	-58.8	-43.8	178.2	176.5	-93.9	0	0	0	111.7	S138 V139 D140 N146 Y147 R221 I222	S138-Y142 VanDerWaalsContact O-CB 3.29Å; S138-Y142 WeakPolarHBondContact O-CB 3.37Å; S138-Y142 PolarHBondContact O-N 2.99Å; V139-Y142 WeakPolarHBondContact O-CB 3.29Å; V139-Y142 PolarHBondContact O-N 2.98Å; V139-Y142 VanDerWaalsContact O-N 3.14Å; D140-Y142 PolarHBondContact O-N 3.14Å; Y142-N146 WeakPolarHBondContact CD2-ND2 3.28Å; Y142-N146 HydrophobicContact CE1-CB 4.48Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.35Å; Y142-N146 VanDerWaalsContact O-CB 3.3Å; Y142-N146 WeakPolarHBondContact O-CB 3.48Å; Y142-N146 PolarHBondContact O-N 3.29Å; Y142-N146 PolarHBondContact O-ND2 3.41Å; Y142-Y147 HydrophobicContact CE1-CE2 4.5Å; Y142-R221 HydrophobicContact CE2-CB 4.13Å; Y142-I222 HydrophobicContact CD2-CG1 4.11Å
143	I	85.2	Confident	84	Confident	15 Å²	15	30.7 Å²	30.7	8%	0.077	16%	0.159	C	C	.	.	H	α-helix	trans	-71	-41.2	179.7	-61.1	149.8	0	0	0	110.9	V139 D140 R141 I145 Y147 Y151 F254	V139-I143 HydrophobicContact CG1-CD1 3.48Å; V139-I143 VanDerWaalsContact CG1-CD1 3.48Å; V139-I143 HydrophobicContact CG1-CG1 4.38Å; V139-I143 WeakPolarHBondContact O-CD1 3.13Å; V139-I143 VanDerWaalsContact O-CG1 3.25Å; V139-I143 WeakPolarHBondContact O-CG1 3.37Å; V139-I143 PolarHBondContact O-N 3.32Å; D140-I143 PolarHBondContact O-N 3.27Å; R141-I143 VanDerWaalsContact C-N 3.32Å; R141-I143 PolarHBondContact O-N 2.81Å; I143-I145 VanDerWaalsContact C-N 3.27Å; I143-I145 PolarHBondContact O-N 2.84Å; I143-Y147 CarbonylContact O-C 3.59Å; I143-Y147 WeakPolarHBondContact O-CA 3.4Å; I143-Y147 PolarHBondContact O-N 3.45Å; I143-Y151 HydrophobicContact CB-CD2 4.36Å; I143-Y151 HydrophobicContact CG2-CD2 3.95Å; I143-F254 HydrophobicContact CD1-CE2 3.3Å; I143-F254 HydrophobicContact CD1-CZ 3.43Å; I143-F254 VanDerWaalsContact CD1-CZ 3.43Å; I143-F254 HydrophobicContact CG1-CE2 4Å; I143-F254 HydrophobicContact CG1-CZ 4.46Å; I143-F254 HydrophobicContact CG2-CE2 4.21Å; I143-F254 HydrophobicContact CG2-CZ 4.47Å
144	A	84.6	Confident	83.4	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-56.9	-43.8	176	0	0	0	0	0	111.7	D140 R141 Y151 E438	D140-A144 WeakPolarHBondContact O-CB 3.44Å; D140-A144 PolarHBondContact O-N 2.93Å; R141-A144 PolarHBondContact O-N 3.41Å; A144-Y151 VanDerWaalsContact CA-CG 3.47Å; A144-Y151 HydrophobicContact CB-CD1 3.61Å; A144-Y151 HydrophobicContact CB-CD2 3.98Å; A144-Y151 HydrophobicContact CB-CE1 3.43Å; A144-Y151 VanDerWaalsContact CB-CE1 3.43Å; A144-Y151 HydrophobicContact CB-CE2 3.85Å; A144-Y151 HydrophobicContact CB-CG 3.88Å; A144-E438 HydrophobicContact CB-CG 4.03Å
145	I	79.4	Confident	82.9	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.015	19%	0.186	C	C	.	.	H	α-helix	trans	-74.5	-53.8	179.4	-65.8	167.7	0	0	0	110.2	R141 I143 I222 V225 I226 R229 E438 V442	R141-I145 WeakPolarHBondContact O-CB 3.35Å; R141-I145 VanDerWaalsContact O-CG1 3.27Å; R141-I145 WeakPolarHBondContact O-CG1 3.48Å; R141-I145 PolarHBondContact O-N 2.9Å; I143-I145 VanDerWaalsContact C-N 3.27Å; I143-I145 PolarHBondContact O-N 2.84Å; I145-I222 HydrophobicContact CD1-CG2 3.67Å; I145-V225 HydrophobicContact CG2-CB 4.48Å; I145-V225 HydrophobicContact CG2-CG1 3.71Å; I145-I226 HydrophobicContact CD1-CD1 4.01Å; I145-I226 HydrophobicContact CD1-CG1 4.25Å; I145-I226 HydrophobicContact CG2-CG1 4.37Å; I145-R229 PolarHBondContact O-NH1 3.41Å; I145-R229 PolarHBondContact O-NH2 3.43Å; I145-E438 HydrophobicContact CG1-CB 4.37Å; I145-V442 HydrophobicContact CD1-CG2 4.29Å
146	N	77.7	Confident	82.8	Confident	30 Å²	30	40 Å²	40	16%	0.16	20%	0.199	C	C	.	.	H	α-helix	trans	-71.4	-40.1	-171.4	-76.1	-78	0	0	0	113.1	Y142 P148 V225 R229	Y142-N146 WeakPolarHBondContact CD2-ND2 3.28Å; Y142-N146 HydrophobicContact CE1-CB 4.48Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.35Å; Y142-N146 VanDerWaalsContact O-CB 3.3Å; Y142-N146 WeakPolarHBondContact O-CB 3.48Å; Y142-N146 PolarHBondContact O-N 3.29Å; Y142-N146 PolarHBondContact O-ND2 3.41Å; N146-P148 VanDerWaalsContact C-CD 3.46Å; N146-P148 VanDerWaalsContact O-CD 3.32Å; N146-P148 WeakPolarHBondContact O-CD 3.37Å; N146-V225 WeakPolarHBondContact OD1-CG2 3.33Å; N146-R229 PolarHBondContact O-NH2 3.49Å
147	Y	80.4	Confident	82.7	Confident	83 Å²	83	46.2 Å²	46.2	33%	0.325	22%	0.22	S	C	.	.			trans	-126.2	63.8	-171.5	-54.2	-78.5	0	0	0	112.1	Y142 I143 M149 K150 Y151	Y142-Y147 HydrophobicContact CE1-CE2 4.5Å; I143-Y147 CarbonylContact O-C 3.59Å; I143-Y147 WeakPolarHBondContact O-CA 3.4Å; I143-Y147 PolarHBondContact O-N 3.45Å; Y147-M149 PolarHBondContact O-N 2.86Å; Y147-M149 VanDerWaalsContact O-N 3.09Å; Y147-K150 PolarHBondContact O-N 3.29Å; Y147-Y151 WeakPolarHBondContact O-CB 3.37Å; Y147-Y151 PolarHBondContact O-N 3.06Å
148	P	76	Confident	82.6	Confident	10 Å²	10	55.2 Å²	55.2	7%	0.065	25%	0.253	C	S	.	.	H	α-helix	trans	-57.7	-35.1	-170.3	20.1	-31.6	0	0	0	113.3	N146 I152 K431	N146-P148 VanDerWaalsContact C-CD 3.46Å; N146-P148 VanDerWaalsContact O-CD 3.32Å; N146-P148 WeakPolarHBondContact O-CD 3.37Å; P148-I152 WeakPolarHBondContact O-CD1 3.3Å; P148-I152 WeakPolarHBondContact O-CG1 3.32Å; P148-I152 PolarHBondContact O-N 3.09Å; P148-K431 HydrophobicContact CB-CG 3.91Å; P148-K431 HydrophobicContact CG-CD 3.87Å; P148-K431 HydrophobicContact CG-CG 3.61Å
149	M	77.9	Confident	82.7	Confident	69 Å²	69	57.1 Å²	57.1	34%	0.34	26%	0.264	S	S	.	.	H	α-helix	trans	-73.1	-41	177.6	-66.6	-52.1	-58.3	0	0	113.7	Y147 Y151 S153 Y427	Y147-M149 PolarHBondContact O-N 2.86Å; Y147-M149 VanDerWaalsContact O-N 3.09Å; M149-Y151 VanDerWaalsContact C-N 3.27Å; M149-S153 WeakPolarHBondContact O-CB 3.46Å; M149-S153 PolarHBondContact O-N 3.18Å; M149-S153 VanDerWaalsContact O-N 3.16Å; M149-Y427 HydrophobicContact CB-CE2 4.46Å; M149-Y427 HydrophobicContact CE-CD2 3.29Å; M149-Y427 HydrophobicContact CE-CE2 3.28Å; M149-Y427 HydrophobicContact CE-CG 4.33Å; M149-Y427 HydrophobicContact CG-CD2 4.15Å; M149-Y427 HydrophobicContact CG-CE1 4.27Å; M149-Y427 HydrophobicContact CG-CE2 3.25Å; M149-Y427 WeakPolarHBondContact CG-OH 3.25Å; M149-Y427 HydrophobicContact SD-CD1 4.41Å; M149-Y427 HydrophobicContact SD-CD2 3.41Å; M149-Y427 WeakPolarHBondContact SD-CD2 3.41Å; M149-Y427 HydrophobicContact SD-CE1 4.14Å; M149-Y427 HydrophobicContact SD-CE2 3.15Å; M149-Y427 WeakPolarHBondContact SD-CE2 3.24Å; M149-Y427 HydrophobicContact SD-CG 4.04Å; M149-Y427 VanDerWaalsContact SD-CZ 3.52Å
150	K	79.7	Confident	82.9	Confident	76 Å²	76	55.5 Å²	55.5	33%	0.33	26%	0.255	S	S	.	.	H	α-helix	trans	-66.3	-38.5	175.3	-168.6	176.9	178.4	-176.6	0	109.6	Y147 S153 K154	Y147-K150 PolarHBondContact O-N 3.29Å; K150-S153 PolarHBondContact O-N 3.21Å; K150-K154 HydrophobicContact CG-CD 3.99Å; K150-K154 HydrophobicContact CG-CG 4.33Å; K150-K154 VanDerWaalsContact O-CB 3.27Å; K150-K154 WeakPolarHBondContact O-CB 3.46Å; K150-K154 WeakPolarHBondContact O-CG 3.09Å; K150-K154 PolarHBondContact O-N 3.47Å
151	Y	81.1	Confident	83.1	Confident	9 Å²	9	61 Å²	61	4%	0.035	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-54.6	175.9	-169.6	-113.4	0	0	0	111.3	D140 R141 I143 A144 Y147 M149 S153 K154 R155 V434	D140-Y151 VanDerWaalsContact OD1-CE2 3.26Å; D140-Y151 WeakPolarHBondContact OD1-CE2 3.41Å; D140-Y151 PolarHBondContact OD1-OH 2.95Å; D140-Y151 PolarHBondContact OD2-OH 3.16Å; R141-Y151 PolarHBondContact NH2-OH 3.02Å; I143-Y151 HydrophobicContact CB-CD2 4.36Å; I143-Y151 HydrophobicContact CG2-CD2 3.95Å; A144-Y151 VanDerWaalsContact CA-CG 3.47Å; A144-Y151 HydrophobicContact CB-CD1 3.61Å; A144-Y151 HydrophobicContact CB-CD2 3.98Å; A144-Y151 HydrophobicContact CB-CE1 3.43Å; A144-Y151 VanDerWaalsContact CB-CE1 3.43Å; A144-Y151 HydrophobicContact CB-CE2 3.85Å; A144-Y151 HydrophobicContact CB-CG 3.88Å; Y147-Y151 WeakPolarHBondContact O-CB 3.37Å; Y147-Y151 PolarHBondContact O-N 3.06Å; M149-Y151 VanDerWaalsContact C-N 3.27Å; Y151-S153 PolarHBondContact O-N 3.29Å; Y151-K154 PolarHBondContact O-N 3.43Å; Y151-R155 HydrophobicContact CD2-CB 4.43Å; Y151-R155 HydrophobicContact CE1-CG 4.27Å; Y151-R155 HydrophobicContact CE2-CB 4.35Å; Y151-R155 HydrophobicContact CE2-CG 4.15Å; Y151-R155 WeakPolarHBondContact O-CA 3.44Å; Y151-R155 WeakPolarHBondContact O-CB 3.2Å; Y151-R155 PolarHBondContact O-N 3.27Å; Y151-R155 VanDerWaalsContact OH-CD 3.29Å; Y151-R155 WeakPolarHBondContact OH-CD 3.44Å; Y151-V434 HydrophobicContact CD1-CG1 4.26Å
152	I	77.6	Confident	83.4	Confident	57 Å²	57	65.6 Å²	65.6	29%	0.292	30%	0.303	S	S	.	.	H	α-helix	trans	-57.6	-37.6	179.6	-67	161.4	0	0	0	112.1	P148 R430 V434	P148-I152 WeakPolarHBondContact O-CD1 3.3Å; P148-I152 WeakPolarHBondContact O-CG1 3.32Å; P148-I152 PolarHBondContact O-N 3.09Å; I152-R430 HydrophobicContact CD1-CB 4.09Å; I152-V434 HydrophobicContact CD1-CG2 3.89Å; I152-V434 HydrophobicContact CG1-CG2 3.89Å
153	S	77.8	Confident	83.8	Confident	100 Å²	100	64.8 Å²	64.8	70%	0.699	30%	0.302	S	S	*	.	H	α-helix	trans	-76.2	-37.4	-179.6	-177.3	0	0	0	0	113.4	M149 K150 Y151	M149-S153 WeakPolarHBondContact O-CB 3.46Å; M149-S153 PolarHBondContact O-N 3.18Å; M149-S153 VanDerWaalsContact O-N 3.16Å; K150-S153 PolarHBondContact O-N 3.21Å; Y151-S153 PolarHBondContact O-N 3.29Å
154	K	78.9	Confident	84.3	Confident	93 Å²	93	65 Å²	65	40%	0.404	30%	0.303	S	S	.	.	H	α-helix	trans	-97.7	-14.4	-174.6	-65.5	-163.6	173.3	-152.7	0	114.7	K150 Y151 T156 T159	K150-K154 HydrophobicContact CG-CD 3.99Å; K150-K154 HydrophobicContact CG-CG 4.33Å; K150-K154 VanDerWaalsContact O-CB 3.27Å; K150-K154 WeakPolarHBondContact O-CB 3.46Å; K150-K154 WeakPolarHBondContact O-CG 3.09Å; K150-K154 PolarHBondContact O-N 3.47Å; Y151-K154 PolarHBondContact O-N 3.43Å; K154-T156 PolarHBondContact O-N 3.4Å; K154-T159 PolarHBondContact O-OG1 3.25Å
155	R	78.9	Confident	84.9	Confident	92 Å²	92	66.4 Å²	66.4	35%	0.347	32%	0.318	S	S	.	.			trans	-71.1	94.6	-177.1	-171.8	-170.3	71.9	167.5	-2.8	109.7	I76 Y151	I76-R155 HydrophobicContact CB-CG 4.11Å; I76-R155 HydrophobicContact CD1-CG 3.65Å; I76-R155 VanDerWaalsContact CD1-O 3.3Å; I76-R155 WeakPolarHBondContact CD1-O 3.45Å; I76-R155 HydrophobicContact CG1-CG 4.46Å; I76-R155 HydrophobicContact CG2-CG 3.94Å; Y151-R155 HydrophobicContact CD2-CB 4.43Å; Y151-R155 HydrophobicContact CE1-CG 4.27Å; Y151-R155 HydrophobicContact CE2-CB 4.35Å; Y151-R155 HydrophobicContact CE2-CG 4.15Å; Y151-R155 WeakPolarHBondContact O-CA 3.44Å; Y151-R155 WeakPolarHBondContact O-CB 3.2Å; Y151-R155 PolarHBondContact O-N 3.27Å; Y151-R155 VanDerWaalsContact OH-CD 3.29Å; Y151-R155 WeakPolarHBondContact OH-CD 3.44Å
156	T	87.1	Confident	85.6	Confident	60 Å²	60	68.2 Å²	68.2	37%	0.368	34%	0.337	S	S	.	.			trans	-117.6	159.2	175.2	67.9	0	0	0	0	110.2	K154 R158 T159 A160	K154-T156 PolarHBondContact O-N 3.4Å; T156-R158 PolarHBondContact O-N 3.43Å; T156-T159 PolarHBondContact N-OG1 3.34Å; T156-T159 VanDerWaalsContact N-OG1 3.11Å; T156-T159 PolarHBondContact O-N 3.06Å; T156-T159 PolarHBondContact O-OG1 3.25Å; T156-T159 WeakPolarHBondContact OG1-CG2 3.17Å; T156-T159 PolarHBondContact OG1-N 3.39Å; T156-T159 VanDerWaalsContact OG1-N 3.11Å; T156-T159 PolarHBondContact OG1-OG1 3.13Å; T156-T159 VanDerWaalsContact OG1-OG1 3.05Å; T156-A160 PolarHBondContact O-N 3.32Å
157	R	87.7	Confident	86.4	Confident	147 Å²	147	67 Å²	67	56%	0.555	33%	0.331	S	S	*	.	H	α-helix	trans	-61.2	-36.5	171.4	-71.2	-174.5	177.5	174.8	-1	111.4	I76 L79 T159 A160 F161	I76-R157 HydrophobicContact CD1-CG 4.48Å; I76-R157 HydrophobicContact CG1-CG 4Å; L79-R157 HydrophobicContact CD1-CB 4.43Å; L79-R157 HydrophobicContact CD1-CG 4.22Å; R157-T159 PolarHBondContact O-N 3.47Å; R157-A160 PolarHBondContact O-N 3.28Å; R157-A160 VanDerWaalsContact O-N 3.17Å; R157-F161 HydrophobicContact CB-CD2 4.4Å; R157-F161 HydrophobicContact CB-CE2 4.23Å; R157-F161 WeakPolarHBondContact O-CD2 3.26Å; R157-F161 PolarHBondContact O-N 3.29Å
158	R	89.2	Confident	87.2	Confident	209 Å²	209	65.4 Å²	65.4	79%	0.789	33%	0.325	S	S	*	.	H	α-helix	trans	-58.5	-46.9	177.2	-67.6	-176.2	-178.8	169.9	-1.1	112	T156 A160 F161 L162	T156-R158 PolarHBondContact O-N 3.43Å; R158-A160 VanDerWaalsContact C-N 3.29Å; R158-A160 PolarHBondContact O-N 3.35Å; R158-F161 PolarHBondContact O-N 2.92Å; R158-L162 WeakPolarHBondContact O-CG 3.37Å; R158-L162 PolarHBondContact O-N 3.38Å
159	T	90.1	Very high	88.1	Confident	40 Å²	40	69.2 Å²	69.2	25%	0.245	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-36.8	177.3	47.1	0	0	0	0	112.2	K154 T156 R157 L162 M163	K154-T159 PolarHBondContact O-OG1 3.25Å; T156-T159 PolarHBondContact N-OG1 3.34Å; T156-T159 VanDerWaalsContact N-OG1 3.11Å; T156-T159 PolarHBondContact O-N 3.06Å; T156-T159 PolarHBondContact O-OG1 3.25Å; T156-T159 WeakPolarHBondContact OG1-CG2 3.17Å; T156-T159 PolarHBondContact OG1-N 3.39Å; T156-T159 VanDerWaalsContact OG1-N 3.11Å; T156-T159 PolarHBondContact OG1-OG1 3.13Å; T156-T159 VanDerWaalsContact OG1-OG1 3.05Å; R157-T159 PolarHBondContact O-N 3.47Å; T159-L162 PolarHBondContact O-N 2.9Å; T159-M163 WeakPolarHBondContact O-CG 3.19Å; T159-M163 PolarHBondContact O-N 3.31Å
160	A	91.4	Very high	88.8	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-67.8	-44.6	176	0	0	0	0	0	112.2	I76 L79 Y80 T156 R157 R158 L162 M163 I164	I76-A160 HydrophobicContact CG2-CB 3.68Å; L79-A160 HydrophobicContact CD1-CB 4.15Å; Y80-A160 HydrophobicContact CE1-CB 4.42Å; Y80-A160 HydrophobicContact CE2-CB 4.21Å; T156-A160 PolarHBondContact O-N 3.32Å; R157-A160 PolarHBondContact O-N 3.28Å; R157-A160 VanDerWaalsContact O-N 3.17Å; R158-A160 VanDerWaalsContact C-N 3.29Å; R158-A160 PolarHBondContact O-N 3.35Å; A160-L162 VanDerWaalsContact C-N 3.3Å; A160-L162 PolarHBondContact O-N 2.85Å; A160-M163 PolarHBondContact O-N 2.91Å; A160-I164 WeakPolarHBondContact O-CB 3.38Å; A160-I164 VanDerWaalsContact O-CG1 3.32Å; A160-I164 WeakPolarHBondContact O-CG1 3.38Å; A160-I164 PolarHBondContact O-N 3.48Å
161	F	93.2	Very high	89.3	Confident	123 Å²	123	64.1 Å²	64.1	54%	0.539	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-37	174.2	-75.1	-61.2	0	0	0	112.8	L79 R157 R158 G165	L79-F161 HydrophobicContact CD1-CE2 4.34Å; L79-F161 HydrophobicContact CD1-CZ 4.31Å; L79-F161 HydrophobicContact CD2-CZ 4.4Å; R157-F161 HydrophobicContact CB-CD2 4.4Å; R157-F161 HydrophobicContact CB-CE2 4.23Å; R157-F161 WeakPolarHBondContact O-CD2 3.26Å; R157-F161 PolarHBondContact O-N 3.29Å; R158-F161 PolarHBondContact O-N 2.92Å; F161-G165 PolarHBondContact O-N 2.82Å
162	L	94.1	Very high	89.8	Confident	102 Å²	102	69.1 Å²	69.1	53%	0.534	35%	0.352	S	S	.	.	H	α-helix	trans	-66.4	-40.9	174.6	-71.4	172.9	0	0	0	112.2	R158 T159 A160 G166	R158-L162 WeakPolarHBondContact O-CG 3.37Å; R158-L162 PolarHBondContact O-N 3.38Å; T159-L162 PolarHBondContact O-N 2.9Å; A160-L162 VanDerWaalsContact C-N 3.3Å; A160-L162 PolarHBondContact O-N 2.85Å; L162-G166 PolarHBondContact O-N 3.24Å
163	M	92.6	Very high	90.4	Very high	42 Å²	42	71.7 Å²	71.7	21%	0.207	37%	0.366	C	S	.	.	H	α-helix	trans	-66.2	-45.8	176.1	-75	179.9	60.3	0	0	111.7	Y80 C136 V139 T159 A160 G166 A167	Y80-M163 HydrophobicContact CE1-CB 3.95Å; Y80-M163 HydrophobicContact CE1-CE 4.27Å; Y80-M163 PolarHBondContact OH-SD 2.89Å; C136-M163 HydrophobicContact CB-CE 4.15Å; V139-M163 HydrophobicContact CB-CE 4.43Å; V139-M163 HydrophobicContact CG1-CE 4.12Å; T159-M163 WeakPolarHBondContact O-CG 3.19Å; T159-M163 PolarHBondContact O-N 3.31Å; A160-M163 PolarHBondContact O-N 2.91Å; M163-G166 PolarHBondContact O-N 3.1Å; M163-A167 PolarHBondContact O-N 3.15Å
164	I	95.3	Very high	90.5	Very high	18 Å²	18	70.2 Å²	70.2	9%	0.092	35%	0.353	C	S	.	.	H	α-helix	trans	-61.1	-52.6	175.8	-70.5	165.1	0	0	0	110	L79 Y80 S83 A160 G166 A167 W168	L79-I164 HydrophobicContact CB-CD1 4.09Å; Y80-I164 HydrophobicContact CD1-CD1 3.99Å; Y80-I164 HydrophobicContact CD1-CG1 3.67Å; Y80-I164 HydrophobicContact CE1-CD1 4.37Å; Y80-I164 HydrophobicContact CE1-CG1 3.94Å; S83-I164 VanDerWaalsContact OG-CG2 3.24Å; S83-I164 WeakPolarHBondContact OG-CG2 3.41Å; A160-I164 WeakPolarHBondContact O-CB 3.38Å; A160-I164 VanDerWaalsContact O-CG1 3.32Å; A160-I164 WeakPolarHBondContact O-CG1 3.38Å; A160-I164 PolarHBondContact O-N 3.48Å; I164-G166 VanDerWaalsContact C-N 3.28Å; I164-G166 PolarHBondContact O-N 3.37Å; I164-A167 WeakPolarHBondContact O-CA 3.31Å; I164-A167 WeakPolarHBondContact O-CB 3.14Å; I164-A167 PolarHBondContact O-N 3.01Å; I164-W168 PolarHBondContact O-N 3.42Å
165	G	96.4	Very high	90.7	Very high	32 Å²	32	66.7 Å²	66.7	33%	0.33	34%	0.338	S	S	.	.	H	α-helix	trans	-58.2	-40.4	177.8	0	0	0	0	0	112.4	F161 A167 W168 V169	F161-G165 PolarHBondContact O-N 2.82Å; G165-A167 VanDerWaalsContact C-N 3.35Å; G165-A167 PolarHBondContact O-N 3.17Å; G165-W168 PolarHBondContact O-N 3.21Å; G165-V169 WeakPolarHBondContact O-CB 3.12Å; G165-V169 VanDerWaalsContact O-CG2 3.28Å; G165-V169 WeakPolarHBondContact O-CG2 3.27Å; G165-V169 PolarHBondContact O-N 3.4Å
166	G	95.7	Very high	90.6	Very high	40 Å²	40	64.4 Å²	64.4	41%	0.412	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-39.2	173.2	0	0	0	0	0	113.2	L162 M163 I164 A170	L162-G166 PolarHBondContact O-N 3.24Å; M163-G166 PolarHBondContact O-N 3.1Å; I164-G166 VanDerWaalsContact C-N 3.28Å; I164-G166 PolarHBondContact O-N 3.37Å; G166-A170 WeakPolarHBondContact O-CB 3.36Å; G166-A170 PolarHBondContact O-N 3.4Å
167	A	94	Very high	89.8	Confident	5 Å²	5	65.4 Å²	65.4	4%	0.041	34%	0.342	C	S	.	.	H	α-helix	trans	-62.1	-50.4	173.4	0	0	0	0	0	111.3	L132 M163 I164 G165 V169 A170 S171	L132-A167 HydrophobicContact CB-CB 3.75Å; L132-A167 WeakPolarHBondContact CD1-O 3.25Å; M163-A167 PolarHBondContact O-N 3.15Å; I164-A167 WeakPolarHBondContact O-CA 3.31Å; I164-A167 WeakPolarHBondContact O-CB 3.14Å; I164-A167 PolarHBondContact O-N 3.01Å; G165-A167 VanDerWaalsContact C-N 3.35Å; G165-A167 PolarHBondContact O-N 3.17Å; A167-V169 PolarHBondContact O-N 2.96Å; A167-A170 PolarHBondContact O-N 2.95Å; A167-S171 PolarHBondContact O-N 3.04Å; A167-S171 PolarHBondContact O-OG 3.1Å; A167-S171 VanDerWaalsContact O-OG 3.05Å
168	W	96.3	Very high	88.6	Confident	50 Å²	50	59.7 Å²	59.7	19%	0.189	32%	0.324	C	S	.	.	H	α-helix	trans	-60.6	-43.5	178	-74.6	99.4	0	0	0	112.7	S83 A87 L90 F125 L126 A129 I164 G165 S171 F172	S83-W168 PolarHBondContact OG-NE1 3.49Å; S83-W168 VanDerWaalsContact OG-NE1 3.14Å; A87-W168 HydrophobicContact CB-CH2 3.93Å; A87-W168 HydrophobicContact CB-CZ2 4.06Å; L90-W168 HydrophobicContact CD1-CH2 4.05Å; F125-W168 HydrophobicContact CE1-CE3 4.03Å; F125-W168 AromaticContact CE1-CZ3 3.82Å; F125-W168 HydrophobicContact CE1-CZ3 3.82Å; F125-W168 HydrophobicContact CE2-CE3 4.11Å; F125-W168 AromaticContact CZ-CE3 3.47Å; F125-W168 HydrophobicContact CZ-CE3 3.47Å; F125-W168 VanDerWaalsContact CZ-CE3 3.47Å; F125-W168 AromaticContact CZ-CZ3 3.77Å; F125-W168 HydrophobicContact CZ-CZ3 3.77Å; L126-W168 HydrophobicContact CD2-CH2 4.49Å; L126-W168 HydrophobicContact CD2-CZ3 4.18Å; A129-W168 HydrophobicContact CB-CD2 4.28Å; A129-W168 HydrophobicContact CB-CE3 3.86Å; A129-W168 HydrophobicContact CB-CH2 4.27Å; A129-W168 HydrophobicContact CB-CZ3 3.87Å; I164-W168 PolarHBondContact O-N 3.42Å; G165-W168 PolarHBondContact O-N 3.21Å; W168-S171 PolarHBondContact O-N 3.01Å; W168-F172 PolarHBondContact O-N 3.04Å
169	V	95.5	Very high	87.4	Confident	90 Å²	90	53.1 Å²	53.1	55%	0.545	30%	0.304	S	S	.	.	H	α-helix	trans	-64.8	-44.8	176.7	170.9	0	0	0	0	111.3	G165 A167 S171 F172 L173	G165-V169 WeakPolarHBondContact O-CB 3.12Å; G165-V169 VanDerWaalsContact O-CG2 3.28Å; G165-V169 WeakPolarHBondContact O-CG2 3.27Å; G165-V169 PolarHBondContact O-N 3.4Å; A167-V169 PolarHBondContact O-N 2.96Å; V169-S171 VanDerWaalsContact C-N 3.29Å; V169-S171 PolarHBondContact O-N 2.88Å; V169-F172 WeakPolarHBondContact O-CB 3.3Å; V169-F172 PolarHBondContact O-N 3.44Å; V169-F172 VanDerWaalsContact O-N 3.16Å; V169-L173 WeakPolarHBondContact O-CG 3.39Å; V169-L173 PolarHBondContact O-N 3.17Å
170	A	91.7	Very high	86.3	Confident	38 Å²	38	59.1 Å²	59.1	31%	0.314	33%	0.327	S	S	.	.	H	α-helix	trans	-62.5	-37.4	176.9	0	0	0	0	0	111.8	L132 G166 A167 F172 L173 V174	L132-A170 HydrophobicContact CD1-CB 3.54Å; G166-A170 WeakPolarHBondContact O-CB 3.36Å; G166-A170 PolarHBondContact O-N 3.4Å; A167-A170 PolarHBondContact O-N 2.95Å; A170-F172 VanDerWaalsContact C-N 3.35Å; A170-L173 WeakPolarHBondContact O-CB 3.29Å; A170-L173 PolarHBondContact O-N 2.86Å; A170-V174 WeakPolarHBondContact O-CG2 3.12Å; A170-V174 PolarHBondContact O-N 3.3Å
171	S	91.2	Very high	84.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-38.2	173.3	-62.8	0	0	0	0	113.1	S128 A129 L132 A167 W168 V169 L173 V174 M175	S128-S171 PolarHBondContact O-OG 3.47Å; S128-S171 WeakPolarHBondContact OG-CA 3.22Å; S128-S171 WeakPolarHBondContact OG-CB 3.06Å; S128-S171 PolarHBondContact OG-OG 3.5Å; S128-S171 VanDerWaalsContact OG-OG 3.09Å; A129-S171 WeakPolarHBondContact CA-OG 3.22Å; A129-S171 PolarHBondContact N-OG 3.42Å; L132-S171 WeakPolarHBondContact CD1-OG 3.35Å; A167-S171 PolarHBondContact O-N 3.04Å; A167-S171 PolarHBondContact O-OG 3.1Å; A167-S171 VanDerWaalsContact O-OG 3.05Å; W168-S171 PolarHBondContact O-N 3.01Å; V169-S171 VanDerWaalsContact C-N 3.29Å; V169-S171 PolarHBondContact O-N 2.88Å; S171-L173 VanDerWaalsContact C-N 3.3Å; S171-L173 PolarHBondContact O-N 3.41Å; S171-V174 PolarHBondContact O-N 3.46Å; S171-M175 PolarHBondContact O-N 3.31Å
172	F	91.6	Very high	82.8	Confident	113 Å²	113	60.3 Å²	60.3	50%	0.496	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-40.2	173.4	-173.7	-95.5	0	0	0	111.3	F125 W168 V169 A170 V174 M175 T176	F125-F172 HydrophobicContact CD2-CB 4.14Å; F125-F172 HydrophobicContact CE2-CB 3.87Å; F125-F172 HydrophobicContact CE2-CD2 4.35Å; W168-F172 PolarHBondContact O-N 3.04Å; V169-F172 WeakPolarHBondContact O-CB 3.3Å; V169-F172 PolarHBondContact O-N 3.44Å; V169-F172 VanDerWaalsContact O-N 3.16Å; A170-F172 VanDerWaalsContact C-N 3.35Å; F172-V174 VanDerWaalsContact C-N 3.32Å; F172-V174 PolarHBondContact O-N 2.89Å; F172-M175 HydrophobicContact CD2-CE 3.56Å; F172-M175 HydrophobicContact CE2-CE 3.37Å; F172-M175 HydrophobicContact CG-CE 4.44Å; F172-M175 HydrophobicContact CZ-CE 4.12Å; F172-M175 WeakPolarHBondContact O-CB 3.38Å; F172-M175 PolarHBondContact O-N 3.02Å; F172-M175 VanDerWaalsContact O-N 3.13Å; F172-T176 PolarHBondContact O-N 3.43Å; F172-T176 PolarHBondContact O-OG1 3.45Å
173	L	89	Confident	80.8	Confident	111 Å²	111	59.1 Å²	59.1	58%	0.581	35%	0.347	S	S	*	.	H	α-helix	trans	-65.3	-33.3	175.3	-65.1	174.8	0	0	0	113	V169 A170 S171 M175 T176	V169-L173 WeakPolarHBondContact O-CG 3.39Å; V169-L173 PolarHBondContact O-N 3.17Å; A170-L173 WeakPolarHBondContact O-CB 3.29Å; A170-L173 PolarHBondContact O-N 2.86Å; S171-L173 VanDerWaalsContact C-N 3.3Å; S171-L173 PolarHBondContact O-N 3.41Å; L173-M175 VanDerWaalsContact C-N 3.26Å; L173-M175 PolarHBondContact O-N 3.2Å; L173-T176 WeakPolarHBondContact O-CB 3.23Å; L173-T176 PolarHBondContact O-N 3.05Å; L173-T176 PolarHBondContact O-OG1 3.25Å
174	V	81.2	Confident	78.9	Confident	69 Å²	69	60.1 Å²	60.1	42%	0.418	35%	0.351	S	S	.	.	H	α-helix	trans	-67.9	-27.7	174.4	172.4	0	0	0	0	111.7	L124 A170 S171 F172 T176 P177	L124-V174 HydrophobicContact CD1-CG1 4.07Å; L124-V174 HydrophobicContact CD2-CG1 4.33Å; L124-V174 WeakPolarHBondContact CD2-O 3.47Å; L124-V174 HydrophobicContact CG-CG1 4.12Å; A170-V174 WeakPolarHBondContact O-CG2 3.12Å; A170-V174 PolarHBondContact O-N 3.3Å; S171-V174 PolarHBondContact O-N 3.46Å; F172-V174 VanDerWaalsContact C-N 3.32Å; F172-V174 PolarHBondContact O-N 2.89Å; V174-T176 VanDerWaalsContact C-N 3.34Å; V174-P177 VanDerWaalsContact O-CD 3.23Å; V174-P177 WeakPolarHBondContact O-CD 3.17Å
175	M	82	Confident	76.7	Confident	20 Å²	20	64.9 Å²	64.9	10%	0.099	37%	0.372	C	S	.	.	H	α-helix	trans	-75.7	-20.3	175.6	180	-174.4	73.8	0	0	113.3	S121 F125 S171 F172 L173 P178 I179	S121-M175 VanDerWaalsContact CB-SD 3.59Å; S121-M175 VanDerWaalsContact O-CG 3.22Å; S121-M175 WeakPolarHBondContact O-CG 3.5Å; F125-M175 HydrophobicContact CB-CB 4.12Å; F125-M175 HydrophobicContact CB-CG 4.29Å; F125-M175 HydrophobicContact CB-SD 3.66Å; F125-M175 HydrophobicContact CG-SD 4.35Å; S171-M175 PolarHBondContact O-N 3.31Å; F172-M175 HydrophobicContact CD2-CE 3.56Å; F172-M175 HydrophobicContact CE2-CE 3.37Å; F172-M175 HydrophobicContact CG-CE 4.44Å; F172-M175 HydrophobicContact CZ-CE 4.12Å; F172-M175 WeakPolarHBondContact O-CB 3.38Å; F172-M175 PolarHBondContact O-N 3.02Å; F172-M175 VanDerWaalsContact O-N 3.13Å; L173-M175 VanDerWaalsContact C-N 3.26Å; L173-M175 PolarHBondContact O-N 3.2Å; M175-P178 VanDerWaalsContact O-CD 3.29Å; M175-P178 WeakPolarHBondContact O-CD 3.34Å; M175-I179 HydrophobicContact CE-CD1 3.74Å; M175-I179 HydrophobicContact CG-CD1 3.95Å; M175-I179 HydrophobicContact SD-CD1 4.27Å
176	T	77.3	Confident	74.5	Confident	43 Å²	43	71 Å²	71	26%	0.264	40%	0.398	S	S	.	.	H	α-helix	trans	-58.3	-45.8	-176.4	-54.1	0	0	0	0	114.3	F172 L173 V174 I179 F180	F172-T176 PolarHBondContact O-N 3.43Å; F172-T176 PolarHBondContact O-OG1 3.45Å; L173-T176 WeakPolarHBondContact O-CB 3.23Å; L173-T176 PolarHBondContact O-N 3.05Å; L173-T176 PolarHBondContact O-OG1 3.25Å; V174-T176 VanDerWaalsContact C-N 3.34Å; T176-I179 PolarHBondContact O-N 2.96Å; T176-F180 HydrophobicContact CG2-CD2 3.51Å; T176-F180 HydrophobicContact CG2-CE2 3.64Å; T176-F180 WeakPolarHBondContact O-CD2 3.36Å; T176-F180 PolarHBondContact O-N 3.43Å
177	P	69.4	Low	72.4	Confident	82 Å²	82	71 Å²	71	53%	0.532	40%	0.398	S	S	.	.	H	α-helix	trans	-60.5	-41.9	-173.2	-20.5	32.2	0	0	0	114.5	V174 I179 F180 G181	V174-P177 VanDerWaalsContact O-CD 3.23Å; V174-P177 WeakPolarHBondContact O-CD 3.17Å; P177-I179 VanDerWaalsContact C-N 3.28Å; P177-I179 PolarHBondContact O-N 3.43Å; P177-F180 PolarHBondContact O-N 3.33Å; P177-G181 PolarHBondContact O-N 2.97Å
178	P	62.6	Low	70.4	Confident	26 Å²	26	76.9 Å²	76.9	17%	0.169	43%	0.433	C	S	.	.	H	α-helix	trans	-61.5	-28.2	172.9	-28.7	35.7	0	0	0	115.7	L124 M175 I193	L124-P178 HydrophobicContact CD2-CG 3.65Å; M175-P178 VanDerWaalsContact O-CD 3.29Å; M175-P178 WeakPolarHBondContact O-CD 3.34Å; P178-I193 HydrophobicContact CB-CD1 4.34Å; P178-I193 HydrophobicContact CG-CD1 4.23Å
179	I	65.5	Low	68.6	Low	72 Å²	72	75.4 Å²	75.4	37%	0.369	43%	0.433	S	S	.	.	H	α-helix	trans	-75.6	-36.4	-178.5	-64.3	173.9	0	0	0	111.2	S121 M175 T176 P177	S121-I179 WeakPolarHBondContact OG-CG1 3.25Å; M175-I179 HydrophobicContact CE-CD1 3.74Å; M175-I179 HydrophobicContact CG-CD1 3.95Å; M175-I179 HydrophobicContact SD-CD1 4.27Å; T176-I179 PolarHBondContact O-N 2.96Å; P177-I179 VanDerWaalsContact C-N 3.28Å; P177-I179 PolarHBondContact O-N 3.43Å
180	F	67	Low	67.1	Low	166 Å²	166	74.4 Å²	74.4	73%	0.728	43%	0.43	S	S	*	.	H	α-helix	trans	-99	-4.8	-177.1	-67.1	-79.6	0	0	0	113.6	T176 P177 S182	T176-F180 HydrophobicContact CG2-CD2 3.51Å; T176-F180 HydrophobicContact CG2-CE2 3.64Å; T176-F180 WeakPolarHBondContact O-CD2 3.36Å; T176-F180 PolarHBondContact O-N 3.43Å; P177-F180 PolarHBondContact O-N 3.33Å; F180-S182 PolarHBondContact O-N 3.36Å
181	G	60.7	Low	66.1	Low	31 Å²	31	72.6 Å²	72.6	32%	0.32	42%	0.415	S	S	.	.			trans	-72.3	115	177	0	0	0	0	0	111.8	P177 Q183	P177-G181 PolarHBondContact O-N 2.97Å; G181-Q183 PolarHBondContact O-N 2.9Å
182	S	49.7	Very low	64.9	Low	116 Å²	116	77.2 Å²	77.2	81%	0.811	43%	0.433	S	S	*	.			trans	-74.6	53	-178.6	62.9	0	0	0	0	113.9	F180	F180-S182 PolarHBondContact O-N 3.36Å
183	Q	52.4	Low	63.5	Low	78 Å²	78	74.5 Å²	74.5	36%	0.364	42%	0.423	S	S	.	.			trans	-131.2	43.8	-169.7	-68.3	-90	0.6	0	0	113	G181 R194	G181-Q183 PolarHBondContact O-N 2.9Å; Q183-R194 HydrophobicContact CB-CB 4.47Å; Q183-R194 WeakPolarHBondContact CB-O 3.42Å; Q183-R194 WeakPolarHBondContact O-CB 3.37Å
184	H	52.2	Low	62	Low	63 Å²	63	72.4 Å²	72.4	29%	0.292	41%	0.407	S	S	.	.			trans	-93.7	127.9	177.2	-64.7	-67.1	0	0	0	111.5	H113 I117 R194	H113-H184 AromaticContact CE1-CD2 3.82Å; H113-H184 AromaticContact CE1-CG 3.44Å; H113-H184 VanDerWaalsContact CE1-CG 3.44Å; H113-H184 AromaticContact CE1-ND1 3.78Å; H113-H184 WeakPolarHBondContact NE2-CB 3.37Å; H113-H184 AromaticContact NE2-CD2 3.89Å; H113-H184 AromaticContact NE2-CG 3.06Å; H113-H184 AromaticContact NE2-ND1 3.18Å; H113-H184 PolarHBondContact NE2-ND1 3.06Å; H113-H184 VanDerWaalsContact NE2-ND1 3.18Å; I117-H184 VanDerWaalsContact CD1-CE1 3.42Å; I117-H184 WeakPolarHBondContact CD1-CE1 3.26Å; I117-H184 WeakPolarHBondContact CD1-NE2 3.41Å; I117-H184 VanDerWaalsContact CG1-CE1 3.46Å; I117-H184 WeakPolarHBondContact CG1-CE1 3.39Å; H184-R194 PolarHBondContact O-NH1 2.84Å
185	H	49.8	Very low	61.1	Low	117 Å²	117	71.2 Å²	71.2	54%	0.542	40%	0.398	S	S	.	.			trans	-91.4	131	170.7	-120.6	133	0	0	0	108.7	G187 R194	H185-G187 PolarHBondContact O-N 3.44Å; H185-R194 VanDerWaalsContact CB-NH1 3.3Å; H185-R194 PolarHBondContact CD2-NH1 3.37Å; H185-R194 PolarHBondContact CE1-NH1 3.45Å; H185-R194 VanDerWaalsContact CE1-NH1 3.3Å; H185-R194 WeakPolarHBondContact ND1-CD 3.38Å; H185-R194 PolarHBondContact ND1-NH1 2.95Å; H185-R194 PolarHBondContact NE2-NH1 2.8Å
186	N	48.7	Very low	60.3	Low	161 Å²	161	75.8 Å²	75.8	86%	0.861	42%	0.423	S	S	*	.			trans	-72.4	52.7	174.8	-58.8	-21.8	0	0	0	111.7
187	G	53	Low	59.8	Low	40 Å²	40	77.5 Å²	77.5	41%	0.412	44%	0.442	S	S	.	.			trans	-104.3	109.4	176.6	0	0	0	0	0	110.3	H185 G189 S190	H185-G187 PolarHBondContact O-N 3.44Å; G187-G189 PolarHBondContact O-N 3.36Å; G187-S190 PolarHBondContact O-N 2.82Å
188	V	52	Low	60	Low	129 Å²	129	76.3 Å²	76.3	78%	0.782	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	128.5	172.1	-156.8	0	0	0	0	108.3
189	G	57.9	Low	60.1	Low	18 Å²	18	80.8 Å²	80.8	19%	0.186	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-9.3	176	0	0	0	0	0	117.1	H107 W108 G187	H107-G189 CarbonylContact C-O 3.54Å; H107-G189 VanDerWaalsContact CA-O 3.3Å; H107-G189 WeakPolarHBondContact CA-O 3.3Å; H107-G189 VanDerWaalsContact CB-O 3.27Å; H107-G189 WeakPolarHBondContact CB-O 3.29Å; W108-G189 PolarHBondContact N-O 3.2Å; G187-G189 PolarHBondContact O-N 3.36Å
190	S	64.9	Low	60.1	Low	69 Å²	69	81.8 Å²	81.8	48%	0.483	46%	0.458	S	S	.	.			trans	-116.2	102.3	-175	-93.3	0	0	0	0	113.3	G187 Y192	G187-S190 PolarHBondContact O-N 2.82Å; S190-Y192 VanDerWaalsContact CB-CE1 3.48Å
191	C	69.6	Low	60.3	Low	1 Å²	1	80.6 Å²	80.6	1%	0.007	45%	0.452	C	S	.	.			trans	-98.7	99	176.1	-179.1	0	0	0	0	111.5	R102 W108 C116	R102-C191 PolarHBondContact NH2-O 3.09Å; W108-C191 HydrophobicContact CB-CB 3.8Å; W108-C191 HydrophobicContact CD2-CB 3.79Å; W108-C191 HydrophobicContact CE3-CB 3.91Å; W108-C191 HydrophobicContact CG-CB 3.78Å; C116-C191 WeakPolarHBondContact CA-SG 3.31Å; C116-C191 HydrophobicContact CB-CB 3.8Å; C116-C191 WeakPolarHBondContact CB-SG 3.25Å; C116-C191 WeakPolarHBondContact SG-CA 3.41Å; C116-C191 WeakPolarHBondContact SG-CB 3.35Å; C116-C191 CovalentContact SG-SG 2.02Å; C116-C191 PolarHBondContact SG-SG 3.47Å
192	Y	66.7	Low	61	Low	96 Å²	96	84.2 Å²	84.2	38%	0.376	46%	0.464	S	S	.	.	S	Bend	trans	-154.8	154.5	173.2	55.7	-101.4	0	0	0	111.4	S190 R194 R200	S190-Y192 VanDerWaalsContact CB-CE1 3.48Å; Y192-R194 PolarHBondContact O-N 3.43Å; Y192-R200 VanDerWaalsContact CD2-NH2 3.32Å
193	I	62.4	Low	61.8	Low	57 Å²	57	80.3 Å²	80.3	29%	0.292	44%	0.435	S	S	.	.			trans	-73.8	114.6	174	-41.4	-178.8	0	0	0	108.5	L120 P178 I195 R200	L120-I193 HydrophobicContact CD1-CD1 4.34Å; L120-I193 HydrophobicContact CD1-CG1 4.2Å; L120-I193 HydrophobicContact CD2-CB 4.38Å; L120-I193 HydrophobicContact CD2-CD1 4.05Å; L120-I193 HydrophobicContact CD2-CG1 3.23Å; L120-I193 HydrophobicContact CG-CD1 4.09Å; L120-I193 HydrophobicContact CG-CG1 3.83Å; P178-I193 HydrophobicContact CB-CD1 4.34Å; P178-I193 HydrophobicContact CG-CD1 4.23Å; I193-I195 HydrophobicContact CB-CD1 4.17Å; I193-I195 HydrophobicContact CB-CG1 4.25Å; I193-I195 HydrophobicContact CG2-CD1 3.54Å; I193-I195 HydrophobicContact CG2-CG1 3.53Å; I193-I195 PolarHBondContact O-N 2.87Å; I193-R200 PolarHBondContact O-NE 3.43Å; I193-R200 VanDerWaalsContact O-NE 3.11Å; I193-R200 PolarHBondContact O-NH2 2.89Å
194	R	56.8	Low	62.7	Low	66 Å²	66	78.5 Å²	78.5	25%	0.249	44%	0.438	C	S	.	.			trans	-72.3	108.4	170.7	-163.4	177.9	69.6	-148.9	-7.3	108.4	Q183 H184 H185 Y192	Q183-R194 HydrophobicContact CB-CB 4.47Å; Q183-R194 WeakPolarHBondContact CB-O 3.42Å; Q183-R194 WeakPolarHBondContact O-CB 3.37Å; H184-R194 PolarHBondContact O-NH1 2.84Å; H185-R194 VanDerWaalsContact CB-NH1 3.3Å; H185-R194 PolarHBondContact CD2-NH1 3.37Å; H185-R194 PolarHBondContact CE1-NH1 3.45Å; H185-R194 VanDerWaalsContact CE1-NH1 3.3Å; H185-R194 WeakPolarHBondContact ND1-CD 3.38Å; H185-R194 PolarHBondContact ND1-NH1 2.95Å; H185-R194 PolarHBondContact NE2-NH1 2.8Å; Y192-R194 PolarHBondContact O-N 3.43Å
195	I	61.6	Low	63.8	Low	45 Å²	45	78.1 Å²	78.1	23%	0.231	44%	0.437	C	S	.	.			trans	-141.7	150	169.5	-43.2	165.5	0	0	0	106.5	I193 A197 Y199 R200	I193-I195 HydrophobicContact CB-CD1 4.17Å; I193-I195 HydrophobicContact CB-CG1 4.25Å; I193-I195 HydrophobicContact CG2-CD1 3.54Å; I193-I195 HydrophobicContact CG2-CG1 3.53Å; I193-I195 PolarHBondContact O-N 2.87Å; I195-A197 PolarHBondContact O-N 2.68Å; I195-Y199 HydrophobicContact CB-CD1 3.96Å; I195-Y199 HydrophobicContact CD1-CD1 3.99Å; I195-Y199 HydrophobicContact CD1-CE1 3.79Å; I195-Y199 HydrophobicContact CG1-CD1 4.49Å; I195-Y199 HydrophobicContact CG2-CD1 3.07Å; I195-Y199 HydrophobicContact CG2-CE1 3.7Å; I195-Y199 HydrophobicContact CG2-CG 3.56Å; I195-R200 HydrophobicContact CB-CG 3.91Å; I195-R200 WeakPolarHBondContact O-CD 3.29Å; I195-R200 WeakPolarHBondContact O-CG 3.48Å; I195-R200 PolarHBondContact O-NE 3.06Å
196	D	65.9	Low	64.8	Low	116 Å²	116	75.4 Å²	75.4	62%	0.62	43%	0.43	S	S	*	.			trans	-49.7	138.7	-179.3	-61.2	-50.2	0	0	0	110.7	G198 Y199 R200	D196-G198 PolarHBondContact O-N 3.41Å; D196-G198 VanDerWaalsContact O-N 3.1Å; D196-Y199 CarbonylContact O-C 3.57Å; D196-Y199 WeakPolarHBondContact O-CA 3.42Å; D196-Y199 PolarHBondContact O-N 2.86Å; D196-R200 PolarHBondContact O-N 3.36Å
197	A	67.7	Low	65.8	Low	79 Å²	79	72.2 Å²	72.2	65%	0.653	41%	0.412	S	S	*	.	H	α-helix	trans	-52	-39.1	-177.1	0	0	0	0	0	112	I195 R200 F201	I195-A197 PolarHBondContact O-N 2.68Å; A197-R200 PolarHBondContact O-N 2.86Å; A197-F201 WeakPolarHBondContact O-CB 3.43Å; A197-F201 PolarHBondContact O-N 3.44Å
198	G	71.9	Confident	66.6	Low	56 Å²	56	72.6 Å²	72.6	58%	0.577	40%	0.403	S	S	*	.	H	α-helix	trans	-63.7	-41.8	174.9	0	0	0	0	0	113.6	D196 L202	D196-G198 PolarHBondContact O-N 3.41Å; D196-G198 VanDerWaalsContact O-N 3.1Å; G198-L202 VanDerWaalsContact O-CB 3.24Å; G198-L202 WeakPolarHBondContact O-CB 3.25Å; G198-L202 PolarHBondContact O-N 3.35Å
199	Y	64.7	Low	67.9	Low	121 Å²	121	71 Å²	71	48%	0.475	39%	0.385	S	S	.	.	H	α-helix	trans	-73	-37.7	176.4	179.2	-74.9	0	0	0	111.7	I195 D196 F201 L202 T203	I195-Y199 HydrophobicContact CB-CD1 3.96Å; I195-Y199 HydrophobicContact CD1-CD1 3.99Å; I195-Y199 HydrophobicContact CD1-CE1 3.79Å; I195-Y199 HydrophobicContact CG1-CD1 4.49Å; I195-Y199 HydrophobicContact CG2-CD1 3.07Å; I195-Y199 HydrophobicContact CG2-CE1 3.7Å; I195-Y199 HydrophobicContact CG2-CG 3.56Å; D196-Y199 CarbonylContact O-C 3.57Å; D196-Y199 WeakPolarHBondContact O-CA 3.42Å; D196-Y199 PolarHBondContact O-N 2.86Å; Y199-F201 VanDerWaalsContact C-N 3.34Å; Y199-F201 PolarHBondContact O-N 3.43Å; Y199-L202 PolarHBondContact O-N 3.42Å; Y199-T203 HydrophobicContact CD1-CG2 3.62Å; Y199-T203 HydrophobicContact CD2-CG2 4.32Å; Y199-T203 HydrophobicContact CE1-CG2 3.24Å; Y199-T203 HydrophobicContact CE2-CG2 3.98Å; Y199-T203 HydrophobicContact CG-CG2 4.18Å; Y199-T203 VanDerWaalsContact CZ-CG2 3.45Å; Y199-T203 VanDerWaalsContact O-CB 3.31Å; Y199-T203 WeakPolarHBondContact O-CB 3.48Å; Y199-T203 WeakPolarHBondContact O-CG2 3.42Å; Y199-T203 PolarHBondContact O-N 2.96Å; Y199-T203 PolarHBondContact O-OG1 2.95Å
200	R	66	Low	68.8	Low	93 Å²	93	74.5 Å²	74.5	35%	0.351	40%	0.403	S	S	.	.	H	α-helix	trans	-58.3	-47.2	172.5	-73	178.3	172.3	168	0.4	111.2	Y192 I193 I195 D196 A197 T203 G204	Y192-R200 VanDerWaalsContact CD2-NH2 3.32Å; I193-R200 PolarHBondContact O-NE 3.43Å; I193-R200 VanDerWaalsContact O-NE 3.11Å; I193-R200 PolarHBondContact O-NH2 2.89Å; I195-R200 HydrophobicContact CB-CG 3.91Å; I195-R200 WeakPolarHBondContact O-CD 3.29Å; I195-R200 WeakPolarHBondContact O-CG 3.48Å; I195-R200 PolarHBondContact O-NE 3.06Å; D196-R200 PolarHBondContact O-N 3.36Å; A197-R200 PolarHBondContact O-N 2.86Å; R200-T203 PolarHBondContact O-OG1 3.34Å; R200-G204 WeakPolarHBondContact O-CA 3.34Å; R200-G204 PolarHBondContact O-N 3.48Å
201	F	71.5	Confident	69.2	Low	141 Å²	141	72.3 Å²	72.3	62%	0.618	39%	0.387	S	S	*	.	H	α-helix	trans	-63.8	-48.6	177.9	-173.1	-103	0	0	0	111.5	A197 Y199 T203 G204 I205	A197-F201 WeakPolarHBondContact O-CB 3.43Å; A197-F201 PolarHBondContact O-N 3.44Å; Y199-F201 VanDerWaalsContact C-N 3.34Å; Y199-F201 PolarHBondContact O-N 3.43Å; F201-T203 PolarHBondContact O-N 3.32Å; F201-G204 PolarHBondContact O-N 3.01Å; F201-I205 HydrophobicContact CD1-CD1 3.63Å; F201-I205 HydrophobicContact CD2-CD1 4.33Å; F201-I205 HydrophobicContact CE1-CD1 3.21Å; F201-I205 HydrophobicContact CE1-CG1 4.49Å; F201-I205 HydrophobicContact CE2-CD1 3.98Å; F201-I205 HydrophobicContact CG-CD1 4.19Å; F201-I205 HydrophobicContact CZ-CD1 3.42Å; F201-I205 VanDerWaalsContact CZ-CD1 3.42Å; F201-I205 WeakPolarHBondContact O-CB 3.02Å; F201-I205 VanDerWaalsContact O-CG1 3.28Å; F201-I205 WeakPolarHBondContact O-CG1 3.49Å; F201-I205 PolarHBondContact O-N 3.49Å
202	L	74.5	Confident	69.6	Low	107 Å²	107	77.7 Å²	77.7	56%	0.56	41%	0.411	S	S	*	.	H	α-helix	trans	-61.8	-47	179.6	-175.4	66.1	0	0	0	111.7	G198 Y199 C206	G198-L202 VanDerWaalsContact O-CB 3.24Å; G198-L202 WeakPolarHBondContact O-CB 3.25Å; G198-L202 PolarHBondContact O-N 3.35Å; Y199-L202 PolarHBondContact O-N 3.42Å; L202-C206 WeakPolarHBondContact O-CB 3.49Å; L202-C206 PolarHBondContact O-N 2.91Å; L202-C206 PolarHBondContact O-SG 3.44Å
203	T	68.5	Low	70.5	Confident	34 Å²	34	78.5 Å²	78.5	21%	0.209	42%	0.421	C	S	.	.	H	α-helix	trans	-70	-40.3	178.8	53.3	0	0	0	0	112.5	Y199 R200 F201 I205 C206 I207	Y199-T203 HydrophobicContact CD1-CG2 3.62Å; Y199-T203 HydrophobicContact CD2-CG2 4.32Å; Y199-T203 HydrophobicContact CE1-CG2 3.24Å; Y199-T203 HydrophobicContact CE2-CG2 3.98Å; Y199-T203 HydrophobicContact CG-CG2 4.18Å; Y199-T203 VanDerWaalsContact CZ-CG2 3.45Å; Y199-T203 VanDerWaalsContact O-CB 3.31Å; Y199-T203 WeakPolarHBondContact O-CB 3.48Å; Y199-T203 WeakPolarHBondContact O-CG2 3.42Å; Y199-T203 PolarHBondContact O-N 2.96Å; Y199-T203 PolarHBondContact O-OG1 2.95Å; R200-T203 PolarHBondContact O-OG1 3.34Å; F201-T203 PolarHBondContact O-N 3.32Å; T203-I205 VanDerWaalsContact C-N 3.33Å; T203-I205 PolarHBondContact O-N 3.32Å; T203-C206 PolarHBondContact O-N 3.24Å; T203-I207 VanDerWaalsContact O-CB 3.3Å; T203-I207 WeakPolarHBondContact O-CB 2.97Å; T203-I207 WeakPolarHBondContact O-CD1 3.22Å; T203-I207 WeakPolarHBondContact O-CG1 3.33Å; T203-I207 PolarHBondContact O-N 2.84Å
204	G	69.2	Low	71.4	Confident	40 Å²	40	79.8 Å²	79.8	41%	0.412	43%	0.428	S	S	.	.	H	α-helix	trans	-57.9	-46	174.7	0	0	0	0	0	111.9	R200 F201 I207 F208	R200-G204 WeakPolarHBondContact O-CA 3.34Å; R200-G204 PolarHBondContact O-N 3.48Å; F201-G204 PolarHBondContact O-N 3.01Å; G204-I207 PolarHBondContact O-N 3Å; G204-F208 WeakPolarHBondContact O-CB 3.39Å; G204-F208 PolarHBondContact O-N 3.49Å
205	I	75.3	Confident	72.4	Confident	54 Å²	54	78.1 Å²	78.1	28%	0.277	43%	0.425	S	S	.	.	H	α-helix	trans	-61.3	-52.5	172.8	-72.3	176.2	0	0	0	110.4	F201 T203 I207 F208 F209	F201-I205 HydrophobicContact CD1-CD1 3.63Å; F201-I205 HydrophobicContact CD2-CD1 4.33Å; F201-I205 HydrophobicContact CE1-CD1 3.21Å; F201-I205 HydrophobicContact CE1-CG1 4.49Å; F201-I205 HydrophobicContact CE2-CD1 3.98Å; F201-I205 HydrophobicContact CG-CD1 4.19Å; F201-I205 HydrophobicContact CZ-CD1 3.42Å; F201-I205 VanDerWaalsContact CZ-CD1 3.42Å; F201-I205 WeakPolarHBondContact O-CB 3.02Å; F201-I205 VanDerWaalsContact O-CG1 3.28Å; F201-I205 WeakPolarHBondContact O-CG1 3.49Å; F201-I205 PolarHBondContact O-N 3.49Å; T203-I205 VanDerWaalsContact C-N 3.33Å; T203-I205 PolarHBondContact O-N 3.32Å; I205-I207 VanDerWaalsContact C-N 3.31Å; I205-I207 PolarHBondContact O-N 2.84Å; I205-F208 PolarHBondContact O-N 2.87Å; I205-F209 HydrophobicContact CB-CD2 4.17Å; I205-F209 HydrophobicContact CB-CE2 4.44Å; I205-F209 HydrophobicContact CG1-CE2 4.39Å; I205-F209 HydrophobicContact CG2-CD2 3.44Å; I205-F209 VanDerWaalsContact CG2-CD2 3.44Å; I205-F209 HydrophobicContact CG2-CE2 3.81Å; I205-F209 HydrophobicContact CG2-CG 4.43Å; I205-F209 WeakPolarHBondContact O-CB 3.14Å; I205-F209 VanDerWaalsContact O-CD2 3.24Å; I205-F209 WeakPolarHBondContact O-CD2 3.16Å; I205-F209 PolarHBondContact O-N 3.49Å
206	C	71.7	Confident	73.5	Confident	60 Å²	60	77.2 Å²	77.2	41%	0.405	43%	0.427	S	S	.	.	H	α-helix	trans	-58.5	-42.5	-179.2	-71.3	0	0	0	0	112.5	L202 T203 F208 V210	L202-C206 WeakPolarHBondContact O-CB 3.49Å; L202-C206 PolarHBondContact O-N 2.91Å; L202-C206 PolarHBondContact O-SG 3.44Å; T203-C206 PolarHBondContact O-N 3.24Å; C206-F208 VanDerWaalsContact C-N 3.33Å; C206-F208 PolarHBondContact O-N 2.89Å; C206-V210 WeakPolarHBondContact O-CB 3.16Å; C206-V210 WeakPolarHBondContact O-CG2 3.18Å; C206-V210 PolarHBondContact O-N 3.35Å
207	I	69.7	Low	74.5	Confident	94 Å²	94	77.8 Å²	77.8	48%	0.482	42%	0.424	S	S	.	.	H	α-helix	trans	-67.7	-33	-179.8	-68.3	164.5	0	0	0	111.5	T203 G204 I205 P211	T203-I207 VanDerWaalsContact O-CB 3.3Å; T203-I207 WeakPolarHBondContact O-CB 2.97Å; T203-I207 WeakPolarHBondContact O-CD1 3.22Å; T203-I207 WeakPolarHBondContact O-CG1 3.33Å; T203-I207 PolarHBondContact O-N 2.84Å; G204-I207 PolarHBondContact O-N 3Å; I205-I207 VanDerWaalsContact C-N 3.31Å; I205-I207 PolarHBondContact O-N 2.84Å; I207-P211 WeakPolarHBondContact O-CD 3.33Å; I207-P211 WeakPolarHBondContact O-CG 3.17Å
208	F	70.2	Confident	75.1	Confident	48 Å²	48	75 Å²	75	21%	0.211	40%	0.398	C	S	.	.	H	α-helix	trans	-79.4	-50.6	176	170.6	-116.4	0	0	0	112.4	G204 I205 C206 F212 F452 L456	G204-F208 WeakPolarHBondContact O-CB 3.39Å; G204-F208 PolarHBondContact O-N 3.49Å; I205-F208 PolarHBondContact O-N 2.87Å; C206-F208 VanDerWaalsContact C-N 3.33Å; C206-F208 PolarHBondContact O-N 2.89Å; F208-F212 WeakPolarHBondContact O-CB 3.44Å; F208-F212 PolarHBondContact O-N 3.41Å; F208-F452 AromaticContact CD2-CE1 3.81Å; F208-F452 HydrophobicContact CD2-CE1 3.81Å; F208-F452 AromaticContact CD2-CZ 3.86Å; F208-F452 HydrophobicContact CD2-CZ 3.86Å; F208-F452 HydrophobicContact CE2-CD1 4.47Å; F208-F452 AromaticContact CE2-CE1 3.58Å; F208-F452 HydrophobicContact CE2-CE1 3.58Å; F208-F452 HydrophobicContact CE2-CZ 4.13Å; F208-L456 HydrophobicContact CB-CD2 4.39Å; F208-L456 HydrophobicContact CD2-CD1 3.4Å; F208-L456 VanDerWaalsContact CD2-CD1 3.4Å; F208-L456 HydrophobicContact CD2-CD2 3.41Å; F208-L456 VanDerWaalsContact CD2-CD2 3.41Å; F208-L456 HydrophobicContact CD2-CG 4.04Å; F208-L456 HydrophobicContact CE2-CD1 3.1Å; F208-L456 HydrophobicContact CE2-CD2 4.02Å; F208-L456 HydrophobicContact CE2-CG 4.17Å; F208-L456 HydrophobicContact CG-CD2 4.12Å; F208-L456 HydrophobicContact CZ-CD1 4.16Å
209	F	78.5	Confident	75.7	Confident	96 Å²	96	74.9 Å²	74.9	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-75.1	-37.1	-171.6	-78.3	-83.3	0	0	0	112.7	I205 F212 L213	I205-F209 HydrophobicContact CB-CD2 4.17Å; I205-F209 HydrophobicContact CB-CE2 4.44Å; I205-F209 HydrophobicContact CG1-CE2 4.39Å; I205-F209 HydrophobicContact CG2-CD2 3.44Å; I205-F209 VanDerWaalsContact CG2-CD2 3.44Å; I205-F209 HydrophobicContact CG2-CE2 3.81Å; I205-F209 HydrophobicContact CG2-CG 4.43Å; I205-F209 WeakPolarHBondContact O-CB 3.14Å; I205-F209 VanDerWaalsContact O-CD2 3.24Å; I205-F209 WeakPolarHBondContact O-CD2 3.16Å; I205-F209 PolarHBondContact O-N 3.49Å; F209-F212 PolarHBondContact O-N 3Å; F209-L213 VanDerWaalsContact O-CB 3.27Å; F209-L213 WeakPolarHBondContact O-CB 2.92Å; F209-L213 WeakPolarHBondContact O-CG 3.3Å; F209-L213 PolarHBondContact O-N 3.1Å
210	V	77.4	Confident	76.8	Confident	92 Å²	92	74.6 Å²	74.6	56%	0.558	39%	0.386	S	S	*	.	H	α-helix	trans	-63.3	-50.7	-176.9	172.2	0	0	0	0	111.8	C206 F212 L213 L214	C206-V210 WeakPolarHBondContact O-CB 3.16Å; C206-V210 WeakPolarHBondContact O-CG2 3.18Å; C206-V210 PolarHBondContact O-N 3.35Å; V210-F212 PolarHBondContact O-N 3.31Å; V210-L213 PolarHBondContact O-N 3.47Å; V210-L214 VanDerWaalsContact O-CB 3.3Å; V210-L214 WeakPolarHBondContact O-CB 3.46Å; V210-L214 PolarHBondContact O-N 3.4Å
211	P	72.8	Confident	77.7	Confident	23 Å²	23	75.5 Å²	75.5	15%	0.149	39%	0.39	C	S	.	.	H	α-helix	trans	-62.7	-40.7	174.7	-24.6	37	0	0	0	113.1	I131 I207 L214 V215	I131-P211 HydrophobicContact CG2-CB 3.69Å; I131-P211 HydrophobicContact CG2-CG 4.18Å; I207-P211 WeakPolarHBondContact O-CD 3.33Å; I207-P211 WeakPolarHBondContact O-CG 3.17Å; P211-L214 PolarHBondContact O-N 2.95Å; P211-V215 WeakPolarHBondContact O-CB 3.27Å; P211-V215 VanDerWaalsContact O-CG2 3.31Å; P211-V215 WeakPolarHBondContact O-CG2 3.12Å; P211-V215 PolarHBondContact O-N 3.22Å
212	F	79.3	Confident	78.2	Confident	114 Å²	114	68.9 Å²	68.9	50%	0.5	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-46.3	179.3	-178.5	-98.7	0	0	0	111.8	F208 F209 V210 G216 F452	F208-F212 WeakPolarHBondContact O-CB 3.44Å; F208-F212 PolarHBondContact O-N 3.41Å; F209-F212 PolarHBondContact O-N 3Å; V210-F212 PolarHBondContact O-N 3.31Å; F212-G216 WeakPolarHBondContact O-CA 3.29Å; F212-G216 PolarHBondContact O-N 2.74Å; F212-F452 HydrophobicContact CD2-CE1 4.48Å
213	L	85.2	Confident	78.6	Confident	112 Å²	112	70.6 Å²	70.6	59%	0.586	36%	0.364	S	S	*	.	H	α-helix	trans	-66.3	-40.7	176.9	-69.8	175	0	0	0	111.7	F209 V210 F217	F209-L213 VanDerWaalsContact O-CB 3.27Å; F209-L213 WeakPolarHBondContact O-CB 2.92Å; F209-L213 WeakPolarHBondContact O-CG 3.3Å; F209-L213 PolarHBondContact O-N 3.1Å; V210-L213 PolarHBondContact O-N 3.47Å; L213-F217 WeakPolarHBondContact O-CB 3.42Å; L213-F217 PolarHBondContact O-N 3.25Å
214	L	80.3	Confident	79.4	Confident	85 Å²	85	75.5 Å²	75.5	45%	0.445	38%	0.379	S	S	.	.	H	α-helix	trans	-63.2	-52	178.2	179.9	65.9	0	0	0	111.5	V210 P211 F217 I218	V210-L214 VanDerWaalsContact O-CB 3.3Å; V210-L214 WeakPolarHBondContact O-CB 3.46Å; V210-L214 PolarHBondContact O-N 3.4Å; P211-L214 PolarHBondContact O-N 2.95Å; L214-F217 PolarHBondContact O-N 3.42Å; L214-I218 HydrophobicContact CD1-CD1 4.27Å; L214-I218 HydrophobicContact CG-CD1 4.21Å; L214-I218 VanDerWaalsContact O-CG1 3.28Å; L214-I218 WeakPolarHBondContact O-CG1 3.24Å; L214-I218 PolarHBondContact O-N 2.96Å
215	V	78.4	Confident	79.9	Confident	30 Å²	30	74.3 Å²	74.3	18%	0.182	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-47.7	179	174	0	0	0	0	109.8	I134 P211 F217 I218 Y219	I134-V215 HydrophobicContact CG2-CG1 4.34Å; I134-V215 HydrophobicContact CG2-CG2 4.3Å; P211-V215 WeakPolarHBondContact O-CB 3.27Å; P211-V215 VanDerWaalsContact O-CG2 3.31Å; P211-V215 WeakPolarHBondContact O-CG2 3.12Å; P211-V215 PolarHBondContact O-N 3.22Å; V215-F217 PolarHBondContact O-N 3.34Å; V215-I218 PolarHBondContact O-N 2.99Å; V215-Y219 HydrophobicContact CG1-CD2 3.58Å; V215-Y219 HydrophobicContact CG1-CE2 3.58Å; V215-Y219 VanDerWaalsContact O-CD2 3.3Å; V215-Y219 WeakPolarHBondContact O-CD2 3.5Å; V215-Y219 PolarHBondContact O-N 3.09Å
216	G	84.4	Confident	80	Confident	27 Å²	27	73 Å²	73	28%	0.278	36%	0.356	S	S	.	.	H	α-helix	trans	-55.4	-47.9	176.6	0	0	0	0	0	112.3	F212 I218 Y219 I220	F212-G216 WeakPolarHBondContact O-CA 3.29Å; F212-G216 PolarHBondContact O-N 2.74Å; G216-I218 PolarHBondContact O-N 3.44Å; G216-Y219 PolarHBondContact O-N 3.48Å; G216-I220 WeakPolarHBondContact O-CB 3.43Å; G216-I220 WeakPolarHBondContact O-CD1 3.46Å; G216-I220 WeakPolarHBondContact O-CG1 3.35Å; G216-I220 PolarHBondContact O-N 2.83Å
217	F	87.5	Confident	80.4	Confident	128 Å²	128	74.1 Å²	74.1	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-58.9	-45.8	176.4	176.1	-100.4	0	0	0	112.2	L213 L214 V215 Y219 I220 R221	L213-F217 WeakPolarHBondContact O-CB 3.42Å; L213-F217 PolarHBondContact O-N 3.25Å; L214-F217 PolarHBondContact O-N 3.42Å; V215-F217 PolarHBondContact O-N 3.34Å; F217-Y219 PolarHBondContact O-N 3.35Å; F217-I220 PolarHBondContact O-N 3.15Å; F217-R221 HydrophobicContact CD1-CG 4.45Å; F217-R221 HydrophobicContact CE1-CG 4.1Å; F217-R221 HydrophobicContact CE2-CG 4.16Å; F217-R221 HydrophobicContact CZ-CG 3.95Å; F217-R221 VanDerWaalsContact O-CG 3.25Å; F217-R221 WeakPolarHBondContact O-CG 3.33Å; F217-R221 PolarHBondContact O-N 2.02Å
218	I	80.9	Confident	80.8	Confident	20 Å²	20	75.8 Å²	75.8	10%	0.103	36%	0.356	C	S	.	.	H	α-helix	trans	-62	-46.4	178.6	-65.4	164.3	0	0	0	110.6	V139 L214 V215 G216 R221 I222	V139-I218 HydrophobicContact CG2-CD1 4.38Å; L214-I218 HydrophobicContact CD1-CD1 4.27Å; L214-I218 HydrophobicContact CG-CD1 4.21Å; L214-I218 VanDerWaalsContact O-CG1 3.28Å; L214-I218 WeakPolarHBondContact O-CG1 3.24Å; L214-I218 PolarHBondContact O-N 2.96Å; V215-I218 PolarHBondContact O-N 2.99Å; G216-I218 PolarHBondContact O-N 3.44Å; I218-R221 PolarHBondContact O-N 3.15Å; I218-I222 HydrophobicContact CG2-CD1 3.85Å; I218-I222 HydrophobicContact CG2-CG1 4.41Å; I218-I222 VanDerWaalsContact O-CG1 3.31Å; I218-I222 WeakPolarHBondContact O-CG1 3.49Å; I218-I222 PolarHBondContact O-N 3.37Å
219	Y	83.2	Confident	80.8	Confident	54 Å²	54	76 Å²	76	21%	0.212	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-37.3	179.3	-83.6	-78	0	0	0	113	S138 V215 G216 F217 R221 I222 F223 S445	S138-Y219 WeakPolarHBondContact OG-CE2 3.44Å; V215-Y219 HydrophobicContact CG1-CD2 3.58Å; V215-Y219 HydrophobicContact CG1-CE2 3.58Å; V215-Y219 VanDerWaalsContact O-CD2 3.3Å; V215-Y219 WeakPolarHBondContact O-CD2 3.5Å; V215-Y219 PolarHBondContact O-N 3.09Å; G216-Y219 PolarHBondContact O-N 3.48Å; F217-Y219 PolarHBondContact O-N 3.35Å; Y219-R221 VanDerWaalsContact C-N 3.32Å; Y219-R221 PolarHBondContact O-N 3.48Å; Y219-I222 HydrophobicContact CD1-CD1 4.49Å; Y219-I222 PolarHBondContact O-N 3.03Å; Y219-F223 WeakPolarHBondContact O-CB 3.28Å; Y219-F223 PolarHBondContact O-N 3.5Å; Y219-S445 PolarHBondContact OH-OG 3.21Å
220	I	87.4	Confident	80.5	Confident	115 Å²	115	73.2 Å²	73.2	59%	0.59	35%	0.348	S	S	*	.	H	α-helix	trans	-59.9	-45	173.1	-70.7	163.7	0	0	0	110.2	G216 F217 F223 W224	G216-I220 WeakPolarHBondContact O-CB 3.43Å; G216-I220 WeakPolarHBondContact O-CD1 3.46Å; G216-I220 WeakPolarHBondContact O-CG1 3.35Å; G216-I220 PolarHBondContact O-N 2.83Å; F217-I220 PolarHBondContact O-N 3.15Å; I220-F223 PolarHBondContact O-N 2.8Å; I220-W224 WeakPolarHBondContact O-CB 3.3Å; I220-W224 PolarHBondContact O-N 3.18Å
221	R	85.5	Confident	80.2	Confident	112 Å²	112	74.9 Å²	74.9	42%	0.423	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-42	177	-66.8	-73.8	-83.6	-171.7	-9.5	111.5	Y142 F217 I218 Y219 W224 V225	Y142-R221 HydrophobicContact CE2-CB 4.13Å; F217-R221 HydrophobicContact CD1-CG 4.45Å; F217-R221 HydrophobicContact CE1-CG 4.1Å; F217-R221 HydrophobicContact CE2-CG 4.16Å; F217-R221 HydrophobicContact CZ-CG 3.95Å; F217-R221 VanDerWaalsContact O-CG 3.25Å; F217-R221 WeakPolarHBondContact O-CG 3.33Å; F217-R221 PolarHBondContact O-N 2.02Å; I218-R221 PolarHBondContact O-N 3.15Å; Y219-R221 VanDerWaalsContact C-N 3.32Å; Y219-R221 PolarHBondContact O-N 3.48Å; R221-W224 PolarHBondContact O-N 2.98Å; R221-V225 WeakPolarHBondContact O-CB 3.35Å; R221-V225 VanDerWaalsContact O-CG2 3.22Å; R221-V225 WeakPolarHBondContact O-CG2 3.15Å; R221-V225 PolarHBondContact O-N 3.11Å
222	I	81.9	Confident	79.8	Confident	1 Å²	1	78.4 Å²	78.4	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-58.5	-49.4	173.6	-71.7	169.5	0	0	0	110.3	R141 Y142 I145 I218 Y219 W224 V225 I226 V442	R141-I222 HydrophobicContact CB-CD1 4.24Å; Y142-I222 HydrophobicContact CD2-CG1 4.11Å; I145-I222 HydrophobicContact CD1-CG2 3.67Å; I218-I222 HydrophobicContact CG2-CD1 3.85Å; I218-I222 HydrophobicContact CG2-CG1 4.41Å; I218-I222 VanDerWaalsContact O-CG1 3.31Å; I218-I222 WeakPolarHBondContact O-CG1 3.49Å; I218-I222 PolarHBondContact O-N 3.37Å; Y219-I222 HydrophobicContact CD1-CD1 4.49Å; Y219-I222 PolarHBondContact O-N 3.03Å; I222-W224 PolarHBondContact O-N 3.17Å; I222-V225 PolarHBondContact O-N 3.46Å; I222-I226 HydrophobicContact CG2-CD1 3.61Å; I222-I226 HydrophobicContact CG2-CG1 4.34Å; I222-I226 WeakPolarHBondContact O-CB 3.43Å; I222-I226 VanDerWaalsContact O-CG1 3.27Å; I222-I226 WeakPolarHBondContact O-CG1 3.39Å; I222-I226 PolarHBondContact O-N 3.35Å; I222-V442 HydrophobicContact CG2-CG2 4.49Å
223	F	84.3	Confident	79	Confident	144 Å²	144	77.5 Å²	77.5	63%	0.632	36%	0.362	S	S	*	.	H	α-helix	trans	-59	-48	179.7	178	-99.3	0	0	0	111.6	Y219 I220 V225 I226 H227	Y219-F223 WeakPolarHBondContact O-CB 3.28Å; Y219-F223 PolarHBondContact O-N 3.5Å; I220-F223 PolarHBondContact O-N 2.8Å; F223-V225 PolarHBondContact O-N 3.3Å; F223-I226 PolarHBondContact O-N 2.84Å; F223-H227 VanDerWaalsContact O-CB 3.32Å; F223-H227 WeakPolarHBondContact O-CB 3.32Å; F223-H227 PolarHBondContact O-N 2.98Å
224	W	85.1	Confident	77.6	Confident	137 Å²	137	79.6 Å²	79.6	52%	0.519	37%	0.366	S	S	.	.	H	α-helix	trans	-61.8	-42.9	179.5	-170.1	83.1	0	0	0	112.2	I220 R221 I222 H227 R228	I220-W224 WeakPolarHBondContact O-CB 3.3Å; I220-W224 PolarHBondContact O-N 3.18Å; R221-W224 PolarHBondContact O-N 2.98Å; I222-W224 PolarHBondContact O-N 3.17Å; W224-H227 PolarHBondContact O-N 3.01Å; W224-R228 WeakPolarHBondContact O-CB 3.43Å; W224-R228 PolarHBondContact O-N 3.47Å
225	V	78.9	Confident	76.5	Confident	15 Å²	15	84.1 Å²	84.1	9%	0.091	38%	0.382	C	S	.	.	H	α-helix	trans	-65.6	-42.7	177	172.6	0	0	0	0	111.6	I145 N146 R221 I222 F223 H227 R229	I145-V225 HydrophobicContact CG2-CB 4.48Å; I145-V225 HydrophobicContact CG2-CG1 3.71Å; N146-V225 WeakPolarHBondContact OD1-CG2 3.33Å; R221-V225 WeakPolarHBondContact O-CB 3.35Å; R221-V225 VanDerWaalsContact O-CG2 3.22Å; R221-V225 WeakPolarHBondContact O-CG2 3.15Å; R221-V225 PolarHBondContact O-N 3.11Å; I222-V225 PolarHBondContact O-N 3.46Å; F223-V225 PolarHBondContact O-N 3.3Å; V225-H227 VanDerWaalsContact C-N 3.33Å; V225-R229 WeakPolarHBondContact O-CB 3.37Å; V225-R229 WeakPolarHBondContact O-CG 3.34Å; V225-R229 PolarHBondContact O-N 3.5Å
226	I	77.4	Confident	75.2	Confident	26 Å²	26	84.3 Å²	84.3	13%	0.133	39%	0.391	C	S	.	.	H	α-helix	trans	-61.5	-44.7	175.4	-70.1	170.9	0	0	0	110	I145 I222 F223 R229 S230 Y435	I145-I226 HydrophobicContact CD1-CD1 4.01Å; I145-I226 HydrophobicContact CD1-CG1 4.25Å; I145-I226 HydrophobicContact CG2-CG1 4.37Å; I222-I226 HydrophobicContact CG2-CD1 3.61Å; I222-I226 HydrophobicContact CG2-CG1 4.34Å; I222-I226 WeakPolarHBondContact O-CB 3.43Å; I222-I226 VanDerWaalsContact O-CG1 3.27Å; I222-I226 WeakPolarHBondContact O-CG1 3.39Å; I222-I226 PolarHBondContact O-N 3.35Å; F223-I226 PolarHBondContact O-N 2.84Å; I226-R229 PolarHBondContact O-N 3.03Å; I226-S230 WeakPolarHBondContact O-CB 3.42Å; I226-S230 PolarHBondContact O-N 3Å; I226-Y435 PolarHBondContact O-OH 2.85Å
227	H	80.7	Confident	73.3	Confident	84 Å²	84	86.8 Å²	86.8	39%	0.389	39%	0.394	S	S	.	.	H	α-helix	trans	-67	-45.8	-178	-170.3	76.8	0	0	0	112	F223 W224 V225 R229 S230 K231	F223-H227 VanDerWaalsContact O-CB 3.32Å; F223-H227 WeakPolarHBondContact O-CB 3.32Å; F223-H227 PolarHBondContact O-N 2.98Å; W224-H227 PolarHBondContact O-N 3.01Å; V225-H227 VanDerWaalsContact C-N 3.33Å; H227-R229 PolarHBondContact O-N 3.3Å; H227-S230 PolarHBondContact O-N 3.5Å; H227-K231 WeakPolarHBondContact NE2-CE 3.25Å; H227-K231 PolarHBondContact NE2-NZ 3.34Å; H227-K231 PolarHBondContact O-N 3.01Å
228	R	78.2	Confident	71.1	Confident	129 Å²	129	89.4 Å²	89.4	49%	0.487	41%	0.405	S	S	.	.	H	α-helix	trans	-57.3	-47.9	174.8	-179.2	176.5	175.8	164.3	6.5	111.4	W224 S230 K231 E232	W224-R228 WeakPolarHBondContact O-CB 3.43Å; W224-R228 PolarHBondContact O-N 3.47Å; R228-S230 VanDerWaalsContact C-N 3.33Å; R228-S230 PolarHBondContact O-N 2.91Å; R228-K231 WeakPolarHBondContact O-CB 3.49Å; R228-K231 PolarHBondContact O-N 2.75Å; R228-E232 IonicContact NE-OE1 3.19Å; R228-E232 PolarHBondContact NE-OE1 3.29Å; R228-E232 WeakPolarHBondContact O-CG 3.39Å; R228-E232 PolarHBondContact O-N 3.48Å
229	R	69.4	Low	68.8	Low	53 Å²	53	95 Å²	95	20%	0.2	44%	0.435	C	S	.	.	H	α-helix	trans	-68	-31.8	177.5	-71	-178.7	-178.8	-175.4	7.6	113	I145 N146 V225 I226 H227 K231 E232 L233	I145-R229 PolarHBondContact O-NH1 3.41Å; I145-R229 PolarHBondContact O-NH2 3.43Å; N146-R229 PolarHBondContact O-NH2 3.49Å; V225-R229 WeakPolarHBondContact O-CB 3.37Å; V225-R229 WeakPolarHBondContact O-CG 3.34Å; V225-R229 PolarHBondContact O-N 3.5Å; I226-R229 PolarHBondContact O-N 3.03Å; H227-R229 PolarHBondContact O-N 3.3Å; R229-K231 VanDerWaalsContact C-N 3.31Å; R229-E232 CarbonylContact O-C 3.59Å; R229-E232 PolarHBondContact O-N 2.93Å; R229-L233 WeakPolarHBondContact O-CB 3.38Å; R229-L233 WeakPolarHBondContact O-CG 3.17Å; R229-L233 PolarHBondContact O-N 3.47Å
230	S	73.1	Confident	66.7	Low	37 Å²	37	100.9 Å²	100.9	26%	0.259	46%	0.462	S	S	.	.	H	α-helix	trans	-66.6	-35	173.3	-172.5	0	0	0	0	111.6	I226 H227 R228 K234	I226-S230 WeakPolarHBondContact O-CB 3.42Å; I226-S230 PolarHBondContact O-N 3Å; H227-S230 PolarHBondContact O-N 3.5Å; R228-S230 VanDerWaalsContact C-N 3.33Å; R228-S230 PolarHBondContact O-N 2.91Å; S230-K234 VanDerWaalsContact O-CG 3.31Å; S230-K234 WeakPolarHBondContact O-CG 3.31Å; S230-K234 PolarHBondContact O-N 3.17Å; S230-K234 VanDerWaalsContact O-N 3.1Å
231	K	69.6	Low	64.2	Low	126 Å²	126	101.8 Å²	101.8	55%	0.548	47%	0.468	S	S	.	.	H	α-helix	trans	-67.6	-45.9	171.8	-71.4	-177.7	172.4	169.7	0	110.7	H227 R228 R229 L233 K234 F235	H227-K231 WeakPolarHBondContact NE2-CE 3.25Å; H227-K231 PolarHBondContact NE2-NZ 3.34Å; H227-K231 PolarHBondContact O-N 3.01Å; R228-K231 WeakPolarHBondContact O-CB 3.49Å; R228-K231 PolarHBondContact O-N 2.75Å; R229-K231 VanDerWaalsContact C-N 3.31Å; K231-L233 VanDerWaalsContact C-N 3.29Å; K231-L233 PolarHBondContact O-N 2.99Å; K231-K234 PolarHBondContact O-N 3.43Å; K231-K234 VanDerWaalsContact O-N 3.11Å; K231-F235 WeakPolarHBondContact O-CB 3.24Å; K231-F235 PolarHBondContact O-N 3.47Å
232	E	64.5	Low	62	Low	97 Å²	97	102 Å²	102	45%	0.453	48%	0.484	S	S	.	.	H	α-helix	trans	-63.6	-30.3	175.7	-68.7	170.3	-171.8	0	0	112.9	R228 R229 G236	R228-E232 IonicContact NE-OE1 3.19Å; R228-E232 PolarHBondContact NE-OE1 3.29Å; R228-E232 WeakPolarHBondContact O-CG 3.39Å; R228-E232 PolarHBondContact O-N 3.48Å; R229-E232 CarbonylContact O-C 3.59Å; R229-E232 PolarHBondContact O-N 2.93Å; E232-G236 WeakPolarHBondContact O-CA 3.38Å; E232-G236 PolarHBondContact O-N 2.9Å
233	L	62.4	Low	59.8	Low	95 Å²	95	110.7 Å²	110.7	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-77.5	-27.6	173.9	-74	167.5	0	0	0	112.6	R229 K231 Y435	R229-L233 WeakPolarHBondContact O-CB 3.38Å; R229-L233 WeakPolarHBondContact O-CG 3.17Å; R229-L233 PolarHBondContact O-N 3.47Å; K231-L233 VanDerWaalsContact C-N 3.29Å; K231-L233 PolarHBondContact O-N 2.99Å; L233-Y435 HydrophobicContact CD1-CE1 4.11Å
234	K	57.2	Low	57.5	Low	156 Å²	156	112.9 Å²	112.9	68%	0.678	53%	0.533	S	S	*	.	H	α-helix	trans	-74.8	-40.5	171.7	-74.7	-179.4	178.5	-166.5	0	111.5	S230 K231	S230-K234 VanDerWaalsContact O-CG 3.31Å; S230-K234 WeakPolarHBondContact O-CG 3.31Å; S230-K234 PolarHBondContact O-N 3.17Å; S230-K234 VanDerWaalsContact O-N 3.1Å; K231-K234 PolarHBondContact O-N 3.43Å; K231-K234 VanDerWaalsContact O-N 3.11Å
235	F	57.5	Low	55.2	Low	180 Å²	180	114.3 Å²	114.3	79%	0.789	55%	0.546	S	S	*	.	H	α-helix	trans	-84.5	-36.1	-179.7	-130.2	-91.2	0	0	0	112.9	K231 K237 F238	K231-F235 WeakPolarHBondContact O-CB 3.24Å; K231-F235 PolarHBondContact O-N 3.47Å; F235-K237 VanDerWaalsContact C-N 3.29Å; F235-K237 PolarHBondContact O-N 3.31Å; F235-F238 PolarHBondContact O-N 2.91Å
236	G	50.3	Low	53	Low	35 Å²	35	124.8 Å²	124.8	36%	0.361	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	8	-172.8	0	0	0	0	0	115.4	E232 F238	E232-G236 WeakPolarHBondContact O-CA 3.38Å; E232-G236 PolarHBondContact O-N 2.9Å; G236-F238 PolarHBondContact O-N 2.91Å
237	K	44.4	Very low	51.3	Low	78 Å²	78	131.9 Å²	131.9	34%	0.339	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.8	-5.8	156.2	-86.8	178.8	176.6	166.6	0	112.6	F235 Q408	F235-K237 VanDerWaalsContact C-N 3.29Å; F235-K237 PolarHBondContact O-N 3.31Å; K237-Q408 VanDerWaalsContact CE-OE1 3.23Å
238	F	40.8	Very low	49	Very low	184 Å²	184	130.6 Å²	130.6	81%	0.807	62%	0.623	S	S	*	*	S	Bend	trans	-106.6	-14.6	178.7	-143.2	-97	0	0	0	115.7	F235 G236	F235-F238 PolarHBondContact O-N 2.91Å; G236-F238 PolarHBondContact O-N 2.91Å
239	L	34	Very low	46.8	Very low	137 Å²	137	129.3 Å²	129.3	72%	0.717	63%	0.634	S	S	*	*			trans	-140.6	83.2	-173.1	-76	162.3	0	0	0	112.5	N241	L239-N241 PolarHBondContact O-N 2.97Å; L239-N241 VanDerWaalsContact O-N 3.17Å
240	F	38.5	Very low	45.2	Very low	178 Å²	178	134 Å²	134	78%	0.781	66%	0.656	S	S	*	*			trans	-75.6	89.8	160.5	-96.8	-90.7	0	0	0	108.9
241	N	34.6	Very low	43.6	Very low	133 Å²	133	140.1 Å²	140.1	71%	0.711	68%	0.678	S	S	*	*			trans	-143.6	111.5	162.5	-142.8	-25.1	0	0	0	109.7	L239 K243	L239-N241 PolarHBondContact O-N 2.97Å; L239-N241 VanDerWaalsContact O-N 3.17Å; N241-K243 PolarHBondContact O-N 2.9Å
242	P	39.5	Very low	42.4	Very low	117 Å²	117	141.5 Å²	141.5	76%	0.76	69%	0.691	S	S	*	*			trans	-85.1	97.5	-172.8	33.3	-29	0	0	0	109.4
243	K	34.8	Very low	41.5	Very low	184 Å²	184	142.2 Å²	142.2	80%	0.8	70%	0.697	S	S	*	*			trans	-103.7	118.1	158.9	-73.9	-171.5	177.9	-178.9	0	109.2	N241 H245	N241-K243 PolarHBondContact O-N 2.9Å; K243-H245 PolarHBondContact O-N 3.11Å
244	E	37.1	Very low	40.5	Very low	189 Å²	189	140.6 Å²	140.6	88%	0.883	69%	0.686	S	S	*	*			trans	-51.4	115.5	173.8	-71.4	176.9	123.1	0	0	111
245	H	37.5	Very low	39.5	Very low	168 Å²	168	138.3 Å²	138.3	78%	0.778	69%	0.685	S	S	*	*			trans	-94	99	158.1	-96.4	-84.7	0	0	0	109.5	K243 F247	K243-H245 PolarHBondContact O-N 3.11Å; H245-F247 PolarHBondContact O-N 3.1Å
246	R	30.7	Very low	38.4	Very low	234 Å²	234	133.5 Å²	133.5	88%	0.883	68%	0.678	S	S	*	*			trans	-53.4	116.7	164.5	-160.7	-174.2	-67	178.6	-1.6	108.5
247	F	41.7	Very low	37.6	Very low	176 Å²	176	138.7 Å²	138.7	77%	0.772	70%	0.698	S	S	*	*			trans	-140.8	112.7	173.7	-115.5	-86.2	0	0	0	112.8	H245	H245-F247 PolarHBondContact O-N 3.1Å
248	G	32.3	Very low	37	Very low	56 Å²	56	142.4 Å²	142.4	58%	0.577	72%	0.721	S	S	*	*			trans	72.6	103.5	133.2	0	0	0	0	0	117	F250	G248-F250 PolarHBondContact O-N 3.44Å
249	S	33.1	Very low	36.7	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	72%	0.719	S	S	*	*			trans	-51.5	115.7	171	-173.7	0	0	0	0	113.4
250	F	36.6	Very low	36.5	Very low	151 Å²	151	145.3 Å²	145.3	66%	0.662	73%	0.729	S	S	*	*			trans	-127.8	78.9	146.1	-106.7	-92.2	0	0	0	107	G248 L252 L253	G248-F250 PolarHBondContact O-N 3.44Å; F250-L252 VanDerWaalsContact C-N 3.26Å; F250-L253 HydrophobicContact CD1-CD1 4.18Å
251	K	39	Very low	36.2	Very low	165 Å²	165	144.7 Å²	144.7	72%	0.717	73%	0.733	S	S	*	*			trans	-76.4	-11.9	176.1	-123	178.7	-179.5	-179.1	0	112.1	V255	K251-V255 WeakPolarHBondContact O-CG2 3.42Å
252	L	44	Very low	35.9	Very low	156 Å²	156	150.4 Å²	150.4	82%	0.817	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-82.5	-33.7	-169.6	-134.6	78.7	0	0	0	115	F250 F254	F250-L252 VanDerWaalsContact C-N 3.26Å; L252-F254 PolarHBondContact O-N 2.83Å; L252-F254 VanDerWaalsContact O-N 3.1Å
253	L	44.7	Very low	35.4	Very low	112 Å²	112	149.2 Å²	149.2	59%	0.586	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-75.6	1.8	-173.9	-86.9	157.7	0	0	0	115.3	F250	F250-L253 HydrophobicContact CD1-CD1 4.18Å
254	F	41.5	Very low	35.4	Very low	61 Å²	61	150.4 Å²	150.4	27%	0.268	75%	0.745	S	S	.	*	G	3₁₀ helix	trans	-141.5	17.8	-175.4	-82.6	-72.2	0	0	0	114.8	I143 L252	I143-F254 HydrophobicContact CD1-CE2 3.3Å; I143-F254 HydrophobicContact CD1-CZ 3.43Å; I143-F254 VanDerWaalsContact CD1-CZ 3.43Å; I143-F254 HydrophobicContact CG1-CE2 4Å; I143-F254 HydrophobicContact CG1-CZ 4.46Å; I143-F254 HydrophobicContact CG2-CE2 4.21Å; I143-F254 HydrophobicContact CG2-CZ 4.47Å; L252-F254 PolarHBondContact O-N 2.83Å; L252-F254 VanDerWaalsContact O-N 3.1Å
255	V	36.2	Very low	35.1	Very low	107 Å²	107	144.8 Å²	144.8	65%	0.648	74%	0.738	S	S	*	*			trans	-112	78.1	177.7	-178.5	0	0	0	0	108.6	K251	K251-V255 WeakPolarHBondContact O-CG2 3.42Å
256	A	35.5	Very low	34.7	Very low	79 Å²	79	145.3 Å²	145.3	65%	0.653	74%	0.74	S	S	*	*			trans	-132.6	75.7	158.3	0	0	0	0	0	106.7
257	N	33.7	Very low	34.8	Very low	144 Å²	144	143.6 Å²	143.6	77%	0.77	74%	0.739	S	S	*	*			trans	164.6	90.4	150.8	-89.1	-21.7	0	0	0	109.7
258	N	32	Very low	34.2	Very low	156 Å²	156	143.3 Å²	143.3	83%	0.834	74%	0.738	S	S	*	*			trans	-129	48.6	163.6	-144.2	29	0	0	0	108.8
259	I	34.6	Very low	34.2	Very low	147 Å²	147	150.9 Å²	150.9	75%	0.754	75%	0.75	S	S	*	*	S	Bend	trans	-144.5	40.4	179.6	-43.4	179.5	0	0	0	111.3
260	Y	30	Very low	33.9	Very low	236 Å²	236	152 Å²	152	93%	0.925	76%	0.756	S	S	*	*	S	Bend	trans	-162.5	72	164.2	-99	-74.5	0	0	0	110.6
261	N	30.9	Very low	33.6	Very low	164 Å²	164	154.5 Å²	154.5	88%	0.877	77%	0.768	S	S	*	*			trans	-172.8	68.3	142.2	-121	-3.4	0	0	0	109.7
262	R	28.2	Very low	33	Very low	253 Å²	253	151.4 Å²	151.4	96%	0.955	77%	0.767	S	S	*	*			trans	-108.8	78.3	166.3	-164.8	-175.9	-163.7	-155	4.8	106.9
263	S	29.3	Very low	32.2	Very low	93 Å²	93	148.7 Å²	148.7	65%	0.65	76%	0.761	S	S	*	*			trans	161.8	99.3	157.6	-176.3	0	0	0	0	108
264	F	34.4	Very low	31.6	Very low	208 Å²	208	150.8 Å²	150.8	91%	0.912	77%	0.767	S	S	*	*			trans	-174.8	123.1	135	-122.8	-94.5	0	0	0	110.6
265	G	31.3	Very low	30.9	Very low	71 Å²	71	154 Å²	154	73%	0.732	79%	0.788	S	S	*	*			trans	93.2	72.4	137.3	0	0	0	0	0	117.6	K267	G265-K267 PolarHBondContact O-N 3.05Å
266	H	29.7	Very low	30.6	Very low	179 Å²	179	153.1 Å²	153.1	83%	0.829	79%	0.786	S	S	*	*			trans	-51.3	122.3	155.8	-158.4	-90.6	0	0	0	111.8
267	K	32.2	Very low	30.2	Very low	199 Å²	199	156.8 Å²	156.8	87%	0.865	79%	0.794	S	S	*	*			trans	-173.5	122.8	136.2	-108.2	172.7	-178.1	179.8	0	112.9	G265	G265-K267 PolarHBondContact O-N 3.05Å
268	K	29.9	Very low	30.1	Very low	170 Å²	170	158.8 Å²	158.8	74%	0.739	80%	0.799	S	S	*	*			trans	-55.4	152.8	166.8	-72.7	171.4	171.8	173.8	0	111.3
269	Y	31.7	Very low	29.8	Very low	214 Å²	214	163 Å²	163	84%	0.839	80%	0.803	S	S	*	*				-176.1	121.6	106.6	-94.5	-76.5	0	0	0	109.7
270	C	27	Very low	29.7	Very low	126 Å²	126	163.6 Å²	163.6	85%	0.851	80%	0.803	S	S	*	*			trans	-67.4	138.2	156.6	-86.2	0	0	0	0	108.5
271	F	30.5	Very low	29.5	Very low	204 Å²	204	159.6 Å²	159.6	90%	0.895	80%	0.797	S	S	*	*			trans	-127.3	119.7	152.4	-119.9	-89.7	0	0	0	109.2
272	S	26.2	Very low	29.4	Very low	100 Å²	100	160.6 Å²	160.6	70%	0.699	79%	0.794	S	S	*	*			trans	-81.3	155.2	171.6	170.6	0	0	0	0	109.6
273	S	26.8	Very low	29.3	Very low	99 Å²	99	154.2 Å²	154.2	69%	0.692	78%	0.783	S	S	*	*			trans	66.8	119	152.4	-159.1	0	0	0	0	118
274	H	31	Very low	29.4	Very low	157 Å²	157	154.5 Å²	154.5	73%	0.727	79%	0.79	S	S	*	*				158.4	109.7	102	-158.4	-105.7	0	0	0	110.9
275	N	27.7	Very low	29	Very low	129 Å²	129	151.5 Å²	151.5	69%	0.69	78%	0.784	S	S	*	*			trans	57.7	141.7	131.8	-131.9	-6.6	0	0	0	123.7
276	S	29.6	Very low	29.1	Very low	88 Å²	88	152 Å²	152	62%	0.615	78%	0.782	S	S	*	*			trans	80.5	110.7	149.6	74.2	0	0	0	0	120.4
277	N	27.1	Very low	29.1	Very low	155 Å²	155	149.8 Å²	149.8	83%	0.829	78%	0.781	S	S	*	*			trans	55.7	97.1	130.7	-59.7	-18.5	0	0	0	119
278	Q	32.9	Very low	29.1	Very low	186 Å²	186	149.3 Å²	149.3	87%	0.869	78%	0.782	S	S	*	*			trans	-157.9	105.5	130.3	-112.1	173.4	5.2	0	0	111.3
279	R	25.4	Very low	29.1	Very low	244 Å²	244	146.1 Å²	146.1	92%	0.921	78%	0.78	S	S	*	*			trans	-65.2	125.3	156.1	-78.1	179	173.2	-165.1	-0.7	107.8
280	Q	32.2	Very low	29	Very low	160 Å²	160	142.7 Å²	142.7	75%	0.748	78%	0.777	S	S	*	*			trans	-136.9	111.3	142.8	-76.5	-159.2	6.4	0	0	110
281	L	24.4	Very low	29.1	Very low	153 Å²	153	144.1 Å²	144.1	80%	0.801	78%	0.775	S	S	*	*			trans	-88.8	118	172.7	-170.2	97.5	0	0	0	106.6	V283	L281-V283 HydrophobicContact CD2-CG2 4.15Å; L281-V283 HydrophobicContact CG-CG2 4.34Å
282	F	29.6	Very low	28.9	Very low	185 Å²	185	143.4 Å²	143.4	81%	0.811	77%	0.772	S	S	*	*			trans	-120.8	102.2	162.6	-89.1	-82	0	0	0	109.3
283	V	26.4	Very low	29.3	Very low	119 Å²	119	145.2 Å²	145.2	72%	0.721	77%	0.772	S	S	*	*			trans	-79.9	111.5	165.8	173.7	0	0	0	0	106.8	L281	L281-V283 HydrophobicContact CD2-CG2 4.15Å; L281-V283 HydrophobicContact CG-CG2 4.34Å
284	A	32	Very low	29.5	Very low	98 Å²	98	144.7 Å²	144.7	81%	0.81	77%	0.774	S	S	*	*			trans	-106.6	111.2	164.2	0	0	0	0	0	108.8
285	N	25.1	Very low	29.4	Very low	145 Å²	145	147.9 Å²	147.9	78%	0.775	78%	0.781	S	S	*	*			trans	-85.7	108.9	177.1	-152.5	15	0	0	0	107.4
286	A	32.6	Very low	29.7	Very low	83 Å²	83	147.8 Å²	147.8	69%	0.686	79%	0.786	S	S	*	*			trans	-150.3	123.4	167.5	0	0	0	0	0	110.6
287	T	31.3	Very low	29.7	Very low	132 Å²	132	148.7 Å²	148.7	81%	0.81	79%	0.792	S	S	*	*			trans	-75.1	159.7	174.9	38.6	0	0	0	0	111.7
288	Q	32	Very low	29.8	Very low	189 Å²	189	153 Å²	153	88%	0.883	80%	0.797	S	S	*	*			trans	88.2	105.8	173.5	-69.9	-177.1	-15.5	0	0	118.2
289	S	28.7	Very low	29.9	Very low	102 Å²	102	150.1 Å²	150.1	71%	0.713	79%	0.792	S	S	*	*			trans	-44.4	127.6	158.6	41	0	0	0	0	114.9
290	N	31.2	Very low	30	Very low	142 Å²	142	148.4 Å²	148.4	76%	0.759	79%	0.791	S	S	*	*			trans	174	75.2	131.5	-81.9	-22	0	0	0	109.1	F292	N290-F292 PolarHBondContact O-N 3.45Å
291	L	28.4	Very low	30	Very low	157 Å²	157	150 Å²	150	82%	0.822	80%	0.798	S	S	*	*			trans	-84.4	98.3	177	-168.7	73	0	0	0	110.3	I293	L291-I293 HydrophobicContact CD2-CD1 4.32Å; L291-I293 HydrophobicContact CD2-CG1 4.21Å; L291-I293 HydrophobicContact CG-CG1 4.28Å
292	F	26.3	Very low	30.5	Very low	188 Å²	188	151.2 Å²	151.2	83%	0.825	80%	0.797	S	S	*	*			trans	-61	130.2	156.9	-75.9	-100.3	0	0	0	109.2	N290	N290-F292 PolarHBondContact O-N 3.45Å
293	I	33.9	Very low	30.3	Very low	139 Å²	139	149.1 Å²	149.1	71%	0.713	79%	0.794	S	S	*	*			trans	-114.6	96.1	162.6	-61.1	178.6	0	0	0	106.7	L291	L291-I293 HydrophobicContact CD2-CD1 4.32Å; L291-I293 HydrophobicContact CD2-CG1 4.21Å; L291-I293 HydrophobicContact CG-CG1 4.28Å
294	A	31.4	Very low	30.5	Very low	88 Å²	88	151.7 Å²	151.7	73%	0.727	80%	0.796	S	S	*	*			trans	-69.3	133.6	160.9	0	0	0	0	0	108.8
295	Y	29.9	Very low	30.5	Very low	223 Å²	223	154.1 Å²	154.1	88%	0.875	79%	0.79	S	S	*	*			trans	-93.3	112.5	171.5	-127.3	-92.6	0	0	0	107.3
296	T	32.9	Very low	30.5	Very low	128 Å²	128	155.3 Å²	155.3	79%	0.785	79%	0.791	S	S	*	*			trans	-97.5	123.9	164.4	55.6	0	0	0	0	108.8	R298	T296-R298 PolarHBondContact O-N 3.27Å
297	S	30.3	Very low	30.2	Very low	106 Å²	106	162.2 Å²	162.2	74%	0.741	80%	0.801	S	S	*	*			trans	-70.4	118	175.5	-179.9	0	0	0	0	108.9	T299	S297-T299 PolarHBondContact O-N 3.02Å
298	R	29.5	Very low	29.9	Very low	247 Å²	247	161.5 Å²	161.5	93%	0.932	80%	0.797	S	S	*	*			trans	-85.4	94.9	176	-144	177.1	-168.2	-174.9	3.1	108.9	T296	T296-R298 PolarHBondContact O-N 3.27Å
299	T	34.6	Very low	29.9	Very low	125 Å²	125	159.3 Å²	159.3	77%	0.767	80%	0.796	S	S	*	*			trans	-69.5	135	160.1	33.5	0	0	0	0	109.1	S297	S297-T299 PolarHBondContact O-N 3.02Å
300	K	27.8	Very low	29.6	Very low	207 Å²	207	161.4 Å²	161.4	90%	0.9	80%	0.799	S	S	*	*			trans	-70.2	129.3	173.6	-75	177.9	173.8	179.2	0	109.1
301	H	32.7	Very low	29.7	Very low	194 Å²	194	163.8 Å²	163.8	90%	0.898	81%	0.806	S	S	*	*			trans	-138.5	135.5	152.4	-131.2	-93.5	0	0	0	110
302	K	33	Very low	29.5	Very low	178 Å²	178	161 Å²	161	77%	0.774	80%	0.799	S	S	*	*			trans	-77.1	149.9	-175.2	-84.9	174.6	168.4	179	0	111.9
303	N	26.7	Very low	29.6	Very low	141 Å²	141	160.3 Å²	160.3	75%	0.754	80%	0.798	S	S	*	*			trans	53	119.7	144	-57.1	0.2	0	0	0	120.4
304	F	30.2	Very low	29.4	Very low	174 Å²	174	158.9 Å²	158.9	76%	0.763	80%	0.796	S	S	*	*				-178.1	114.7	118.2	-123.8	-111.4	0	0	0	109.7
305	E	31.4	Very low	29.2	Very low	148 Å²	148	162.7 Å²	162.7	69%	0.692	80%	0.799	S	S	*	*				55.1	104.6	118.6	-64.2	-175.5	177.9	0	0	114.9
306	E	26.3	Very low	29.1	Very low	171 Å²	171	156.9 Å²	156.9	80%	0.799	79%	0.79	S	S	*	*				60.3	109.1	80.7	-163.5	167.1	-147.4	0	0	113.7
307	Y	25.8	Very low	29	Very low	228 Å²	228	158 Å²	158	89%	0.894	80%	0.797	S	S	*	*			trans	-168.2	120.4	134.7	-116.2	-84	0	0	0	110.4
308	T	24.8	Very low	29	Very low	117 Å²	117	158 Å²	158	72%	0.718	80%	0.797	S	S	*	*			trans	-85.9	137.8	171.6	40.6	0	0	0	0	111.2
309	V	31.3	Very low	29	Very low	142 Å²	142	153.4 Å²	153.4	86%	0.861	79%	0.791	S	S	*	*			trans	-145.1	123.4	148.6	179.3	0	0	0	0	109.9
310	N	24.3	Very low	29.1	Very low	147 Å²	147	156.8 Å²	156.8	79%	0.786	80%	0.795	S	S	*	*			trans	-74.1	143.7	170	-70.4	-37.5	0	0	0	110.7
311	Q	32.8	Very low	29.2	Very low	192 Å²	192	157 Å²	157	90%	0.897	79%	0.79	S	S	*	*				-168.9	131.7	127.7	-108.2	167.7	7.7	0	0	112.6
312	S	24.8	Very low	29.4	Very low	97 Å²	97	152.7 Å²	152.7	68%	0.678	78%	0.782	S	S	*	*			trans	-57.7	141.2	165.8	45	0	0	0	0	113.4
313	H	28	Very low	29.6	Very low	174 Å²	174	152.1 Å²	152.1	81%	0.806	78%	0.78	S	S	*	*				-177.4	137.1	125.6	-110	-69.6	0	0	0	113.3
314	V	29.4	Very low	30.2	Very low	109 Å²	109	151.8 Å²	151.8	66%	0.661	77%	0.773	S	S	*	*			trans	61.9	98.3	150.7	-164.9	0	0	0	0	117.6
315	Q	27.6	Very low	30.6	Very low	169 Å²	169	148.7 Å²	148.7	79%	0.79	76%	0.764	S	S	*	*				75.5	120.9	82	-145.8	169.3	3.2	0	0	114.4
316	S	27.3	Very low	30.8	Very low	100 Å²	100	148.9 Å²	148.9	70%	0.699	77%	0.765	S	S	*	*			trans	61.1	98.9	151	46.3	0	0	0	0	119.4
317	T	30.7	Very low	31.2	Very low	152 Å²	152	148.3 Å²	148.3	93%	0.933	76%	0.755	S	S	*	*				-161.3	107.9	119.9	15.5	0	0	0	0	109.2
318	S	29.5	Very low	31.8	Very low	105 Å²	105	142.1 Å²	142.1	73%	0.734	74%	0.741	S	S	*	*			trans	-73	157.2	179.2	59.4	0	0	0	0	111.5
319	N	30.7	Very low	32	Very low	152 Å²	152	145.6 Å²	145.6	81%	0.813	74%	0.742	S	S	*	*	S	Bend	trans	59.3	67.2	152.7	-76.4	-13.2	0	0	0	117.7
320	K	35.8	Very low	32.2	Very low	196 Å²	196	142.2 Å²	142.2	85%	0.852	73%	0.725	S	S	*	*	S	Bend	trans	-159.3	-12.6	147	-111.4	161.7	-172.6	-178.3	0	115.6
321	R	29.8	Very low	32.8	Very low	210 Å²	210	142 Å²	142	79%	0.792	72%	0.719	S	S	*	*	S	Bend	trans	-90.8	-18.9	-172.8	-148.5	167.7	-175	177.1	0.2	116.1
322	S	37.6	Very low	32.9	Very low	104 Å²	104	137.9 Å²	137.9	73%	0.727	71%	0.707	S	S	*	*	H	α-helix	trans	-80.2	-16.2	-178.9	-58.1	0	0	0	0	115.1
323	K	37.5	Very low	33.3	Very low	167 Å²	167	138.5 Å²	138.5	73%	0.726	71%	0.712	S	S	*	*	H	α-helix	trans	-90.3	-5.1	177.5	-80.2	-173.5	177	-179.6	0	114.8	R327	K323-R327 PolarHBondContact O-NH2 3.08Å
324	Q	38.9	Very low	33.5	Very low	133 Å²	133	140.6 Å²	140.6	62%	0.621	71%	0.712	S	S	*	*	H	α-helix	trans	-103.2	-27.4	-179	-150.9	161.5	-6.8	0	0	111.9
325	I	38.3	Very low	33.7	Very low	110 Å²	110	143.3 Å²	143.3	56%	0.564	72%	0.718	S	S	*	*	H	α-helix	trans	-77.9	-28.1	175.2	-62.2	173.5	0	0	0	111.4	R327	I325-R327 VanDerWaalsContact C-N 3.35Å
326	E	36.7	Very low	33.9	Very low	152 Å²	152	144.7 Å²	144.7	71%	0.71	72%	0.724	S	S	*	*	H	α-helix	trans	-74	-21.3	173.3	-109.1	175.5	172.9	0	0	114
327	R	33.6	Very low	33.9	Very low	159 Å²	159	144 Å²	144	60%	0.6	73%	0.725	S	S	*	*	H	α-helix	trans	-79.2	-37.4	177.9	-116	177.9	-77.9	152.7	-5.3	112.2	K323 I325 Y329 S330	K323-R327 PolarHBondContact O-NH2 3.08Å; I325-R327 VanDerWaalsContact C-N 3.35Å; R327-Y329 PolarHBondContact O-N 2.99Å; R327-S330 PolarHBondContact O-N 3.03Å; R327-S330 PolarHBondContact O-OG 3.35Å
328	V	37.6	Very low	34	Very low	97 Å²	97	146.2 Å²	146.2	59%	0.588	72%	0.724	S	S	*	*	H	α-helix	trans	-73.1	-24.9	-179	179.2	0	0	0	0	112.7	T332	V328-T332 PolarHBondContact O-OG1 3.5Å
329	Y	30.4	Very low	33.8	Very low	190 Å²	190	149.7 Å²	149.7	75%	0.745	73%	0.726	S	S	*	*	H	α-helix	trans	-84.5	-12.4	174.9	-111	-90.7	0	0	0	114.4	R327	R327-Y329 PolarHBondContact O-N 2.99Å
330	S	34.1	Very low	33.7	Very low	71 Å²	71	149.6 Å²	149.6	50%	0.497	72%	0.724	S	S	.	*	H	α-helix	trans	-88.5	-18.8	179.1	86.9	0	0	0	0	113.7	R327	R327-S330 PolarHBondContact O-N 3.03Å; R327-S330 PolarHBondContact O-OG 3.35Å
331	E	37.3	Very low	33.2	Very low	142 Å²	142	148 Å²	148	66%	0.664	72%	0.72	S	S	*	*	H	α-helix	trans	-88.5	-19.1	-179.4	-82.1	169.4	157.3	0	0	113.5
332	T	34.5	Very low	33.1	Very low	107 Å²	107	146.4 Å²	146.4	66%	0.656	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-88.4	-10.4	-179.3	-3.8	0	0	0	0	114.7	V328	V328-T332 PolarHBondContact O-OG1 3.5Å
333	S	34.7	Very low	32.7	Very low	110 Å²	110	146.9 Å²	146.9	77%	0.769	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-90.7	3.9	174.9	-74.8	0	0	0	0	114.1
334	R	31.9	Very low	32.3	Very low	217 Å²	217	144.5 Å²	144.5	82%	0.819	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-95	4.8	180	-84	-176.1	173	167.2	-1.1	115.3
335	Q	33.7	Very low	32	Very low	167 Å²	167	145.5 Å²	145.5	78%	0.78	73%	0.731	S	S	*	*	S	Bend	trans	-117.7	13.3	-174.5	-75.7	-171.9	-21.1	0	0	117
336	H	30.8	Very low	31.8	Very low	198 Å²	198	145.2 Å²	145.2	92%	0.917	74%	0.737	S	S	*	*			trans	-133.3	36.7	178.4	-95.7	-84.5	0	0	0	115.6
337	A	29	Very low	31.5	Very low	86 Å²	86	146.8 Å²	146.8	71%	0.711	75%	0.746	S	S	*	*			trans	-104.4	81	168.8	0	0	0	0	0	110.5
338	Q	31.4	Very low	31.3	Very low	198 Å²	198	148.6 Å²	148.6	93%	0.925	76%	0.759	S	S	*	*			trans	-90.5	121.5	165.1	-92.8	179.8	-7.5	0	0	110.3
339	F	26.7	Very low	31.1	Very low	177 Å²	177	152 Å²	152	78%	0.776	77%	0.768	S	S	*	*			trans	-62.6	140.5	-175.4	-82.1	-114.4	0	0	0	113.5
340	I	28.1	Very low	31	Very low	150 Å²	150	153.4 Å²	153.4	77%	0.769	77%	0.772	S	S	*	*			trans	-126.8	106.4	142.8	-61.6	-179.1	0	0	0	106.8	M342	I340-M342 HydrophobicContact CG2-CE 4.32Å; I340-M342 HydrophobicContact CG2-CG 4.39Å
341	Q	25.2	Very low	30.9	Very low	164 Å²	164	156.8 Å²	156.8	77%	0.766	79%	0.785	S	S	*	*			trans	-83.2	119.3	174.8	-152.7	174.4	4.7	0	0	107.3
342	M	27.7	Very low	30.6	Very low	175 Å²	175	155.5 Å²	155.5	86%	0.862	79%	0.786	S	S	*	*			trans	-115.3	115.5	165.9	-74.8	-165.5	-154.7	0	0	109.5	I340	I340-M342 HydrophobicContact CG2-CE 4.32Å; I340-M342 HydrophobicContact CG2-CG 4.39Å
343	V	28.1	Very low	30.5	Very low	115 Å²	115	159.9 Å²	159.9	70%	0.697	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-73.6	136	175.9	177.9	0	0	0	0	109.2	I345	V343-I345 PolarHBondContact O-N 3.14Å
344	P	30.7	Very low	30.3	Very low	117 Å²	117	159.7 Å²	159.7	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.8	117	171.4	27.3	-30	0	0	0	110	P346	P344-P346 WeakPolarHBondContact O-CD 3.41Å
345	I	31.8	Very low	30.3	Very low	153 Å²	153	156.6 Å²	156.6	79%	0.785	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-73	120.1	169.9	-60.4	171.2	0	0	0	108.2	V343 M347	V343-I345 PolarHBondContact O-N 3.14Å; I345-M347 PolarHBondContact O-N 2.95Å
346	P	33	Very low	30	Very low	105 Å²	105	154.2 Å²	154.2	68%	0.682	79%	0.794	S	S	*	*			trans	-76.5	110.2	169.3	29.2	-28.3	0	0	0	109.1	P344 F348	P344-P346 WeakPolarHBondContact O-CD 3.41Å; P346-F348 PolarHBondContact O-N 3.26Å
347	M	32.2	Very low	30	Very low	184 Å²	184	150.4 Å²	150.4	91%	0.906	79%	0.785	S	S	*	*			trans	-75.1	107.3	165.2	-99.2	-164.4	-78.3	0	0	109.1	I345 H349	I345-M347 PolarHBondContact O-N 2.95Å; M347-H349 PolarHBondContact O-N 3.28Å
348	F	29	Very low	30.1	Very low	198 Å²	198	153.4 Å²	153.4	87%	0.868	79%	0.789	S	S	*	*			trans	-52.4	115.9	166.8	-95.2	-95.9	0	0	0	110.8	P346	P346-F348 PolarHBondContact O-N 3.26Å
349	H	32.1	Very low	30	Very low	167 Å²	167	153 Å²	153	77%	0.773	78%	0.784	S	S	*	*			trans	-93.7	95.9	161.5	-151.3	-66.1	0	0	0	107.7	M347 N351	M347-H349 PolarHBondContact O-N 3.28Å; H349-N351 PolarHBondContact O-N 2.95Å
350	R	28.3	Very low	30.2	Very low	221 Å²	221	149.2 Å²	149.2	83%	0.834	78%	0.78	S	S	*	*			trans	-73.2	108.3	172	-166.9	178.7	-158	167.6	4.4	107.9
351	N	32.9	Very low	30.1	Very low	142 Å²	142	146.9 Å²	146.9	76%	0.759	78%	0.777	S	S	*	*			trans	-126.4	112.2	159.1	-99.9	-0.1	0	0	0	108.1	H349	H349-N351 PolarHBondContact O-N 2.95Å
352	T	31	Very low	30.2	Very low	114 Å²	114	148.3 Å²	148.3	70%	0.699	78%	0.781	S	S	*	*			trans	-64.3	126.7	174	46.8	0	0	0	0	111.4
353	K	31.4	Very low	30.1	Very low	200 Å²	200	144.3 Å²	144.3	87%	0.87	77%	0.77	S	S	*	*			trans	179.8	119.2	131.4	-102.5	173.5	178.9	-178.1	0	112.4
354	S	31.9	Very low	30.2	Very low	105 Å²	105	146.4 Å²	146.4	73%	0.734	78%	0.776	S	S	*	*			trans	58.1	112	145.6	61.2	0	0	0	0	121.5
355	N	30.6	Very low	30	Very low	152 Å²	152	149.5 Å²	149.5	81%	0.813	78%	0.78	S	S	*	*				-165	125.6	109.8	-118.2	-3.4	0	0	0	110.3
356	P	29.1	Very low	30	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	77%	0.772	S	S	*	*			trans	-105	111	171.8	34.3	-20.9	0	0	0	110.1
357	T	29.7	Very low	29.8	Very low	119 Å²	119	146.7 Å²	146.7	73%	0.73	78%	0.775	S	S	*	*			trans	-148.5	97.3	158.4	49.2	0	0	0	0	105.8
358	D	30.8	Very low	29.6	Very low	149 Å²	149	143.9 Å²	143.9	80%	0.797	76%	0.763	S	S	*	*			trans	170.9	125.5	135.4	-89.6	-17.5	0	0	0	112.2
359	F	30.5	Very low	29.7	Very low	188 Å²	188	142 Å²	142	83%	0.825	76%	0.756	S	S	*	*			trans	85.4	108.8	153.4	-84.7	-101.3	0	0	0	121.9
360	S	29.2	Very low	29.6	Very low	98 Å²	98	139.9 Å²	139.9	69%	0.685	75%	0.751	S	S	*	*			trans	78.7	108.4	138.6	58.1	0	0	0	0	121.1
361	S	27.4	Very low	29.5	Very low	102 Å²	102	135.3 Å²	135.3	71%	0.713	75%	0.748	S	S	*	*			trans	65.7	107.1	133.4	68.2	0	0	0	0	118.8
362	F	27.2	Very low	29.3	Very low	193 Å²	193	137.6 Å²	137.6	85%	0.846	75%	0.754	S	S	*	*				-179.8	132.6	89.4	-133.7	-98.9	0	0	0	110.8
363	S	25.4	Very low	29.3	Very low	92 Å²	92	137.9 Å²	137.9	64%	0.643	75%	0.75	S	S	*	*			trans	-21.5	140.6	166	-36.9	0	0	0	0	119.7
364	I	30	Very low	29.1	Very low	159 Å²	159	135.9 Å²	135.9	82%	0.815	74%	0.743	S	S	*	*				170.3	108.4	105.9	-81.9	170	0	0	0	110.9
365	H	27.2	Very low	29.2	Very low	181 Å²	181	136.9 Å²	136.9	84%	0.838	75%	0.745	S	S	*	*				52.7	129.7	128.9	-119.1	-78.1	0	0	0	124.3
366	G	30.9	Very low	29.3	Very low	61 Å²	61	135.7 Å²	135.7	63%	0.629	74%	0.738	S	S	*	*			trans	127.3	88.4	149.8	0	0	0	0	0	113.8
367	N	28.4	Very low	29.5	Very low	139 Å²	139	136 Å²	136	74%	0.743	73%	0.729	S	S	*	*				55.2	132.1	95.7	-83.2	6.7	0	0	0	113.2
368	I	29.5	Very low	29.8	Very low	125 Å²	125	134.3 Å²	134.3	64%	0.641	72%	0.719	S	S	*	*			cis	-173.4	142.4	23	-112.7	162.6	0	0	0	107.7
369	E	30.4	Very low	30.2	Very low	157 Å²	157	131 Å²	131	73%	0.734	71%	0.705	S	S	*	*			trans	73	136.7	141.6	-81.9	-178.2	155.6	0	0	127.1
370	N	29.1	Very low	30.5	Very low	124 Å²	124	126.6 Å²	126.6	66%	0.663	69%	0.69	S	S	*	*			trans	91.3	91.7	143.7	-58.7	-16.9	0	0	0	117.2
371	T	27.4	Very low	31	Very low	125 Å²	125	125.9 Å²	125.9	77%	0.767	68%	0.681	S	S	*	*				69	81.5	65.7	-42.5	0	0	0	0	113.1
372	E	29.4	Very low	31.7	Very low	190 Å²	190	125.7 Å²	125.7	89%	0.888	67%	0.671	S	S	*	*			trans	-171.3	40.5	152.3	-119.9	-178.9	-173.1	0	0	115.9
373	I	30.1	Very low	32.2	Very low	120 Å²	120	120.8 Å²	120.8	62%	0.615	65%	0.653	S	S	*	*			trans	-145.8	69.7	173.8	-45.7	176	0	0	0	111.5
374	H	27.9	Very low	33.1	Very low	158 Å²	158	123.2 Å²	123.2	73%	0.731	65%	0.653	S	S	*	*			trans	-114.5	9.5	-178.8	-97.2	-76.8	0	0	0	116.5
375	T	34	Very low	33.9	Very low	126 Å²	126	119.6 Å²	119.6	77%	0.773	64%	0.638	S	S	*	*	S	Bend	trans	-120.1	-5.7	179.3	40.7	0	0	0	0	115.7
376	L	31.6	Very low	34.9	Very low	127 Å²	127	114.3 Å²	114.3	67%	0.665	62%	0.618	S	S	*	*	S	Bend	trans	-104.5	-23.2	176.4	-86.4	152.6	0	0	0	114.1	T378	L376-T378 PolarHBondContact O-N 2.85Å
377	Q	33.1	Very low	35.6	Very low	123 Å²	123	116 Å²	116	58%	0.575	61%	0.613	S	S	*	*	H	α-helix	trans	-73.1	-23.9	-179.8	-94.6	-179.7	-32.8	0	0	114	T381	Q377-T381 WeakPolarHBondContact O-CB 3.45Å; Q377-T381 PolarHBondContact O-N 2.87Å; Q377-T381 PolarHBondContact O-OG1 3.29Å
378	T	36.8	Very low	36.6	Very low	84 Å²	84	111.8 Å²	111.8	52%	0.515	60%	0.598	S	S	.	*	H	α-helix	trans	-71.8	-35.5	-177.6	-11.2	0	0	0	0	111.7	L376 I382	L376-T378 PolarHBondContact O-N 2.85Å; T378-I382 WeakPolarHBondContact O-CD1 3.27Å; T378-I382 VanDerWaalsContact O-CG1 3.24Å; T378-I382 WeakPolarHBondContact O-CG1 3.37Å; T378-I382 PolarHBondContact O-N 3.23Å
379	T	38	Very low	37.5	Very low	80 Å²	80	108.4 Å²	108.4	49%	0.491	59%	0.585	S	S	.	*	H	α-helix	trans	-75.2	-38.4	-179.6	-31.9	0	0	0	0	112.1	N383	T379-N383 PolarHBondContact O-N 3.45Å
380	D	37.4	Very low	38.3	Very low	95 Å²	95	106.2 Å²	106.2	51%	0.508	58%	0.576	S	S	.	*	H	α-helix	trans	-72.2	-30	177.4	-86.7	-8.2	0	0	0	113.2	K384	D380-K384 WeakPolarHBondContact O-CB 3.47Å; D380-K384 VanDerWaalsContact O-CG 3.31Å; D380-K384 WeakPolarHBondContact O-CG 3.42Å; D380-K384 PolarHBondContact O-N 2.85Å
381	T	39.7	Very low	39.1	Very low	83 Å²	83	104.8 Å²	104.8	51%	0.509	57%	0.568	S	S	.	*	H	α-helix	trans	-76.7	-35.1	177.8	-50	0	0	0	0	111.3	Q377 T385	Q377-T381 WeakPolarHBondContact O-CB 3.45Å; Q377-T381 PolarHBondContact O-N 2.87Å; Q377-T381 PolarHBondContact O-OG1 3.29Å; T381-T385 WeakPolarHBondContact O-CB 3.32Å; T381-T385 WeakPolarHBondContact O-CG2 3.19Å; T381-T385 PolarHBondContact O-N 3.45Å; T381-T385 PolarHBondContact O-OG1 2.86Å
382	I	42.2	Very low	40.4	Very low	98 Å²	98	103.3 Å²	103.3	50%	0.503	56%	0.556	S	S	.	*	H	α-helix	trans	-67.9	-43.9	173	-67.7	167.9	0	0	0	110.5	T378 K384 T385 V386	T378-I382 WeakPolarHBondContact O-CD1 3.27Å; T378-I382 VanDerWaalsContact O-CG1 3.24Å; T378-I382 WeakPolarHBondContact O-CG1 3.37Å; T378-I382 PolarHBondContact O-N 3.23Å; I382-K384 PolarHBondContact O-N 2.9Å; I382-T385 WeakPolarHBondContact CA-OG1 3.14Å; I382-T385 PolarHBondContact O-N 2.81Å; I382-T385 PolarHBondContact O-OG1 2.74Å; I382-V386 HydrophobicContact CG2-CG2 4.35Å; I382-V386 WeakPolarHBondContact O-CB 3.24Å; I382-V386 VanDerWaalsContact O-CG2 3.24Å; I382-V386 WeakPolarHBondContact O-CG2 3.4Å; I382-V386 PolarHBondContact O-N 3.11Å
383	N	38.5	Very low	41.6	Very low	89 Å²	89	103.5 Å²	103.5	48%	0.476	55%	0.548	S	S	.	.	H	α-helix	trans	-64.4	-43.1	177.6	-74.3	-18.5	0	0	0	112.2	T379 T385 V386 D387	T379-N383 PolarHBondContact O-N 3.45Å; N383-T385 VanDerWaalsContact C-N 3.35Å; N383-T385 PolarHBondContact O-N 2.82Å; N383-V386 PolarHBondContact O-N 3.18Å; N383-D387 WeakPolarHBondContact O-CB 3.15Å; N383-D387 VanDerWaalsContact O-CG 3.23Å; N383-D387 PolarHBondContact O-N 2.66Å
384	K	43.9	Very low	42.6	Very low	144 Å²	144	104 Å²	104	63%	0.626	55%	0.548	S	S	*	.	H	α-helix	trans	-65.1	-34.3	176.6	-76.6	172.2	-177	160.9	0	113.5	D380 I382 A388	D380-K384 WeakPolarHBondContact O-CB 3.47Å; D380-K384 VanDerWaalsContact O-CG 3.31Å; D380-K384 WeakPolarHBondContact O-CG 3.42Å; D380-K384 PolarHBondContact O-N 2.85Å; I382-K384 PolarHBondContact O-N 2.9Å; K384-A388 VanDerWaalsContact O-CB 3.29Å; K384-A388 WeakPolarHBondContact O-CB 3.1Å; K384-A388 PolarHBondContact O-N 2.96Å
385	T	45.9	Very low	43.4	Very low	83 Å²	83	102.9 Å²	102.9	51%	0.509	54%	0.541	S	S	.	.	H	α-helix	trans	-76.9	-35.1	178	45.3	0	0	0	0	112.3	T381 I382 N383 S389	T381-T385 WeakPolarHBondContact O-CB 3.32Å; T381-T385 WeakPolarHBondContact O-CG2 3.19Å; T381-T385 PolarHBondContact O-N 3.45Å; T381-T385 PolarHBondContact O-OG1 2.86Å; I382-T385 WeakPolarHBondContact CA-OG1 3.14Å; I382-T385 PolarHBondContact O-N 2.81Å; I382-T385 PolarHBondContact O-OG1 2.74Å; N383-T385 VanDerWaalsContact C-N 3.35Å; N383-T385 PolarHBondContact O-N 2.82Å; T385-S389 PolarHBondContact O-N 3.06Å
386	V	49.1	Very low	44.6	Very low	69 Å²	69	100.6 Å²	100.6	42%	0.418	53%	0.527	S	S	.	.	H	α-helix	trans	-65	-45.2	171.3	174.3	0	0	0	0	110.7	I382 N383 A388 S389 M390	I382-V386 HydrophobicContact CG2-CG2 4.35Å; I382-V386 WeakPolarHBondContact O-CB 3.24Å; I382-V386 VanDerWaalsContact O-CG2 3.24Å; I382-V386 WeakPolarHBondContact O-CG2 3.4Å; I382-V386 PolarHBondContact O-N 3.11Å; N383-V386 PolarHBondContact O-N 3.18Å; V386-A388 PolarHBondContact O-N 2.8Å; V386-S389 PolarHBondContact O-N 3.41Å; V386-S389 PolarHBondContact O-OG 3.01Å; V386-M390 HydrophobicContact CG1-CG 4.45Å; V386-M390 HydrophobicContact CG1-SD 4.09Å; V386-M390 WeakPolarHBondContact O-CB 3.42Å; V386-M390 WeakPolarHBondContact O-CG 3.3Å; V386-M390 PolarHBondContact O-N 2.95Å
387	D	45.6	Very low	45.6	Very low	97 Å²	97	99.7 Å²	99.7	52%	0.519	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-39.9	178	-73.5	-25.1	0	0	0	112.8	N383 M390 N391	N383-D387 WeakPolarHBondContact O-CB 3.15Å; N383-D387 VanDerWaalsContact O-CG 3.23Å; N383-D387 PolarHBondContact O-N 2.66Å; D387-M390 PolarHBondContact O-N 3.49Å; D387-N391 WeakPolarHBondContact O-CB 3.28Å; D387-N391 PolarHBondContact O-N 3.41Å
388	A	48.4	Very low	46.2	Very low	51 Å²	51	100.3 Å²	100.3	42%	0.421	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-44.7	174.8	0	0	0	0	0	111.6	K384 V386 M390 N391 D392	K384-A388 VanDerWaalsContact O-CB 3.29Å; K384-A388 WeakPolarHBondContact O-CB 3.1Å; K384-A388 PolarHBondContact O-N 2.96Å; V386-A388 PolarHBondContact O-N 2.8Å; A388-M390 PolarHBondContact O-N 3.2Å; A388-N391 PolarHBondContact O-N 3.21Å; A388-D392 PolarHBondContact O-N 3.34Å
389	S	48.5	Very low	46.7	Very low	54 Å²	54	99.5 Å²	99.5	38%	0.378	52%	0.52	S	S	.	.	H	α-helix	trans	-69	-32.9	178.9	104.4	0	0	0	0	112.7	T385 V386 R393	T385-S389 PolarHBondContact O-N 3.06Å; V386-S389 PolarHBondContact O-N 3.41Å; V386-S389 PolarHBondContact O-OG 3.01Å; S389-R393 WeakPolarHBondContact O-CG 3.05Å; S389-R393 PolarHBondContact O-N 3.02Å
390	M	47.1	Very low	47.4	Very low	111 Å²	111	102.1 Å²	102.1	55%	0.547	52%	0.524	S	S	.	.	H	α-helix	trans	-68.4	-40.8	174.3	-75.9	-175	74.4	0	0	111.7	V386 D387 A388 R393 Q394	V386-M390 HydrophobicContact CG1-CG 4.45Å; V386-M390 HydrophobicContact CG1-SD 4.09Å; V386-M390 WeakPolarHBondContact O-CB 3.42Å; V386-M390 WeakPolarHBondContact O-CG 3.3Å; V386-M390 PolarHBondContact O-N 2.95Å; D387-M390 PolarHBondContact O-N 3.49Å; A388-M390 PolarHBondContact O-N 3.2Å; M390-R393 PolarHBondContact O-N 2.73Å; M390-Q394 WeakPolarHBondContact O-CB 3.27Å; M390-Q394 PolarHBondContact O-N 2.92Å
391	N	45.8	Very low	47.9	Very low	93 Å²	93	101 Å²	101	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-39.7	175.3	-96.1	-25.9	0	0	0	112.7	D387 A388 Q394 K395	D387-N391 WeakPolarHBondContact O-CB 3.28Å; D387-N391 PolarHBondContact O-N 3.41Å; A388-N391 PolarHBondContact O-N 3.21Å; N391-Q394 PolarHBondContact O-N 3.39Å; N391-K395 PolarHBondContact O-N 3.19Å
392	D	54.7	Low	48.2	Very low	95 Å²	95	103.4 Å²	103.4	51%	0.508	52%	0.524	S	S	.	.	H	α-helix	trans	-70.1	-39.7	177.2	-79.1	-19.9	0	0	0	112	A388 Q394 K395 V396	A388-D392 PolarHBondContact O-N 3.34Å; D392-Q394 VanDerWaalsContact C-N 3.32Å; D392-Q394 PolarHBondContact O-N 2.96Å; D392-K395 PolarHBondContact O-N 3.5Å; D392-V396 WeakPolarHBondContact O-CB 3.16Å; D392-V396 VanDerWaalsContact O-CG2 3.29Å; D392-V396 WeakPolarHBondContact O-CG2 3.19Å; D392-V396 PolarHBondContact O-N 2.94Å
393	R	55.6	Low	48.7	Very low	194 Å²	194	105.5 Å²	105.5	73%	0.732	53%	0.531	S	S	*	.	H	α-helix	trans	-61.2	-40.5	170.9	-74.3	-174.3	-163.2	-153.2	5.5	111.8	S389 M390 Q397	S389-R393 WeakPolarHBondContact O-CG 3.05Å; S389-R393 PolarHBondContact O-N 3.02Å; M390-R393 PolarHBondContact O-N 2.73Å; R393-Q397 VanDerWaalsContact O-CB 3.28Å; R393-Q397 WeakPolarHBondContact O-CB 3.32Å; R393-Q397 PolarHBondContact O-N 3.4Å
394	Q	50	Low	49	Very low	129 Å²	129	109.1 Å²	109.1	60%	0.603	54%	0.538	S	S	*	.	H	α-helix	trans	-64.2	-42.9	175.1	-85.8	-172.6	-14.1	0	0	112.5	M390 N391 D392 Q397 Q398	M390-Q394 WeakPolarHBondContact O-CB 3.27Å; M390-Q394 PolarHBondContact O-N 2.92Å; N391-Q394 PolarHBondContact O-N 3.39Å; D392-Q394 VanDerWaalsContact C-N 3.32Å; D392-Q394 PolarHBondContact O-N 2.96Å; Q394-Q397 PolarHBondContact O-N 3.35Å; Q394-Q398 WeakPolarHBondContact O-CB 3.47Å; Q394-Q398 PolarHBondContact O-N 2.85Å
395	K	44.9	Very low	49.3	Very low	136 Å²	136	105.2 Å²	105.2	59%	0.591	52%	0.524	S	S	*	.	H	α-helix	trans	-64.6	-42.5	176.2	-79.7	179.3	-178.6	171.1	0	112.4	N391 D392 Q397 Q398 S399	N391-K395 PolarHBondContact O-N 3.19Å; D392-K395 PolarHBondContact O-N 3.5Å; K395-Q397 VanDerWaalsContact C-N 3.34Å; K395-Q398 PolarHBondContact O-N 3.32Å; K395-S399 WeakPolarHBondContact O-CB 3.33Å; K395-S399 PolarHBondContact O-N 3.28Å
396	V	60.5	Low	49.4	Very low	78 Å²	78	106.3 Å²	106.3	47%	0.473	53%	0.527	S	S	.	.	H	α-helix	trans	-65	-40.5	176.3	172.7	0	0	0	0	110.7	D392 S399 K400	D392-V396 WeakPolarHBondContact O-CB 3.16Å; D392-V396 VanDerWaalsContact O-CG2 3.29Å; D392-V396 WeakPolarHBondContact O-CG2 3.19Å; D392-V396 PolarHBondContact O-N 2.94Å; V396-S399 PolarHBondContact O-N 3.29Å; V396-K400 HydrophobicContact CG1-CD 4.41Å; V396-K400 WeakPolarHBondContact O-CB 3.24Å; V396-K400 WeakPolarHBondContact O-CG 3.39Å; V396-K400 PolarHBondContact O-N 3.49Å
397	Q	52.7	Low	49.4	Very low	107 Å²	107	105.2 Å²	105.2	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-66.5	-41.3	175.8	-165.2	64.6	20	0	0	111.6	R393 Q394 K395 S399 K400 D401	R393-Q397 VanDerWaalsContact O-CB 3.28Å; R393-Q397 WeakPolarHBondContact O-CB 3.32Å; R393-Q397 PolarHBondContact O-N 3.4Å; Q394-Q397 PolarHBondContact O-N 3.35Å; K395-Q397 VanDerWaalsContact C-N 3.34Å; Q397-S399 PolarHBondContact O-N 3.19Å; Q397-K400 PolarHBondContact O-N 3.4Å; Q397-D401 WeakPolarHBondContact O-CB 3.31Å; Q397-D401 VanDerWaalsContact O-CG 3.28Å; Q397-D401 PolarHBondContact O-N 3.45Å
398	Q	45.9	Very low	49.5	Very low	136 Å²	136	103.7 Å²	103.7	64%	0.636	51%	0.511	S	S	*	.	H	α-helix	trans	-61.3	-42.6	174	-114.2	176.5	-2.1	0	0	112.4	Q394 K395 D401 E402	Q394-Q398 WeakPolarHBondContact O-CB 3.47Å; Q394-Q398 PolarHBondContact O-N 2.85Å; K395-Q398 PolarHBondContact O-N 3.32Å; Q398-D401 PolarHBondContact O-N 2.85Å; Q398-E402 PolarHBondContact O-N 3.34Å
399	S	46.5	Very low	49.4	Very low	68 Å²	68	103.9 Å²	103.9	48%	0.476	51%	0.505	S	S	.	.	H	α-helix	trans	-67.5	-42.4	178.1	-177.5	0	0	0	0	112	K395 V396 Q397 D401 E402 H403	K395-S399 WeakPolarHBondContact O-CB 3.33Å; K395-S399 PolarHBondContact O-N 3.28Å; V396-S399 PolarHBondContact O-N 3.29Å; Q397-S399 PolarHBondContact O-N 3.19Å; S399-D401 VanDerWaalsContact C-N 3.34Å; S399-D401 PolarHBondContact O-N 3.11Å; S399-E402 PolarHBondContact O-N 3.41Å; S399-H403 PolarHBondContact O-N 3.44Å
400	K	52.5	Low	49.3	Very low	134 Å²	134	108.6 Å²	108.6	58%	0.583	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-40.4	172.6	-78.4	-178.2	179	177.3	0	112	V396 Q397 H403 R404	V396-K400 HydrophobicContact CG1-CD 4.41Å; V396-K400 WeakPolarHBondContact O-CB 3.24Å; V396-K400 WeakPolarHBondContact O-CG 3.39Å; V396-K400 PolarHBondContact O-N 3.49Å; Q397-K400 PolarHBondContact O-N 3.4Å; K400-H403 PolarHBondContact O-N 3.4Å; K400-R404 WeakPolarHBondContact O-CB 3.38Å; K400-R404 PolarHBondContact O-N 3.18Å
401	D	47.2	Very low	49.1	Very low	71 Å²	71	111.8 Å²	111.8	38%	0.38	53%	0.525	S	S	.	.	H	α-helix	trans	-66.5	-41.1	176.5	-76.5	-21.7	0	0	0	112	Q397 Q398 S399 R404 I405	Q397-D401 WeakPolarHBondContact O-CB 3.31Å; Q397-D401 VanDerWaalsContact O-CG 3.28Å; Q397-D401 PolarHBondContact O-N 3.45Å; Q398-D401 PolarHBondContact O-N 2.85Å; S399-D401 VanDerWaalsContact C-N 3.34Å; S399-D401 PolarHBondContact O-N 3.11Å; D401-R404 PolarHBondContact O-N 2.94Å; D401-I405 WeakPolarHBondContact O-CB 3.24Å; D401-I405 WeakPolarHBondContact O-CD1 3.4Å; D401-I405 WeakPolarHBondContact O-CG1 3.48Å; D401-I405 PolarHBondContact O-N 3.42Å
402	E	46.9	Very low	49.2	Very low	135 Å²	135	111.2 Å²	111.2	63%	0.631	52%	0.521	S	S	*	.	H	α-helix	trans	-64	-42.7	173.5	-84.3	-166.1	146	0	0	112.4	Q398 S399 R404 I405 N406	Q398-E402 PolarHBondContact O-N 3.34Å; S399-E402 PolarHBondContact O-N 3.41Å; E402-R404 PolarHBondContact O-N 3.44Å; E402-I405 PolarHBondContact O-N 3.28Å; E402-N406 WeakPolarHBondContact O-CB 3.26Å; E402-N406 PolarHBondContact O-N 3.44Å
403	H	52.6	Low	48.8	Very low	142 Å²	142	109.9 Å²	109.9	66%	0.657	52%	0.517	S	S	*	.	H	α-helix	trans	-63.8	-39.5	175.3	-113.1	-74.4	0	0	0	112.2	S399 K400 S407	S399-H403 PolarHBondContact O-N 3.44Å; K400-H403 PolarHBondContact O-N 3.4Å; H403-S407 WeakPolarHBondContact O-CB 3.35Å; H403-S407 PolarHBondContact O-N 3.5Å; H403-S407 PolarHBondContact O-OG 3.02Å; H403-S407 VanDerWaalsContact O-OG 3.12Å
404	R	46	Very low	48.2	Very low	164 Å²	164	106.5 Å²	106.5	62%	0.619	51%	0.513	S	S	*	.	H	α-helix	trans	-67.6	-39.2	175	-164.7	175.9	-174.8	179.8	2.4	111.5	K400 D401 E402 S407 Q408	K400-R404 WeakPolarHBondContact O-CB 3.38Å; K400-R404 PolarHBondContact O-N 3.18Å; D401-R404 PolarHBondContact O-N 2.94Å; E402-R404 PolarHBondContact O-N 3.44Å; R404-S407 PolarHBondContact O-OG 2.88Å; R404-Q408 WeakPolarHBondContact O-CB 2.96Å; R404-Q408 WeakPolarHBondContact O-CG 3.35Å; R404-Q408 PolarHBondContact O-N 3.1Å
405	I	49.6	Very low	47.8	Very low	63 Å²	63	103.8 Å²	103.8	32%	0.323	51%	0.508	S	S	.	.	H	α-helix	trans	-66.2	-43.9	176.3	-70.5	163.6	0	0	0	111.2	D401 E402 Q408 N409	D401-I405 WeakPolarHBondContact O-CB 3.24Å; D401-I405 WeakPolarHBondContact O-CD1 3.4Å; D401-I405 WeakPolarHBondContact O-CG1 3.48Å; D401-I405 PolarHBondContact O-N 3.42Å; E402-I405 PolarHBondContact O-N 3.28Å; I405-Q408 PolarHBondContact O-N 2.93Å; I405-N409 WeakPolarHBondContact O-CB 3.16Å; I405-N409 VanDerWaalsContact O-CG 3.27Å; I405-N409 PolarHBondContact O-N 2.93Å
406	N	46.6	Very low	47.5	Very low	106 Å²	106	105.1 Å²	105.1	57%	0.567	51%	0.514	S	S	*	.	H	α-helix	trans	-66.9	-41.9	177.7	-82.4	-20	0	0	0	112.5	E402 N409 K410	E402-N406 WeakPolarHBondContact O-CB 3.26Å; E402-N406 PolarHBondContact O-N 3.44Å; N406-N409 PolarHBondContact O-N 2.81Å; N406-K410 WeakPolarHBondContact O-CB 3.46Å; N406-K410 PolarHBondContact O-N 3.36Å
407	S	49.6	Very low	46.6	Very low	46 Å²	46	104.8 Å²	104.8	32%	0.322	51%	0.513	S	S	.	.	H	α-helix	trans	-67	-36.4	176.1	65.7	0	0	0	0	112.9	H403 R404 K410 R411	H403-S407 WeakPolarHBondContact O-CB 3.35Å; H403-S407 PolarHBondContact O-N 3.5Å; H403-S407 PolarHBondContact O-OG 3.02Å; H403-S407 VanDerWaalsContact O-OG 3.12Å; R404-S407 PolarHBondContact O-OG 2.88Å; S407-K410 PolarHBondContact O-N 3.3Å; S407-R411 PolarHBondContact O-N 3.18Å; S407-R411 VanDerWaalsContact O-N 3.08Å
408	Q	47.3	Very low	45.9	Very low	64 Å²	64	109.3 Å²	109.3	30%	0.299	53%	0.531	S	S	.	.	H	α-helix	trans	-69.7	-39.1	173.3	-78.4	177.6	-31.8	0	0	112.1	K237 R404 I405 K410 R411 I412	K237-Q408 VanDerWaalsContact CE-OE1 3.23Å; R404-Q408 WeakPolarHBondContact O-CB 2.96Å; R404-Q408 WeakPolarHBondContact O-CG 3.35Å; R404-Q408 PolarHBondContact O-N 3.1Å; I405-Q408 PolarHBondContact O-N 2.93Å; Q408-K410 VanDerWaalsContact C-N 3.33Å; Q408-K410 PolarHBondContact O-N 3.15Å; Q408-R411 PolarHBondContact O-N 3.07Å; Q408-I412 VanDerWaalsContact O-CG1 3.3Å; Q408-I412 WeakPolarHBondContact O-CG1 3.31Å; Q408-I412 PolarHBondContact O-N 3.22Å
409	N	46.3	Very low	45.6	Very low	55 Å²	55	112.4 Å²	112.4	29%	0.294	55%	0.545	S	S	.	.	H	α-helix	trans	-63.2	-39.6	173.9	-76.9	-14.4	0	0	0	111.5	I405 N406 R411 I412 V413	I405-N409 WeakPolarHBondContact O-CB 3.16Å; I405-N409 VanDerWaalsContact O-CG 3.27Å; I405-N409 PolarHBondContact O-N 2.93Å; N406-N409 PolarHBondContact O-N 2.81Å; N409-R411 VanDerWaalsContact C-N 3.33Å; N409-R411 PolarHBondContact O-N 3.06Å; N409-I412 PolarHBondContact O-N 3.24Å; N409-V413 WeakPolarHBondContact O-CB 3.41Å; N409-V413 VanDerWaalsContact O-CG2 3.24Å; N409-V413 WeakPolarHBondContact O-CG2 3.4Å; N409-V413 PolarHBondContact O-N 3.45Å
410	K	46.5	Very low	45.5	Very low	154 Å²	154	111.9 Å²	111.9	67%	0.67	54%	0.542	S	S	*	.	H	α-helix	trans	-64	-36.3	174.9	-144.6	173.6	-173.9	-178.9	0	111.8	N406 S407 Q408 N414	N406-K410 WeakPolarHBondContact O-CB 3.46Å; N406-K410 PolarHBondContact O-N 3.36Å; S407-K410 PolarHBondContact O-N 3.3Å; Q408-K410 VanDerWaalsContact C-N 3.33Å; Q408-K410 PolarHBondContact O-N 3.15Å; K410-N414 WeakPolarHBondContact O-CB 3.41Å; K410-N414 VanDerWaalsContact O-CG 3.29Å; K410-N414 PolarHBondContact O-N 2.67Å
411	R	42.7	Very low	45.3	Very low	177 Å²	177	109.5 Å²	109.5	67%	0.668	54%	0.542	S	S	*	.	H	α-helix	trans	-69.8	-40.3	173.6	-79.6	-171.8	-108.9	-161.8	-5.1	113.5	S407 Q408 N409 V413 N414 S415	S407-R411 PolarHBondContact O-N 3.18Å; S407-R411 VanDerWaalsContact O-N 3.08Å; Q408-R411 PolarHBondContact O-N 3.07Å; N409-R411 VanDerWaalsContact C-N 3.33Å; N409-R411 PolarHBondContact O-N 3.06Å; R411-V413 VanDerWaalsContact C-N 3.29Å; R411-V413 PolarHBondContact O-N 2.85Å; R411-N414 CarbonylContact O-C 3.49Å; R411-N414 PolarHBondContact O-N 3.47Å; R411-N414 VanDerWaalsContact O-N 3.11Å; R411-S415 PolarHBondContact O-N 3.29Å; R411-S415 PolarHBondContact O-OG 3.49Å
412	I	48.1	Very low	45.3	Very low	81 Å²	81	111 Å²	111	42%	0.415	55%	0.554	S	S	.	*	H	α-helix	trans	-67.9	-30.3	176.2	-65.5	163.8	0	0	0	111.5	Q408 N409 N414 S415	Q408-I412 VanDerWaalsContact O-CG1 3.3Å; Q408-I412 WeakPolarHBondContact O-CG1 3.31Å; Q408-I412 PolarHBondContact O-N 3.22Å; N409-I412 PolarHBondContact O-N 3.24Å; I412-N414 VanDerWaalsContact C-N 3.31Å; I412-S415 PolarHBondContact O-OG 2.92Å
413	V	46.7	Very low	45.4	Very low	68 Å²	68	115 Å²	115	41%	0.412	56%	0.563	S	S	.	*	H	α-helix	trans	-76.7	-18.1	173.4	173.8	0	0	0	0	112.2	N409 R411 R429	N409-V413 WeakPolarHBondContact O-CB 3.41Å; N409-V413 VanDerWaalsContact O-CG2 3.24Å; N409-V413 WeakPolarHBondContact O-CG2 3.4Å; N409-V413 PolarHBondContact O-N 3.45Å; R411-V413 VanDerWaalsContact C-N 3.29Å; R411-V413 PolarHBondContact O-N 2.85Å; V413-R429 VanDerWaalsContact C-NH2 3.28Å; V413-R429 PolarHBondContact O-NH2 3.44Å
414	N	43	Very low	45.4	Very low	123 Å²	123	110.4 Å²	110.4	66%	0.658	55%	0.547	S	S	*	.	H	α-helix	trans	-107	-9	-178.5	-72.2	-6.3	0	0	0	114.4	K410 R411 I412 K416	K410-N414 WeakPolarHBondContact O-CB 3.41Å; K410-N414 VanDerWaalsContact O-CG 3.29Å; K410-N414 PolarHBondContact O-N 2.67Å; R411-N414 CarbonylContact O-C 3.49Å; R411-N414 PolarHBondContact O-N 3.47Å; R411-N414 VanDerWaalsContact O-N 3.11Å; I412-N414 VanDerWaalsContact C-N 3.31Å; N414-K416 PolarHBondContact O-N 2.87Å
415	S	42	Very low	45.7	Very low	71 Å²	71	104.6 Å²	104.6	50%	0.497	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-74.3	117.2	175.2	51	0	0	0	0	111.4	R411 I412	R411-S415 PolarHBondContact O-N 3.29Å; R411-S415 PolarHBondContact O-OG 3.49Å; I412-S415 PolarHBondContact O-OG 2.92Å
416	K	37.7	Very low	46.1	Very low	165 Å²	165	105.5 Å²	105.5	72%	0.717	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-61.5	126.2	165.3	-83.3	-178.8	176.6	178.9	0	108.4	N414 K418	N414-K416 PolarHBondContact O-N 2.87Å; K416-K418 PolarHBondContact O-N 2.87Å
417	P	43	Very low	46.6	Very low	70 Å²	70	105 Å²	105	46%	0.455	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-74.8	120	-177.9	29.3	-33.1	0	0	0	110.4	V425	P417-V425 HydrophobicContact CB-CG2 4.03Å; P417-V425 HydrophobicContact CG-CG2 4.18Å
418	K	36.8	Very low	47.1	Very low	202 Å²	202	107.1 Å²	107.1	88%	0.878	53%	0.53	S	S	*	.	S	Bend	trans	-74.5	122.9	158.5	-74	-177.5	176.3	-178.1	0	107.7	K416 S420	K416-K418 PolarHBondContact O-N 2.87Å; K418-S420 PolarHBondContact O-N 3.12Å; K418-S420 VanDerWaalsContact O-N 3.13Å
419	H	40.6	Very low	47.7	Very low	202 Å²	202	109 Å²	109	94%	0.935	53%	0.534	S	S	*	.	S	Bend	trans	60.9	9.4	163.7	-106.5	-73.8	0	0	0	122.2
420	S	43.3	Very low	48.4	Very low	57 Å²	57	113.5 Å²	113.5	40%	0.399	55%	0.547	S	S	.	.	S	Bend	trans	-103.3	131.6	168.4	56.9	0	0	0	0	111	K418 T422	K418-S420 PolarHBondContact O-N 3.12Å; K418-S420 VanDerWaalsContact O-N 3.13Å; S420-T422 PolarHBondContact O-N 2.97Å
421	S	48.7	Very low	49.2	Very low	83 Å²	83	109.5 Å²	109.5	58%	0.58	53%	0.53	S	S	*	.			trans	-49	127.8	-174.2	68.6	0	0	0	0	110.8	R423 S424	S421-R423 PolarHBondContact O-N 3.47Å; S421-S424 WeakPolarHBondContact O-CB 3.16Å; S421-S424 PolarHBondContact O-N 3.31Å; S421-S424 PolarHBondContact O-OG 3.17Å
422	T	47.7	Very low	50.1	Low	103 Å²	103	104.1 Å²	104.1	63%	0.632	51%	0.514	S	S	*	.	H	α-helix	trans	-47.5	-28.8	-178.2	-46.6	0	0	0	0	112.6	S420 I426	S420-T422 PolarHBondContact O-N 2.97Å; T422-I426 HydrophobicContact CG2-CD1 4.09Å; T422-I426 WeakPolarHBondContact O-CG1 3.47Å; T422-I426 PolarHBondContact O-N 3.48Å
423	R	48.4	Very low	50.8	Low	218 Å²	218	106 Å²	106	82%	0.823	52%	0.524	S	S	*	.	H	α-helix	trans	-62.6	-38.9	175.2	-155.9	172.7	-172.2	177.4	1.9	113.6	S421 Y427	S421-R423 PolarHBondContact O-N 3.47Å; R423-Y427 WeakPolarHBondContact O-CB 3.24Å; R423-Y427 PolarHBondContact O-N 2.89Å
424	S	52.4	Low	51.6	Low	46 Å²	46	103.7 Å²	103.7	32%	0.322	51%	0.51	S	S	.	.	H	α-helix	trans	-69.9	-36.9	179.9	71.6	0	0	0	0	112.9	S421 Y427 Q428	S421-S424 WeakPolarHBondContact O-CB 3.16Å; S421-S424 PolarHBondContact O-N 3.31Å; S421-S424 PolarHBondContact O-OG 3.17Å; S424-Y427 WeakPolarHBondContact O-CB 3.1Å; S424-Y427 PolarHBondContact O-N 3.01Å; S424-Q428 WeakPolarHBondContact O-CG 3.42Å; S424-Q428 PolarHBondContact O-N 3.13Å
425	V	52	Low	52.5	Low	43 Å²	43	98.9 Å²	98.9	26%	0.261	48%	0.483	S	S	.	.	H	α-helix	trans	-73.9	-43.3	179.5	179.4	0	0	0	0	111.1	P417 Y427 Q428 R429	P417-V425 HydrophobicContact CB-CG2 4.03Å; P417-V425 HydrophobicContact CG-CG2 4.18Å; V425-Y427 VanDerWaalsContact C-N 3.26Å; V425-Y427 PolarHBondContact O-N 3.44Å; V425-Q428 PolarHBondContact O-N 3.08Å; V425-R429 PolarHBondContact O-N 3.48Å
426	I	58	Low	53.5	Low	82 Å²	82	99 Å²	99	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-59.9	-41.6	173.4	-66.8	169.8	0	0	0	110.2	T422 R429 R430	T422-I426 HydrophobicContact CG2-CD1 4.09Å; T422-I426 WeakPolarHBondContact O-CG1 3.47Å; T422-I426 PolarHBondContact O-N 3.48Å; I426-R429 PolarHBondContact O-N 2.74Å; I426-R430 WeakPolarHBondContact O-CG 3.43Å; I426-R430 PolarHBondContact O-N 2.88Å
427	Y	58.8	Low	54.7	Low	95 Å²	95	94 Å²	94	37%	0.373	46%	0.464	S	S	.	.	H	α-helix	trans	-57.9	-50.3	175.7	173.7	-75.6	0	0	0	111.9	M149 R423 S424 V425 R430 K431	M149-Y427 HydrophobicContact CB-CE2 4.46Å; M149-Y427 HydrophobicContact CE-CD2 3.29Å; M149-Y427 HydrophobicContact CE-CE2 3.28Å; M149-Y427 HydrophobicContact CE-CG 4.33Å; M149-Y427 HydrophobicContact CG-CD2 4.15Å; M149-Y427 HydrophobicContact CG-CE1 4.27Å; M149-Y427 HydrophobicContact CG-CE2 3.25Å; M149-Y427 WeakPolarHBondContact CG-OH 3.25Å; M149-Y427 HydrophobicContact SD-CD1 4.41Å; M149-Y427 HydrophobicContact SD-CD2 3.41Å; M149-Y427 WeakPolarHBondContact SD-CD2 3.41Å; M149-Y427 HydrophobicContact SD-CE1 4.14Å; M149-Y427 HydrophobicContact SD-CE2 3.15Å; M149-Y427 WeakPolarHBondContact SD-CE2 3.24Å; M149-Y427 HydrophobicContact SD-CG 4.04Å; M149-Y427 VanDerWaalsContact SD-CZ 3.52Å; R423-Y427 WeakPolarHBondContact O-CB 3.24Å; R423-Y427 PolarHBondContact O-N 2.89Å; S424-Y427 WeakPolarHBondContact O-CB 3.1Å; S424-Y427 PolarHBondContact O-N 3.01Å; V425-Y427 VanDerWaalsContact C-N 3.26Å; V425-Y427 PolarHBondContact O-N 3.44Å; Y427-R430 PolarHBondContact O-N 3.36Å; Y427-K431 HydrophobicContact CE1-CD 4.41Å; Y427-K431 WeakPolarHBondContact O-CB 3.33Å; Y427-K431 PolarHBondContact O-N 3Å
428	Q	59.4	Low	55.6	Low	90 Å²	90	90.8 Å²	90.8	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-67.7	-38.7	-178	-69	-64.4	-6.6	0	0	112.3	S424 V425 K431 L432	S424-Q428 WeakPolarHBondContact O-CG 3.42Å; S424-Q428 PolarHBondContact O-N 3.13Å; V425-Q428 PolarHBondContact O-N 3.08Å; Q428-K431 PolarHBondContact O-N 2.9Å; Q428-L432 PolarHBondContact O-N 2.88Å
429	R	58.9	Low	56.6	Low	105 Å²	105	85.8 Å²	85.8	40%	0.396	42%	0.421	S	S	.	.	H	α-helix	trans	-61.6	-45.9	174.9	-76.9	-170.7	-173.5	-163.5	5.1	112.2	V413 V425 I426 K431 L432 L433	V413-R429 VanDerWaalsContact C-NH2 3.28Å; V413-R429 PolarHBondContact O-NH2 3.44Å; V425-R429 PolarHBondContact O-N 3.48Å; I426-R429 PolarHBondContact O-N 2.74Å; R429-K431 VanDerWaalsContact C-N 3.32Å; R429-K431 PolarHBondContact O-N 3.15Å; R429-L432 PolarHBondContact O-N 3.39Å; R429-L433 WeakPolarHBondContact O-CG 3.34Å; R429-L433 PolarHBondContact O-N 2.72Å
430	R	62.2	Low	57.4	Low	148 Å²	148	83.8 Å²	83.8	56%	0.558	41%	0.41	S	S	*	.	H	α-helix	trans	-62	-41.4	177.9	-74.2	-179.2	179.3	-170.8	0.4	111.6	I152 I426 Y427 L432 L433 V434	I152-R430 HydrophobicContact CD1-CB 4.09Å; I426-R430 WeakPolarHBondContact O-CG 3.43Å; I426-R430 PolarHBondContact O-N 2.88Å; Y427-R430 PolarHBondContact O-N 3.36Å; R430-L432 PolarHBondContact O-N 2.87Å; R430-L433 PolarHBondContact O-N 3.41Å; R430-V434 WeakPolarHBondContact O-CG2 3.36Å; R430-V434 PolarHBondContact O-N 2.9Å; R430-V434 VanDerWaalsContact O-N 3.1Å
431	K	62.9	Low	57.9	Low	71 Å²	71	83.6 Å²	83.6	31%	0.309	41%	0.406	S	S	.	.	H	α-helix	trans	-59.5	-44	175.6	-175.7	172.6	179.2	-173.1	0	112.2	P148 Y427 Q428 R429 Y435	P148-K431 HydrophobicContact CB-CG 3.91Å; P148-K431 HydrophobicContact CG-CD 3.87Å; P148-K431 HydrophobicContact CG-CG 3.61Å; Y427-K431 HydrophobicContact CE1-CD 4.41Å; Y427-K431 WeakPolarHBondContact O-CB 3.33Å; Y427-K431 PolarHBondContact O-N 3Å; Q428-K431 PolarHBondContact O-N 2.9Å; R429-K431 VanDerWaalsContact C-N 3.32Å; R429-K431 PolarHBondContact O-N 3.15Å; K431-Y435 WeakPolarHBondContact O-CB 3.5Å; K431-Y435 PolarHBondContact O-N 3.43Å; K431-Y435 VanDerWaalsContact O-N 3.13Å
432	L	62.3	Low	58.1	Low	64 Å²	64	81 Å²	81	34%	0.335	39%	0.386	S	S	.	.	H	α-helix	trans	-69.2	-39.6	178.8	-171.9	66.5	0	0	0	112.6	Q428 R429 R430 Y435 N436	Q428-L432 PolarHBondContact O-N 2.88Å; R429-L432 PolarHBondContact O-N 3.39Å; R430-L432 PolarHBondContact O-N 2.87Å; L432-Y435 PolarHBondContact O-N 3.49Å; L432-N436 WeakPolarHBondContact O-CB 3.43Å; L432-N436 PolarHBondContact O-N 3.37Å
433	L	63.1	Low	58.2	Low	121 Å²	121	83.7 Å²	83.7	63%	0.634	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-45.7	177.7	-74.3	171.5	0	0	0	112.1	R429 R430 N436 S437	R429-L433 WeakPolarHBondContact O-CG 3.34Å; R429-L433 PolarHBondContact O-N 2.72Å; R430-L433 PolarHBondContact O-N 3.41Å; L433-N436 PolarHBondContact O-N 3.29Å; L433-S437 PolarHBondContact O-N 3.18Å; L433-S437 PolarHBondContact O-OG 3.43Å
434	V	63	Low	58.1	Low	19 Å²	19	79.3 Å²	79.3	12%	0.115	38%	0.383	C	S	.	.	H	α-helix	trans	-58.6	-54.2	174.3	172.6	0	0	0	0	109.2	Y151 I152 R430 N436 S437 E438	Y151-V434 HydrophobicContact CD1-CG1 4.26Å; I152-V434 HydrophobicContact CD1-CG2 3.89Å; I152-V434 HydrophobicContact CG1-CG2 3.89Å; R430-V434 WeakPolarHBondContact O-CG2 3.36Å; R430-V434 PolarHBondContact O-N 2.9Å; R430-V434 VanDerWaalsContact O-N 3.1Å; V434-N436 VanDerWaalsContact C-N 3.31Å; V434-N436 PolarHBondContact O-N 2.87Å; V434-S437 PolarHBondContact O-N 2.95Å; V434-S437 VanDerWaalsContact O-N 3.15Å; V434-S437 PolarHBondContact O-OG 3.35Å; V434-E438 HydrophobicContact CG1-CG 3.91Å; V434-E438 WeakPolarHBondContact O-CB 3.4Å; V434-E438 WeakPolarHBondContact O-CG 3.31Å; V434-E438 PolarHBondContact O-N 2.84Å
435	Y	61.4	Low	57.5	Low	21 Å²	21	78.5 Å²	78.5	8%	0.082	38%	0.377	C	S	.	.	H	α-helix	trans	-53.3	-44.2	179.7	179.4	-99.1	0	0	0	113.6	I226 L233 K431 L432 E438 K439	I226-Y435 PolarHBondContact O-OH 2.85Å; L233-Y435 HydrophobicContact CD1-CE1 4.11Å; K431-Y435 WeakPolarHBondContact O-CB 3.5Å; K431-Y435 PolarHBondContact O-N 3.43Å; K431-Y435 VanDerWaalsContact O-N 3.13Å; L432-Y435 PolarHBondContact O-N 3.49Å; Y435-E438 PolarHBondContact O-N 3.35Å; Y435-K439 WeakPolarHBondContact O-CB 3.36Å; Y435-K439 PolarHBondContact O-N 3.48Å
436	N	62.9	Low	56.9	Low	73 Å²	73	80.3 Å²	80.3	39%	0.39	39%	0.392	S	S	.	.	H	α-helix	trans	-70.4	-38.5	-179.7	-74.7	-15.4	0	0	0	113.1	L432 L433 V434 E438	L432-N436 WeakPolarHBondContact O-CB 3.43Å; L432-N436 PolarHBondContact O-N 3.37Å; L433-N436 PolarHBondContact O-N 3.29Å; V434-N436 VanDerWaalsContact C-N 3.31Å; V434-N436 PolarHBondContact O-N 2.87Å; N436-E438 VanDerWaalsContact C-N 3.34Å
437	S	62.2	Low	56	Low	60 Å²	60	82.3 Å²	82.3	42%	0.42	40%	0.403	S	S	.	.	H	α-helix	trans	-64.9	-41.5	175	72	0	0	0	0	111.3	L433 V434 K440 T441	L433-S437 PolarHBondContact O-N 3.18Å; L433-S437 PolarHBondContact O-OG 3.43Å; V434-S437 PolarHBondContact O-N 2.95Å; V434-S437 VanDerWaalsContact O-N 3.15Å; V434-S437 PolarHBondContact O-OG 3.35Å; S437-K440 PolarHBondContact O-N 3.45Å; S437-T441 PolarHBondContact O-N 2.92Å
438	E	62.5	Low	55.3	Low	4 Å²	4	79.8 Å²	79.8	2%	0.019	40%	0.399	C	S	.	.	H	α-helix	trans	-68.8	-41	-177.8	-67.2	-71.8	141.6	0	0	111.2	R141 A144 I145 V434 Y435 N436 K440 T441 V442	R141-E438 VanDerWaalsContact CD-OE2 3.22Å; R141-E438 WeakPolarHBondContact CD-OE2 3.33Å; R141-E438 IonicContact CZ-OE1 3.02Å; R141-E438 IonicContact CZ-OE2 2.79Å; R141-E438 IonicContact NE-OE2 3.12Å; R141-E438 PolarHBondContact NE-OE2 2.96Å; R141-E438 VanDerWaalsContact NE-OE2 3.12Å; R141-E438 IonicContact NH1-OE1 2.78Å; R141-E438 PolarHBondContact NH1-OE1 3.47Å; R141-E438 IonicContact NH1-OE2 2.75Å; R141-E438 PolarHBondContact NH1-OE2 3.33Å; R141-E438 IonicContact NH2-OE1 2.77Å; R141-E438 PolarHBondContact NH2-OE1 3.45Å; R141-E438 IonicContact NH2-OE2 3.27Å; R141-E438 PolarHBondContact NH2-OE2 2.89Å; A144-E438 HydrophobicContact CB-CG 4.03Å; I145-E438 HydrophobicContact CG1-CB 4.37Å; V434-E438 HydrophobicContact CG1-CG 3.91Å; V434-E438 WeakPolarHBondContact O-CB 3.4Å; V434-E438 WeakPolarHBondContact O-CG 3.31Å; V434-E438 PolarHBondContact O-N 2.84Å; Y435-E438 PolarHBondContact O-N 3.35Å; N436-E438 VanDerWaalsContact C-N 3.34Å; E438-K440 PolarHBondContact O-N 2.93Å; E438-T441 WeakPolarHBondContact CA-OG1 3.22Å; E438-T441 PolarHBondContact O-N 2.96Å; E438-T441 PolarHBondContact O-OG1 2.86Å; E438-V442 WeakPolarHBondContact O-CG2 3.36Å; E438-V442 PolarHBondContact O-N 2.89Å
439	K	57.3	Low	54.8	Low	96 Å²	96	78.4 Å²	78.4	42%	0.417	40%	0.399	S	S	.	.	H	α-helix	trans	-56.9	-33.8	174.8	-171.5	179.7	179.4	-176.1	0	112.6	Y435	Y435-K439 WeakPolarHBondContact O-CB 3.36Å; Y435-K439 PolarHBondContact O-N 3.48Å
440	K	57.5	Low	54.3	Low	161 Å²	161	77.2 Å²	77.2	70%	0.7	40%	0.404	S	S	*	.	H	α-helix	trans	-71.7	-42	174.4	-71.4	-174.5	177.3	-173.8	0	111.7	S437 E438 V442 K443	S437-K440 PolarHBondContact O-N 3.45Å; E438-K440 PolarHBondContact O-N 2.93Å; K440-V442 PolarHBondContact O-N 3.3Å; K440-K443 PolarHBondContact O-N 3.43Å
441	T	54.8	Low	53.8	Low	52 Å²	52	72.3 Å²	72.3	32%	0.319	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-36.5	178.9	59.8	0	0	0	0	113.4	R141 S437 E438 K443 N444 S445	R141-T441 PolarHBondContact NH1-OG1 3.27Å; S437-T441 PolarHBondContact O-N 2.92Å; E438-T441 WeakPolarHBondContact CA-OG1 3.22Å; E438-T441 PolarHBondContact O-N 2.96Å; E438-T441 PolarHBondContact O-OG1 2.86Å; T441-K443 VanDerWaalsContact C-N 3.3Å; T441-K443 PolarHBondContact O-N 3.45Å; T441-N444 PolarHBondContact O-N 3.01Å; T441-N444 VanDerWaalsContact O-N 3.14Å; T441-S445 PolarHBondContact O-N 3.43Å
442	V	52.6	Low	53.2	Low	28 Å²	28	71.6 Å²	71.6	17%	0.17	39%	0.385	C	S	.	.	H	α-helix	trans	-63.8	-34.8	178.5	173.3	0	0	0	0	111.9	I145 I222 E438 K440 N444	I145-V442 HydrophobicContact CD1-CG2 4.29Å; I222-V442 HydrophobicContact CG2-CG2 4.49Å; E438-V442 WeakPolarHBondContact O-CG2 3.36Å; E438-V442 PolarHBondContact O-N 2.89Å; K440-V442 PolarHBondContact O-N 3.3Å; V442-N444 VanDerWaalsContact C-N 3.33Å; V442-N444 PolarHBondContact O-N 3.06Å
443	K	49.1	Very low	52.6	Low	160 Å²	160	77.3 Å²	77.3	70%	0.696	40%	0.402	S	S	*	.	H	α-helix	trans	-64.8	-36	174.7	-80.7	-171.2	172.6	-169.4	0	112.5	K440 T441	K440-K443 PolarHBondContact O-N 3.43Å; T441-K443 VanDerWaalsContact C-N 3.3Å; T441-K443 PolarHBondContact O-N 3.45Å
444	N	47.1	Very low	52	Low	127 Å²	127	76.2 Å²	76.2	68%	0.679	39%	0.393	S	S	*	.	H	α-helix	trans	-81.4	-32.1	-178.5	-69.9	5.1	0	0	0	112.6	T441 V442 S446 N447	T441-N444 PolarHBondContact O-N 3.01Å; T441-N444 VanDerWaalsContact O-N 3.14Å; V442-N444 VanDerWaalsContact C-N 3.33Å; V442-N444 PolarHBondContact O-N 3.06Å; N444-S446 PolarHBondContact O-N 2.95Å; N444-N447 PolarHBondContact O-N 2.81Å
445	S	40.5	Very low	51.6	Low	28 Å²	28	77.4 Å²	77.4	20%	0.196	40%	0.397	C	S	.	.	H	α-helix	trans	-66.6	-18.6	178.8	-177.6	0	0	0	0	113.7	Y219 T441 N447 S448	Y219-S445 PolarHBondContact OH-OG 3.21Å; T441-S445 PolarHBondContact O-N 3.43Å; S445-N447 PolarHBondContact O-N 3.45Å; S445-S448 PolarHBondContact O-N 2.94Å; S445-S448 PolarHBondContact O-OG 3.43Å
446	S	38	Very low	51.2	Low	82 Å²	82	77.8 Å²	77.8	57%	0.573	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-68.8	-13.4	-179.8	-156.8	0	0	0	0	113.6	N444	N444-S446 PolarHBondContact O-N 2.95Å
447	N	40.4	Very low	50.5	Low	124 Å²	124	76.9 Å²	76.9	66%	0.663	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-85.4	-7.6	-179	-69.3	-11.7	0	0	0	113.8	N444 S445 S449	N444-N447 PolarHBondContact O-N 2.81Å; S445-N447 PolarHBondContact O-N 3.45Å; N447-S449 PolarHBondContact O-N 2.89Å; N447-S449 VanDerWaalsContact O-N 3.17Å
448	S	44.1	Very low	49.9	Very low	41 Å²	41	75.6 Å²	75.6	29%	0.287	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-73.4	-0.2	176.8	62.8	0	0	0	0	114	S445 V450	S445-S448 PolarHBondContact O-N 2.94Å; S445-S448 PolarHBondContact O-OG 3.43Å; S448-V450 VanDerWaalsContact C-N 3.27Å; S448-V450 PolarHBondContact O-N 2.98Å
449	S	48.8	Very low	49.4	Very low	61 Å²	61	80.9 Å²	80.9	43%	0.427	42%	0.421	S	S	.	.	H	α-helix	trans	-72.2	-15.2	177.7	72.5	0	0	0	0	114.4	N447 R453	N447-S449 PolarHBondContact O-N 2.89Å; N447-S449 VanDerWaalsContact O-N 3.17Å; S449-R453 WeakPolarHBondContact O-CG 3.5Å; S449-R453 PolarHBondContact O-N 3.47Å
450	V	47.2	Very low	48.9	Very low	81 Å²	81	82.7 Å²	82.7	49%	0.491	43%	0.426	S	S	.	.	H	α-helix	trans	-71.8	-43.6	-178	179.9	0	0	0	0	111	S448 F452 R453 F454	S448-V450 VanDerWaalsContact C-N 3.27Å; S448-V450 PolarHBondContact O-N 2.98Å; V450-F452 PolarHBondContact O-N 3.42Å; V450-R453 PolarHBondContact O-N 2.8Å; V450-F454 HydrophobicContact CG1-CD2 3.71Å; V450-F454 HydrophobicContact CG1-CE2 3.64Å; V450-F454 VanDerWaalsContact O-CD2 3.31Å; V450-F454 WeakPolarHBondContact O-CD2 3.41Å; V450-F454 PolarHBondContact O-N 3.48Å; V450-F454 VanDerWaalsContact O-N 3.1Å
451	L	51	Low	48.3	Very low	44 Å²	44	78.2 Å²	78.2	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-59.9	-43.1	178.6	-88.7	158.2	0	0	0	113	I56 R453 F454 M455	I56-L451 HydrophobicContact CD1-CD2 3.69Å; I56-L451 HydrophobicContact CG1-CD2 3.66Å; I56-L451 HydrophobicContact CG2-CD2 4.12Å; L451-R453 VanDerWaalsContact C-N 3.35Å; L451-R453 PolarHBondContact O-N 3.43Å; L451-F454 PolarHBondContact O-N 2.94Å; L451-M455 HydrophobicContact CD2-CE 4.35Å; L451-M455 WeakPolarHBondContact O-CG 3.45Å; L451-M455 PolarHBondContact O-N 3.37Å
452	F	50.8	Low	47.8	Very low	56 Å²	56	78.2 Å²	78.2	25%	0.246	40%	0.403	C	S	.	.	H	α-helix	trans	-65.4	-39.1	179.2	-166.3	-114.4	0	0	0	111.7	I131 F208 F212 V450 L456	I131-F452 HydrophobicContact CD1-CE2 4.03Å; I131-F452 HydrophobicContact CG1-CE2 4.32Å; F208-F452 AromaticContact CD2-CE1 3.81Å; F208-F452 HydrophobicContact CD2-CE1 3.81Å; F208-F452 AromaticContact CD2-CZ 3.86Å; F208-F452 HydrophobicContact CD2-CZ 3.86Å; F208-F452 HydrophobicContact CE2-CD1 4.47Å; F208-F452 AromaticContact CE2-CE1 3.58Å; F208-F452 HydrophobicContact CE2-CE1 3.58Å; F208-F452 HydrophobicContact CE2-CZ 4.13Å; F212-F452 HydrophobicContact CD2-CE1 4.48Å; V450-F452 PolarHBondContact O-N 3.42Å; F452-L456 HydrophobicContact CD1-CD1 3.6Å; F452-L456 HydrophobicContact CE1-CD1 3.53Å; F452-L456 HydrophobicContact CG-CD1 4.19Å; F452-L456 HydrophobicContact CZ-CD1 4.02Å; F452-L456 WeakPolarHBondContact O-CB 3.4Å; F452-L456 VanDerWaalsContact O-CD1 3.29Å; F452-L456 WeakPolarHBondContact O-CD1 3.32Å; F452-L456 VanDerWaalsContact O-CG 3.25Å; F452-L456 WeakPolarHBondContact O-CG 3.48Å; F452-L456 PolarHBondContact O-N 3Å; F452-L456 VanDerWaalsContact O-N 3.09Å
453	R	49.3	Very low	47.5	Very low	184 Å²	184	81.8 Å²	81.8	69%	0.694	42%	0.418	S	S	*	.	H	α-helix	trans	-66.3	-37.3	176.3	-71.6	177.5	-177.9	-97.7	1.1	112.5	S449 V450 L451 A457	S449-R453 WeakPolarHBondContact O-CG 3.5Å; S449-R453 PolarHBondContact O-N 3.47Å; V450-R453 PolarHBondContact O-N 2.8Å; L451-R453 VanDerWaalsContact C-N 3.35Å; L451-R453 PolarHBondContact O-N 3.43Å; R453-A457 WeakPolarHBondContact O-CB 3.23Å; R453-A457 PolarHBondContact O-N 3.31Å
454	F	51.7	Low	46.9	Very low	98 Å²	98	77.5 Å²	77.5	43%	0.43	41%	0.408	S	S	.	.	H	α-helix	trans	-71.3	-40.6	176.6	-87.9	-76.1	0	0	0	113.2	V450 L451 A457 S458	V450-F454 HydrophobicContact CG1-CD2 3.71Å; V450-F454 HydrophobicContact CG1-CE2 3.64Å; V450-F454 VanDerWaalsContact O-CD2 3.31Å; V450-F454 WeakPolarHBondContact O-CD2 3.41Å; V450-F454 PolarHBondContact O-N 3.48Å; V450-F454 VanDerWaalsContact O-N 3.1Å; L451-F454 PolarHBondContact O-N 2.94Å; F454-A457 PolarHBondContact O-N 3.5Å; F454-S458 PolarHBondContact O-N 2.87Å; F454-S458 PolarHBondContact O-OG 2.91Å
455	M	53.4	Low	46.7	Very low	44 Å²	44	73.7 Å²	73.7	22%	0.217	39%	0.388	C	S	.	.	H	α-helix	trans	-64	-41.7	176.1	-70.1	-168.5	-145.8	0	0	111.5	L451 S458 M459	L451-M455 HydrophobicContact CD2-CE 4.35Å; L451-M455 WeakPolarHBondContact O-CG 3.45Å; L451-M455 PolarHBondContact O-N 3.37Å; M455-S458 PolarHBondContact O-N 2.96Å; M455-M459 WeakPolarHBondContact O-CG 3.28Å; M455-M459 PolarHBondContact O-N 2.88Å
456	L	53.3	Low	46.6	Very low	29 Å²	29	75 Å²	75	15%	0.152	41%	0.405	C	S	.	.	H	α-helix	trans	-66.9	-43.6	176.6	-71	162.3	0	0	0	112.6	F208 F452 S458 M459 Y460	F208-L456 HydrophobicContact CB-CD2 4.39Å; F208-L456 HydrophobicContact CD2-CD1 3.4Å; F208-L456 VanDerWaalsContact CD2-CD1 3.4Å; F208-L456 HydrophobicContact CD2-CD2 3.41Å; F208-L456 VanDerWaalsContact CD2-CD2 3.41Å; F208-L456 HydrophobicContact CD2-CG 4.04Å; F208-L456 HydrophobicContact CE2-CD1 3.1Å; F208-L456 HydrophobicContact CE2-CD2 4.02Å; F208-L456 HydrophobicContact CE2-CG 4.17Å; F208-L456 HydrophobicContact CG-CD2 4.12Å; F208-L456 HydrophobicContact CZ-CD1 4.16Å; F452-L456 HydrophobicContact CD1-CD1 3.6Å; F452-L456 HydrophobicContact CE1-CD1 3.53Å; F452-L456 HydrophobicContact CG-CD1 4.19Å; F452-L456 HydrophobicContact CZ-CD1 4.02Å; F452-L456 WeakPolarHBondContact O-CB 3.4Å; F452-L456 VanDerWaalsContact O-CD1 3.29Å; F452-L456 WeakPolarHBondContact O-CD1 3.32Å; F452-L456 VanDerWaalsContact O-CG 3.25Å; F452-L456 WeakPolarHBondContact O-CG 3.48Å; F452-L456 PolarHBondContact O-N 3Å; F452-L456 VanDerWaalsContact O-N 3.09Å; L456-S458 PolarHBondContact O-N 3.41Å; L456-M459 PolarHBondContact O-N 2.95Å; L456-M459 VanDerWaalsContact O-N 3.14Å; L456-Y460 VanDerWaalsContact O-CD2 3.25Å; L456-Y460 WeakPolarHBondContact O-CD2 3.39Å; L456-Y460 PolarHBondContact O-N 3.32Å
457	A	48.4	Very low	46.6	Very low	55 Å²	55	75.9 Å²	75.9	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-57.4	-37.6	175.1	0	0	0	0	0	111.2	R453 F454 H461	R453-A457 WeakPolarHBondContact O-CB 3.23Å; R453-A457 PolarHBondContact O-N 3.31Å; F454-A457 PolarHBondContact O-N 3.5Å; A457-H461 WeakPolarHBondContact O-CB 3.4Å; A457-H461 PolarHBondContact O-N 2.93Å
458	S	50.8	Low	46.3	Very low	33 Å²	33	72.3 Å²	72.3	23%	0.231	40%	0.397	C	S	.	.	H	α-helix	trans	-71.9	-36.9	177.4	-53.2	0	0	0	0	112.6	F454 M455 L456 H461 F462	F454-S458 PolarHBondContact O-N 2.87Å; F454-S458 PolarHBondContact O-OG 2.91Å; M455-S458 PolarHBondContact O-N 2.96Å; L456-S458 PolarHBondContact O-N 3.41Å; S458-H461 PolarHBondContact O-N 3.16Å; S458-F462 WeakPolarHBondContact O-CB 3.38Å; S458-F462 PolarHBondContact O-N 2.9Å; S458-F462 VanDerWaalsContact O-N 3.08Å
459	M	51.6	Low	45.6	Very low	114 Å²	114	81.3 Å²	81.3	56%	0.562	44%	0.437	S	S	*	.	H	α-helix	trans	-67.7	-39.8	173.3	-70.2	179.9	74.3	0	0	112.4	M455 L456 F462 E463	M455-M459 WeakPolarHBondContact O-CG 3.28Å; M455-M459 PolarHBondContact O-N 2.88Å; L456-M459 PolarHBondContact O-N 2.95Å; L456-M459 VanDerWaalsContact O-N 3.14Å; M459-F462 WeakPolarHBondContact O-CB 3.32Å; M459-F462 PolarHBondContact O-N 3.34Å; M459-E463 PolarHBondContact O-N 3.31Å
460	Y	45.7	Very low	45.5	Very low	134 Å²	134	82.4 Å²	82.4	53%	0.525	44%	0.437	S	S	.	.	H	α-helix	trans	-68.4	-37.2	174.8	-85.7	-73.4	0	0	0	112.1	L456 F462 E463 S464	L456-Y460 VanDerWaalsContact O-CD2 3.25Å; L456-Y460 WeakPolarHBondContact O-CD2 3.39Å; L456-Y460 PolarHBondContact O-N 3.32Å; Y460-F462 VanDerWaalsContact C-N 3.29Å; Y460-F462 PolarHBondContact O-N 3.26Å; Y460-E463 WeakPolarHBondContact O-CB 3.07Å; Y460-E463 PolarHBondContact O-N 3.39Å; Y460-S464 PolarHBondContact O-N 2.95Å
461	H	45.4	Very low	45.4	Very low	67 Å²	67	82.4 Å²	82.4	31%	0.31	44%	0.435	S	S	.	.	H	α-helix	trans	-69.1	-29.8	176.6	-135.4	-57.3	0	0	0	112.9	I45 A457 S458 E463 S464	I45-H461 WeakPolarHBondContact CD1-CE1 3.44Å; I45-H461 WeakPolarHBondContact CD1-NE2 3.48Å; A457-H461 WeakPolarHBondContact O-CB 3.4Å; A457-H461 PolarHBondContact O-N 2.93Å; S458-H461 PolarHBondContact O-N 3.16Å; H461-E463 PolarHBondContact O-N 3.1Å; H461-S464 PolarHBondContact O-N 3.15Å
462	F	45.5	Very low	45.1	Very low	52 Å²	52	84.6 Å²	84.6	23%	0.228	45%	0.446	C	S	.	.	H	α-helix	trans	-63.8	-28.6	172.9	-167.5	-91.5	0	0	0	112.4	F99 W119 S458 M459 Y460	F99-F462 HydrophobicContact CD2-CD2 4.44Å; F99-F462 AromaticContact CE2-CD2 3.49Å; F99-F462 HydrophobicContact CE2-CD2 3.49Å; F99-F462 VanDerWaalsContact CE2-CD2 3.49Å; F99-F462 HydrophobicContact CE2-CE2 4.03Å; F99-F462 HydrophobicContact CE2-CG 4.43Å; F99-F462 HydrophobicContact CZ-CD2 4.04Å; W119-F462 HydrophobicContact CH2-CE2 4.45Å; S458-F462 WeakPolarHBondContact O-CB 3.38Å; S458-F462 PolarHBondContact O-N 2.9Å; S458-F462 VanDerWaalsContact O-N 3.08Å; M459-F462 WeakPolarHBondContact O-CB 3.32Å; M459-F462 PolarHBondContact O-N 3.34Å; Y460-F462 VanDerWaalsContact C-N 3.29Å; Y460-F462 PolarHBondContact O-N 3.26Å
463	E	46.2	Very low	44.7	Very low	103 Å²	103	86.2 Å²	86.2	48%	0.481	46%	0.458	S	S	.	.	H	α-helix	trans	-81.3	-31.7	-178	-155.3	166.9	-162.9	0	0	112.6	M459 Y460 H461 S467	M459-E463 PolarHBondContact O-N 3.31Å; Y460-E463 WeakPolarHBondContact O-CB 3.07Å; Y460-E463 PolarHBondContact O-N 3.39Å; H461-E463 PolarHBondContact O-N 3.1Å; E463-S467 PolarHBondContact O-OG 3.33Å
464	S	36.8	Very low	44.5	Very low	70 Å²	70	80.1 Å²	80.1	49%	0.49	44%	0.443	S	S	.	.	H	α-helix	trans	-71.3	-37.9	178.3	165.1	0	0	0	0	113.5	Y460 H461 S468	Y460-S464 PolarHBondContact O-N 2.95Å; H461-S464 PolarHBondContact O-N 3.15Å; S464-S468 PolarHBondContact O-OG 3.48Å
465	N	41.1	Very low	44	Very low	48 Å²	48	78.9 Å²	78.9	26%	0.257	44%	0.444	S	S	.	.	H	α-helix	trans	-85.5	-23.4	-178.3	-77.3	-2	0	0	0	113.1	N42 Q103 S467	N42-N465 PolarHBondContact OD1-ND2 2.74Å; Q103-N465 PolarHBondContact NE2-ND2 3.48Å; N465-S467 VanDerWaalsContact C-N 3.33Å
466	G	39.6	Very low	43.3	Very low	55 Å²	55	81.4 Å²	81.4	57%	0.567	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-5.7	176.5	0	0	0	0	0	115.3
467	S	37.2	Very low	42.5	Very low	100 Å²	100	85.5 Å²	85.5	70%	0.699	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	6.1	179.2	-51.1	0	0	0	0	113.1	E463 N465	E463-S467 PolarHBondContact O-OG 3.33Å; N465-S467 VanDerWaalsContact C-N 3.33Å
468	S	33.7	Very low	42	Very low	50 Å²	50	88 Å²	88	35%	0.35	49%	0.486	S	S	.	.			trans	-130.5	20.6	-178.5	60.3	0	0	0	0	114.8	R38 S464	R38-S468 PolarHBondContact NH1-OG 2.8Å; R38-S468 VanDerWaalsContact NH1-OG 3.08Å; R38-S468 PolarHBondContact NH2-OG 3.45Å; R38-S468 VanDerWaalsContact NH2-OG 3.13Å; S464-S468 PolarHBondContact O-OG 3.48Å
469	M	31.1	Very low	41.3	Very low	230 Å²	230	93 Å²	93	100%	1.133	51%	0.509	S	S	*	.			trans	-121.2	0	154.6	-85.5	-179	133.6	0	0	106.9

Retrieved 469 of 469 residues in 100.3 ms (Link to these results)

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