A0A5K4FBD4_SCHMA Loading...

XK-related protein

AlphaFold DB , UniProt , Accession A0A5K4FBD4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 702 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	45.8	Very low	41.3	Very low	206 Å²	206	109.4 Å²	109.4	100%	1.015	60%	0.599	S	S	*	*				0	-64.1	0	-81.6	175.8	159.5	0	0	113.1	S3 Y4	M1-S3 VanDerWaalsContact C-N 3.27Å; M1-S3 PolarHBondContact O-N 3.22Å; M1-Y4 PolarHBondContact O-N 3.21Å
2	S	40.9	Very low	42	Very low	104 Å²	104	110.3 Å²	110.3	73%	0.727	60%	0.596	S	S	*	*	H	α-helix	trans	-41.1	-44.7	-177	168.8	0	0	0	0	115.8	Y4 Q5	S2-Y4 VanDerWaalsContact C-N 3.26Å; S2-Y4 PolarHBondContact O-N 3.39Å; S2-Q5 PolarHBondContact O-N 2.77Å
3	S	37.5	Very low	42.8	Very low	84 Å²	84	108.3 Å²	108.3	59%	0.587	59%	0.59	S	S	*	*	H	α-helix	trans	-57.8	-28.6	177.8	48.5	0	0	0	0	115.7	M1	M1-S3 VanDerWaalsContact C-N 3.27Å; M1-S3 PolarHBondContact O-N 3.22Å
4	Y	37.9	Very low	43.7	Very low	177 Å²	177	104.8 Å²	104.8	69%	0.694	57%	0.57	S	S	*	*	H	α-helix	trans	-79	-36.6	-176.5	-85	-94.8	0	0	0	113.3	M1 S2 S6 Y7 S8	M1-Y4 PolarHBondContact O-N 3.21Å; S2-Y4 VanDerWaalsContact C-N 3.26Å; S2-Y4 PolarHBondContact O-N 3.39Å; Y4-S6 VanDerWaalsContact C-N 3.28Å; Y4-S6 PolarHBondContact O-N 2.88Å; Y4-Y7 PolarHBondContact O-N 3.32Å; Y4-S8 PolarHBondContact O-N 3.32Å
5	Q	39.2	Very low	44.4	Very low	153 Å²	153	101.1 Å²	101.1	72%	0.715	55%	0.55	S	S	*	.	H	α-helix	trans	-64.9	-33.2	177.7	-75.7	176.1	-42.7	0	0	112.2	S2 Y7 S8 G9	S2-Q5 PolarHBondContact O-N 2.77Å; Q5-Y7 VanDerWaalsContact C-N 3.34Å; Q5-Y7 PolarHBondContact O-N 2.7Å; Q5-S8 PolarHBondContact O-OG 2.86Å; Q5-G9 PolarHBondContact O-N 3.26Å
6	S	38.1	Very low	44.9	Very low	82 Å²	82	99.4 Å²	99.4	57%	0.573	55%	0.547	S	S	*	.	H	α-helix	trans	-62.1	-41.3	174.1	-172	0	0	0	0	111.8	Y4 V10	Y4-S6 VanDerWaalsContact C-N 3.28Å; Y4-S6 PolarHBondContact O-N 2.88Å; S6-V10 WeakPolarHBondContact O-CG2 3.34Å; S6-V10 PolarHBondContact O-N 3.14Å; S6-V10 VanDerWaalsContact O-N 3.14Å
7	Y	40.1	Very low	45.3	Very low	190 Å²	190	95.2 Å²	95.2	75%	0.745	53%	0.527	S	S	*	.	H	α-helix	trans	-71.4	-39.3	-176.8	-128.2	-89	0	0	0	113.2	Y4 Q5 V10 A11	Y4-Y7 PolarHBondContact O-N 3.32Å; Q5-Y7 VanDerWaalsContact C-N 3.34Å; Q5-Y7 PolarHBondContact O-N 2.7Å; Y7-V10 PolarHBondContact O-N 3.03Å; Y7-A11 PolarHBondContact O-N 3.03Å
8	S	42.8	Very low	45.6	Very low	67 Å²	67	90.3 Å²	90.3	47%	0.469	50%	0.501	S	S	.	.	H	α-helix	trans	-68.8	-36.9	176.8	58.5	0	0	0	0	112.4	Y4 Q5 A11 H12	Y4-S8 PolarHBondContact O-N 3.32Å; Q5-S8 PolarHBondContact O-OG 2.86Å; S8-A11 PolarHBondContact O-N 3.33Å; S8-H12 PolarHBondContact O-CD2 3.05Å; S8-H12 PolarHBondContact O-N 2.78Å; S8-H12 VanDerWaalsContact O-N 3.13Å
9	G	39.5	Very low	45.7	Very low	36 Å²	36	88.5 Å²	88.5	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-58.8	-49.4	171.6	0	0	0	0	0	112.2	Q5 A11 H12 T13	Q5-G9 PolarHBondContact O-N 3.26Å; G9-A11 VanDerWaalsContact C-N 3.32Å; G9-A11 PolarHBondContact O-N 2.84Å; G9-H12 PolarHBondContact O-N 3.32Å; G9-T13 PolarHBondContact O-N 3.43Å; G9-T13 PolarHBondContact O-OG1 3.12Å
10	V	46.3	Very low	46	Very low	74 Å²	74	87.2 Å²	87.2	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-39.7	177.8	170.8	0	0	0	0	112	S6 Y7 T13 N14	S6-V10 WeakPolarHBondContact O-CG2 3.34Å; S6-V10 PolarHBondContact O-N 3.14Å; S6-V10 VanDerWaalsContact O-N 3.14Å; Y7-V10 PolarHBondContact O-N 3.03Å; V10-T13 WeakPolarHBondContact CA-OG1 3.06Å; V10-T13 PolarHBondContact O-N 3.28Å; V10-T13 PolarHBondContact O-OG1 3.29Å; V10-N14 WeakPolarHBondContact O-CB 3.47Å; V10-N14 VanDerWaalsContact O-CG 3.23Å; V10-N14 PolarHBondContact O-N 2.7Å; V10-N14 PolarHBondContact O-ND2 3.36Å
11	A	46.5	Very low	46.1	Very low	30 Å²	30	83.5 Å²	83.5	25%	0.248	48%	0.475	C	S	.	.	H	α-helix	trans	-61.2	-48.5	176	0	0	0	0	0	112	Y7 S8 G9 N14 L15 M196	Y7-A11 PolarHBondContact O-N 3.03Å; S8-A11 PolarHBondContact O-N 3.33Å; G9-A11 VanDerWaalsContact C-N 3.32Å; G9-A11 PolarHBondContact O-N 2.84Å; A11-N14 PolarHBondContact O-N 2.86Å; A11-L15 WeakPolarHBondContact O-CB 3.37Å; A11-L15 PolarHBondContact O-N 2.82Å; A11-M196 HydrophobicContact CB-CE 4.43Å
12	H	49.5	Very low	46.2	Very low	121 Å²	121	76.3 Å²	76.3	56%	0.56	45%	0.445	S	S	*	.	H	α-helix	trans	-67.6	-35.2	178.3	-82.3	-71.6	0	0	0	113.6	S8 G9 N14 L15 S16	S8-H12 PolarHBondContact O-CD2 3.05Å; S8-H12 PolarHBondContact O-N 2.78Å; S8-H12 VanDerWaalsContact O-N 3.13Å; G9-H12 PolarHBondContact O-N 3.32Å; H12-N14 VanDerWaalsContact C-N 3.35Å; H12-L15 PolarHBondContact O-N 3.14Å; H12-S16 WeakPolarHBondContact O-CB 3.32Å; H12-S16 PolarHBondContact O-N 3.35Å; H12-S16 PolarHBondContact O-OG 3.05Å
13	T	52.3	Low	46.4	Very low	84 Å²	84	75 Å²	75	52%	0.515	44%	0.441	S	S	.	.	H	α-helix	trans	-67.6	-34.7	172.9	52.6	0	0	0	0	112.4	G9 V10 S16 S17	G9-T13 PolarHBondContact O-N 3.43Å; G9-T13 PolarHBondContact O-OG1 3.12Å; V10-T13 WeakPolarHBondContact CA-OG1 3.06Å; V10-T13 PolarHBondContact O-N 3.28Å; V10-T13 PolarHBondContact O-OG1 3.29Å; T13-S16 WeakPolarHBondContact CA-OG 3.46Å; T13-S16 PolarHBondContact O-OG 3.24Å; T13-S17 WeakPolarHBondContact O-CB 3.35Å; T13-S17 PolarHBondContact O-N 3.14Å
14	N	55.1	Low	47.1	Very low	59 Å²	59	72.5 Å²	72.5	32%	0.316	42%	0.421	S	S	.	.	H	α-helix	trans	-71.3	-37.2	175.2	-73.5	-15.1	0	0	0	111.9	V10 A11 H12 S17 A18	V10-N14 WeakPolarHBondContact O-CB 3.47Å; V10-N14 VanDerWaalsContact O-CG 3.23Å; V10-N14 PolarHBondContact O-N 2.7Å; V10-N14 PolarHBondContact O-ND2 3.36Å; A11-N14 PolarHBondContact O-N 2.86Å; H12-N14 VanDerWaalsContact C-N 3.35Å; N14-S17 WeakPolarHBondContact O-CB 3.34Å; N14-S17 PolarHBondContact O-N 3.32Å; N14-A18 WeakPolarHBondContact O-CB 3.34Å; N14-A18 PolarHBondContact O-N 3.4Å
15	L	54.3	Low	47.7	Very low	50 Å²	50	69.3 Å²	69.3	26%	0.262	42%	0.415	S	S	.	.	H	α-helix	trans	-71.1	-41.4	-180	-155.2	69.3	0	0	0	112	A11 H12 A18 A19 T152 V156	A11-L15 WeakPolarHBondContact O-CB 3.37Å; A11-L15 PolarHBondContact O-N 2.82Å; H12-L15 PolarHBondContact O-N 3.14Å; L15-A18 PolarHBondContact O-N 3.27Å; L15-A19 PolarHBondContact O-N 3.29Å; L15-T152 HydrophobicContact CD1-CG2 4.11Å; L15-V156 HydrophobicContact CD1-CG2 3.86Å; L15-V156 HydrophobicContact CD2-CG2 3.92Å; L15-V156 HydrophobicContact CG-CG2 3.86Å
16	S	52.1	Low	48.4	Very low	73 Å²	73	63.1 Å²	63.1	51%	0.51	39%	0.386	S	S	.	.	H	α-helix	trans	-69.1	-35	172.1	51	0	0	0	0	112.4	H12 T13 A19 S20	H12-S16 WeakPolarHBondContact O-CB 3.32Å; H12-S16 PolarHBondContact O-N 3.35Å; H12-S16 PolarHBondContact O-OG 3.05Å; T13-S16 WeakPolarHBondContact CA-OG 3.46Å; T13-S16 PolarHBondContact O-OG 3.24Å; S16-A19 PolarHBondContact O-N 3.43Å; S16-S20 PolarHBondContact O-N 2.91Å; S16-S20 PolarHBondContact O-OG 2.87Å
17	S	52.5	Low	49.1	Very low	29 Å²	29	59.4 Å²	59.4	20%	0.203	36%	0.361	C	S	.	.	H	α-helix	trans	-59.7	-48.1	168.4	176.9	0	0	0	0	111.3	T13 N14 A19 S20 V21	T13-S17 WeakPolarHBondContact O-CB 3.35Å; T13-S17 PolarHBondContact O-N 3.14Å; N14-S17 WeakPolarHBondContact O-CB 3.34Å; N14-S17 PolarHBondContact O-N 3.32Å; S17-A19 PolarHBondContact O-N 2.85Å; S17-S20 PolarHBondContact O-N 3Å; S17-S20 PolarHBondContact O-OG 3.35Å; S17-V21 WeakPolarHBondContact O-CG2 3.39Å; S17-V21 PolarHBondContact O-N 2.87Å
18	A	50.8	Low	50.1	Low	7 Å²	7	55.4 Å²	55.4	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-59.5	-43	176.7	0	0	0	0	0	112.5	N14 L15 S20 V21 S22 T152	N14-A18 WeakPolarHBondContact O-CB 3.34Å; N14-A18 PolarHBondContact O-N 3.4Å; L15-A18 PolarHBondContact O-N 3.27Å; A18-S20 PolarHBondContact O-N 2.99Å; A18-V21 CarbonylContact O-C 3.58Å; A18-V21 PolarHBondContact O-N 3.02Å; A18-S22 PolarHBondContact O-N 2.88Å; A18-T152 HydrophobicContact CB-CG2 4.16Å
19	A	48.1	Very low	51.1	Low	55 Å²	55	60.8 Å²	60.8	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-62.8	-40.5	174.8	0	0	0	0	0	112.7	L15 S16 S17 V21 S22 A23	L15-A19 PolarHBondContact O-N 3.29Å; S16-A19 PolarHBondContact O-N 3.43Å; S17-A19 PolarHBondContact O-N 2.85Å; A19-V21 VanDerWaalsContact C-N 3.33Å; A19-V21 PolarHBondContact O-N 2.88Å; A19-S22 WeakPolarHBondContact CA-OG 3.06Å; A19-S22 PolarHBondContact O-N 3.28Å; A19-S22 PolarHBondContact O-OG 3.41Å; A19-A23 PolarHBondContact O-N 2.88Å; A19-A23 VanDerWaalsContact O-N 3.14Å
20	S	50.5	Low	52.7	Low	63 Å²	63	59.2 Å²	59.2	44%	0.441	34%	0.343	S	S	.	.	H	α-helix	trans	-65.9	-35.7	173.8	69	0	0	0	0	112.5	S16 S17 A18 A23 D24	S16-S20 PolarHBondContact O-N 2.91Å; S16-S20 PolarHBondContact O-OG 2.87Å; S17-S20 PolarHBondContact O-N 3Å; S17-S20 PolarHBondContact O-OG 3.35Å; A18-S20 PolarHBondContact O-N 2.99Å; S20-A23 PolarHBondContact O-N 3.1Å; S20-D24 PolarHBondContact O-N 3.48Å
21	V	49.1	Very low	54.5	Low	9 Å²	9	57.1 Å²	57.1	6%	0.055	33%	0.33	C	S	.	.	H	α-helix	trans	-68.3	-32.7	173.5	170.9	0	0	0	0	111.8	S17 A18 A19 M149	S17-V21 WeakPolarHBondContact O-CG2 3.39Å; S17-V21 PolarHBondContact O-N 2.87Å; A18-V21 CarbonylContact O-C 3.58Å; A18-V21 PolarHBondContact O-N 3.02Å; A19-V21 VanDerWaalsContact C-N 3.33Å; A19-V21 PolarHBondContact O-N 2.88Å; V21-M149 HydrophobicContact CB-CE 4.2Å; V21-M149 HydrophobicContact CG1-CE 3.78Å
22	S	47	Very low	56.3	Low	55 Å²	55	63.5 Å²	63.5	39%	0.385	35%	0.348	S	S	.	.	H	α-helix	trans	-72.7	-26.1	173.5	65.5	0	0	0	0	114.3	A18 A19	A18-S22 PolarHBondContact O-N 2.88Å; A19-S22 WeakPolarHBondContact CA-OG 3.06Å; A19-S22 PolarHBondContact O-N 3.28Å; A19-S22 PolarHBondContact O-OG 3.41Å
23	A	45.8	Very low	58	Low	78 Å²	78	61.6 Å²	61.6	65%	0.645	34%	0.336	S	S	*	.	H	α-helix	trans	-77	-29.3	178.2	0	0	0	0	0	112.4	A19 S20 L25	A19-A23 PolarHBondContact O-N 2.88Å; A19-A23 VanDerWaalsContact O-N 3.14Å; S20-A23 PolarHBondContact O-N 3.1Å; A23-L25 PolarHBondContact O-N 2.98Å
24	D	51	Low	59.7	Low	31 Å²	31	57.6 Å²	57.6	17%	0.166	31%	0.311	C	S	.	.			trans	-83.7	78.3	-178.4	-153.5	-2.1	0	0	0	111.4	S20 I26 Q297	S20-D24 PolarHBondContact O-N 3.48Å; D24-I26 HydrophobicContact CB-CG1 4.26Å; D24-I26 VanDerWaalsContact CG-CG1 3.48Å; D24-I26 PolarHBondContact O-N 3.07Å; D24-I26 WeakPolarHBondContact OD1-CG1 3.41Å; D24-I26 WeakPolarHBondContact OD2-CD1 3.38Å; D24-Q297 VanDerWaalsContact CG-NE2 3.31Å; D24-Q297 PolarHBondContact OD1-NE2 2.94Å; D24-Q297 PolarHBondContact OD2-NE2 3.49Å; D24-Q297 VanDerWaalsContact OD2-NE2 3.09Å
25	L	51.1	Low	61.5	Low	109 Å²	109	57.7 Å²	57.7	57%	0.571	31%	0.311	S	S	*	.			trans	-67.3	35.1	-178.1	-107.3	150.6	0	0	0	114.7	A23 A27 H28	A23-L25 PolarHBondContact O-N 2.98Å; L25-A27 VanDerWaalsContact C-N 3.27Å; L25-A27 PolarHBondContact O-N 3.48Å; L25-H28 HydrophobicContact CD2-CB 4.13Å; L25-H28 PolarHBondContact O-N 3.35Å
26	I	54.2	Low	63.3	Low	23 Å²	23	59.6 Å²	59.6	12%	0.118	32%	0.321	C	S	.	.	H	α-helix	trans	-48.7	-46.1	-176	-57.2	179.4	0	0	0	111.8	D24 H28 R29 G30 Y291	D24-I26 HydrophobicContact CB-CG1 4.26Å; D24-I26 VanDerWaalsContact CG-CG1 3.48Å; D24-I26 PolarHBondContact O-N 3.07Å; D24-I26 WeakPolarHBondContact OD1-CG1 3.41Å; D24-I26 WeakPolarHBondContact OD2-CD1 3.38Å; I26-H28 VanDerWaalsContact C-N 3.26Å; I26-H28 PolarHBondContact O-N 3.42Å; I26-R29 PolarHBondContact O-N 3.16Å; I26-R29 VanDerWaalsContact O-N 3.16Å; I26-G30 PolarHBondContact O-N 3Å; I26-Y291 HydrophobicContact CD1-CE2 4.42Å
27	A	53.7	Low	65.2	Low	4 Å²	4	56.3 Å²	56.3	3%	0.033	30%	0.298	C	S	.	.	H	α-helix	trans	-52.1	-44.2	-175.4	0	0	0	0	0	112.1	L25 G30 V31 V138 L142	L25-A27 VanDerWaalsContact C-N 3.27Å; L25-A27 PolarHBondContact O-N 3.48Å; A27-G30 PolarHBondContact O-N 3.02Å; A27-V31 WeakPolarHBondContact O-CG2 3.4Å; A27-V31 PolarHBondContact O-N 3.36Å; A27-V138 HydrophobicContact CB-CG1 4.16Å; A27-L142 HydrophobicContact CB-CD2 3.65Å; A27-L142 HydrophobicContact CB-CG 4.02Å
28	H	59.6	Low	67.3	Low	106 Å²	106	56.7 Å²	56.7	49%	0.491	30%	0.297	S	S	.	.	H	α-helix	trans	-73.9	-31.6	-175.6	-134.7	-56.7	0	0	0	113.4	L25 I26	L25-H28 HydrophobicContact CD2-CB 4.13Å; L25-H28 PolarHBondContact O-N 3.35Å; I26-H28 VanDerWaalsContact C-N 3.26Å; I26-H28 PolarHBondContact O-N 3.42Å
29	R	64.1	Low	69.4	Low	180 Å²	180	61.5 Å²	61.5	68%	0.679	32%	0.321	S	S	*	.	H	α-helix	trans	-73.1	-30.1	172.9	-67.7	179.4	174.5	167.3	-1	112	I26	I26-R29 PolarHBondContact O-N 3.16Å; I26-R29 VanDerWaalsContact O-N 3.16Å
30	G	73.7	Confident	71.7	Confident	4 Å²	4	60 Å²	60	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-69.6	-33.2	177.8	0	0	0	0	0	114.4	I26 A27 K34	I26-G30 PolarHBondContact O-N 3Å; A27-G30 PolarHBondContact O-N 3.02Å; G30-K34 WeakPolarHBondContact O-CE 3.34Å
31	V	83.2	Confident	73.9	Confident	30 Å²	30	57 Å²	57	18%	0.182	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-53.4	-176.5	170.1	0	0	0	0	112.4	A27 R33 K34 I35 L135 V138	A27-V31 WeakPolarHBondContact O-CG2 3.4Å; A27-V31 PolarHBondContact O-N 3.36Å; V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 PolarHBondContact O-N 2.93Å; V31-K34 WeakPolarHBondContact O-CB 3.4Å; V31-K34 PolarHBondContact O-N 3.35Å; V31-I35 HydrophobicContact CG1-CD1 3.67Å; V31-I35 HydrophobicContact CG1-CG1 4.27Å; V31-I35 PolarHBondContact O-N 2.91Å; V31-I35 VanDerWaalsContact O-N 3.13Å; V31-L135 HydrophobicContact CB-CD2 4.37Å; V31-L135 HydrophobicContact CG1-CD2 4.06Å; V31-L135 HydrophobicContact CG2-CD2 4.09Å; V31-V138 HydrophobicContact CG2-CG1 3.69Å
32	W	83.9	Confident	76.2	Confident	163 Å²	163	60 Å²	60	62%	0.617	30%	0.298	S	S	*	.	H	α-helix	trans	-56.9	-40.2	-174.5	-76.2	113.7	0	0	0	113.2	K34 I35 I36	W32-K34 VanDerWaalsContact C-N 3.28Å; W32-K34 PolarHBondContact O-N 3.03Å; W32-I35 HydrophobicContact CE3-CD1 4.27Å; W32-I35 PolarHBondContact O-N 2.96Å; W32-I36 WeakPolarHBondContact O-CG1 3.16Å; W32-I36 PolarHBondContact O-N 3.42Å
33	R	85	Confident	78.6	Confident	81 Å²	81	58 Å²	58	31%	0.306	29%	0.286	S	S	.	.	H	α-helix	trans	-58.6	-39.4	176.5	-58	-172.9	-54.6	-176.2	7	112.2	V31 I36 S37	V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 PolarHBondContact O-N 2.93Å; R33-I36 PolarHBondContact O-N 3.15Å; R33-S37 PolarHBondContact O-N 3.34Å; R33-S37 PolarHBondContact O-OG 3.3Å
34	K	89.6	Confident	81	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-73.4	-38.2	-179	-62.1	165.5	-168	173.1	0	111.8	G30 V31 W32 I36 S37 I38 Y131 S134 L135 E217	G30-K34 WeakPolarHBondContact O-CE 3.34Å; V31-K34 WeakPolarHBondContact O-CB 3.4Å; V31-K34 PolarHBondContact O-N 3.35Å; W32-K34 VanDerWaalsContact C-N 3.28Å; W32-K34 PolarHBondContact O-N 3.03Å; K34-I36 VanDerWaalsContact C-N 3.33Å; K34-S37 PolarHBondContact O-N 2.96Å; K34-I38 VanDerWaalsContact O-CG1 3.25Å; K34-I38 WeakPolarHBondContact O-CG1 3.38Å; K34-I38 PolarHBondContact O-N 3.01Å; K34-Y131 HydrophobicContact CB-CD1 3.96Å; K34-Y131 HydrophobicContact CB-CE1 4.49Å; K34-Y131 HydrophobicContact CG-CD1 3.83Å; K34-Y131 HydrophobicContact CG-CE1 4.19Å; K34-S134 WeakPolarHBondContact CE-OG 3.4Å; K34-S134 PolarHBondContact NZ-OG 3.11Å; K34-L135 HydrophobicContact CB-CD2 4.4Å; K34-L135 HydrophobicContact CD-CD2 4.04Å; K34-L135 HydrophobicContact CD-CG 4.24Å; K34-E217 VanDerWaalsContact CE-CD 3.48Å; K34-E217 WeakPolarHBondContact CE-OE1 3.28Å; K34-E217 WeakPolarHBondContact CE-OE2 3.25Å; K34-E217 IonicContact NZ-OE1 3.36Å; K34-E217 PolarHBondContact NZ-OE1 2.72Å; K34-E217 IonicContact NZ-OE2 2.78Å; K34-E217 PolarHBondContact NZ-OE2 3.43Å
35	I	91.5	Very high	83.1	Confident	62 Å²	62	53.3 Å²	53.3	32%	0.318	25%	0.25	S	S	.	.	H	α-helix	trans	-59.8	-47.5	172.9	-64.1	173.1	0	0	0	109.3	V31 W32 S37 I38 I39	V31-I35 HydrophobicContact CG1-CD1 3.67Å; V31-I35 HydrophobicContact CG1-CG1 4.27Å; V31-I35 PolarHBondContact O-N 2.91Å; V31-I35 VanDerWaalsContact O-N 3.13Å; W32-I35 HydrophobicContact CE3-CD1 4.27Å; W32-I35 PolarHBondContact O-N 2.96Å; I35-S37 PolarHBondContact O-N 3.12Å; I35-I38 PolarHBondContact O-N 3.18Å; I35-I39 HydrophobicContact CG2-CD1 3.85Å; I35-I39 VanDerWaalsContact O-CG1 3.29Å; I35-I39 WeakPolarHBondContact O-CG1 3.13Å; I35-I39 PolarHBondContact O-N 2.89Å
36	I	92.3	Very high	85.3	Confident	90 Å²	90	53.4 Å²	53.4	46%	0.462	25%	0.25	S	C	.	.	H	α-helix	trans	-60.2	-46.2	174.9	-66.8	164.5	0	0	0	111.3	W32 R33 K34 I38 I39 I40	W32-I36 WeakPolarHBondContact O-CG1 3.16Å; W32-I36 PolarHBondContact O-N 3.42Å; R33-I36 PolarHBondContact O-N 3.15Å; K34-I36 VanDerWaalsContact C-N 3.33Å; I36-I38 PolarHBondContact O-N 3.22Å; I36-I39 PolarHBondContact O-N 2.81Å; I36-I40 HydrophobicContact CG2-CD1 3.67Å; I36-I40 HydrophobicContact CG2-CG1 4.34Å; I36-I40 WeakPolarHBondContact O-CG1 3.48Å; I36-I40 PolarHBondContact O-N 3.22Å
37	S	93.4	Very high	87.3	Confident	4 Å²	4	53 Å²	53	3%	0.028	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-40.3	176	-62.2	0	0	0	0	113.4	R33 K34 I35 F41 Y131 T274	R33-S37 PolarHBondContact O-N 3.34Å; R33-S37 PolarHBondContact O-OG 3.3Å; K34-S37 PolarHBondContact O-N 2.96Å; I35-S37 PolarHBondContact O-N 3.12Å; S37-F41 WeakPolarHBondContact O-CB 3.31Å; S37-F41 PolarHBondContact O-N 3.21Å; S37-Y131 VanDerWaalsContact CB-CZ 3.41Å; S37-Y131 VanDerWaalsContact CB-OH 3.28Å; S37-Y131 WeakPolarHBondContact CB-OH 3.5Å; S37-Y131 PolarHBondContact OG-OH 3.13Å; S37-T274 WeakPolarHBondContact OG-CG2 3.45Å
38	I	95	Very high	89.3	Confident	37 Å²	37	52.9 Å²	52.9	19%	0.19	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-45.1	175.1	-68.8	161.6	0	0	0	110.2	K34 I35 I36 F41 M42 Y131 L135	K34-I38 VanDerWaalsContact O-CG1 3.25Å; K34-I38 WeakPolarHBondContact O-CG1 3.38Å; K34-I38 PolarHBondContact O-N 3.01Å; I35-I38 PolarHBondContact O-N 3.18Å; I36-I38 PolarHBondContact O-N 3.22Å; I38-F41 PolarHBondContact O-N 2.71Å; I38-M42 HydrophobicContact CG2-CG 4.28Å; I38-M42 WeakPolarHBondContact O-CB 3.47Å; I38-M42 VanDerWaalsContact O-CG 3.27Å; I38-M42 WeakPolarHBondContact O-CG 3.26Å; I38-M42 PolarHBondContact O-N 2.99Å; I38-Y131 HydrophobicContact CD1-CG 4.48Å; I38-Y131 HydrophobicContact CG1-CD2 3.84Å; I38-Y131 HydrophobicContact CG1-CG 4.09Å; I38-L135 HydrophobicContact CD1-CD1 4.1Å
39	I	96.4	Very high	91	Very high	108 Å²	108	52.9 Å²	52.9	55%	0.554	24%	0.243	S	C	*	.	H	α-helix	trans	-62.7	-47.2	180	-68.2	165.1	0	0	0	111	I35 I36 F41 M42 G43	I35-I39 HydrophobicContact CG2-CD1 3.85Å; I35-I39 VanDerWaalsContact O-CG1 3.29Å; I35-I39 WeakPolarHBondContact O-CG1 3.13Å; I35-I39 PolarHBondContact O-N 2.89Å; I36-I39 PolarHBondContact O-N 2.81Å; I39-F41 PolarHBondContact O-N 3.02Å; I39-M42 PolarHBondContact O-N 3.22Å; I39-G43 PolarHBondContact O-N 3.35Å
40	I	96.4	Very high	92.4	Very high	22 Å²	22	46.1 Å²	46.1	11%	0.113	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-42.8	178.6	-67.9	172.5	0	0	0	110.8	I36 G43 F44 L270 W271 T274	I36-I40 HydrophobicContact CG2-CD1 3.67Å; I36-I40 HydrophobicContact CG2-CG1 4.34Å; I36-I40 WeakPolarHBondContact O-CG1 3.48Å; I36-I40 PolarHBondContact O-N 3.22Å; I40-G43 PolarHBondContact O-N 3.28Å; I40-F44 PolarHBondContact O-N 3.2Å; I40-L270 HydrophobicContact CG2-CB 3.9Å; I40-W271 HydrophobicContact CG2-CB 3.95Å; I40-W271 HydrophobicContact CG2-CE3 4.37Å; I40-T274 HydrophobicContact CD1-CG2 4.49Å; I40-T274 WeakPolarHBondContact CD1-OG1 3.28Å
41	F	96.9	Very high	93.3	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.9	-39.8	177.8	176.7	-106	0	0	0	113.1	S37 I38 I39 G43 F44 L45 M125 P127 I128 S227 W271	S37-F41 WeakPolarHBondContact O-CB 3.31Å; S37-F41 PolarHBondContact O-N 3.21Å; I38-F41 PolarHBondContact O-N 2.71Å; I39-F41 PolarHBondContact O-N 3.02Å; F41-G43 VanDerWaalsContact C-N 3.35Å; F41-F44 AromaticContact CD2-CD1 3.87Å; F41-F44 HydrophobicContact CD2-CD1 3.87Å; F41-F44 HydrophobicContact CD2-CE1 4.49Å; F41-F44 AromaticContact CE2-CD1 3.9Å; F41-F44 HydrophobicContact CE2-CD1 3.9Å; F41-F44 HydrophobicContact CE2-CE1 4.1Å; F41-F44 WeakPolarHBondContact O-CB 3.49Å; F41-F44 PolarHBondContact O-N 3.19Å; F41-L45 HydrophobicContact CD1-CD1 4.3Å; F41-L45 HydrophobicContact CE1-CD1 3.47Å; F41-L45 VanDerWaalsContact CE1-CD1 3.47Å; F41-L45 HydrophobicContact CE1-CG 4.05Å; F41-L45 HydrophobicContact CE2-CD1 4.37Å; F41-L45 HydrophobicContact CE2-CD2 4.38Å; F41-L45 HydrophobicContact CE2-CG 4.15Å; F41-L45 HydrophobicContact CZ-CD1 3.52Å; F41-L45 HydrophobicContact CZ-CD2 4.14Å; F41-L45 HydrophobicContact CZ-CG 3.79Å; F41-L45 PolarHBondContact O-N 3.22Å; F41-M125 HydrophobicContact CE1-CB 4.45Å; F41-M125 HydrophobicContact CE1-CG 4.37Å; F41-P127 HydrophobicContact CD2-CG 4.33Å; F41-P127 HydrophobicContact CE1-CB 4.48Å; F41-P127 HydrophobicContact CE1-CG 4.34Å; F41-P127 HydrophobicContact CE2-CG 3.9Å; F41-P127 HydrophobicContact CZ-CB 4.5Å; F41-P127 HydrophobicContact CZ-CG 3.9Å; F41-I128 HydrophobicContact CD1-CD1 3.7Å; F41-I128 HydrophobicContact CD1-CG1 3.52Å; F41-I128 HydrophobicContact CE1-CD1 3.8Å; F41-I128 HydrophobicContact CE1-CG1 3.71Å; F41-S227 WeakPolarHBondContact CE2-OG 3.49Å; F41-W271 HydrophobicContact CB-CD2 4.1Å; F41-W271 HydrophobicContact CB-CE3 3.84Å; F41-W271 HydrophobicContact CB-CH2 4.04Å; F41-W271 HydrophobicContact CB-CZ2 4.26Å; F41-W271 HydrophobicContact CB-CZ3 3.82Å; F41-W271 AromaticContact CD2-CD2 3.96Å; F41-W271 HydrophobicContact CD2-CD2 3.96Å; F41-W271 AromaticContact CD2-CE2 3.43Å; F41-W271 VanDerWaalsContact CD2-CE2 3.43Å; F41-W271 HydrophobicContact CD2-CE3 4.48Å; F41-W271 HydrophobicContact CD2-CG 4.45Å; F41-W271 HydrophobicContact CD2-CH2 4.16Å; F41-W271 AromaticContact CD2-CZ2 3.55Å; F41-W271 HydrophobicContact CD2-CZ2 3.55Å; F41-W271 AromaticContact CD2-NE1 3.6Å; F41-W271 HydrophobicContact CE2-CZ2 4.25Å; F41-W271 HydrophobicContact CG-CH2 4.27Å; F41-W271 HydrophobicContact CG-CZ2 4.11Å
42	M	96.6	Very high	93.8	Very high	72 Å²	72	44.8 Å²	44.8	36%	0.355	22%	0.217	S	C	.	.	H	α-helix	trans	-64.7	-39.9	172.8	-73.8	-68.3	-75.1	0	0	111.3	I38 I39 L45 I46 M125 I128	I38-M42 HydrophobicContact CG2-CG 4.28Å; I38-M42 WeakPolarHBondContact O-CB 3.47Å; I38-M42 VanDerWaalsContact O-CG 3.27Å; I38-M42 WeakPolarHBondContact O-CG 3.26Å; I38-M42 PolarHBondContact O-N 2.99Å; I39-M42 PolarHBondContact O-N 3.22Å; M42-L45 PolarHBondContact O-N 3.04Å; M42-I46 WeakPolarHBondContact O-CB 3.47Å; M42-I46 WeakPolarHBondContact O-CD1 3.24Å; M42-I46 WeakPolarHBondContact O-CG1 3.41Å; M42-I46 PolarHBondContact O-N 3.16Å; M42-M125 HydrophobicContact SD-SD 4.22Å; M42-I128 HydrophobicContact CG-CD1 3.87Å; M42-I128 HydrophobicContact SD-CD1 3.4Å; M42-I128 WeakPolarHBondContact SD-CD1 3.34Å
43	G	96.7	Very high	94.2	Very high	13 Å²	13	40.5 Å²	40.5	13%	0.134	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-45	172.3	0	0	0	0	0	112.5	I39 I40 F41 T47	I39-G43 PolarHBondContact O-N 3.35Å; I40-G43 PolarHBondContact O-N 3.28Å; F41-G43 VanDerWaalsContact C-N 3.35Å; G43-T47 WeakPolarHBondContact O-CB 3.33Å; G43-T47 WeakPolarHBondContact O-CG2 3.38Å; G43-T47 PolarHBondContact O-N 2.92Å; G43-T47 PolarHBondContact O-OG1 3.07Å
44	F	96.6	Very high	94.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-55.8	-54.1	171.4	158.8	-115.8	0	0	0	112.1	I40 F41 I46 T47 S48 L74 Q78 A232 F267 C268 W271	I40-F44 PolarHBondContact O-N 3.2Å; F41-F44 AromaticContact CD2-CD1 3.87Å; F41-F44 HydrophobicContact CD2-CD1 3.87Å; F41-F44 HydrophobicContact CD2-CE1 4.49Å; F41-F44 AromaticContact CE2-CD1 3.9Å; F41-F44 HydrophobicContact CE2-CD1 3.9Å; F41-F44 HydrophobicContact CE2-CE1 4.1Å; F41-F44 WeakPolarHBondContact O-CB 3.49Å; F41-F44 PolarHBondContact O-N 3.19Å; F44-I46 PolarHBondContact O-N 3.23Å; F44-T47 PolarHBondContact O-N 2.84Å; F44-T47 PolarHBondContact O-OG1 3.44Å; F44-T47 VanDerWaalsContact O-OG1 3.07Å; F44-S48 WeakPolarHBondContact CD2-OG 3.5Å; F44-S48 VanDerWaalsContact CE2-OG 3.23Å; F44-S48 WeakPolarHBondContact CE2-OG 3.35Å; F44-S48 WeakPolarHBondContact O-CB 3.4Å; F44-S48 PolarHBondContact O-N 2.91Å; F44-S48 PolarHBondContact O-OG 3.12Å; F44-S48 VanDerWaalsContact O-OG 3.06Å; F44-L74 HydrophobicContact CZ-CD1 4Å; F44-Q78 HydrophobicContact CE1-CG 4.11Å; F44-A232 HydrophobicContact CD2-CB 4Å; F44-A232 HydrophobicContact CE1-CB 4.16Å; F44-A232 HydrophobicContact CE2-CB 3.62Å; F44-A232 HydrophobicContact CG-CB 4.43Å; F44-A232 HydrophobicContact CZ-CB 3.71Å; F44-F267 HydrophobicContact CB-CB 4.38Å; F44-C268 VanDerWaalsContact CD2-SG 3.51Å; F44-W271 HydrophobicContact CB-CB 4.41Å; F44-W271 AromaticContact CD1-CD1 3.9Å
45	L	96.1	Very high	94.2	Very high	12 Å²	12	38.1 Å²	38.1	6%	0.063	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-46.6	-180	-72.4	-176.1	0	0	0	112.8	F41 M42 T47 S48 W49 Q78 M125	F41-L45 HydrophobicContact CD1-CD1 4.3Å; F41-L45 HydrophobicContact CE1-CD1 3.47Å; F41-L45 VanDerWaalsContact CE1-CD1 3.47Å; F41-L45 HydrophobicContact CE1-CG 4.05Å; F41-L45 HydrophobicContact CE2-CD1 4.37Å; F41-L45 HydrophobicContact CE2-CD2 4.38Å; F41-L45 HydrophobicContact CE2-CG 4.15Å; F41-L45 HydrophobicContact CZ-CD1 3.52Å; F41-L45 HydrophobicContact CZ-CD2 4.14Å; F41-L45 HydrophobicContact CZ-CG 3.79Å; F41-L45 PolarHBondContact O-N 3.22Å; M42-L45 PolarHBondContact O-N 3.04Å; L45-T47 VanDerWaalsContact C-N 3.34Å; L45-T47 PolarHBondContact O-N 3.44Å; L45-S48 PolarHBondContact O-N 2.91Å; L45-W49 VanDerWaalsContact O-CD1 3.28Å; L45-W49 PolarHBondContact O-N 2.94Å; L45-Q78 HydrophobicContact CD2-CG 3.96Å; L45-M125 HydrophobicContact CD1-CG 3.7Å
46	I	96.3	Very high	94.1	Very high	110 Å²	110	39 Å²	39	56%	0.564	21%	0.21	S	C	*	.	H	α-helix	trans	-61.8	-44.5	-179	-69.7	165	0	0	0	110.4	M42 F44 W49 A50	M42-I46 WeakPolarHBondContact O-CB 3.47Å; M42-I46 WeakPolarHBondContact O-CD1 3.24Å; M42-I46 WeakPolarHBondContact O-CG1 3.41Å; M42-I46 PolarHBondContact O-N 3.16Å; F44-I46 PolarHBondContact O-N 3.23Å; I46-W49 PolarHBondContact O-N 3.46Å; I46-A50 WeakPolarHBondContact O-CB 3.47Å; I46-A50 PolarHBondContact O-N 3.07Å
47	T	95.8	Very high	93.8	Very high	16 Å²	16	41.4 Å²	41.4	10%	0.098	22%	0.22	C	C	.	.	H	α-helix	trans	-70.4	-38.3	179.9	54.5	0	0	0	0	112.4	G43 F44 L45 W49 A50 T51 I263 F267	G43-T47 WeakPolarHBondContact O-CB 3.33Å; G43-T47 WeakPolarHBondContact O-CG2 3.38Å; G43-T47 PolarHBondContact O-N 2.92Å; G43-T47 PolarHBondContact O-OG1 3.07Å; F44-T47 PolarHBondContact O-N 2.84Å; F44-T47 PolarHBondContact O-OG1 3.44Å; F44-T47 VanDerWaalsContact O-OG1 3.07Å; L45-T47 VanDerWaalsContact C-N 3.34Å; L45-T47 PolarHBondContact O-N 3.44Å; T47-W49 VanDerWaalsContact C-N 3.31Å; T47-W49 PolarHBondContact O-N 2.69Å; T47-A50 PolarHBondContact O-N 2.77Å; T47-T51 WeakPolarHBondContact O-CG2 3.27Å; T47-T51 PolarHBondContact O-N 2.97Å; T47-T51 PolarHBondContact O-OG1 3.24Å; T47-I263 HydrophobicContact CG2-CG2 3.79Å; T47-F267 HydrophobicContact CG2-CD2 3.86Å; T47-F267 HydrophobicContact CG2-CE2 4.3Å
48	S	95.3	Very high	93.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-69.1	-24.3	175.3	-64.1	0	0	0	0	114.2	F44 L45 T51 I52 Y235 C264	F44-S48 WeakPolarHBondContact CD2-OG 3.5Å; F44-S48 VanDerWaalsContact CE2-OG 3.23Å; F44-S48 WeakPolarHBondContact CE2-OG 3.35Å; F44-S48 WeakPolarHBondContact O-CB 3.4Å; F44-S48 PolarHBondContact O-N 2.91Å; F44-S48 PolarHBondContact O-OG 3.12Å; F44-S48 VanDerWaalsContact O-OG 3.06Å; L45-S48 PolarHBondContact O-N 2.91Å; S48-T51 WeakPolarHBondContact CA-OG1 3.28Å; S48-T51 PolarHBondContact O-OG1 2.98Å; S48-I52 VanDerWaalsContact O-CD1 3.3Å; S48-I52 WeakPolarHBondContact O-CD1 3.47Å; S48-I52 VanDerWaalsContact O-CG1 3.28Å; S48-I52 WeakPolarHBondContact O-CG1 3.42Å; S48-Y235 WeakPolarHBondContact CA-OH 3.46Å; S48-Y235 PolarHBondContact O-OH 3.44Å; S48-Y235 VanDerWaalsContact O-OH 3.05Å; S48-Y235 VanDerWaalsContact OG-CE1 3.27Å; S48-Y235 WeakPolarHBondContact OG-CE1 3.44Å; S48-C264 PolarHBondContact OG-SG 3.04Å; S48-C264 VanDerWaalsContact OG-SG 3.32Å
49	W	95.6	Very high	92.5	Very high	106 Å²	106	48.1 Å²	48.1	40%	0.402	25%	0.251	S	S	.	.	H	α-helix	trans	-82.6	-34.9	168	-81.3	105.9	0	0	0	112.3	L45 I46 T47 I52 V53 Y79	L45-W49 VanDerWaalsContact O-CD1 3.28Å; L45-W49 PolarHBondContact O-N 2.94Å; I46-W49 PolarHBondContact O-N 3.46Å; T47-W49 VanDerWaalsContact C-N 3.31Å; T47-W49 PolarHBondContact O-N 2.69Å; W49-I52 HydrophobicContact CE3-CB 4.45Å; W49-I52 HydrophobicContact CE3-CD1 4.37Å; W49-I52 HydrophobicContact CE3-CG2 4.21Å; W49-I52 HydrophobicContact CZ3-CG2 4.24Å; W49-I52 PolarHBondContact O-N 2.94Å; W49-V53 WeakPolarHBondContact O-CG2 3.18Å; W49-V53 PolarHBondContact O-N 3.42Å; W49-Y79 HydrophobicContact CZ2-CE2 4.5Å; W49-Y79 AromaticContact NE1-CZ 3.97Å; W49-Y79 PolarHBondContact NE1-OH 3.43Å
50	A	94.3	Very high	91.7	Very high	38 Å²	38	46 Å²	46	31%	0.314	24%	0.244	S	C	.	.	H	α-helix	trans	-62.8	-42.3	175.2	0	0	0	0	0	112.4	I46 T47 V53 L54 I260	I46-A50 WeakPolarHBondContact O-CB 3.47Å; I46-A50 PolarHBondContact O-N 3.07Å; T47-A50 PolarHBondContact O-N 2.77Å; A50-V53 PolarHBondContact O-N 2.88Å; A50-L54 WeakPolarHBondContact O-CG 3.27Å; A50-L54 PolarHBondContact O-N 3.49Å; A50-I260 HydrophobicContact CB-CG2 4.2Å
51	T	92.5	Very high	90.8	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-46	172.8	49.6	0	0	0	0	111.7	T47 S48 V53 L54 H55 Y235 I260 L261 C264	T47-T51 WeakPolarHBondContact O-CG2 3.27Å; T47-T51 PolarHBondContact O-N 2.97Å; T47-T51 PolarHBondContact O-OG1 3.24Å; S48-T51 WeakPolarHBondContact CA-OG1 3.28Å; S48-T51 PolarHBondContact O-OG1 2.98Å; T51-V53 VanDerWaalsContact C-N 3.33Å; T51-V53 PolarHBondContact O-N 3.39Å; T51-L54 WeakPolarHBondContact O-CB 3.21Å; T51-L54 PolarHBondContact O-N 3.46Å; T51-L54 VanDerWaalsContact O-N 3.12Å; T51-H55 PolarHBondContact O-CD2 3Å; T51-H55 PolarHBondContact O-N 2.91Å; T51-Y235 PolarHBondContact OG1-OH 3.31Å; T51-I260 HydrophobicContact CG2-CG2 3.85Å; T51-L261 HydrophobicContact CG2-CD2 3.69Å; T51-L261 HydrophobicContact CG2-CG 4.44Å; T51-C264 HydrophobicContact CG2-CB 3.76Å
52	I	93.1	Very high	89.5	Confident	6 Å²	6	57 Å²	57	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-58	-45.5	175.1	-73.1	169.8	0	0	0	110.8	S48 W49 L54 H55 V56 L67 I71 L74	S48-I52 VanDerWaalsContact O-CD1 3.3Å; S48-I52 WeakPolarHBondContact O-CD1 3.47Å; S48-I52 VanDerWaalsContact O-CG1 3.28Å; S48-I52 WeakPolarHBondContact O-CG1 3.42Å; W49-I52 HydrophobicContact CE3-CB 4.45Å; W49-I52 HydrophobicContact CE3-CD1 4.37Å; W49-I52 HydrophobicContact CE3-CG2 4.21Å; W49-I52 HydrophobicContact CZ3-CG2 4.24Å; W49-I52 PolarHBondContact O-N 2.94Å; I52-L54 VanDerWaalsContact C-N 3.33Å; I52-L54 PolarHBondContact O-N 3.4Å; I52-H55 PolarHBondContact O-N 3.32Å; I52-V56 WeakPolarHBondContact O-CG2 3.29Å; I52-V56 PolarHBondContact O-N 3.4Å; I52-V56 VanDerWaalsContact O-N 3.15Å; I52-L67 HydrophobicContact CG2-CD1 3.99Å; I52-I71 HydrophobicContact CD1-CG1 4.02Å; I52-I71 HydrophobicContact CG1-CG1 4.28Å; I52-I71 HydrophobicContact CG2-CD1 4.17Å; I52-I71 HydrophobicContact CG2-CG1 3.92Å; I52-L74 HydrophobicContact CD1-CD2 3.61Å
53	V	92.6	Very high	88.8	Confident	73 Å²	73	53.5 Å²	53.5	44%	0.442	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-39	175.6	169.6	0	0	0	0	111.6	W49 A50 T51 V56 M57	W49-V53 WeakPolarHBondContact O-CG2 3.18Å; W49-V53 PolarHBondContact O-N 3.42Å; A50-V53 PolarHBondContact O-N 2.88Å; T51-V53 VanDerWaalsContact C-N 3.33Å; T51-V53 PolarHBondContact O-N 3.39Å; V53-V56 CarbonylContact O-C 3.58Å; V53-V56 PolarHBondContact O-N 2.94Å; V53-M57 HydrophobicContact CG1-CG 4.21Å; V53-M57 HydrophobicContact CG1-SD 3.89Å; V53-M57 WeakPolarHBondContact O-CG 3.41Å; V53-M57 PolarHBondContact O-N 2.9Å
54	L	88.6	Confident	88.3	Confident	26 Å²	26	56 Å²	56	14%	0.136	30%	0.295	C	S	.	.	H	α-helix	trans	-64.4	-39.5	174.2	-71.6	173.3	0	0	0	113.1	A50 T51 I52 V56 M57 N58 T257 I260	A50-L54 WeakPolarHBondContact O-CG 3.27Å; A50-L54 PolarHBondContact O-N 3.49Å; T51-L54 WeakPolarHBondContact O-CB 3.21Å; T51-L54 PolarHBondContact O-N 3.46Å; T51-L54 VanDerWaalsContact O-N 3.12Å; I52-L54 VanDerWaalsContact C-N 3.33Å; I52-L54 PolarHBondContact O-N 3.4Å; L54-V56 PolarHBondContact O-N 3.43Å; L54-M57 PolarHBondContact O-N 3.43Å; L54-N58 WeakPolarHBondContact O-CB 3.43Å; L54-N58 PolarHBondContact O-N 2.87Å; L54-T257 HydrophobicContact CB-CG2 4.43Å; L54-T257 HydrophobicContact CD1-CG2 4.17Å; L54-I260 HydrophobicContact CD1-CB 3.72Å; L54-I260 HydrophobicContact CD1-CD1 3.76Å; L54-I260 HydrophobicContact CD1-CG1 4.31Å; L54-I260 HydrophobicContact CD1-CG2 3.65Å
55	H	86	Confident	87.8	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.019	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-22.8	174.9	-65.2	-74.3	0	0	0	112.8	T51 I52 S63 E66 L67	T51-H55 PolarHBondContact O-CD2 3Å; T51-H55 PolarHBondContact O-N 2.91Å; I52-H55 PolarHBondContact O-N 3.32Å; H55-S63 PolarHBondContact O-OG 3.17Å; H55-S63 VanDerWaalsContact O-OG 3.14Å; H55-E66 IonicContact CE1-OE2 3.3Å; H55-E66 PolarHBondContact CE1-OE2 3.21Å; H55-E66 VanDerWaalsContact CE1-OE2 3.3Å; H55-E66 IonicContact ND1-OE2 2.96Å; H55-E66 PolarHBondContact ND1-OE2 2.76Å; H55-L67 HydrophobicContact CB-CB 4.12Å; H55-L67 HydrophobicContact CB-CD1 4.11Å
56	V	89	Confident	87.4	Confident	81 Å²	81	59.7 Å²	59.7	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-83.1	-37.4	171.5	176.8	0	0	0	0	112.5	I52 V53 L54 F59 L67	I52-V56 WeakPolarHBondContact O-CG2 3.29Å; I52-V56 PolarHBondContact O-N 3.4Å; I52-V56 VanDerWaalsContact O-N 3.15Å; V53-V56 CarbonylContact O-C 3.58Å; V53-V56 PolarHBondContact O-N 2.94Å; L54-V56 PolarHBondContact O-N 3.43Å; V56-F59 WeakPolarHBondContact O-CB 3.3Å; V56-L67 HydrophobicContact CG2-CD1 3.55Å; V56-L67 HydrophobicContact CG2-CD2 3.8Å; V56-L67 HydrophobicContact CG2-CG 4.34Å
57	M	87	Confident	87.2	Confident	140 Å²	140	55.7 Å²	55.7	69%	0.69	29%	0.294	S	S	*	.	H	α-helix	trans	-72.6	-44.1	177.5	-72.6	-179.8	66.9	0	0	111.5	V53 L54 F59	V53-M57 HydrophobicContact CG1-CG 4.21Å; V53-M57 HydrophobicContact CG1-SD 3.89Å; V53-M57 WeakPolarHBondContact O-CG 3.41Å; V53-M57 PolarHBondContact O-N 2.9Å; L54-M57 PolarHBondContact O-N 3.43Å; M57-F59 PolarHBondContact O-N 3.44Å
58	N	81.8	Confident	87.1	Confident	68 Å²	68	57.6 Å²	57.6	36%	0.364	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	44.5	175.2	-59.5	-35.1	0	0	0	110.5	L54 T60 T257	L54-N58 WeakPolarHBondContact O-CB 3.43Å; L54-N58 PolarHBondContact O-N 2.87Å; N58-T60 PolarHBondContact O-N 3.05Å; N58-T257 PolarHBondContact ND2-OG1 2.78Å
59	F	79.4	Confident	86.9	Confident	114 Å²	114	59.8 Å²	59.8	50%	0.5	32%	0.32	S	S	.	.			trans	-69.3	120.2	-173.4	-169.5	-98.2	0	0	0	111.8	V56 M57 S63 T64 L67	V56-F59 WeakPolarHBondContact O-CB 3.3Å; M57-F59 PolarHBondContact O-N 3.44Å; F59-S63 WeakPolarHBondContact CA-OG 3.32Å; F59-T64 WeakPolarHBondContact CZ-OG1 3.45Å; F59-L67 HydrophobicContact CD2-CD2 4.24Å; F59-L67 HydrophobicContact CE2-CD2 4.11Å
60	T	78.9	Confident	86.9	Confident	65 Å²	65	54.7 Å²	54.7	40%	0.399	30%	0.301	S	S	.	.			trans	-129.7	163.7	170.3	70.6	0	0	0	0	108.6	N58 E62 S63 T64	N58-T60 PolarHBondContact O-N 3.05Å; T60-E62 PolarHBondContact O-N 3.1Å; T60-E62 PolarHBondContact OG1-N 2.86Å; T60-S63 PolarHBondContact N-OG 2.92Å; T60-S63 PolarHBondContact O-N 2.86Å; T60-S63 PolarHBondContact O-OG 3.09Å; T60-S63 PolarHBondContact OG1-N 3.39Å; T60-S63 VanDerWaalsContact OG1-N 3.14Å; T60-T64 PolarHBondContact O-N 3.32Å; T60-T64 PolarHBondContact O-OG1 2.69Å
61	N	77	Confident	86.9	Confident	151 Å²	151	55.7 Å²	55.7	81%	0.807	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-32.8	174.7	-68.7	-16.5	0	0	0	112	T64	N61-T64 VanDerWaalsContact O-CB 3.28Å; N61-T64 WeakPolarHBondContact O-CB 3.48Å; N61-T64 PolarHBondContact O-OG1 2.94Å
62	E	71.4	Confident	87.1	Confident	100 Å²	100	59 Å²	59	47%	0.467	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-37.4	177.9	-55.5	-178.5	142.3	0	0	113.1	T60 T64 L65 F251	T60-E62 PolarHBondContact O-N 3.1Å; T60-E62 PolarHBondContact OG1-N 2.86Å; E62-T64 PolarHBondContact O-N 3.39Å; E62-L65 PolarHBondContact O-N 3.46Å; E62-F251 WeakPolarHBondContact OE1-CZ 3.18Å; E62-F251 WeakPolarHBondContact OE2-CE1 3.13Å; E62-F251 WeakPolarHBondContact OE2-CZ 3.33Å
63	S	80.7	Confident	87.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-66	-18.2	176.7	87.3	0	0	0	0	112.7	H55 F59 T60 L65 E66 L67	H55-S63 PolarHBondContact O-OG 3.17Å; H55-S63 VanDerWaalsContact O-OG 3.14Å; F59-S63 WeakPolarHBondContact CA-OG 3.32Å; T60-S63 PolarHBondContact N-OG 2.92Å; T60-S63 PolarHBondContact O-N 2.86Å; T60-S63 PolarHBondContact O-OG 3.09Å; T60-S63 PolarHBondContact OG1-N 3.39Å; T60-S63 VanDerWaalsContact OG1-N 3.14Å; S63-L65 PolarHBondContact O-N 2.91Å; S63-E66 WeakPolarHBondContact O-CB 3.33Å; S63-E66 PolarHBondContact O-N 3.43Å; S63-L67 VanDerWaalsContact O-CB 3.27Å; S63-L67 WeakPolarHBondContact O-CB 3.36Å; S63-L67 PolarHBondContact O-N 3.46Å
64	T	86.9	Confident	87.4	Confident	65 Å²	65	57 Å²	57	40%	0.399	31%	0.312	S	S	.	.	H	α-helix	trans	-49.3	-42	169.9	-45.6	0	0	0	0	112.6	F59 T60 N61 E62 S68	F59-T64 WeakPolarHBondContact CZ-OG1 3.45Å; T60-T64 PolarHBondContact O-N 3.32Å; T60-T64 PolarHBondContact O-OG1 2.69Å; N61-T64 VanDerWaalsContact O-CB 3.28Å; N61-T64 WeakPolarHBondContact O-CB 3.48Å; N61-T64 PolarHBondContact O-OG1 2.94Å; E62-T64 PolarHBondContact O-N 3.39Å; T64-S68 VanDerWaalsContact O-CB 3.28Å; T64-S68 WeakPolarHBondContact O-CB 3.4Å; T64-S68 PolarHBondContact O-N 2.93Å; T64-S68 PolarHBondContact O-OG 3.32Å
65	L	86.6	Confident	87.7	Confident	77 Å²	77	59 Å²	59	40%	0.403	32%	0.322	S	S	.	.	H	α-helix	trans	-69.8	-41	178.3	179.7	63	0	0	0	111.3	E62 S63 S68 V69 R245	E62-L65 PolarHBondContact O-N 3.46Å; S63-L65 PolarHBondContact O-N 2.91Å; L65-S68 WeakPolarHBondContact CA-OG 3.3Å; L65-S68 PolarHBondContact O-OG 2.97Å; L65-S68 VanDerWaalsContact O-OG 3.1Å; L65-V69 HydrophobicContact CD1-CG2 4.09Å; L65-V69 HydrophobicContact CG-CG2 4.49Å; L65-V69 VanDerWaalsContact O-CB 3.31Å; L65-V69 WeakPolarHBondContact O-CB 3.39Å; L65-V69 VanDerWaalsContact O-CG2 3.22Å; L65-V69 WeakPolarHBondContact O-CG2 3.22Å; L65-V69 PolarHBondContact O-N 3.28Å; L65-R245 VanDerWaalsContact CD2-NH1 3.27Å
66	E	87	Confident	88.2	Confident	13 Å²	13	60.8 Å²	60.8	6%	0.061	34%	0.338	C	S	.	.	H	α-helix	trans	-68.1	-44.3	-178.3	-49.5	-171.5	137.4	0	0	111.7	H55 S63 S70 L242 R246	H55-E66 IonicContact CE1-OE2 3.3Å; H55-E66 PolarHBondContact CE1-OE2 3.21Å; H55-E66 VanDerWaalsContact CE1-OE2 3.3Å; H55-E66 IonicContact ND1-OE2 2.96Å; H55-E66 PolarHBondContact ND1-OE2 2.76Å; S63-E66 WeakPolarHBondContact O-CB 3.33Å; S63-E66 PolarHBondContact O-N 3.43Å; E66-S70 WeakPolarHBondContact O-CB 3.25Å; E66-S70 PolarHBondContact O-N 3.28Å; E66-S70 PolarHBondContact O-OG 2.92Å; E66-L242 HydrophobicContact CB-CD1 3.97Å; E66-L242 HydrophobicContact CG-CD1 4.41Å; E66-L242 HydrophobicContact CG-CD2 4.15Å; E66-R246 VanDerWaalsContact CD-NE 3.29Å; E66-R246 WeakPolarHBondContact OE1-CD 3.31Å; E66-R246 WeakPolarHBondContact OE1-CG 3.28Å; E66-R246 IonicContact OE1-CZ 3.58Å; E66-R246 IonicContact OE1-NE 2.72Å; E66-R246 PolarHBondContact OE1-NE 3.37Å; E66-R246 IonicContact OE1-NH2 3.67Å; E66-R246 IonicContact OE2-CZ 3.33Å; E66-R246 IonicContact OE2-NE 3.11Å; E66-R246 PolarHBondContact OE2-NE 2.94Å; E66-R246 VanDerWaalsContact OE2-NE 3.11Å; E66-R246 IonicContact OE2-NH2 2.7Å; E66-R246 PolarHBondContact OE2-NH2 3.45Å
67	L	91.3	Very high	88.4	Confident	26 Å²	26	57 Å²	57	14%	0.136	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-49.6	176.2	-179	60.6	0	0	0	110.9	I52 H55 V56 F59 S63 S70 I71	I52-L67 HydrophobicContact CG2-CD1 3.99Å; H55-L67 HydrophobicContact CB-CB 4.12Å; H55-L67 HydrophobicContact CB-CD1 4.11Å; V56-L67 HydrophobicContact CG2-CD1 3.55Å; V56-L67 HydrophobicContact CG2-CD2 3.8Å; V56-L67 HydrophobicContact CG2-CG 4.34Å; F59-L67 HydrophobicContact CD2-CD2 4.24Å; F59-L67 HydrophobicContact CE2-CD2 4.11Å; S63-L67 VanDerWaalsContact O-CB 3.27Å; S63-L67 WeakPolarHBondContact O-CB 3.36Å; S63-L67 PolarHBondContact O-N 3.46Å; L67-S70 PolarHBondContact O-N 2.96Å; L67-I71 HydrophobicContact CD1-CD1 3.58Å; L67-I71 HydrophobicContact CD1-CG1 4.15Å; L67-I71 HydrophobicContact CG-CD1 3.9Å; L67-I71 WeakPolarHBondContact O-CB 3.45Å; L67-I71 VanDerWaalsContact O-CG1 3.29Å; L67-I71 WeakPolarHBondContact O-CG1 3.35Å; L67-I71 PolarHBondContact O-N 3.24Å
68	S	93.1	Very high	88.8	Confident	55 Å²	55	50.4 Å²	50.4	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-66.1	-40.3	179.5	56.3	0	0	0	0	112.6	T64 L65 S72	T64-S68 VanDerWaalsContact O-CB 3.28Å; T64-S68 WeakPolarHBondContact O-CB 3.4Å; T64-S68 PolarHBondContact O-N 2.93Å; T64-S68 PolarHBondContact O-OG 3.32Å; L65-S68 WeakPolarHBondContact CA-OG 3.3Å; L65-S68 PolarHBondContact O-OG 2.97Å; L65-S68 VanDerWaalsContact O-OG 3.1Å; S68-S72 WeakPolarHBondContact O-CB 3.45Å; S68-S72 PolarHBondContact O-N 3.27Å; S68-S72 PolarHBondContact O-OG 3Å
69	V	93	Very high	89.5	Confident	46 Å²	46	49.4 Å²	49.4	28%	0.279	27%	0.274	S	S	.	.	H	α-helix	trans	-64.1	-48.4	172.9	168.5	0	0	0	0	111	L65 I71 S72 V73 L242	L65-V69 HydrophobicContact CD1-CG2 4.09Å; L65-V69 HydrophobicContact CG-CG2 4.49Å; L65-V69 VanDerWaalsContact O-CB 3.31Å; L65-V69 WeakPolarHBondContact O-CB 3.39Å; L65-V69 VanDerWaalsContact O-CG2 3.22Å; L65-V69 WeakPolarHBondContact O-CG2 3.22Å; L65-V69 PolarHBondContact O-N 3.28Å; V69-I71 PolarHBondContact O-N 3.39Å; V69-S72 PolarHBondContact O-N 2.93Å; V69-V73 HydrophobicContact CG1-CG2 4.23Å; V69-V73 WeakPolarHBondContact O-CB 3.43Å; V69-V73 VanDerWaalsContact O-CG2 3.28Å; V69-V73 WeakPolarHBondContact O-CG2 3.48Å; V69-V73 PolarHBondContact O-N 3.29Å; V69-L242 HydrophobicContact CG1-CD1 4.32Å
70	S	93.9	Very high	90.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-47.6	-178.6	-61.7	0	0	0	0	112.2	E66 L67 L74 Y235 Q239	E66-S70 WeakPolarHBondContact O-CB 3.25Å; E66-S70 PolarHBondContact O-N 3.28Å; E66-S70 PolarHBondContact O-OG 2.92Å; L67-S70 PolarHBondContact O-N 2.96Å; S70-L74 VanDerWaalsContact O-CB 3.27Å; S70-L74 WeakPolarHBondContact O-CB 3.34Å; S70-L74 PolarHBondContact O-N 3.23Å; S70-L74 VanDerWaalsContact O-N 3.08Å; S70-Y235 WeakPolarHBondContact O-CE2 3.23Å; S70-Q239 PolarHBondContact OG-NE2 3.17Å
71	I	95.5	Very high	90.9	Very high	58 Å²	58	48.5 Å²	48.5	30%	0.297	27%	0.271	S	S	.	.	H	α-helix	trans	-63.4	-48.2	176.2	-70.9	174.2	0	0	0	110.4	I52 L67 V69 V73 L74 I75	I52-I71 HydrophobicContact CD1-CG1 4.02Å; I52-I71 HydrophobicContact CG1-CG1 4.28Å; I52-I71 HydrophobicContact CG2-CD1 4.17Å; I52-I71 HydrophobicContact CG2-CG1 3.92Å; L67-I71 HydrophobicContact CD1-CD1 3.58Å; L67-I71 HydrophobicContact CD1-CG1 4.15Å; L67-I71 HydrophobicContact CG-CD1 3.9Å; L67-I71 WeakPolarHBondContact O-CB 3.45Å; L67-I71 VanDerWaalsContact O-CG1 3.29Å; L67-I71 WeakPolarHBondContact O-CG1 3.35Å; L67-I71 PolarHBondContact O-N 3.24Å; V69-I71 PolarHBondContact O-N 3.39Å; I71-V73 PolarHBondContact O-N 2.97Å; I71-L74 PolarHBondContact O-N 2.9Å; I71-I75 HydrophobicContact CG2-CD1 3.6Å; I71-I75 HydrophobicContact CG2-CG1 4.32Å; I71-I75 WeakPolarHBondContact O-CB 3.21Å; I71-I75 WeakPolarHBondContact O-CG1 3.27Å; I71-I75 PolarHBondContact O-N 3.47Å
72	S	96	Very high	91.8	Very high	72 Å²	72	41.3 Å²	41.3	50%	0.503	23%	0.232	S	C	.	.	H	α-helix	trans	-63.1	-44.8	-176.4	-61	0	0	0	0	112.2	S68 V69 A76	S68-S72 WeakPolarHBondContact O-CB 3.45Å; S68-S72 PolarHBondContact O-N 3.27Å; S68-S72 PolarHBondContact O-OG 3Å; V69-S72 PolarHBondContact O-N 2.93Å; S72-A76 WeakPolarHBondContact O-CB 3.3Å; S72-A76 PolarHBondContact O-N 3.09Å
73	V	95.6	Very high	92.8	Very high	36 Å²	36	37.1 Å²	37.1	22%	0.218	22%	0.216	C	C	.	.	H	α-helix	trans	-67.9	-43.9	179.9	175.5	0	0	0	0	110.9	V69 I71 G77 P234 Y235	V69-V73 HydrophobicContact CG1-CG2 4.23Å; V69-V73 WeakPolarHBondContact O-CB 3.43Å; V69-V73 VanDerWaalsContact O-CG2 3.28Å; V69-V73 WeakPolarHBondContact O-CG2 3.48Å; V69-V73 PolarHBondContact O-N 3.29Å; I71-V73 PolarHBondContact O-N 2.97Å; V73-G77 PolarHBondContact O-N 3.39Å; V73-P234 HydrophobicContact CG1-CB 3.84Å; V73-Y235 HydrophobicContact CG1-CD2 4.37Å
74	L	96	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-49	178.2	-172.8	63.8	0	0	0	111.5	F44 I52 S70 I71 Q78 Y79 Y235	F44-L74 HydrophobicContact CZ-CD1 4Å; I52-L74 HydrophobicContact CD1-CD2 3.61Å; S70-L74 VanDerWaalsContact O-CB 3.27Å; S70-L74 WeakPolarHBondContact O-CB 3.34Å; S70-L74 PolarHBondContact O-N 3.23Å; S70-L74 VanDerWaalsContact O-N 3.08Å; I71-L74 PolarHBondContact O-N 2.9Å; L74-Q78 HydrophobicContact CD1-CB 4.04Å; L74-Q78 WeakPolarHBondContact O-CA 3.28Å; L74-Q78 VanDerWaalsContact O-CB 3.26Å; L74-Q78 WeakPolarHBondContact O-CB 3.18Å; L74-Q78 PolarHBondContact O-N 2.79Å; L74-Y79 HydrophobicContact CD2-CE2 4.48Å; L74-Y79 HydrophobicContact CG-CE2 4.13Å; L74-Y235 HydrophobicContact CB-CD2 3.86Å; L74-Y235 HydrophobicContact CB-CE2 3.86Å; L74-Y235 HydrophobicContact CD1-CD2 4.25Å; L74-Y235 HydrophobicContact CD1-CE2 4.39Å; L74-Y235 HydrophobicContact CG-CE2 4.48Å
75	I	96.4	Very high	93.6	Very high	67 Å²	67	39.9 Å²	39.9	34%	0.344	23%	0.228	S	C	.	.	I	π-helix	trans	-66.6	-46.8	-179.3	-67.4	-179.8	0	0	0	110.9	I71 Y79 I80	I71-I75 HydrophobicContact CG2-CD1 3.6Å; I71-I75 HydrophobicContact CG2-CG1 4.32Å; I71-I75 WeakPolarHBondContact O-CB 3.21Å; I71-I75 WeakPolarHBondContact O-CG1 3.27Å; I71-I75 PolarHBondContact O-N 3.47Å; I75-Y79 WeakPolarHBondContact O-CB 3.31Å; I75-Y79 PolarHBondContact O-N 3.26Å; I75-I80 HydrophobicContact CG2-CD1 3.88Å; I75-I80 HydrophobicContact CG2-CG1 4.14Å; I75-I80 PolarHBondContact O-N 3.42Å
76	A	95.9	Very high	93.9	Very high	42 Å²	42	36.4 Å²	36.4	35%	0.347	21%	0.21	S	C	.	.	I	π-helix	trans	-62.7	-49.2	-179.3	0	0	0	0	0	112.1	S72 I81	S72-A76 WeakPolarHBondContact O-CB 3.3Å; S72-A76 PolarHBondContact O-N 3.09Å; A76-I81 WeakPolarHBondContact O-CB 3.47Å; A76-I81 WeakPolarHBondContact O-CD1 3.33Å; A76-I81 VanDerWaalsContact O-CG1 3.25Å; A76-I81 WeakPolarHBondContact O-CG1 3.29Å; A76-I81 PolarHBondContact O-N 3.33Å
77	G	93.7	Very high	94.1	Very high	3 Å²	3	37.5 Å²	37.5	3%	0.031	22%	0.224	C	C	.	.	I	π-helix	trans	-76.4	-55.1	-176.4	0	0	0	0	0	114	V73 T82 I230	V73-G77 PolarHBondContact O-N 3.39Å; G77-T82 PolarHBondContact O-N 3.34Å; G77-T82 VanDerWaalsContact O-N 3.15Å; G77-T82 PolarHBondContact O-OG1 3.24Å; G77-I230 WeakPolarHBondContact CA-O 3.31Å
78	Q	95.1	Very high	94.1	Very high	1 Å²	1	40 Å²	40	1%	0.005	24%	0.237	C	C	.	.	I	π-helix	trans	-86.6	-32.4	-168.9	-174.1	55.7	43.6	0	0	113.8	F44 L45 L74 T82 G124 S227	F44-Q78 HydrophobicContact CE1-CG 4.11Å; L45-Q78 HydrophobicContact CD2-CG 3.96Å; L74-Q78 HydrophobicContact CD1-CB 4.04Å; L74-Q78 WeakPolarHBondContact O-CA 3.28Å; L74-Q78 VanDerWaalsContact O-CB 3.26Å; L74-Q78 WeakPolarHBondContact O-CB 3.18Å; L74-Q78 PolarHBondContact O-N 2.79Å; Q78-T82 WeakPolarHBondContact O-CB 3.28Å; Q78-G124 PolarHBondContact NE2-O 3.39Å; Q78-S227 VanDerWaalsContact CD-OG 3.25Å; Q78-S227 PolarHBondContact NE2-OG 2.64Å; Q78-S227 VanDerWaalsContact NE2-OG 3.08Å; Q78-S227 PolarHBondContact OE1-O 3.07Å; Q78-S227 PolarHBondContact OE1-OG 3.44Å
79	Y	95.6	Very high	93.8	Very high	46 Å²	46	38.5 Å²	38.5	18%	0.18	23%	0.225	C	C	.	.	I	π-helix	trans	-93.8	-56.7	-179.6	-69.5	-110.4	0	0	0	110.8	W49 L74 I75 G83 V122 L123	W49-Y79 HydrophobicContact CZ2-CE2 4.5Å; W49-Y79 AromaticContact NE1-CZ 3.97Å; W49-Y79 PolarHBondContact NE1-OH 3.43Å; L74-Y79 HydrophobicContact CD2-CE2 4.48Å; L74-Y79 HydrophobicContact CG-CE2 4.13Å; I75-Y79 WeakPolarHBondContact O-CB 3.31Å; I75-Y79 PolarHBondContact O-N 3.26Å; Y79-G83 PolarHBondContact O-N 2.93Å; Y79-V122 WeakPolarHBondContact CD1-O 3.28Å; Y79-L123 WeakPolarHBondContact CE1-O 3.35Å; Y79-L123 PolarHBondContact OH-O 3.49Å
80	I	95.6	Very high	93.6	Very high	91 Å²	91	38.5 Å²	38.5	47%	0.467	22%	0.22	S	C	.	.	I	π-helix	trans	-76	-65.6	-173.1	-61.4	174.6	0	0	0	111.5	I75 G83 I84	I75-I80 HydrophobicContact CG2-CD1 3.88Å; I75-I80 HydrophobicContact CG2-CG1 4.14Å; I75-I80 PolarHBondContact O-N 3.42Å; I80-G83 PolarHBondContact O-N 3.32Å; I80-I84 HydrophobicContact CG2-CD1 3.73Å; I80-I84 VanDerWaalsContact O-CG1 3.3Å; I80-I84 WeakPolarHBondContact O-CG1 3.22Å; I80-I84 PolarHBondContact O-N 2.91Å
81	I	93.6	Very high	93.2	Very high	70 Å²	70	46.3 Å²	46.3	36%	0.359	25%	0.25	S	C	.	.	I	π-helix	trans	-66.8	-46.3	-171.1	-64	163.1	0	0	0	111.2	A76 G83 I84 V85 I230	A76-I81 WeakPolarHBondContact O-CB 3.47Å; A76-I81 WeakPolarHBondContact O-CD1 3.33Å; A76-I81 VanDerWaalsContact O-CG1 3.25Å; A76-I81 WeakPolarHBondContact O-CG1 3.29Å; A76-I81 PolarHBondContact O-N 3.33Å; I81-G83 VanDerWaalsContact C-N 3.28Å; I81-G83 PolarHBondContact O-N 3.49Å; I81-I84 PolarHBondContact O-N 3.39Å; I81-V85 WeakPolarHBondContact O-CG2 3.23Å; I81-V85 PolarHBondContact O-N 2.93Å; I81-I230 HydrophobicContact CB-CG2 4.19Å; I81-I230 HydrophobicContact CD1-CG2 3.88Å; I81-I230 HydrophobicContact CG2-CD1 3.88Å; I81-I230 HydrophobicContact CG2-CG2 3.97Å
82	T	93.8	Very high	92.8	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-38.5	176.2	-59.4	0	0	0	0	111.6	G77 Q78 V85 D86 A126 I223	G77-T82 PolarHBondContact O-N 3.34Å; G77-T82 VanDerWaalsContact O-N 3.15Å; G77-T82 PolarHBondContact O-OG1 3.24Å; Q78-T82 WeakPolarHBondContact O-CB 3.28Å; T82-V85 PolarHBondContact O-N 2.96Å; T82-D86 PolarHBondContact O-N 2.95Å; T82-A126 HydrophobicContact CG2-CB 4.22Å; T82-I223 HydrophobicContact CG2-CG2 4.26Å
83	G	93.7	Very high	92.1	Very high	12 Å²	12	48.7 Å²	48.7	12%	0.124	24%	0.244	C	C	.	.	H	α-helix	trans	-68.4	-37.9	175.7	0	0	0	0	0	114	Y79 I80 I81 D86 G87 T121	Y79-G83 PolarHBondContact O-N 2.93Å; I80-G83 PolarHBondContact O-N 3.32Å; I81-G83 VanDerWaalsContact C-N 3.28Å; I81-G83 PolarHBondContact O-N 3.49Å; G83-D86 PolarHBondContact O-N 3.49Å; G83-G87 PolarHBondContact O-N 2.86Å; G83-T121 VanDerWaalsContact CA-CG2 3.46Å
84	I	93	Very high	91.4	Very high	95 Å²	95	50.7 Å²	50.7	49%	0.487	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-45.7	172.9	-71.7	165.9	0	0	0	110.6	I80 I81 D86 G87 I88	I80-I84 HydrophobicContact CG2-CD1 3.73Å; I80-I84 VanDerWaalsContact O-CG1 3.3Å; I80-I84 WeakPolarHBondContact O-CG1 3.22Å; I80-I84 PolarHBondContact O-N 2.91Å; I81-I84 PolarHBondContact O-N 3.39Å; I84-D86 VanDerWaalsContact C-N 3.35Å; I84-D86 PolarHBondContact O-N 3.15Å; I84-G87 PolarHBondContact O-N 2.88Å; I84-I88 HydrophobicContact CG2-CD1 3.74Å; I84-I88 HydrophobicContact CG2-CG1 4.43Å; I84-I88 VanDerWaalsContact O-CG1 3.3Å; I84-I88 WeakPolarHBondContact O-CG1 3.26Å; I84-I88 PolarHBondContact O-N 2.83Å
85	V	91.3	Very high	90.7	Very high	28 Å²	28	54.3 Å²	54.3	17%	0.17	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-41	177.6	-180	0	0	0	0	110.8	I81 T82 G87 I88 I89 I223 T226	I81-V85 WeakPolarHBondContact O-CG2 3.23Å; I81-V85 PolarHBondContact O-N 2.93Å; T82-V85 PolarHBondContact O-N 2.96Å; V85-G87 PolarHBondContact O-N 3.45Å; V85-I88 PolarHBondContact O-N 3.09Å; V85-I89 HydrophobicContact CG1-CD1 4.06Å; V85-I89 WeakPolarHBondContact O-CG1 3.46Å; V85-I89 PolarHBondContact O-N 3.45Å; V85-I223 HydrophobicContact CB-CD1 4.18Å; V85-I223 HydrophobicContact CG1-CD1 3.72Å; V85-T226 HydrophobicContact CB-CG2 4.16Å; V85-T226 HydrophobicContact CG1-CG2 4.42Å; V85-T226 HydrophobicContact CG2-CG2 3.95Å
86	D	93.1	Very high	89.9	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-41.4	174.8	-170.4	62.4	0	0	0	112.8	T82 G83 I84 I89 Y90 R117 T121 A126 R130 I223	T82-D86 PolarHBondContact O-N 2.95Å; G83-D86 PolarHBondContact O-N 3.49Å; I84-D86 VanDerWaalsContact C-N 3.35Å; I84-D86 PolarHBondContact O-N 3.15Å; D86-I89 PolarHBondContact O-N 3.46Å; D86-Y90 WeakPolarHBondContact O-CB 3.34Å; D86-Y90 PolarHBondContact O-N 3.01Å; D86-R117 PolarHBondContact O-NH2 3.34Å; D86-R117 VanDerWaalsContact O-NH2 3.1Å; D86-R117 IonicContact OD1-CZ 3.95Å; D86-R117 IonicContact OD1-NE 2.68Å; D86-R117 IonicContact OD1-NH2 3Å; D86-R117 PolarHBondContact OD1-NH2 3.28Å; D86-R117 IonicContact OD2-CZ 3.29Å; D86-R117 IonicContact OD2-NE 2.73Å; D86-R117 PolarHBondContact OD2-NE 3.02Å; D86-R117 IonicContact OD2-NH2 3.61Å; D86-R117 PolarHBondContact OD2-NH2 2.92Å; D86-T121 PolarHBondContact OD2-OG1 2.86Å; D86-A126 HydrophobicContact CB-CB 4.1Å; D86-R130 IonicContact OD1-CZ 3.69Å; D86-R130 IonicContact OD1-NE 3.81Å; D86-R130 PolarHBondContact OD1-NE 2.91Å; D86-R130 IonicContact OD1-NH2 2.74Å; D86-R130 PolarHBondContact OD1-NH2 3.47Å; D86-I223 HydrophobicContact CB-CD1 3.88Å; D86-I223 HydrophobicContact CB-CG1 4.39Å
87	G	91.3	Very high	88.7	Confident	35 Å²	35	55.7 Å²	55.7	36%	0.361	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-43.1	175	0	0	0	0	0	113.2	G83 I84 V85 Y90 W91	G83-G87 PolarHBondContact O-N 2.86Å; I84-G87 PolarHBondContact O-N 2.88Å; V85-G87 PolarHBondContact O-N 3.45Å; G87-Y90 WeakPolarHBondContact O-CB 3.32Å; G87-Y90 PolarHBondContact O-N 2.97Å; G87-W91 WeakPolarHBondContact O-CB 3.18Å; G87-W91 PolarHBondContact O-N 2.88Å
88	I	89.9	Confident	86.8	Confident	78 Å²	78	59.1 Å²	59.1	40%	0.4	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-45.6	176.9	-70.4	165.8	0	0	0	110.8	I84 V85 Y90 W91 R92	I84-I88 HydrophobicContact CG2-CD1 3.74Å; I84-I88 HydrophobicContact CG2-CG1 4.43Å; I84-I88 VanDerWaalsContact O-CG1 3.3Å; I84-I88 WeakPolarHBondContact O-CG1 3.26Å; I84-I88 PolarHBondContact O-N 2.83Å; V85-I88 PolarHBondContact O-N 3.09Å; I88-Y90 VanDerWaalsContact C-N 3.33Å; I88-W91 PolarHBondContact O-N 2.94Å; I88-R92 WeakPolarHBondContact O-CG 3.38Å; I88-R92 PolarHBondContact O-N 3.34Å; I88-R92 VanDerWaalsContact O-N 3.07Å
89	I	88	Confident	85.1	Confident	25 Å²	25	68.3 Å²	68.3	13%	0.128	35%	0.352	C	S	.	.	H	α-helix	trans	-68.1	-36	178	-59.8	177.4	0	0	0	110.4	V85 D86 R93 R130 D219 I222 I223	V85-I89 HydrophobicContact CG1-CD1 4.06Å; V85-I89 WeakPolarHBondContact O-CG1 3.46Å; V85-I89 PolarHBondContact O-N 3.45Å; D86-I89 PolarHBondContact O-N 3.46Å; I89-R93 WeakPolarHBondContact O-CB 3.41Å; I89-R93 PolarHBondContact O-N 2.86Å; I89-R93 VanDerWaalsContact O-N 3.09Å; I89-R130 VanDerWaalsContact CG2-NH2 3.29Å; I89-D219 HydrophobicContact CG2-CB 4.41Å; I89-D219 VanDerWaalsContact CG2-CG 3.47Å; I89-D219 WeakPolarHBondContact CG2-OD2 3.22Å; I89-I222 HydrophobicContact CD1-CB 4.23Å; I89-I222 HydrophobicContact CD1-CD1 4.3Å; I89-I222 HydrophobicContact CD1-CG2 3.71Å; I89-I223 HydrophobicContact CD1-CD1 3.96Å; I89-I223 HydrophobicContact CD1-CG1 4.43Å
90	Y	87.7	Confident	83.6	Confident	46 Å²	46	72 Å²	72	18%	0.18	37%	0.366	C	S	.	.	H	α-helix	trans	-59.7	-50.7	172.3	-168.7	-130.6	0	0	0	112	D86 G87 I88 R92 R93 W94 V114 R117	D86-Y90 WeakPolarHBondContact O-CB 3.34Å; D86-Y90 PolarHBondContact O-N 3.01Å; G87-Y90 WeakPolarHBondContact O-CB 3.32Å; G87-Y90 PolarHBondContact O-N 2.97Å; I88-Y90 VanDerWaalsContact C-N 3.33Å; Y90-R92 PolarHBondContact O-N 3.06Å; Y90-R93 CarbonylContact O-C 3.57Å; Y90-R93 WeakPolarHBondContact O-CB 3.47Å; Y90-R93 PolarHBondContact O-N 2.94Å; Y90-R93 VanDerWaalsContact O-N 3.1Å; Y90-W94 HydrophobicContact CE1-CE3 4.19Å; Y90-W94 HydrophobicContact CE2-CE3 4.43Å; Y90-W94 AromaticContact CZ-CE3 3.73Å; Y90-W94 WeakPolarHBondContact O-CB 3.29Å; Y90-W94 PolarHBondContact O-N 2.9Å; Y90-W94 VanDerWaalsContact OH-CE3 3.25Å; Y90-W94 VanDerWaalsContact OH-CZ3 3.24Å; Y90-W94 WeakPolarHBondContact OH-CZ3 3.43Å; Y90-V114 HydrophobicContact CE1-CG1 4.07Å; Y90-V114 WeakPolarHBondContact OH-CG2 3.27Å; Y90-R117 VanDerWaalsContact CD2-NH1 3.34Å
91	W	86.9	Confident	82.2	Confident	163 Å²	163	75.9 Å²	75.9	62%	0.617	38%	0.382	S	S	*	.	H	α-helix	trans	-59.1	-45	-177.8	-176.8	-117.8	0	0	0	111.7	G87 I88 R93 W94 N95	G87-W91 WeakPolarHBondContact O-CB 3.18Å; G87-W91 PolarHBondContact O-N 2.88Å; I88-W91 PolarHBondContact O-N 2.94Å; W91-R93 PolarHBondContact O-N 3.08Å; W91-W94 PolarHBondContact O-N 3.48Å; W91-N95 VanDerWaalsContact CE2-ND2 3.26Å; W91-N95 PolarHBondContact NE1-ND2 3.35Å; W91-N95 WeakPolarHBondContact O-CB 3.28Å; W91-N95 PolarHBondContact O-N 3.47Å; W91-N95 PolarHBondContact O-ND2 3.31Å
92	R	85.9	Confident	81.1	Confident	116 Å²	116	75 Å²	75	44%	0.438	37%	0.374	S	S	.	.	H	α-helix	trans	-58.8	-45.4	173.4	-70.9	176.4	180	-175.4	6.2	112	I88 Y90 A96 E372	I88-R92 WeakPolarHBondContact O-CG 3.38Å; I88-R92 PolarHBondContact O-N 3.34Å; I88-R92 VanDerWaalsContact O-N 3.07Å; Y90-R92 PolarHBondContact O-N 3.06Å; R92-A96 WeakPolarHBondContact O-CB 3.34Å; R92-A96 PolarHBondContact O-N 3.28Å; R92-E372 IonicContact CZ-OE1 3.72Å; R92-E372 IonicContact NE-OE1 2.7Å; R92-E372 IonicContact NH1-OE1 2.71Å; R92-E372 PolarHBondContact NH1-OE1 3.3Å; R92-E372 IonicContact NH2-OE1 2.7Å
93	R	81.6	Confident	80.5	Confident	65 Å²	65	78.4 Å²	78.4	25%	0.245	39%	0.394	C	S	.	.	H	α-helix	trans	-66.5	-40.6	178.1	-175.7	177.3	-73	-131	-14.1	112.2	I89 Y90 W91 S97 E133 R215 D219	I89-R93 WeakPolarHBondContact O-CB 3.41Å; I89-R93 PolarHBondContact O-N 2.86Å; I89-R93 VanDerWaalsContact O-N 3.09Å; Y90-R93 CarbonylContact O-C 3.57Å; Y90-R93 WeakPolarHBondContact O-CB 3.47Å; Y90-R93 PolarHBondContact O-N 2.94Å; Y90-R93 VanDerWaalsContact O-N 3.1Å; W91-R93 PolarHBondContact O-N 3.08Å; R93-S97 PolarHBondContact O-N 3.43Å; R93-E133 IonicContact CZ-OE1 3.2Å; R93-E133 IonicContact NH1-OE1 2.65Å; R93-E133 PolarHBondContact NH1-OE1 3.36Å; R93-R215 PolarHBondContact NH2-O 2.94Å; R93-D219 IonicContact CZ-OD1 3.94Å; R93-D219 IonicContact CZ-OD2 3.67Å; R93-D219 IonicContact NE-OD2 3.66Å; R93-D219 PolarHBondContact NE-OD2 3.17Å; R93-D219 IonicContact NH2-OD1 2.62Å; R93-D219 PolarHBondContact NH2-OD1 3.43Å; R93-D219 IonicContact NH2-OD2 2.65Å; R93-D219 PolarHBondContact NH2-OD2 3.22Å
94	W	81.4	Confident	80.1	Confident	78 Å²	78	86.1 Å²	86.1	30%	0.295	43%	0.425	S	S	.	.	H	α-helix	trans	-64.1	-51.1	177.5	-178.7	-85.9	0	0	0	111.3	Y90 W91 A96 S97 S98 K110 V114	Y90-W94 HydrophobicContact CE1-CE3 4.19Å; Y90-W94 HydrophobicContact CE2-CE3 4.43Å; Y90-W94 AromaticContact CZ-CE3 3.73Å; Y90-W94 WeakPolarHBondContact O-CB 3.29Å; Y90-W94 PolarHBondContact O-N 2.9Å; Y90-W94 VanDerWaalsContact OH-CE3 3.25Å; Y90-W94 VanDerWaalsContact OH-CZ3 3.24Å; Y90-W94 WeakPolarHBondContact OH-CZ3 3.43Å; W91-W94 PolarHBondContact O-N 3.48Å; W94-A96 VanDerWaalsContact C-N 3.29Å; W94-A96 PolarHBondContact O-N 2.93Å; W94-S97 WeakPolarHBondContact O-CA 3.27Å; W94-S97 WeakPolarHBondContact O-CB 3.45Å; W94-S97 PolarHBondContact O-N 2.9Å; W94-S97 PolarHBondContact O-OG 2.97Å; W94-S98 PolarHBondContact O-N 2.9Å; W94-K110 HydrophobicContact CH2-CD 3.82Å; W94-K110 VanDerWaalsContact CZ2-NZ 3.33Å; W94-K110 HydrophobicContact CZ3-CD 3.71Å; W94-K110 HydrophobicContact CZ3-CG 4.37Å; W94-V114 HydrophobicContact CH2-CG2 4.46Å; W94-V114 HydrophobicContact CZ3-CG2 3.91Å
95	N	81.8	Confident	79.6	Confident	76 Å²	76	87 Å²	87	41%	0.406	43%	0.429	S	S	.	.	H	α-helix	trans	-59.6	-39.6	179.6	-68.2	-12.9	0	0	0	111.7	W91 S97 S98	W91-N95 VanDerWaalsContact CE2-ND2 3.26Å; W91-N95 PolarHBondContact NE1-ND2 3.35Å; W91-N95 WeakPolarHBondContact O-CB 3.28Å; W91-N95 PolarHBondContact O-N 3.47Å; W91-N95 PolarHBondContact O-ND2 3.31Å; N95-S97 PolarHBondContact O-N 2.65Å; N95-S98 PolarHBondContact O-N 2.93Å
96	A	78.4	Confident	79	Confident	94 Å²	94	86.5 Å²	86.5	78%	0.777	43%	0.425	S	S	*	.	H	α-helix	trans	-65.5	-18.3	173.8	0	0	0	0	0	114.4	R92 W94	R92-A96 WeakPolarHBondContact O-CB 3.34Å; R92-A96 PolarHBondContact O-N 3.28Å; W94-A96 VanDerWaalsContact C-N 3.29Å; W94-A96 PolarHBondContact O-N 2.93Å
97	S	71.2	Confident	78.5	Confident	43 Å²	43	91 Å²	91	30%	0.301	45%	0.446	S	S	.	.	H	α-helix	trans	-95	-12.8	178.5	80.1	0	0	0	0	114.4	R93 W94 N95 Q99	R93-S97 PolarHBondContact O-N 3.43Å; W94-S97 WeakPolarHBondContact O-CA 3.27Å; W94-S97 WeakPolarHBondContact O-CB 3.45Å; W94-S97 PolarHBondContact O-N 2.9Å; W94-S97 PolarHBondContact O-OG 2.97Å; N95-S97 PolarHBondContact O-N 2.65Å; S97-Q99 PolarHBondContact O-N 3.47Å
98	S	53.8	Low	78.2	Confident	75 Å²	75	95 Å²	95	52%	0.524	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	56.1	-155	-170.1	0	0	0	0	115.7	W94 N95	W94-S98 PolarHBondContact O-N 2.9Å; N95-S98 PolarHBondContact O-N 2.93Å
99	Q	59.4	Low	78	Confident	194 Å²	194	94.4 Å²	94.4	91%	0.907	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.8	10.7	168.1	-82.6	-156.4	-20.7	0	0	115.8	S97	S97-Q99 PolarHBondContact O-N 3.47Å
100	R	64.3	Low	77.7	Confident	125 Å²	125	94.7 Å²	94.7	47%	0.472	45%	0.453	S	S	.	.			trans	-106.1	128.2	-177.1	-63.3	-172.1	-175.2	-176.2	2.6	112.7
101	Q	65.1	Low	77.7	Confident	172 Å²	172	97.7 Å²	97.7	80%	0.804	47%	0.469	S	S	*	.			trans	-57.1	142.9	165.5	-72.3	178.2	-26.2	0	0	110.4	Y562	Q101-Y562 WeakPolarHBondContact O-CE1 3.28Å
102	R	70.7	Confident	77.8	Confident	52 Å²	52	92.8 Å²	92.8	20%	0.196	46%	0.463	C	S	.	.			trans	-127.4	158.4	-178.4	-69.5	165.3	176.8	-100.7	-15.5	109.2	Q106 K110 F566	R102-Q106 HydrophobicContact CB-CB 4.36Å; R102-K110 VanDerWaalsContact NH1-CD 3.34Å; R102-F566 PolarHBondContact NH1-O 3.01Å; R102-F566 PolarHBondContact NH2-O 3.32Å
103	T	82.7	Confident	77.9	Confident	70 Å²	70	88.7 Å²	88.7	43%	0.429	45%	0.448	S	S	.	.			trans	-78.6	153.6	164.7	64.8	0	0	0	0	110.1	I105 Q106 E107	T103-I105 PolarHBondContact O-N 3.15Å; T103-I105 VanDerWaalsContact O-N 3.16Å; T103-Q106 CarbonylContact O-C 3.58Å; T103-Q106 WeakPolarHBondContact O-CA 3.39Å; T103-Q106 WeakPolarHBondContact O-CB 3.5Å; T103-Q106 PolarHBondContact O-N 2.91Å; T103-Q106 WeakPolarHBondContact OG1-CG 3.47Å; T103-Q106 PolarHBondContact OG1-OE1 3.15Å; T103-E107 PolarHBondContact O-N 3.47Å; T103-E107 VanDerWaalsContact O-N 3.09Å
104	K	85.1	Confident	78.2	Confident	174 Å²	174	86.8 Å²	86.8	76%	0.757	44%	0.443	S	S	*	.	H	α-helix	trans	-52.5	-39.4	-179.8	-67	-174.9	176.3	-176.4	0	113.3	Q106 E107 Q108	K104-Q106 VanDerWaalsContact C-N 3.3Å; K104-Q106 PolarHBondContact O-N 2.64Å; K104-E107 VanDerWaalsContact O-CB 3.32Å; K104-E107 WeakPolarHBondContact O-CB 3.41Å; K104-E107 PolarHBondContact O-N 3.18Å; K104-E107 VanDerWaalsContact O-N 3.1Å; K104-Q108 WeakPolarHBondContact O-CG 3.24Å; K104-Q108 PolarHBondContact O-N 3.5Å
105	I	82.5	Confident	78.7	Confident	113 Å²	113	87.4 Å²	87.4	58%	0.579	46%	0.456	S	S	*	.	H	α-helix	trans	-63.9	-35.9	178.4	-59.1	171.6	0	0	0	111.3	T103 E107 N109	T103-I105 PolarHBondContact O-N 3.15Å; T103-I105 VanDerWaalsContact O-N 3.16Å; I105-E107 VanDerWaalsContact C-N 3.3Å; I105-N109 WeakPolarHBondContact O-CB 3.48Å; I105-N109 VanDerWaalsContact O-CG 3.25Å; I105-N109 PolarHBondContact O-N 3.36Å; I105-N109 PolarHBondContact O-ND2 3.49Å
106	Q	77.9	Confident	79.1	Confident	18 Å²	18	87.1 Å²	87.1	8%	0.084	45%	0.453	C	S	.	.	H	α-helix	trans	-81.7	-9.3	176.6	-70.6	157.3	-11.9	0	0	113.7	R102 T103 K104 K110 D563	R102-Q106 HydrophobicContact CB-CB 4.36Å; T103-Q106 CarbonylContact O-C 3.58Å; T103-Q106 WeakPolarHBondContact O-CA 3.39Å; T103-Q106 WeakPolarHBondContact O-CB 3.5Å; T103-Q106 PolarHBondContact O-N 2.91Å; T103-Q106 WeakPolarHBondContact OG1-CG 3.47Å; T103-Q106 PolarHBondContact OG1-OE1 3.15Å; K104-Q106 VanDerWaalsContact C-N 3.3Å; K104-Q106 PolarHBondContact O-N 2.64Å; Q106-K110 VanDerWaalsContact O-CB 3.29Å; Q106-K110 WeakPolarHBondContact O-CB 3.45Å; Q106-D563 WeakPolarHBondContact CG-O 3.42Å; Q106-D563 PolarHBondContact NE2-O 3.31Å
107	E	81.9	Confident	79.7	Confident	98 Å²	98	83 Å²	83	46%	0.458	42%	0.417	S	S	.	.	H	α-helix	trans	-82.6	-54	168	-158.8	141.9	-121.1	0	0	108.2	T103 K104 I105 N109 K110 E111	T103-E107 PolarHBondContact O-N 3.47Å; T103-E107 VanDerWaalsContact O-N 3.09Å; K104-E107 VanDerWaalsContact O-CB 3.32Å; K104-E107 WeakPolarHBondContact O-CB 3.41Å; K104-E107 PolarHBondContact O-N 3.18Å; K104-E107 VanDerWaalsContact O-N 3.1Å; I105-E107 VanDerWaalsContact C-N 3.3Å; E107-N109 PolarHBondContact O-N 3.22Å; E107-K110 CarbonylContact O-C 3.55Å; E107-K110 WeakPolarHBondContact O-CA 3.29Å; E107-K110 WeakPolarHBondContact O-CB 3.34Å; E107-K110 PolarHBondContact O-N 2.98Å; E107-E111 WeakPolarHBondContact O-CG 3.25Å; E107-E111 PolarHBondContact O-N 2.9Å
108	Q	85.7	Confident	80.7	Confident	119 Å²	119	85.6 Å²	85.6	56%	0.556	43%	0.427	S	S	*	.	H	α-helix	trans	-55.7	-46.6	175.1	-67.8	174.1	-52.3	0	0	113.4	K104 K110 E111 A112	K104-Q108 WeakPolarHBondContact O-CG 3.24Å; K104-Q108 PolarHBondContact O-N 3.5Å; Q108-K110 VanDerWaalsContact C-N 3.31Å; Q108-K110 PolarHBondContact O-N 3.09Å; Q108-E111 PolarHBondContact O-N 2.7Å; Q108-A112 WeakPolarHBondContact O-CB 3.18Å; Q108-A112 PolarHBondContact O-N 3.49Å
109	N	85.5	Confident	82.6	Confident	66 Å²	66	85.5 Å²	85.5	35%	0.353	42%	0.423	S	S	.	.	H	α-helix	trans	-66.4	-32.7	176.7	-73.6	-16.9	0	0	0	112.6	I105 E107 W113 P564	I105-N109 WeakPolarHBondContact O-CB 3.48Å; I105-N109 VanDerWaalsContact O-CG 3.25Å; I105-N109 PolarHBondContact O-N 3.36Å; I105-N109 PolarHBondContact O-ND2 3.49Å; E107-N109 PolarHBondContact O-N 3.22Å; N109-W113 WeakPolarHBondContact O-CB 3.49Å; N109-W113 PolarHBondContact O-N 2.93Å; N109-W113 VanDerWaalsContact O-N 3.12Å; N109-P564 VanDerWaalsContact CB-O 3.22Å; N109-P564 WeakPolarHBondContact CB-O 3.35Å; N109-P564 PolarHBondContact ND2-O 2.89Å
110	K	83.1	Confident	84.2	Confident	31 Å²	31	77.4 Å²	77.4	14%	0.135	39%	0.386	C	S	.	.	H	α-helix	trans	-68.3	-46	174.2	-168.2	-153.8	-155.8	-169.1	0	109.9	W94 R102 Q106 E107 Q108 W113 V114	W94-K110 HydrophobicContact CH2-CD 3.82Å; W94-K110 VanDerWaalsContact CZ2-NZ 3.33Å; W94-K110 HydrophobicContact CZ3-CD 3.71Å; W94-K110 HydrophobicContact CZ3-CG 4.37Å; R102-K110 VanDerWaalsContact NH1-CD 3.34Å; Q106-K110 VanDerWaalsContact O-CB 3.29Å; Q106-K110 WeakPolarHBondContact O-CB 3.45Å; E107-K110 CarbonylContact O-C 3.55Å; E107-K110 WeakPolarHBondContact O-CA 3.29Å; E107-K110 WeakPolarHBondContact O-CB 3.34Å; E107-K110 PolarHBondContact O-N 2.98Å; Q108-K110 VanDerWaalsContact C-N 3.31Å; Q108-K110 PolarHBondContact O-N 3.09Å; K110-W113 CarbonylContact O-C 3.55Å; K110-W113 WeakPolarHBondContact O-CB 3.4Å; K110-W113 PolarHBondContact O-N 3.35Å; K110-V114 WeakPolarHBondContact O-CG2 3.27Å; K110-V114 PolarHBondContact O-N 3.4Å
111	E	85.9	Confident	85.6	Confident	109 Å²	109	72.5 Å²	72.5	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-49.5	177.4	-72.3	169.4	165.7	0	0	111.5	E107 Q108 W113 V114 V115	E107-E111 WeakPolarHBondContact O-CG 3.25Å; E107-E111 PolarHBondContact O-N 2.9Å; Q108-E111 PolarHBondContact O-N 2.7Å; E111-W113 VanDerWaalsContact C-N 3.28Å; E111-W113 PolarHBondContact O-N 3.45Å; E111-V114 WeakPolarHBondContact O-CB 3.23Å; E111-V114 PolarHBondContact O-N 2.92Å; E111-V115 WeakPolarHBondContact O-CG2 3.41Å; E111-V115 PolarHBondContact O-N 2.89Å
112	A	88.9	Confident	86.9	Confident	61 Å²	61	69.4 Å²	69.4	50%	0.504	36%	0.362	S	S	.	.	H	α-helix	trans	-56.9	-41	174.5	0	0	0	0	0	112.2	Q108 V115 M116	Q108-A112 WeakPolarHBondContact O-CB 3.18Å; Q108-A112 PolarHBondContact O-N 3.49Å; A112-V115 PolarHBondContact O-N 2.92Å; A112-M116 WeakPolarHBondContact O-CB 3.46Å; A112-M116 PolarHBondContact O-N 3.35Å
113	W	87.9	Confident	88	Confident	30 Å²	30	71 Å²	71	11%	0.114	37%	0.374	C	S	.	.	H	α-helix	trans	-66.5	-38.4	173.6	-180	-93.4	0	0	0	113	N109 K110 E111 M116 R117 I132 E133 F566	N109-W113 WeakPolarHBondContact O-CB 3.49Å; N109-W113 PolarHBondContact O-N 2.93Å; N109-W113 VanDerWaalsContact O-N 3.12Å; K110-W113 CarbonylContact O-C 3.55Å; K110-W113 WeakPolarHBondContact O-CB 3.4Å; K110-W113 PolarHBondContact O-N 3.35Å; E111-W113 VanDerWaalsContact C-N 3.28Å; E111-W113 PolarHBondContact O-N 3.45Å; W113-M116 HydrophobicContact CD2-CE 4.38Å; W113-M116 HydrophobicContact CE3-CE 3.71Å; W113-M116 HydrophobicContact CH2-CE 3.77Å; W113-M116 HydrophobicContact CZ2-CE 4.43Å; W113-M116 HydrophobicContact CZ3-CE 3.39Å; W113-R117 WeakPolarHBondContact O-CB 3.35Å; W113-R117 PolarHBondContact O-N 2.92Å; W113-I132 HydrophobicContact CH2-CB 4.39Å; W113-I132 HydrophobicContact CH2-CG2 3.87Å; W113-I132 HydrophobicContact CZ3-CG2 4.01Å; W113-E133 HydrophobicContact CH2-CB 4.13Å; W113-E133 HydrophobicContact CZ2-CB 3.71Å; W113-E133 HydrophobicContact CZ2-CG 3.83Å; W113-F566 HydrophobicContact CD2-CE1 4.35Å; W113-F566 AromaticContact NE1-CE1 3.9Å
114	V	89	Confident	88.5	Confident	25 Å²	25	67.6 Å²	67.6	15%	0.152	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-49.3	174.1	-171.1	0	0	0	0	110.2	Y90 W94 K110 E111 R117 I118	Y90-V114 HydrophobicContact CE1-CG1 4.07Å; Y90-V114 WeakPolarHBondContact OH-CG2 3.27Å; W94-V114 HydrophobicContact CH2-CG2 4.46Å; W94-V114 HydrophobicContact CZ3-CG2 3.91Å; K110-V114 WeakPolarHBondContact O-CG2 3.27Å; K110-V114 PolarHBondContact O-N 3.4Å; E111-V114 WeakPolarHBondContact O-CB 3.23Å; E111-V114 PolarHBondContact O-N 2.92Å; V114-R117 PolarHBondContact O-N 2.91Å; V114-I118 HydrophobicContact CG1-CD1 3.8Å; V114-I118 HydrophobicContact CG1-CG1 4.39Å; V114-I118 WeakPolarHBondContact O-CG1 3.44Å; V114-I118 PolarHBondContact O-N 2.93Å
115	V	91	Very high	88.9	Confident	91 Å²	91	61.1 Å²	61.1	55%	0.552	33%	0.326	S	S	*	.	H	α-helix	trans	-60.8	-52.3	-179.5	172.6	0	0	0	0	110.3	E111 A112 R117 I118 T119	E111-V115 WeakPolarHBondContact O-CG2 3.41Å; E111-V115 PolarHBondContact O-N 2.89Å; A112-V115 PolarHBondContact O-N 2.92Å; V115-R117 VanDerWaalsContact C-N 3.26Å; V115-R117 PolarHBondContact O-N 2.66Å; V115-I118 PolarHBondContact O-N 3.45Å; V115-I118 VanDerWaalsContact O-N 3.08Å; V115-T119 PolarHBondContact O-N 2.99Å; V115-T119 PolarHBondContact O-OG1 3.28Å; V115-T119 VanDerWaalsContact O-OG1 3.11Å
116	M	91.2	Very high	89.5	Confident	70 Å²	70	55.8 Å²	55.8	35%	0.345	30%	0.299	S	S	.	.	H	α-helix	trans	-55.2	-42.3	177.9	-171.8	-159.4	74.5	0	0	111.9	A112 W113 T119 L120	A112-M116 WeakPolarHBondContact O-CB 3.46Å; A112-M116 PolarHBondContact O-N 3.35Å; W113-M116 HydrophobicContact CD2-CE 4.38Å; W113-M116 HydrophobicContact CE3-CE 3.71Å; W113-M116 HydrophobicContact CH2-CE 3.77Å; W113-M116 HydrophobicContact CZ2-CE 4.43Å; W113-M116 HydrophobicContact CZ3-CE 3.39Å; M116-T119 PolarHBondContact O-N 2.66Å; M116-L120 HydrophobicContact CE-CD1 4.07Å; M116-L120 HydrophobicContact CG-CD1 4.38Å; M116-L120 WeakPolarHBondContact O-CG 3.49Å; M116-L120 PolarHBondContact O-N 3.12Å
117	R	90.6	Very high	90.3	Very high	6 Å²	6	55 Å²	55	2%	0.023	30%	0.295	C	S	.	.	H	α-helix	trans	-65.2	-44.8	176.4	177.9	176.9	177	157.6	-9.7	112.4	D86 Y90 W113 V114 V115 T119 L120 T121 A129 R130 E133	D86-R117 PolarHBondContact O-NH2 3.34Å; D86-R117 VanDerWaalsContact O-NH2 3.1Å; D86-R117 IonicContact OD1-CZ 3.95Å; D86-R117 IonicContact OD1-NE 2.68Å; D86-R117 IonicContact OD1-NH2 3Å; D86-R117 PolarHBondContact OD1-NH2 3.28Å; D86-R117 IonicContact OD2-CZ 3.29Å; D86-R117 IonicContact OD2-NE 2.73Å; D86-R117 PolarHBondContact OD2-NE 3.02Å; D86-R117 IonicContact OD2-NH2 3.61Å; D86-R117 PolarHBondContact OD2-NH2 2.92Å; Y90-R117 VanDerWaalsContact CD2-NH1 3.34Å; W113-R117 WeakPolarHBondContact O-CB 3.35Å; W113-R117 PolarHBondContact O-N 2.92Å; V114-R117 PolarHBondContact O-N 2.91Å; V115-R117 VanDerWaalsContact C-N 3.26Å; V115-R117 PolarHBondContact O-N 2.66Å; R117-T119 VanDerWaalsContact C-N 3.34Å; R117-L120 PolarHBondContact O-N 3.4Å; R117-T121 WeakPolarHBondContact O-CB 3.32Å; R117-T121 PolarHBondContact O-N 2.86Å; R117-T121 PolarHBondContact O-OG1 3.37Å; R117-A129 HydrophobicContact CG-CB 4.31Å; R117-R130 VanDerWaalsContact CZ-CZ 3.47Å; R117-R130 VanDerWaalsContact CZ-NE 3.31Å; R117-R130 VanDerWaalsContact NH1-CZ 3.28Å; R117-E133 IonicContact NH1-OE2 3.06Å
118	I	91.6	Very high	90.9	Very high	99 Å²	99	51 Å²	51	51%	0.508	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-46	176.9	-70.2	170.9	0	0	0	109.7	V114 V115 L120 T121 V122	V114-I118 HydrophobicContact CG1-CD1 3.8Å; V114-I118 HydrophobicContact CG1-CG1 4.39Å; V114-I118 WeakPolarHBondContact O-CG1 3.44Å; V114-I118 PolarHBondContact O-N 2.93Å; V115-I118 PolarHBondContact O-N 3.45Å; V115-I118 VanDerWaalsContact O-N 3.08Å; I118-L120 PolarHBondContact O-N 2.99Å; I118-T121 PolarHBondContact O-N 3.42Å; I118-V122 HydrophobicContact CG2-CG2 4.26Å; I118-V122 WeakPolarHBondContact O-CB 3.27Å; I118-V122 VanDerWaalsContact O-CG2 3.31Å; I118-V122 WeakPolarHBondContact O-CG2 3.49Å; I118-V122 PolarHBondContact O-N 2.96Å
119	T	93.8	Very high	91.2	Very high	73 Å²	73	45.4 Å²	45.4	45%	0.448	25%	0.251	S	S	.	.	H	α-helix	trans	-57.9	-48.5	175.7	-56.1	0	0	0	0	111.9	V115 M116 R117 T121 V122 L123	V115-T119 PolarHBondContact O-N 2.99Å; V115-T119 PolarHBondContact O-OG1 3.28Å; V115-T119 VanDerWaalsContact O-OG1 3.11Å; M116-T119 PolarHBondContact O-N 2.66Å; R117-T119 VanDerWaalsContact C-N 3.34Å; T119-T121 PolarHBondContact O-N 3.33Å; T119-V122 PolarHBondContact O-N 3.5Å; T119-L123 HydrophobicContact CG2-CD1 3.99Å; T119-L123 WeakPolarHBondContact O-CB 3.4Å; T119-L123 VanDerWaalsContact O-CG 3.28Å; T119-L123 WeakPolarHBondContact O-CG 3.35Å; T119-L123 PolarHBondContact O-N 2.98Å
120	L	93.8	Very high	91.6	Very high	24 Å²	24	42.2 Å²	42.2	13%	0.126	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-42.4	176.8	-72.5	174.4	0	0	0	112	M116 R117 I118 L123 G124 M125 A129 I132	M116-L120 HydrophobicContact CE-CD1 4.07Å; M116-L120 HydrophobicContact CG-CD1 4.38Å; M116-L120 WeakPolarHBondContact O-CG 3.49Å; M116-L120 PolarHBondContact O-N 3.12Å; R117-L120 PolarHBondContact O-N 3.4Å; I118-L120 PolarHBondContact O-N 2.99Å; L120-L123 CarbonylContact O-C 3.58Å; L120-L123 PolarHBondContact O-N 2.92Å; L120-G124 PolarHBondContact O-N 3.22Å; L120-M125 HydrophobicContact CB-CB 4.33Å; L120-M125 HydrophobicContact CD2-CB 4.15Å; L120-M125 HydrophobicContact CD2-CE 3.79Å; L120-M125 HydrophobicContact CD2-SD 4.29Å; L120-M125 CarbonylContact O-C 3.59Å; L120-M125 VanDerWaalsContact O-CA 3.29Å; L120-M125 WeakPolarHBondContact O-CA 3.13Å; L120-M125 WeakPolarHBondContact O-CB 3.47Å; L120-M125 PolarHBondContact O-N 2.96Å; L120-A129 HydrophobicContact CB-CB 4Å; L120-A129 HydrophobicContact CD1-CB 3.75Å; L120-I132 HydrophobicContact CD1-CD1 4.31Å
121	T	92.8	Very high	92.1	Very high	22 Å²	22	40.8 Å²	40.8	14%	0.135	23%	0.228	C	C	.	.	H	α-helix	trans	-66.6	-40.2	178	-68.8	0	0	0	0	112.4	G83 D86 R117 I118 T119 L123 G124 A126	G83-T121 VanDerWaalsContact CA-CG2 3.46Å; D86-T121 PolarHBondContact OD2-OG1 2.86Å; R117-T121 WeakPolarHBondContact O-CB 3.32Å; R117-T121 PolarHBondContact O-N 2.86Å; R117-T121 PolarHBondContact O-OG1 3.37Å; I118-T121 PolarHBondContact O-N 3.42Å; T119-T121 PolarHBondContact O-N 3.33Å; T121-L123 VanDerWaalsContact C-N 3.28Å; T121-L123 PolarHBondContact O-N 3.35Å; T121-G124 PolarHBondContact O-N 2.8Å; T121-A126 HydrophobicContact CG2-CB 4.28Å
122	V	92.7	Very high	92.4	Very high	106 Å²	106	38.2 Å²	38.2	64%	0.642	22%	0.217	S	C	*	.	H	α-helix	trans	-64.7	-31.9	174.1	168.8	0	0	0	0	111.8	Y79 I118 T119 G124	Y79-V122 WeakPolarHBondContact CD1-O 3.28Å; I118-V122 HydrophobicContact CG2-CG2 4.26Å; I118-V122 WeakPolarHBondContact O-CB 3.27Å; I118-V122 VanDerWaalsContact O-CG2 3.31Å; I118-V122 WeakPolarHBondContact O-CG2 3.49Å; I118-V122 PolarHBondContact O-N 2.96Å; T119-V122 PolarHBondContact O-N 3.5Å; V122-G124 PolarHBondContact O-N 2.65Å
123	L	94.1	Very high	92.4	Very high	85 Å²	85	35.8 Å²	35.8	45%	0.445	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	9.8	172.1	-66	170.5	0	0	0	113.5	Y79 T119 L120 T121 M125	Y79-L123 WeakPolarHBondContact CE1-O 3.35Å; Y79-L123 PolarHBondContact OH-O 3.49Å; T119-L123 HydrophobicContact CG2-CD1 3.99Å; T119-L123 WeakPolarHBondContact O-CB 3.4Å; T119-L123 VanDerWaalsContact O-CG 3.28Å; T119-L123 WeakPolarHBondContact O-CG 3.35Å; T119-L123 PolarHBondContact O-N 2.98Å; L120-L123 CarbonylContact O-C 3.58Å; L120-L123 PolarHBondContact O-N 2.92Å; T121-L123 VanDerWaalsContact C-N 3.28Å; T121-L123 PolarHBondContact O-N 3.35Å; L123-M125 HydrophobicContact CB-CE 3.58Å; L123-M125 HydrophobicContact CD1-CE 3.58Å; L123-M125 HydrophobicContact CG-CE 4.22Å; L123-M125 PolarHBondContact O-N 2.95Å
124	G	92.7	Very high	92.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	-0.8	-178.2	0	0	0	0	0	114.3	Q78 L120 T121 V122 A126	Q78-G124 PolarHBondContact NE2-O 3.39Å; L120-G124 PolarHBondContact O-N 3.22Å; T121-G124 PolarHBondContact O-N 2.8Å; V122-G124 PolarHBondContact O-N 2.65Å; G124-A126 VanDerWaalsContact C-N 3.3Å; G124-A126 PolarHBondContact O-N 3.31Å
125	M	95.3	Very high	92.6	Very high	38 Å²	38	35.3 Å²	35.3	19%	0.187	19%	0.194	C	C	.	.			trans	-88.1	26.2	-175.2	-65.8	-170.5	-82.4	0	0	114.2	F41 M42 L45 L120 L123 P127 I128 A129	F41-M125 HydrophobicContact CE1-CB 4.45Å; F41-M125 HydrophobicContact CE1-CG 4.37Å; M42-M125 HydrophobicContact SD-SD 4.22Å; L45-M125 HydrophobicContact CD1-CG 3.7Å; L120-M125 HydrophobicContact CB-CB 4.33Å; L120-M125 HydrophobicContact CD2-CB 4.15Å; L120-M125 HydrophobicContact CD2-CE 3.79Å; L120-M125 HydrophobicContact CD2-SD 4.29Å; L120-M125 CarbonylContact O-C 3.59Å; L120-M125 VanDerWaalsContact O-CA 3.29Å; L120-M125 WeakPolarHBondContact O-CA 3.13Å; L120-M125 WeakPolarHBondContact O-CB 3.47Å; L120-M125 PolarHBondContact O-N 2.96Å; L123-M125 HydrophobicContact CB-CE 3.58Å; L123-M125 HydrophobicContact CD1-CE 3.58Å; L123-M125 HydrophobicContact CG-CE 4.22Å; L123-M125 PolarHBondContact O-N 2.95Å; M125-P127 VanDerWaalsContact C-CD 3.42Å; M125-P127 VanDerWaalsContact C-N 3.32Å; M125-I128 HydrophobicContact CB-CB 4.35Å; M125-I128 HydrophobicContact CB-CD1 4.11Å; M125-I128 HydrophobicContact CB-CG1 4.42Å; M125-I128 HydrophobicContact CG-CD1 4.05Å; M125-I128 WeakPolarHBondContact O-CB 3.49Å; M125-I128 PolarHBondContact O-N 2.61Å; M125-I128 HydrophobicContact SD-CD1 3.86Å; M125-A129 PolarHBondContact O-N 2.78Å
126	A	94.3	Very high	92.5	Very high	1 Å²	1	33 Å²	33	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-52	-38.6	178.4	0	0	0	0	0	114.5	T82 D86 T121 G124 I128 A129 R130 I223	T82-A126 HydrophobicContact CG2-CB 4.22Å; D86-A126 HydrophobicContact CB-CB 4.1Å; T121-A126 HydrophobicContact CG2-CB 4.28Å; G124-A126 VanDerWaalsContact C-N 3.3Å; G124-A126 PolarHBondContact O-N 3.31Å; A126-I128 VanDerWaalsContact C-N 3.34Å; A126-I128 PolarHBondContact O-N 3.39Å; A126-A129 PolarHBondContact O-N 2.82Å; A126-R130 PolarHBondContact O-N 2.99Å; A126-I223 HydrophobicContact CB-CG2 4.06Å
127	P	94.4	Very high	92.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60	-40.2	173.2	-24.2	34.8	0	0	0	113.3	F41 M125 R130 Y131 I223 W271	F41-P127 HydrophobicContact CD2-CG 4.33Å; F41-P127 HydrophobicContact CE1-CB 4.48Å; F41-P127 HydrophobicContact CE1-CG 4.34Å; F41-P127 HydrophobicContact CE2-CG 3.9Å; F41-P127 HydrophobicContact CZ-CB 4.5Å; F41-P127 HydrophobicContact CZ-CG 3.9Å; M125-P127 VanDerWaalsContact C-CD 3.42Å; M125-P127 VanDerWaalsContact C-N 3.32Å; P127-R130 PolarHBondContact O-N 3.04Å; P127-Y131 HydrophobicContact CB-CE2 4.27Å; P127-Y131 WeakPolarHBondContact O-CD2 3.31Å; P127-Y131 PolarHBondContact O-N 3.33Å; P127-I223 HydrophobicContact CG-CG2 4.16Å; P127-W271 HydrophobicContact CB-CH2 4.05Å; P127-W271 HydrophobicContact CB-CZ2 4.01Å; P127-W271 HydrophobicContact CG-CZ2 3.99Å
128	I	94.5	Very high	92.1	Very high	15 Å²	15	29.5 Å²	29.5	8%	0.077	16%	0.163	C	C	.	.	H	α-helix	trans	-64.7	-44.2	178.7	-59.3	179.4	0	0	0	110.3	F41 M42 M125 A126 R130 Y131 I132	F41-I128 HydrophobicContact CD1-CD1 3.7Å; F41-I128 HydrophobicContact CD1-CG1 3.52Å; F41-I128 HydrophobicContact CE1-CD1 3.8Å; F41-I128 HydrophobicContact CE1-CG1 3.71Å; M42-I128 HydrophobicContact CG-CD1 3.87Å; M42-I128 HydrophobicContact SD-CD1 3.4Å; M42-I128 WeakPolarHBondContact SD-CD1 3.34Å; M125-I128 HydrophobicContact CB-CB 4.35Å; M125-I128 HydrophobicContact CB-CD1 4.11Å; M125-I128 HydrophobicContact CB-CG1 4.42Å; M125-I128 HydrophobicContact CG-CD1 4.05Å; M125-I128 WeakPolarHBondContact O-CB 3.49Å; M125-I128 PolarHBondContact O-N 2.61Å; M125-I128 HydrophobicContact SD-CD1 3.86Å; A126-I128 VanDerWaalsContact C-N 3.34Å; A126-I128 PolarHBondContact O-N 3.39Å; I128-R130 PolarHBondContact O-N 3.22Å; I128-R130 VanDerWaalsContact O-N 3.17Å; I128-Y131 PolarHBondContact O-N 3.01Å; I128-Y131 VanDerWaalsContact O-N 3.13Å; I128-I132 HydrophobicContact CG2-CD1 3.74Å; I128-I132 HydrophobicContact CG2-CG1 4.15Å; I128-I132 WeakPolarHBondContact O-CG1 3.49Å; I128-I132 PolarHBondContact O-N 3.39Å
129	A	93.2	Very high	91.9	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-54.2	-37.9	176.8	0	0	0	0	0	112	R117 L120 M125 A126 E133	R117-A129 HydrophobicContact CG-CB 4.31Å; L120-A129 HydrophobicContact CB-CB 4Å; L120-A129 HydrophobicContact CD1-CB 3.75Å; M125-A129 PolarHBondContact O-N 2.78Å; A126-A129 PolarHBondContact O-N 2.82Å; A129-E133 PolarHBondContact O-N 3.29Å
130	R	92.7	Very high	91.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-78.4	-36.1	176.9	-61.6	-50.1	-155.6	124.8	27.6	114.4	D86 I89 R117 A126 P127 I128 I132 E133 S134 D219 A220 I223	D86-R130 IonicContact OD1-CZ 3.69Å; D86-R130 IonicContact OD1-NE 3.81Å; D86-R130 PolarHBondContact OD1-NE 2.91Å; D86-R130 IonicContact OD1-NH2 2.74Å; D86-R130 PolarHBondContact OD1-NH2 3.47Å; I89-R130 VanDerWaalsContact CG2-NH2 3.29Å; R117-R130 VanDerWaalsContact CZ-CZ 3.47Å; R117-R130 VanDerWaalsContact CZ-NE 3.31Å; R117-R130 VanDerWaalsContact NH1-CZ 3.28Å; A126-R130 PolarHBondContact O-N 2.99Å; P127-R130 PolarHBondContact O-N 3.04Å; I128-R130 PolarHBondContact O-N 3.22Å; I128-R130 VanDerWaalsContact O-N 3.17Å; R130-I132 VanDerWaalsContact C-N 3.31Å; R130-E133 VanDerWaalsContact CD-OE2 3.27Å; R130-E133 WeakPolarHBondContact CD-OE2 3.33Å; R130-E133 IonicContact CZ-OE2 3.18Å; R130-E133 IonicContact NE-OE2 3.83Å; R130-E133 IonicContact NH1-OE1 2.63Å; R130-E133 IonicContact NH1-OE2 3.13Å; R130-E133 PolarHBondContact NH1-OE2 2.98Å; R130-E133 WeakPolarHBondContact O-CB 3.34Å; R130-E133 PolarHBondContact O-N 3.28Å; R130-S134 WeakPolarHBondContact O-CB 3.38Å; R130-S134 PolarHBondContact O-N 3.32Å; R130-D219 IonicContact CZ-OD2 3.86Å; R130-D219 IonicContact NH1-OD2 3.1Å; R130-D219 PolarHBondContact NH1-OD2 3.29Å; R130-D219 IonicContact NH2-OD2 3.6Å; R130-D219 PolarHBondContact NH2-OD2 3.47Å; R130-A220 HydrophobicContact CB-CB 3.77Å; R130-I223 HydrophobicContact CG-CB 4.31Å; R130-I223 HydrophobicContact CG-CG1 4.25Å; R130-I223 HydrophobicContact CG-CG2 4.44Å
131	Y	93.1	Very high	90.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.5	-37.3	171	-70.2	-56.1	0	0	0	111.5	K34 S37 I38 P127 I128 S134 L135 A220 A224 W271 H278	K34-Y131 HydrophobicContact CB-CD1 3.96Å; K34-Y131 HydrophobicContact CB-CE1 4.49Å; K34-Y131 HydrophobicContact CG-CD1 3.83Å; K34-Y131 HydrophobicContact CG-CE1 4.19Å; S37-Y131 VanDerWaalsContact CB-CZ 3.41Å; S37-Y131 VanDerWaalsContact CB-OH 3.28Å; S37-Y131 WeakPolarHBondContact CB-OH 3.5Å; S37-Y131 PolarHBondContact OG-OH 3.13Å; I38-Y131 HydrophobicContact CD1-CG 4.48Å; I38-Y131 HydrophobicContact CG1-CD2 3.84Å; I38-Y131 HydrophobicContact CG1-CG 4.09Å; P127-Y131 HydrophobicContact CB-CE2 4.27Å; P127-Y131 WeakPolarHBondContact O-CD2 3.31Å; P127-Y131 PolarHBondContact O-N 3.33Å; I128-Y131 PolarHBondContact O-N 3.01Å; I128-Y131 VanDerWaalsContact O-N 3.13Å; Y131-S134 PolarHBondContact O-N 3.01Å; Y131-L135 WeakPolarHBondContact O-CB 3.27Å; Y131-L135 WeakPolarHBondContact O-CG 3.28Å; Y131-L135 PolarHBondContact O-N 2.91Å; Y131-A220 HydrophobicContact CD1-CB 4.43Å; Y131-A224 WeakPolarHBondContact OH-CB 2.95Å; Y131-W271 AromaticContact CE2-CH2 4Å; Y131-W271 HydrophobicContact CE2-CH2 4Å; Y131-W271 HydrophobicContact CE2-CZ3 4.37Å; Y131-H278 AromaticContact CE1-CE1 3.68Å; Y131-H278 AromaticContact CE1-ND1 3.99Å
132	I	92.3	Very high	90.4	Very high	56 Å²	56	30.8 Å²	30.8	29%	0.287	16%	0.157	S	C	.	.	H	α-helix	trans	-65	-46.2	171.6	-62.6	170.3	0	0	0	110.5	W113 L120 I128 R130 S134 L135 V136	W113-I132 HydrophobicContact CH2-CB 4.39Å; W113-I132 HydrophobicContact CH2-CG2 3.87Å; W113-I132 HydrophobicContact CZ3-CG2 4.01Å; L120-I132 HydrophobicContact CD1-CD1 4.31Å; I128-I132 HydrophobicContact CG2-CD1 3.74Å; I128-I132 HydrophobicContact CG2-CG1 4.15Å; I128-I132 WeakPolarHBondContact O-CG1 3.49Å; I128-I132 PolarHBondContact O-N 3.39Å; R130-I132 VanDerWaalsContact C-N 3.31Å; I132-S134 VanDerWaalsContact C-N 3.27Å; I132-S134 PolarHBondContact O-N 3.37Å; I132-L135 PolarHBondContact O-N 2.87Å; I132-V136 HydrophobicContact CG2-CG2 4.31Å; I132-V136 WeakPolarHBondContact O-CG2 3.27Å; I132-V136 PolarHBondContact O-N 3.11Å
133	E	90.5	Very high	90.1	Very high	10 Å²	10	28.8 Å²	28.8	5%	0.047	15%	0.148	C	C	.	.	H	α-helix	trans	-52.5	-47.8	175.3	-162.4	-175.8	162.5	0	0	110.9	R93 W113 R117 A129 R130 V137 T216 F566	R93-E133 IonicContact CZ-OE1 3.2Å; R93-E133 IonicContact NH1-OE1 2.65Å; R93-E133 PolarHBondContact NH1-OE1 3.36Å; W113-E133 HydrophobicContact CH2-CB 4.13Å; W113-E133 HydrophobicContact CZ2-CB 3.71Å; W113-E133 HydrophobicContact CZ2-CG 3.83Å; R117-E133 IonicContact NH1-OE2 3.06Å; A129-E133 PolarHBondContact O-N 3.29Å; R130-E133 VanDerWaalsContact CD-OE2 3.27Å; R130-E133 WeakPolarHBondContact CD-OE2 3.33Å; R130-E133 IonicContact CZ-OE2 3.18Å; R130-E133 IonicContact NE-OE2 3.83Å; R130-E133 IonicContact NH1-OE1 2.63Å; R130-E133 IonicContact NH1-OE2 3.13Å; R130-E133 PolarHBondContact NH1-OE2 2.98Å; R130-E133 WeakPolarHBondContact O-CB 3.34Å; R130-E133 PolarHBondContact O-N 3.28Å; E133-V137 WeakPolarHBondContact O-CG2 3.49Å; E133-V137 PolarHBondContact O-N 3.45Å; E133-T216 HydrophobicContact CG-CG2 3.87Å; E133-F566 HydrophobicContact CG-CE1 4.46Å; E133-F566 HydrophobicContact CG-CZ 4.34Å
134	S	89.1	Confident	89.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.3	-44.5	177.4	178.2	0	0	0	0	113	K34 R130 Y131 I132 V136 V137 V138 E217	K34-S134 WeakPolarHBondContact CE-OG 3.4Å; K34-S134 PolarHBondContact NZ-OG 3.11Å; R130-S134 WeakPolarHBondContact O-CB 3.38Å; R130-S134 PolarHBondContact O-N 3.32Å; Y131-S134 PolarHBondContact O-N 3.01Å; I132-S134 VanDerWaalsContact C-N 3.27Å; I132-S134 PolarHBondContact O-N 3.37Å; S134-V136 VanDerWaalsContact C-N 3.34Å; S134-V136 PolarHBondContact O-N 3.35Å; S134-V137 PolarHBondContact O-N 3.42Å; S134-V137 VanDerWaalsContact O-N 3.16Å; S134-V138 WeakPolarHBondContact O-CG2 3.13Å; S134-V138 PolarHBondContact O-N 3.22Å; S134-E217 WeakPolarHBondContact CB-OE1 3.37Å; S134-E217 PolarHBondContact OG-OE1 3.09Å
135	L	90.2	Very high	88.8	Confident	44 Å²	44	26.9 Å²	26.9	23%	0.23	14%	0.137	C	C	.	.	H	α-helix	trans	-65.2	-34.5	179.4	-74.3	169.1	0	0	0	112.5	V31 K34 I38 Y131 I132 V138 K139	V31-L135 HydrophobicContact CB-CD2 4.37Å; V31-L135 HydrophobicContact CG1-CD2 4.06Å; V31-L135 HydrophobicContact CG2-CD2 4.09Å; K34-L135 HydrophobicContact CB-CD2 4.4Å; K34-L135 HydrophobicContact CD-CD2 4.04Å; K34-L135 HydrophobicContact CD-CG 4.24Å; I38-L135 HydrophobicContact CD1-CD1 4.1Å; Y131-L135 WeakPolarHBondContact O-CB 3.27Å; Y131-L135 WeakPolarHBondContact O-CG 3.28Å; Y131-L135 PolarHBondContact O-N 2.91Å; I132-L135 PolarHBondContact O-N 2.87Å; L135-V138 PolarHBondContact O-N 2.63Å; L135-K139 WeakPolarHBondContact O-CB 3.34Å; L135-K139 PolarHBondContact O-N 2.88Å
136	V	89.4	Confident	88.2	Confident	42 Å²	42	32.9 Å²	32.9	26%	0.255	16%	0.162	S	C	.	.	H	α-helix	trans	-63.3	-44.1	171.3	171	0	0	0	0	110.8	I132 S134 V138 K139 R140 I565 F566	I132-V136 HydrophobicContact CG2-CG2 4.31Å; I132-V136 WeakPolarHBondContact O-CG2 3.27Å; I132-V136 PolarHBondContact O-N 3.11Å; S134-V136 VanDerWaalsContact C-N 3.34Å; S134-V136 PolarHBondContact O-N 3.35Å; V136-V138 PolarHBondContact O-N 3.24Å; V136-K139 PolarHBondContact O-N 3.39Å; V136-R140 PolarHBondContact O-N 3.48Å; V136-I565 HydrophobicContact CG1-CD1 4.01Å; V136-F566 HydrophobicContact CG1-CE2 4.06Å; V136-F566 HydrophobicContact CG1-CZ 4.42Å
137	V	86.7	Confident	87.6	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-36.6	175.3	177.2	0	0	0	0	111.8	E133 S134 R140 M141 V209 Q212 F213 T216	E133-V137 WeakPolarHBondContact O-CG2 3.49Å; E133-V137 PolarHBondContact O-N 3.45Å; S134-V137 PolarHBondContact O-N 3.42Å; S134-V137 VanDerWaalsContact O-N 3.16Å; V137-R140 PolarHBondContact O-N 2.85Å; V137-M141 WeakPolarHBondContact O-CB 3.49Å; V137-M141 PolarHBondContact O-N 3.16Å; V137-V209 HydrophobicContact CG1-CG1 4.11Å; V137-Q212 HydrophobicContact CG1-CG 4.48Å; V137-Q212 HydrophobicContact CG2-CG 4.33Å; V137-F213 HydrophobicContact CG1-CB 3.79Å; V137-F213 HydrophobicContact CG1-CD2 4.22Å; V137-F213 HydrophobicContact CG1-CG 4.5Å; V137-T216 HydrophobicContact CG2-CG2 4.16Å
138	V	86.6	Confident	86.8	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-65.3	-44.6	172.9	176.4	0	0	0	0	111.7	A27 V31 S134 L135 V136 R140 M141 L142 F213	A27-V138 HydrophobicContact CB-CG1 4.16Å; V31-V138 HydrophobicContact CG2-CG1 3.69Å; S134-V138 WeakPolarHBondContact O-CG2 3.13Å; S134-V138 PolarHBondContact O-N 3.22Å; L135-V138 PolarHBondContact O-N 2.63Å; V136-V138 PolarHBondContact O-N 3.24Å; V138-R140 VanDerWaalsContact C-N 3.26Å; V138-R140 PolarHBondContact O-N 3.01Å; V138-M141 PolarHBondContact O-N 3.16Å; V138-M141 VanDerWaalsContact O-N 3.16Å; V138-L142 HydrophobicContact CG1-CD1 3.85Å; V138-L142 HydrophobicContact CG1-CG 4.2Å; V138-L142 WeakPolarHBondContact O-CB 3.35Å; V138-L142 WeakPolarHBondContact O-CG 3.39Å; V138-L142 PolarHBondContact O-N 2.93Å; V138-F213 HydrophobicContact CG2-CD2 3.83Å; V138-F213 HydrophobicContact CG2-CE2 3.25Å; V138-F213 HydrophobicContact CG2-CZ 3.94Å
139	K	88.4	Confident	85.6	Confident	159 Å²	159	38.9 Å²	38.9	69%	0.691	19%	0.188	S	C	*	.	H	α-helix	trans	-57.5	-42.3	176.6	-177.2	178.2	177.5	-179.9	0	111.1	L135 V136 S143	L135-K139 WeakPolarHBondContact O-CB 3.34Å; L135-K139 PolarHBondContact O-N 2.88Å; V136-K139 PolarHBondContact O-N 3.39Å; K139-S143 PolarHBondContact O-N 2.9Å; K139-S143 PolarHBondContact O-OG 2.94Å
140	R	84.2	Confident	84.9	Confident	36 Å²	36	42.2 Å²	42.2	14%	0.136	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-45.7	173.8	-176.5	-166.1	-172	160.8	21.3	112.5	V136 V137 V138 S143 L144 Y205 V209 D563	V136-R140 PolarHBondContact O-N 3.48Å; V137-R140 PolarHBondContact O-N 2.85Å; V138-R140 VanDerWaalsContact C-N 3.26Å; V138-R140 PolarHBondContact O-N 3.01Å; R140-S143 WeakPolarHBondContact CA-OG 3.37Å; R140-S143 PolarHBondContact O-N 2.99Å; R140-S143 PolarHBondContact O-OG 3.45Å; R140-L144 HydrophobicContact CG-CD1 3.99Å; R140-L144 VanDerWaalsContact O-CG 3.28Å; R140-L144 WeakPolarHBondContact O-CG 3.34Å; R140-L144 PolarHBondContact O-N 3.26Å; R140-Y205 PolarHBondContact NE-OH 3.25Å; R140-Y205 VanDerWaalsContact NE-OH 3.08Å; R140-Y205 PolarHBondContact NH2-OH 3.35Å; R140-V209 HydrophobicContact CG-CG1 4.41Å; R140-D563 IonicContact CZ-OD2 3.04Å; R140-D563 IonicContact NH1-OD2 2.94Å; R140-D563 PolarHBondContact NH1-OD2 2.89Å; R140-D563 IonicContact NH2-OD2 2.81Å; R140-D563 PolarHBondContact NH2-OD2 3.18Å; R140-D563 VanDerWaalsContact NH2-OD2 3.13Å
141	M	82.7	Confident	84.1	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.025	22%	0.223	C	C	.	.	H	α-helix	trans	-58.2	-50.3	177.6	-176.6	166.2	165.4	0	0	110.3	V137 V138 S143 L144 E145 V209 R210 F213	V137-M141 WeakPolarHBondContact O-CB 3.49Å; V137-M141 PolarHBondContact O-N 3.16Å; V138-M141 PolarHBondContact O-N 3.16Å; V138-M141 VanDerWaalsContact O-N 3.16Å; M141-S143 VanDerWaalsContact C-N 3.35Å; M141-S143 PolarHBondContact O-N 3.46Å; M141-L144 PolarHBondContact O-N 2.95Å; M141-E145 WeakPolarHBondContact CE-OE1 3.26Å; M141-E145 HydrophobicContact CG-CG 4.43Å; M141-E145 WeakPolarHBondContact O-CB 3.29Å; M141-E145 WeakPolarHBondContact O-CG 3.31Å; M141-E145 PolarHBondContact O-N 3.37Å; M141-V209 HydrophobicContact CB-CG1 3.99Å; M141-R210 HydrophobicContact CE-CG 4.22Å; M141-F213 HydrophobicContact SD-CB 4.48Å; M141-F213 HydrophobicContact SD-CD1 4.36Å; M141-F213 HydrophobicContact SD-CG 4.41Å
142	L	82.2	Confident	83	Confident	45 Å²	45	45 Å²	45	24%	0.236	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-36.5	176.5	-72	171.7	0	0	0	113.5	A27 V138 K146	A27-L142 HydrophobicContact CB-CD2 3.65Å; A27-L142 HydrophobicContact CB-CG 4.02Å; V138-L142 HydrophobicContact CG1-CD1 3.85Å; V138-L142 HydrophobicContact CG1-CG 4.2Å; V138-L142 WeakPolarHBondContact O-CB 3.35Å; V138-L142 WeakPolarHBondContact O-CG 3.39Å; V138-L142 PolarHBondContact O-N 2.93Å; L142-K146 WeakPolarHBondContact O-CB 3.43Å; L142-K146 VanDerWaalsContact O-CG 3.28Å; L142-K146 WeakPolarHBondContact O-CG 3.29Å; L142-K146 PolarHBondContact O-N 3.45Å
143	S	85.7	Confident	81.9	Confident	65 Å²	65	47.3 Å²	47.3	46%	0.455	24%	0.237	S	C	.	.	H	α-helix	trans	-69.6	-38.2	176.6	62	0	0	0	0	112.4	K139 R140 M141 Q147	K139-S143 PolarHBondContact O-N 2.9Å; K139-S143 PolarHBondContact O-OG 2.94Å; R140-S143 WeakPolarHBondContact CA-OG 3.37Å; R140-S143 PolarHBondContact O-N 2.99Å; R140-S143 PolarHBondContact O-OG 3.45Å; M141-S143 VanDerWaalsContact C-N 3.35Å; M141-S143 PolarHBondContact O-N 3.46Å; S143-Q147 PolarHBondContact O-N 3.24Å
144	L	82	Confident	81.2	Confident	13 Å²	13	49.6 Å²	49.6	7%	0.068	26%	0.258	C	S	.	.	H	α-helix	trans	-75.7	-35.9	178.5	-63	170.5	0	0	0	112.2	R140 M141 Q147 Y148 Y205 V206 V209	R140-L144 HydrophobicContact CG-CD1 3.99Å; R140-L144 VanDerWaalsContact O-CG 3.28Å; R140-L144 WeakPolarHBondContact O-CG 3.34Å; R140-L144 PolarHBondContact O-N 3.26Å; M141-L144 PolarHBondContact O-N 2.95Å; L144-Q147 PolarHBondContact O-N 2.98Å; L144-Y148 HydrophobicContact CB-CD2 4.38Å; L144-Y148 HydrophobicContact CB-CE2 4.49Å; L144-Y148 HydrophobicContact CD2-CE2 4.18Å; L144-Y148 VanDerWaalsContact O-CD2 3.29Å; L144-Y148 WeakPolarHBondContact O-CD2 3.18Å; L144-Y148 PolarHBondContact O-N 3.5Å; L144-Y205 HydrophobicContact CD1-CD1 4.01Å; L144-Y205 HydrophobicContact CD1-CD2 4.37Å; L144-Y205 HydrophobicContact CD1-CE1 3.52Å; L144-Y205 HydrophobicContact CD1-CE2 3.91Å; L144-Y205 HydrophobicContact CD1-CG 4.41Å; L144-Y205 VanDerWaalsContact CD1-CZ 3.44Å; L144-Y205 HydrophobicContact CD2-CD1 3.96Å; L144-Y205 HydrophobicContact CD2-CE1 3.38Å; L144-Y205 HydrophobicContact CG-CE1 4.1Å; L144-V206 HydrophobicContact CB-CG2 4.18Å; L144-V209 HydrophobicContact CD1-CB 4.48Å; L144-V209 HydrophobicContact CD1-CG2 3.79Å
145	E	77.1	Confident	80.3	Confident	31 Å²	31	51.1 Å²	51.1	15%	0.145	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-46.1	171.2	-74.1	172	160	0	0	110.3	M141 Q147 M149 V206	M141-E145 WeakPolarHBondContact CE-OE1 3.26Å; M141-E145 HydrophobicContact CG-CG 4.43Å; M141-E145 WeakPolarHBondContact O-CB 3.29Å; M141-E145 WeakPolarHBondContact O-CG 3.31Å; M141-E145 PolarHBondContact O-N 3.37Å; E145-Q147 VanDerWaalsContact C-N 3.35Å; E145-Q147 PolarHBondContact O-N 3.31Å; E145-M149 WeakPolarHBondContact O-CA 3.18Å; E145-M149 WeakPolarHBondContact O-CB 3.27Å; E145-M149 WeakPolarHBondContact O-CG 3.38Å; E145-M149 PolarHBondContact O-N 3.46Å; E145-V206 HydrophobicContact CG-CG1 4.36Å
146	K	82.5	Confident	79.3	Confident	165 Å²	165	51.2 Å²	51.2	72%	0.717	27%	0.269	S	S	*	.	H	α-helix	trans	-56.9	-46.6	173	-78.2	178.1	177.1	-172.2	0	112.3	L142 S150	L142-K146 WeakPolarHBondContact O-CB 3.43Å; L142-K146 VanDerWaalsContact O-CG 3.28Å; L142-K146 WeakPolarHBondContact O-CG 3.29Å; L142-K146 PolarHBondContact O-N 3.45Å; K146-S150 WeakPolarHBondContact O-CB 3.21Å; K146-S150 PolarHBondContact O-N 2.95Å; K146-S150 VanDerWaalsContact O-N 3.16Å; K146-S150 PolarHBondContact O-OG 3.45Å
147	Q	82.1	Confident	78.5	Confident	77 Å²	77	57.1 Å²	57.1	36%	0.36	29%	0.291	S	S	.	.	H	α-helix	trans	-60.8	-66.9	176.9	-178.3	177.1	-7.9	0	0	111.3	S143 L144 E145 M149 S150 E151	S143-Q147 PolarHBondContact O-N 3.24Å; L144-Q147 PolarHBondContact O-N 2.98Å; E145-Q147 VanDerWaalsContact C-N 3.35Å; E145-Q147 PolarHBondContact O-N 3.31Å; Q147-M149 VanDerWaalsContact C-N 3.35Å; Q147-M149 PolarHBondContact O-N 3.03Å; Q147-S150 PolarHBondContact O-N 2.69Å; Q147-S150 VanDerWaalsContact O-N 3.09Å; Q147-S150 PolarHBondContact O-OG 2.93Å; Q147-E151 VanDerWaalsContact CG-OE1 3.32Å; Q147-E151 WeakPolarHBondContact CG-OE1 3.49Å; Q147-E151 PolarHBondContact NE2-OE1 2.87Å; Q147-E151 PolarHBondContact O-N 3.35Å
148	Y	76.8	Confident	77.6	Confident	36 Å²	36	62.5 Å²	62.5	14%	0.141	32%	0.316	C	S	.	.	H	α-helix	trans	-71.3	-25.5	-170.9	-64.6	-58.7	0	0	0	113.9	L144 T152 Y205 V206	L144-Y148 HydrophobicContact CB-CD2 4.38Å; L144-Y148 HydrophobicContact CB-CE2 4.49Å; L144-Y148 HydrophobicContact CD2-CE2 4.18Å; L144-Y148 VanDerWaalsContact O-CD2 3.29Å; L144-Y148 WeakPolarHBondContact O-CD2 3.18Å; L144-Y148 PolarHBondContact O-N 3.5Å; Y148-T152 VanDerWaalsContact O-CB 3.3Å; Y148-T152 WeakPolarHBondContact O-CB 3.38Å; Y148-T152 PolarHBondContact O-N 2.92Å; Y148-T152 PolarHBondContact O-OG1 2.87Å; Y148-Y205 HydrophobicContact CE2-CD1 4.21Å; Y148-V206 HydrophobicContact CD2-CG2 3.81Å; Y148-V206 HydrophobicContact CE2-CG2 4.49Å
149	M	70.3	Confident	76.6	Confident	28 Å²	28	64.4 Å²	64.4	14%	0.138	33%	0.327	C	S	.	.	H	α-helix	trans	-73.2	-32.4	170.7	-62.1	-59	-176.2	0	0	111.8	V21 E145 Q147 T152 I153	V21-M149 HydrophobicContact CB-CE 4.2Å; V21-M149 HydrophobicContact CG1-CE 3.78Å; E145-M149 WeakPolarHBondContact O-CA 3.18Å; E145-M149 WeakPolarHBondContact O-CB 3.27Å; E145-M149 WeakPolarHBondContact O-CG 3.38Å; E145-M149 PolarHBondContact O-N 3.46Å; Q147-M149 VanDerWaalsContact C-N 3.35Å; Q147-M149 PolarHBondContact O-N 3.03Å; M149-T152 PolarHBondContact O-N 2.69Å; M149-I153 VanDerWaalsContact O-CB 3.27Å; M149-I153 WeakPolarHBondContact O-CB 3.4Å; M149-I153 WeakPolarHBondContact O-CD1 3.41Å; M149-I153 WeakPolarHBondContact O-CG1 3.49Å; M149-I153 PolarHBondContact O-N 2.89Å
150	S	77.8	Confident	75.1	Confident	72 Å²	72	63.7 Å²	63.7	50%	0.503	33%	0.326	S	S	.	.	H	α-helix	trans	-66.3	-42.1	171.1	71	0	0	0	0	112	K146 Q147 T152 I153 A154	K146-S150 WeakPolarHBondContact O-CB 3.21Å; K146-S150 PolarHBondContact O-N 2.95Å; K146-S150 VanDerWaalsContact O-N 3.16Å; K146-S150 PolarHBondContact O-OG 3.45Å; Q147-S150 PolarHBondContact O-N 2.69Å; Q147-S150 VanDerWaalsContact O-N 3.09Å; Q147-S150 PolarHBondContact O-OG 2.93Å; S150-T152 VanDerWaalsContact C-N 3.35Å; S150-T152 PolarHBondContact O-N 3.48Å; S150-I153 PolarHBondContact O-N 2.87Å; S150-A154 VanDerWaalsContact O-CB 3.28Å; S150-A154 WeakPolarHBondContact O-CB 3.21Å; S150-A154 PolarHBondContact O-N 3.43Å
151	E	75.9	Confident	73.5	Confident	48 Å²	48	69.1 Å²	69.1	22%	0.224	35%	0.353	C	S	.	.	H	α-helix	trans	-60.8	-42.3	171.8	-67.4	177.1	-148.9	0	0	111.2	Q147 L155 Q198	Q147-E151 VanDerWaalsContact CG-OE1 3.32Å; Q147-E151 WeakPolarHBondContact CG-OE1 3.49Å; Q147-E151 PolarHBondContact NE2-OE1 2.87Å; Q147-E151 PolarHBondContact O-N 3.35Å; E151-L155 PolarHBondContact O-N 2.62Å; E151-L155 VanDerWaalsContact O-N 3.07Å; E151-Q198 PolarHBondContact OE2-NE2 3.29Å; E151-Q198 VanDerWaalsContact OE2-NE2 3.08Å
152	T	69.6	Low	71.7	Confident	10 Å²	10	74 Å²	74	6%	0.061	39%	0.385	C	S	.	.	H	α-helix	trans	-67.8	-46.1	178.3	-55.7	0	0	0	0	112.2	L15 A18 Y148 M149 S150 A154 L155 V156 L199	L15-T152 HydrophobicContact CD1-CG2 4.11Å; A18-T152 HydrophobicContact CB-CG2 4.16Å; Y148-T152 VanDerWaalsContact O-CB 3.3Å; Y148-T152 WeakPolarHBondContact O-CB 3.38Å; Y148-T152 PolarHBondContact O-N 2.92Å; Y148-T152 PolarHBondContact O-OG1 2.87Å; M149-T152 PolarHBondContact O-N 2.69Å; S150-T152 VanDerWaalsContact C-N 3.35Å; S150-T152 PolarHBondContact O-N 3.48Å; T152-A154 VanDerWaalsContact C-N 3.33Å; T152-A154 PolarHBondContact O-N 3.17Å; T152-L155 WeakPolarHBondContact O-CB 3.41Å; T152-L155 PolarHBondContact O-N 2.8Å; T152-V156 HydrophobicContact CG2-CG2 4.3Å; T152-V156 VanDerWaalsContact O-CG2 3.28Å; T152-V156 WeakPolarHBondContact O-CG2 3.37Å; T152-V156 PolarHBondContact O-N 2.98Å; T152-L199 WeakPolarHBondContact OG1-CD1 3.5Å
153	I	70.4	Confident	70.1	Confident	104 Å²	104	76.1 Å²	76.1	53%	0.533	40%	0.404	S	S	.	.	H	α-helix	trans	-67.7	-36.6	-179.2	-69.7	164.7	0	0	0	110.4	M149 S150 V156 K157	M149-I153 VanDerWaalsContact O-CB 3.27Å; M149-I153 WeakPolarHBondContact O-CB 3.4Å; M149-I153 WeakPolarHBondContact O-CD1 3.41Å; M149-I153 WeakPolarHBondContact O-CG1 3.49Å; M149-I153 PolarHBondContact O-N 2.89Å; S150-I153 PolarHBondContact O-N 2.87Å; I153-V156 PolarHBondContact O-N 3.38Å; I153-K157 VanDerWaalsContact O-CB 3.32Å; I153-K157 WeakPolarHBondContact O-CB 3.15Å; I153-K157 PolarHBondContact O-N 2.84Å
154	A	75	Confident	68.4	Low	59 Å²	59	80.6 Å²	80.6	49%	0.488	42%	0.423	S	S	.	.	H	α-helix	trans	-59.9	-48.7	170.9	0	0	0	0	0	111.3	S150 T152 K157 E158	S150-A154 VanDerWaalsContact O-CB 3.28Å; S150-A154 WeakPolarHBondContact O-CB 3.21Å; S150-A154 PolarHBondContact O-N 3.43Å; T152-A154 VanDerWaalsContact C-N 3.33Å; T152-A154 PolarHBondContact O-N 3.17Å; A154-K157 PolarHBondContact O-N 3.47Å; A154-E158 VanDerWaalsContact O-CB 3.27Å; A154-E158 WeakPolarHBondContact O-CB 3.39Å; A154-E158 PolarHBondContact O-N 2.83Å
155	L	70.3	Confident	66.8	Low	32 Å²	32	86.6 Å²	86.6	17%	0.168	45%	0.454	C	S	.	.	H	α-helix	trans	-60.4	-43.1	174.4	-86.4	162.2	0	0	0	113.1	E151 T152 K157 E158 V159 K195 L199	E151-L155 PolarHBondContact O-N 2.62Å; E151-L155 VanDerWaalsContact O-N 3.07Å; T152-L155 WeakPolarHBondContact O-CB 3.41Å; T152-L155 PolarHBondContact O-N 2.8Å; L155-K157 VanDerWaalsContact C-N 3.33Å; L155-K157 PolarHBondContact O-N 3.25Å; L155-E158 WeakPolarHBondContact CD2-OE2 3.38Å; L155-E158 PolarHBondContact O-N 3.01Å; L155-V159 WeakPolarHBondContact O-CB 3.44Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.46Å; L155-V159 PolarHBondContact O-N 2.87Å; L155-K195 HydrophobicContact CD1-CG 4.37Å; L155-K195 HydrophobicContact CD2-CD 3.88Å; L155-K195 HydrophobicContact CD2-CG 4.34Å; L155-K195 HydrophobicContact CG-CD 4.47Å; L155-L199 HydrophobicContact CD1-CD2 3.89Å
156	V	69.4	Low	65.1	Low	46 Å²	46	90.5 Å²	90.5	28%	0.279	48%	0.483	S	S	.	.	H	α-helix	trans	-60.9	-43.9	176.3	170.2	0	0	0	0	110.3	L15 T152 I153 V159 Q160	L15-V156 HydrophobicContact CD1-CG2 3.86Å; L15-V156 HydrophobicContact CD2-CG2 3.92Å; L15-V156 HydrophobicContact CG-CG2 3.86Å; T152-V156 HydrophobicContact CG2-CG2 4.3Å; T152-V156 VanDerWaalsContact O-CG2 3.28Å; T152-V156 WeakPolarHBondContact O-CG2 3.37Å; T152-V156 PolarHBondContact O-N 2.98Å; I153-V156 PolarHBondContact O-N 3.38Å; V156-V159 PolarHBondContact O-N 3.23Å; V156-Q160 WeakPolarHBondContact O-CA 3.35Å; V156-Q160 WeakPolarHBondContact O-CB 3.29Å; V156-Q160 PolarHBondContact O-N 3.3Å
157	K	73	Confident	63.1	Low	165 Å²	165	89.4 Å²	89.4	72%	0.717	50%	0.495	S	S	*	.	H	α-helix	trans	-71.5	-29.4	179.4	-169.8	177	179.6	-177.2	0	113.4	I153 A154 L155	I153-K157 VanDerWaalsContact O-CB 3.32Å; I153-K157 WeakPolarHBondContact O-CB 3.15Å; I153-K157 PolarHBondContact O-N 2.84Å; A154-K157 PolarHBondContact O-N 3.47Å; L155-K157 VanDerWaalsContact C-N 3.33Å; L155-K157 PolarHBondContact O-N 3.25Å
158	E	68.3	Low	61.3	Low	114 Å²	114	89 Å²	89	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-70.7	-39.1	173.5	-175.1	178.4	-143	0	0	111.4	A154 L155 K195	A154-E158 VanDerWaalsContact O-CB 3.27Å; A154-E158 WeakPolarHBondContact O-CB 3.39Å; A154-E158 PolarHBondContact O-N 2.83Å; L155-E158 WeakPolarHBondContact CD2-OE2 3.38Å; L155-E158 PolarHBondContact O-N 3.01Å; E158-K195 VanDerWaalsContact CD-NZ 3.27Å; E158-K195 IonicContact OE1-NZ 2.78Å; E158-K195 PolarHBondContact OE1-NZ 3.27Å; E158-K195 IonicContact OE2-NZ 3.22Å; E158-K195 PolarHBondContact OE2-NZ 2.84Å
159	V	63.9	Low	59.6	Low	42 Å²	42	92.2 Å²	92.2	26%	0.255	54%	0.54	S	S	.	.	H	α-helix	trans	-76.9	-42.2	175.8	169.6	0	0	0	0	112.5	L155 V156 Q161 P187 I189	L155-V159 WeakPolarHBondContact O-CB 3.44Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.46Å; L155-V159 PolarHBondContact O-N 2.87Å; V156-V159 PolarHBondContact O-N 3.23Å; V159-Q161 VanDerWaalsContact C-N 3.28Å; V159-Q161 PolarHBondContact O-N 3.32Å; V159-Q161 VanDerWaalsContact O-N 3.12Å; V159-P187 HydrophobicContact CG1-CG 4.49Å; V159-I189 HydrophobicContact CB-CD1 4.4Å; V159-I189 HydrophobicContact CG1-CD1 3.85Å; V159-I189 HydrophobicContact CG2-CD1 3.59Å; V159-I189 HydrophobicContact CG2-CG1 3.44Å; V159-I189 VanDerWaalsContact CG2-CG1 3.44Å
160	Q	58.7	Low	58.1	Low	144 Å²	144	98.4 Å²	98.4	67%	0.673	57%	0.572	S	S	*	*	S	Bend	trans	-89.7	70.4	-178.9	-166.3	163.5	-14.1	0	0	109	V156	V156-Q160 WeakPolarHBondContact O-CA 3.35Å; V156-Q160 WeakPolarHBondContact O-CB 3.29Å; V156-Q160 PolarHBondContact O-N 3.3Å
161	Q	48.8	Very low	56.3	Low	150 Å²	150	102.5 Å²	102.5	70%	0.701	59%	0.587	S	S	*	*			trans	-42.1	137.8	173.1	-79.4	-174.5	-28.2	0	0	110.6	V159 S163	V159-Q161 VanDerWaalsContact C-N 3.28Å; V159-Q161 PolarHBondContact O-N 3.32Å; V159-Q161 VanDerWaalsContact O-N 3.12Å; Q161-S163 PolarHBondContact O-N 3.13Å; Q161-S163 VanDerWaalsContact O-N 3.1Å
162	P	46.4	Very low	54.5	Low	107 Å²	107	105.4 Å²	105.4	70%	0.695	61%	0.613	S	S	*	*			trans	-57.9	121.7	175.6	25.8	-33.6	0	0	0	108.6	N164	P162-N164 PolarHBondContact O-N 2.98Å; P162-N164 VanDerWaalsContact O-N 3.14Å; P162-N164 PolarHBondContact O-OD1 3.47Å
163	S	48.6	Very low	53.1	Low	90 Å²	90	110.4 Å²	110.4	63%	0.629	64%	0.643	S	S	*	*			trans	-66.1	114	170.5	50.3	0	0	0	0	108	Q161 L165	Q161-S163 PolarHBondContact O-N 3.13Å; Q161-S163 VanDerWaalsContact O-N 3.1Å; S163-L165 PolarHBondContact O-N 2.99Å
164	N	50.1	Low	51.6	Low	160 Å²	160	111.3 Å²	111.3	86%	0.856	66%	0.655	S	S	*	*			trans	-69.2	33.7	173.6	-66.5	-11.3	0	0	0	112.7	P162	P162-N164 PolarHBondContact O-N 2.98Å; P162-N164 VanDerWaalsContact O-N 3.14Å; P162-N164 PolarHBondContact O-OD1 3.47Å
165	L	48.1	Very low	49.8	Very low	138 Å²	138	115.6 Å²	115.6	72%	0.723	67%	0.667	S	S	*	*			trans	-78.8	128.3	168.1	-69.6	169.3	0	0	0	107.4	S163	S163-L165 PolarHBondContact O-N 2.99Å
166	P	41.6	Very low	48.1	Very low	114 Å²	114	120.5 Å²	120.5	74%	0.74	70%	0.699	S	S	*	*			trans	-63	144.8	-175.4	25.1	-33.9	0	0	0	111.7	G168	P166-G168 VanDerWaalsContact C-N 3.26Å; P166-G168 PolarHBondContact O-N 3.04Å
167	S	40	Very low	46.6	Very low	141 Å²	141	123.8 Å²	123.8	99%	0.986	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	73.8	-177.2	-53.1	0	0	0	0	112.4
168	G	44.6	Very low	45	Very low	68 Å²	68	122.6 Å²	122.6	70%	0.701	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.3	-20.6	177.9	0	0	0	0	0	115.4	P166 L170	P166-G168 VanDerWaalsContact C-N 3.26Å; P166-G168 PolarHBondContact O-N 3.04Å; G168-L170 PolarHBondContact O-N 2.82Å
169	S	39.6	Very low	43.8	Very low	104 Å²	104	125.3 Å²	125.3	73%	0.727	73%	0.734	S	S	*	*			trans	-80.6	79.3	179.5	-165	0	0	0	0	112.2
170	L	40.1	Very low	42.8	Very low	158 Å²	158	129.6 Å²	129.6	83%	0.827	76%	0.755	S	S	*	*			trans	-57.3	152.2	149.9	-69.8	169.4	0	0	0	108.7	G168	G168-L170 PolarHBondContact O-N 2.82Å
171	I	40.5	Very low	41.9	Very low	158 Å²	158	127.4 Å²	127.4	81%	0.81	76%	0.755	S	S	*	*			trans	74.1	90.9	-169.9	-45.9	164.3	0	0	0	113.7
172	S	37.4	Very low	41.8	Very low	109 Å²	109	129.1 Å²	129.1	76%	0.762	76%	0.763	S	S	*	*			trans	-149.5	104.8	142	67.3	0	0	0	0	110.3
173	V	40.3	Very low	41.6	Very low	116 Å²	116	133.1 Å²	133.1	70%	0.703	77%	0.773	S	S	*	*			trans	-60.4	145.3	169.4	176.7	0	0	0	0	109	M175	V173-M175 VanDerWaalsContact C-N 3.26Å; V173-M175 PolarHBondContact O-N 3.44Å
174	P	37.8	Very low	41.4	Very low	122 Å²	122	138.7 Å²	138.7	79%	0.792	78%	0.78	S	S	*	*			trans	-66.1	84.8	170.5	28.1	-35.6	0	0	0	110.9	T176	P174-T176 PolarHBondContact O-N 3.38Å
175	M	38.4	Very low	41.1	Very low	149 Å²	149	140.7 Å²	140.7	73%	0.734	78%	0.781	S	S	*	*			trans	-59.2	129.3	174.9	-92.8	-170	165.3	0	0	111	V173 N177	V173-M175 VanDerWaalsContact C-N 3.26Å; V173-M175 PolarHBondContact O-N 3.44Å; M175-N177 PolarHBondContact O-N 3.01Å; M175-N177 PolarHBondContact SD-ND2 3.03Å; M175-N177 VanDerWaalsContact SD-ND2 3.45Å
176	T	34.4	Very low	41.2	Very low	135 Å²	135	139.2 Å²	139.2	83%	0.828	78%	0.778	S	S	*	*			trans	-76.4	61.6	172.1	51.5	0	0	0	0	111.5	P174 T178	P174-T176 PolarHBondContact O-N 3.38Å; T176-T178 PolarHBondContact O-N 3.38Å
177	N	38.1	Very low	41.5	Very low	116 Å²	116	135.9 Å²	135.9	62%	0.62	76%	0.756	S	S	*	*			trans	-92.5	95.3	-179.8	-88.6	-19.9	0	0	0	112.1	M175 Q179	M175-N177 PolarHBondContact O-N 3.01Å; M175-N177 PolarHBondContact SD-ND2 3.03Å; M175-N177 VanDerWaalsContact SD-ND2 3.45Å; N177-Q179 PolarHBondContact O-N 3.03Å; N177-Q179 VanDerWaalsContact O-N 3.09Å
178	T	40.2	Very low	42.1	Very low	139 Å²	139	135.3 Å²	135.3	85%	0.853	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	11.8	-179.9	33.1	0	0	0	0	115.5	T176	T176-T178 PolarHBondContact O-N 3.38Å
179	Q	42.3	Very low	42.5	Very low	172 Å²	172	136.1 Å²	136.1	80%	0.804	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	1.4	-173.9	-66.2	-165.2	-7.7	0	0	115.9	N177 S181	N177-Q179 PolarHBondContact O-N 3.03Å; N177-Q179 VanDerWaalsContact O-N 3.09Å; Q179-S181 PolarHBondContact O-N 2.85Å
180	L	42.5	Very low	43.1	Very low	132 Å²	132	137.2 Å²	137.2	69%	0.691	73%	0.726	S	S	*	*			trans	-78.1	39.8	-177.3	-151.5	95.4	0	0	0	114.2
181	S	40.9	Very low	43.9	Very low	97 Å²	97	134 Å²	134	68%	0.678	72%	0.717	S	S	*	*			trans	-108.2	1.1	-156.5	58.8	0	0	0	0	117	Q179	Q179-S181 PolarHBondContact O-N 2.85Å
182	Q	45.9	Very low	45.3	Very low	186 Å²	186	130 Å²	130	87%	0.869	70%	0.697	S	S	*	*	S	Bend	trans	-121.9	-8.2	-167.8	-71.1	-168.5	-16.1	0	0	118.3
183	Q	42.3	Very low	47.2	Very low	191 Å²	191	128.4 Å²	128.4	89%	0.893	68%	0.684	S	S	*	*			trans	-140.1	7.5	-171.6	-129.2	178.1	12	0	0	118.5	K185	Q183-K185 PolarHBondContact O-N 2.85Å
184	R	44.5	Very low	49	Very low	208 Å²	208	125.9 Å²	125.9	79%	0.785	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-78.6	118.1	166	-81.9	-173.6	173.2	174.7	-1.1	110	T186	R184-T186 PolarHBondContact O-N 2.69Å
185	K	44.1	Very low	50.9	Low	202 Å²	202	123.5 Å²	123.5	88%	0.878	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-50.7	122.4	157.9	-72.6	-178.1	177	179.8	0	107.4	Q183 P187	Q183-K185 PolarHBondContact O-N 2.85Å; K185-P187 VanDerWaalsContact O-CD 3.3Å; K185-P187 WeakPolarHBondContact O-CD 3.26Å
186	T	49	Very low	52.4	Low	106 Å²	106	120.2 Å²	120.2	65%	0.65	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-69.1	117.2	175.6	46.5	0	0	0	0	108.8	R184	R184-T186 PolarHBondContact O-N 2.69Å
187	P	49.3	Very low	54.6	Low	44 Å²	44	122.7 Å²	122.7	29%	0.286	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-64.1	163.7	169.7	29.8	-34.7	0	0	0	110	V159 K185 I189	V159-P187 HydrophobicContact CG1-CG 4.49Å; K185-P187 VanDerWaalsContact O-CD 3.3Å; K185-P187 WeakPolarHBondContact O-CD 3.26Å; P187-I189 PolarHBondContact O-N 3.3Å
188	D	52.1	Low	56.6	Low	129 Å²	129	121.8 Å²	121.8	69%	0.69	62%	0.622	S	S	*	*	S	Bend	trans	-67.3	36.8	-157.1	-65.2	-76.7	0	0	0	118.6	I190 S191	D188-I190 PolarHBondContact O-N 3.4Å; D188-I190 VanDerWaalsContact O-N 3.12Å; D188-S191 VanDerWaalsContact O-CB 3.28Å; D188-S191 WeakPolarHBondContact O-CB 3.49Å; D188-S191 PolarHBondContact O-N 2.98Å; D188-S191 PolarHBondContact O-OG 2.87Å
189	I	52.7	Low	58.4	Low	85 Å²	85	116.1 Å²	116.1	44%	0.436	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-53.2	-31.4	169.4	-56.1	169.4	0	0	0	111.4	V159 P187 S191	V159-I189 HydrophobicContact CB-CD1 4.4Å; V159-I189 HydrophobicContact CG1-CD1 3.85Å; V159-I189 HydrophobicContact CG2-CD1 3.59Å; V159-I189 HydrophobicContact CG2-CG1 3.44Å; V159-I189 VanDerWaalsContact CG2-CG1 3.44Å; P187-I189 PolarHBondContact O-N 3.3Å; I189-S191 VanDerWaalsContact C-N 3.3Å; I189-S191 PolarHBondContact O-N 3.11Å
190	I	52.6	Low	60.1	Low	128 Å²	128	111.1 Å²	111.1	66%	0.656	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-70.3	-25.5	178.5	-58.9	177	0	0	0	111.8	D188 N192	D188-I190 PolarHBondContact O-N 3.4Å; D188-I190 VanDerWaalsContact O-N 3.12Å; I190-N192 VanDerWaalsContact C-N 3.31Å; I190-N192 PolarHBondContact O-N 3.21Å
191	S	57	Low	61.9	Low	90 Å²	90	107.4 Å²	107.4	63%	0.629	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-66.4	-27	-173.2	69.1	0	0	0	0	114.4	D188 I189	D188-S191 VanDerWaalsContact O-CB 3.28Å; D188-S191 WeakPolarHBondContact O-CB 3.49Å; D188-S191 PolarHBondContact O-N 2.98Å; D188-S191 PolarHBondContact O-OG 2.87Å; I189-S191 VanDerWaalsContact C-N 3.3Å; I189-S191 PolarHBondContact O-N 3.11Å
192	N	69.4	Low	63.8	Low	75 Å²	75	102.8 Å²	102.8	40%	0.401	52%	0.516	S	S	.	.			trans	-130.5	75.7	-175	-160.2	-29.1	0	0	0	113.4	I190 A194 K195 M196	I190-N192 VanDerWaalsContact C-N 3.31Å; I190-N192 PolarHBondContact O-N 3.21Å; N192-A194 PolarHBondContact O-N 3.5Å; N192-A194 WeakPolarHBondContact OD1-CB 3.28Å; N192-A194 PolarHBondContact OD1-N 2.9Å; N192-K195 HydrophobicContact CB-CB 4.04Å; N192-K195 PolarHBondContact O-N 3.04Å; N192-K195 WeakPolarHBondContact OD1-CB 3.35Å; N192-K195 PolarHBondContact OD1-N 3.49Å; N192-M196 PolarHBondContact O-N 3.42Å
193	P	76.9	Confident	65.2	Low	75 Å²	75	95.1 Å²	95.1	49%	0.487	48%	0.481	S	S	.	.	H	α-helix	trans	-64.8	-16.1	174.5	27.3	-35.1	0	0	0	113.4	R197	P193-R197 VanDerWaalsContact O-CG 3.22Å; P193-R197 WeakPolarHBondContact O-CG 3.47Å; P193-R197 PolarHBondContact O-N 3.23Å; P193-R197 VanDerWaalsContact O-N 3.11Å
194	A	79.5	Confident	67	Low	62 Å²	62	89.8 Å²	89.8	51%	0.512	46%	0.456	S	S	.	.	H	α-helix	trans	-72.7	-46.1	173.6	0	0	0	0	0	111.6	N192 M196 R197 Q198	N192-A194 PolarHBondContact O-N 3.5Å; N192-A194 WeakPolarHBondContact OD1-CB 3.28Å; N192-A194 PolarHBondContact OD1-N 2.9Å; A194-M196 VanDerWaalsContact C-N 3.28Å; A194-M196 PolarHBondContact O-N 2.97Å; A194-R197 PolarHBondContact O-N 2.93Å; A194-R197 VanDerWaalsContact O-N 3.11Å; A194-Q198 PolarHBondContact O-N 3.39Å
195	K	75.9	Confident	68.7	Low	73 Å²	73	81.3 Å²	81.3	32%	0.317	42%	0.424	S	S	.	.	H	α-helix	trans	-56.8	-40.6	174.4	-165.8	176.9	-175.7	-172.7	0	111.2	L155 E158 N192 Q198 L199	L155-K195 HydrophobicContact CD1-CG 4.37Å; L155-K195 HydrophobicContact CD2-CD 3.88Å; L155-K195 HydrophobicContact CD2-CG 4.34Å; L155-K195 HydrophobicContact CG-CD 4.47Å; E158-K195 VanDerWaalsContact CD-NZ 3.27Å; E158-K195 IonicContact OE1-NZ 2.78Å; E158-K195 PolarHBondContact OE1-NZ 3.27Å; E158-K195 IonicContact OE2-NZ 3.22Å; E158-K195 PolarHBondContact OE2-NZ 2.84Å; N192-K195 HydrophobicContact CB-CB 4.04Å; N192-K195 PolarHBondContact O-N 3.04Å; N192-K195 WeakPolarHBondContact OD1-CB 3.35Å; N192-K195 PolarHBondContact OD1-N 3.49Å; K195-Q198 PolarHBondContact O-N 3.06Å; K195-L199 PolarHBondContact O-N 3.33Å
196	M	71.7	Confident	70.3	Confident	80 Å²	80	72.1 Å²	72.1	39%	0.394	39%	0.385	S	S	.	.	H	α-helix	trans	-69.1	-38.4	175.1	-167	63.4	178.9	0	0	113.4	A11 N192 A194 L199 D200	A11-M196 HydrophobicContact CB-CE 4.43Å; N192-M196 PolarHBondContact O-N 3.42Å; A194-M196 VanDerWaalsContact C-N 3.28Å; A194-M196 PolarHBondContact O-N 2.97Å; M196-L199 PolarHBondContact O-N 2.99Å; M196-L199 HydrophobicContact SD-CD2 4.43Å; M196-D200 PolarHBondContact O-N 2.99Å
197	R	80.7	Confident	71.8	Confident	186 Å²	186	70.7 Å²	70.7	70%	0.702	37%	0.368	S	S	*	.	H	α-helix	trans	-67	-37.1	173.8	-74.5	170.2	-173.6	179.3	4.4	112.4	P193 A194 T201	P193-R197 VanDerWaalsContact O-CG 3.22Å; P193-R197 WeakPolarHBondContact O-CG 3.47Å; P193-R197 PolarHBondContact O-N 3.23Å; P193-R197 VanDerWaalsContact O-N 3.11Å; A194-R197 PolarHBondContact O-N 2.93Å; A194-R197 VanDerWaalsContact O-N 3.11Å; R197-T201 WeakPolarHBondContact O-CB 3.33Å; R197-T201 PolarHBondContact O-N 3.08Å; R197-T201 PolarHBondContact O-OG1 2.85Å
198	Q	79.2	Confident	73.3	Confident	97 Å²	97	73.3 Å²	73.3	45%	0.453	37%	0.372	S	S	.	.	H	α-helix	trans	-61	-47	172.6	174.1	176.5	-30.2	0	0	110.4	E151 A194 K195 T201 G202	E151-Q198 PolarHBondContact OE2-NE2 3.29Å; E151-Q198 VanDerWaalsContact OE2-NE2 3.08Å; A194-Q198 PolarHBondContact O-N 3.39Å; K195-Q198 PolarHBondContact O-N 3.06Å; Q198-T201 WeakPolarHBondContact O-CB 3.36Å; Q198-T201 PolarHBondContact O-N 3.3Å; Q198-G202 PolarHBondContact O-N 3.38Å
199	L	77.6	Confident	74.7	Confident	21 Å²	21	67.3 Å²	67.3	11%	0.11	34%	0.34	C	S	.	.	H	α-helix	trans	-61.9	-46	178.5	-178.6	61.6	0	0	0	112.8	T152 L155 K195 M196 T201 G202 L203	T152-L199 WeakPolarHBondContact OG1-CD1 3.5Å; L155-L199 HydrophobicContact CD1-CD2 3.89Å; K195-L199 PolarHBondContact O-N 3.33Å; M196-L199 PolarHBondContact O-N 2.99Å; M196-L199 HydrophobicContact SD-CD2 4.43Å; L199-T201 VanDerWaalsContact C-N 3.33Å; L199-T201 PolarHBondContact O-N 2.94Å; L199-G202 PolarHBondContact O-N 2.85Å; L199-L203 WeakPolarHBondContact O-CB 3.32Å; L199-L203 PolarHBondContact O-N 2.86Å
200	D	78.3	Confident	76	Confident	67 Å²	67	64 Å²	64	36%	0.358	32%	0.322	S	S	.	.	H	α-helix	trans	-63.1	-39.7	175.4	-178.3	70.8	0	0	0	111.8	M196 G202 L203 Q204	M196-D200 PolarHBondContact O-N 2.99Å; D200-G202 VanDerWaalsContact C-N 3.32Å; D200-G202 PolarHBondContact O-N 3.17Å; D200-L203 PolarHBondContact O-N 3.06Å; D200-Q204 WeakPolarHBondContact O-CB 3.11Å; D200-Q204 VanDerWaalsContact O-CG 3.31Å; D200-Q204 WeakPolarHBondContact O-CG 3.22Å; D200-Q204 PolarHBondContact O-N 3.35Å; D200-Q204 PolarHBondContact OD2-NE2 3.19Å
201	T	81.3	Confident	77.3	Confident	53 Å²	53	63.2 Å²	63.2	33%	0.325	31%	0.311	S	S	.	.	H	α-helix	trans	-61.5	-41.1	175.2	-57.6	0	0	0	0	111.4	R197 Q198 L199 Y205 I571	R197-T201 WeakPolarHBondContact O-CB 3.33Å; R197-T201 PolarHBondContact O-N 3.08Å; R197-T201 PolarHBondContact O-OG1 2.85Å; Q198-T201 WeakPolarHBondContact O-CB 3.36Å; Q198-T201 PolarHBondContact O-N 3.3Å; L199-T201 VanDerWaalsContact C-N 3.33Å; L199-T201 PolarHBondContact O-N 2.94Å; T201-Y205 PolarHBondContact O-N 3.48Å; T201-I571 HydrophobicContact CG2-CD1 3.93Å
202	G	79.3	Confident	78.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.8	-48	173.8	0	0	0	0	0	113	Q198 L199 D200 Q204 Y205 V206	Q198-G202 PolarHBondContact O-N 3.38Å; L199-G202 PolarHBondContact O-N 2.85Å; D200-G202 VanDerWaalsContact C-N 3.32Å; D200-G202 PolarHBondContact O-N 3.17Å; G202-Q204 VanDerWaalsContact C-N 3.33Å; G202-Q204 PolarHBondContact O-N 3.33Å; G202-Y205 WeakPolarHBondContact O-CA 3.44Å; G202-Y205 WeakPolarHBondContact O-CB 3.37Å; G202-Y205 PolarHBondContact O-N 2.81Å; G202-V206 WeakPolarHBondContact O-CG2 3.28Å; G202-V206 PolarHBondContact O-N 3.15Å
203	L	76	Confident	79.3	Confident	26 Å²	26	56.7 Å²	56.7	14%	0.136	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-38.5	177.2	-173	64.6	0	0	0	112	L199 D200 Y205 V206 R207	L199-L203 WeakPolarHBondContact O-CB 3.32Å; L199-L203 PolarHBondContact O-N 2.86Å; D200-L203 PolarHBondContact O-N 3.06Å; L203-Y205 VanDerWaalsContact C-N 3.33Å; L203-Y205 PolarHBondContact O-N 3.3Å; L203-V206 PolarHBondContact O-N 3.25Å; L203-R207 WeakPolarHBondContact O-CB 3.5Å; L203-R207 WeakPolarHBondContact O-CG 3.46Å; L203-R207 PolarHBondContact O-N 2.84Å
204	Q	80.2	Confident	79.4	Confident	79 Å²	79	55.4 Å²	55.4	37%	0.369	26%	0.26	S	S	.	.	H	α-helix	trans	-62.3	-37.6	170.6	-76.6	-170.5	45	0	0	112.4	D200 G202 R208	D200-Q204 WeakPolarHBondContact O-CB 3.11Å; D200-Q204 VanDerWaalsContact O-CG 3.31Å; D200-Q204 WeakPolarHBondContact O-CG 3.22Å; D200-Q204 PolarHBondContact O-N 3.35Å; D200-Q204 PolarHBondContact OD2-NE2 3.19Å; G202-Q204 VanDerWaalsContact C-N 3.33Å; G202-Q204 PolarHBondContact O-N 3.33Å; Q204-R208 VanDerWaalsContact O-CG 3.3Å; Q204-R208 WeakPolarHBondContact O-CG 3.47Å; Q204-R208 PolarHBondContact O-N 2.88Å; Q204-R208 VanDerWaalsContact OE1-NH2 3.12Å
205	Y	80.4	Confident	79.6	Confident	30 Å²	30	60.5 Å²	60.5	12%	0.118	27%	0.266	C	S	.	.	H	α-helix	trans	-70	-45.1	176.6	178.6	-155.7	0	0	0	111.5	R140 L144 Y148 T201 G202 L203 R207 R208 V209 I570	R140-Y205 PolarHBondContact NE-OH 3.25Å; R140-Y205 VanDerWaalsContact NE-OH 3.08Å; R140-Y205 PolarHBondContact NH2-OH 3.35Å; L144-Y205 HydrophobicContact CD1-CD1 4.01Å; L144-Y205 HydrophobicContact CD1-CD2 4.37Å; L144-Y205 HydrophobicContact CD1-CE1 3.52Å; L144-Y205 HydrophobicContact CD1-CE2 3.91Å; L144-Y205 HydrophobicContact CD1-CG 4.41Å; L144-Y205 VanDerWaalsContact CD1-CZ 3.44Å; L144-Y205 HydrophobicContact CD2-CD1 3.96Å; L144-Y205 HydrophobicContact CD2-CE1 3.38Å; L144-Y205 HydrophobicContact CG-CE1 4.1Å; Y148-Y205 HydrophobicContact CE2-CD1 4.21Å; T201-Y205 PolarHBondContact O-N 3.48Å; G202-Y205 WeakPolarHBondContact O-CA 3.44Å; G202-Y205 WeakPolarHBondContact O-CB 3.37Å; G202-Y205 PolarHBondContact O-N 2.81Å; L203-Y205 VanDerWaalsContact C-N 3.33Å; L203-Y205 PolarHBondContact O-N 3.3Å; Y205-R207 VanDerWaalsContact C-N 3.3Å; Y205-R207 PolarHBondContact O-N 3.48Å; Y205-R208 WeakPolarHBondContact O-CA 3.38Å; Y205-R208 WeakPolarHBondContact O-CB 3.46Å; Y205-R208 PolarHBondContact O-N 2.95Å; Y205-V209 HydrophobicContact CD2-CG2 3.79Å; Y205-V209 HydrophobicContact CE2-CG2 3.44Å; Y205-V209 VanDerWaalsContact CE2-CG2 3.44Å; Y205-V209 PolarHBondContact O-N 2.89Å; Y205-I570 HydrophobicContact CD1-CG2 3.71Å; Y205-I570 HydrophobicContact CD2-CG2 3.63Å; Y205-I570 HydrophobicContact CE1-CD1 4.47Å; Y205-I570 HydrophobicContact CE1-CG2 3.59Å; Y205-I570 HydrophobicContact CE2-CB 4.26Å; Y205-I570 HydrophobicContact CE2-CD1 4.29Å; Y205-I570 HydrophobicContact CE2-CG1 3.84Å; Y205-I570 HydrophobicContact CE2-CG2 3.53Å; Y205-I570 HydrophobicContact CG-CG2 3.74Å; Y205-I570 VanDerWaalsContact OH-CD1 3.28Å; Y205-I570 WeakPolarHBondContact OH-CD1 3.47Å
206	V	77.7	Confident	80.1	Confident	9 Å²	9	57 Å²	57	6%	0.055	25%	0.251	C	S	.	.	H	α-helix	trans	-55.6	-44.8	172.4	173.7	0	0	0	0	110.7	L144 E145 Y148 G202 L203 R208 V209 R210	L144-V206 HydrophobicContact CB-CG2 4.18Å; E145-V206 HydrophobicContact CG-CG1 4.36Å; Y148-V206 HydrophobicContact CD2-CG2 3.81Å; Y148-V206 HydrophobicContact CE2-CG2 4.49Å; G202-V206 WeakPolarHBondContact O-CG2 3.28Å; G202-V206 PolarHBondContact O-N 3.15Å; L203-V206 PolarHBondContact O-N 3.25Å; V206-R208 VanDerWaalsContact C-N 3.34Å; V206-R208 PolarHBondContact O-N 3.48Å; V206-V209 PolarHBondContact O-N 3.24Å; V206-R210 WeakPolarHBondContact O-CB 3.15Å; V206-R210 PolarHBondContact O-N 2.93Å
207	R	79	Confident	80.7	Confident	75 Å²	75	53.8 Å²	53.8	28%	0.283	24%	0.235	S	C	.	.	H	α-helix	trans	-60.8	-35.9	173.8	-79.1	177.1	162.2	143	-2.5	113.6	L203 Y205 R211 E292	L203-R207 WeakPolarHBondContact O-CB 3.5Å; L203-R207 WeakPolarHBondContact O-CG 3.46Å; L203-R207 PolarHBondContact O-N 2.84Å; Y205-R207 VanDerWaalsContact C-N 3.3Å; Y205-R207 PolarHBondContact O-N 3.48Å; R207-R211 WeakPolarHBondContact O-CG 3.37Å; R207-R211 PolarHBondContact O-N 2.87Å; R207-R211 VanDerWaalsContact O-N 3.08Å; R207-E292 IonicContact CZ-OE1 2.86Å; R207-E292 IonicContact NE-OE1 3.23Å; R207-E292 PolarHBondContact NE-OE1 3.39Å; R207-E292 IonicContact NH2-OE1 3.61Å; R207-E292 PolarHBondContact NH2-OE1 3.24Å; R207-E292 IonicContact NH2-OE2 3.52Å; R207-E292 PolarHBondContact NH2-OE2 3.26Å
208	R	81.8	Confident	81	Confident	100 Å²	100	48 Å²	48	38%	0.377	22%	0.216	S	C	.	.	H	α-helix	trans	-67.8	-43.4	174	-69.1	168.3	-150.9	-176.1	6.8	111.6	Q204 Y205 V206 R211 Q212 I570	Q204-R208 VanDerWaalsContact O-CG 3.3Å; Q204-R208 WeakPolarHBondContact O-CG 3.47Å; Q204-R208 PolarHBondContact O-N 2.88Å; Q204-R208 VanDerWaalsContact OE1-NH2 3.12Å; Y205-R208 WeakPolarHBondContact O-CA 3.38Å; Y205-R208 WeakPolarHBondContact O-CB 3.46Å; Y205-R208 PolarHBondContact O-N 2.95Å; V206-R208 VanDerWaalsContact C-N 3.34Å; V206-R208 PolarHBondContact O-N 3.48Å; R208-R211 WeakPolarHBondContact O-CB 3.43Å; R208-R211 PolarHBondContact O-N 3.08Å; R208-Q212 PolarHBondContact O-N 3.28Å; R208-I570 PolarHBondContact NH1-O 3.46Å
209	V	82.4	Confident	81.5	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-38.2	177.2	177.8	0	0	0	0	111.2	V137 R140 M141 L144 Y205 V206 R211 Q212 F213	V137-V209 HydrophobicContact CG1-CG1 4.11Å; R140-V209 HydrophobicContact CG-CG1 4.41Å; M141-V209 HydrophobicContact CB-CG1 3.99Å; L144-V209 HydrophobicContact CD1-CB 4.48Å; L144-V209 HydrophobicContact CD1-CG2 3.79Å; Y205-V209 HydrophobicContact CD2-CG2 3.79Å; Y205-V209 HydrophobicContact CE2-CG2 3.44Å; Y205-V209 VanDerWaalsContact CE2-CG2 3.44Å; Y205-V209 PolarHBondContact O-N 2.89Å; V206-V209 PolarHBondContact O-N 3.24Å; V209-R211 VanDerWaalsContact C-N 3.32Å; V209-R211 PolarHBondContact O-N 2.91Å; V209-Q212 WeakPolarHBondContact O-CB 3.49Å; V209-Q212 PolarHBondContact O-N 2.9Å; V209-Q212 VanDerWaalsContact O-N 3.16Å; V209-F213 WeakPolarHBondContact O-CB 3.37Å; V209-F213 PolarHBondContact O-N 3.49Å
210	R	79.5	Confident	82.1	Confident	15 Å²	15	43.2 Å²	43.2	6%	0.057	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-36.3	172.6	-167.2	168.7	177.8	146.4	-5	112.1	M141 V206 F213 C214 Y291	M141-R210 HydrophobicContact CE-CG 4.22Å; V206-R210 WeakPolarHBondContact O-CB 3.15Å; V206-R210 PolarHBondContact O-N 2.93Å; R210-F213 WeakPolarHBondContact O-CB 3.47Å; R210-C214 PolarHBondContact O-N 3.11Å; R210-C214 VanDerWaalsContact O-N 3.12Å; R210-C214 PolarHBondContact O-SG 3Å; R210-Y291 HydrophobicContact CG-CD1 4.4Å; R210-Y291 HydrophobicContact CG-CE1 3.84Å; R210-Y291 PolarHBondContact NH2-O 2.87Å
211	R	80.1	Confident	82.7	Confident	113 Å²	113	40 Å²	40	43%	0.426	18%	0.176	S	C	.	.	H	α-helix	trans	-69.2	-39.2	170.6	-73.8	168	172.6	161.2	2	113.3	R207 R208 V209 F213 R215 E288	R207-R211 WeakPolarHBondContact O-CG 3.37Å; R207-R211 PolarHBondContact O-N 2.87Å; R207-R211 VanDerWaalsContact O-N 3.08Å; R208-R211 WeakPolarHBondContact O-CB 3.43Å; R208-R211 PolarHBondContact O-N 3.08Å; V209-R211 VanDerWaalsContact C-N 3.32Å; V209-R211 PolarHBondContact O-N 2.91Å; R211-F213 VanDerWaalsContact C-N 3.32Å; R211-R215 WeakPolarHBondContact O-CG 3.25Å; R211-R215 PolarHBondContact O-N 3.38Å; R211-E288 IonicContact CZ-OE1 3.37Å; R211-E288 IonicContact CZ-OE2 3.57Å; R211-E288 IonicContact NE-OE1 2.69Å; R211-E288 PolarHBondContact NE-OE1 2.95Å; R211-E288 IonicContact NE-OE2 3.62Å; R211-E288 IonicContact NH2-OE1 3.84Å; R211-E288 PolarHBondContact NH2-OE1 2.84Å; R211-E288 IonicContact NH2-OE2 3.69Å; R211-E288 PolarHBondContact NH2-OE2 3.34Å
212	Q	82.6	Confident	83.1	Confident	24 Å²	24	39.2 Å²	39.2	11%	0.112	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-45.1	173.2	-170.5	-175.6	18.7	0	0	109.9	V137 R208 V209 R215 T216	V137-Q212 HydrophobicContact CG1-CG 4.48Å; V137-Q212 HydrophobicContact CG2-CG 4.33Å; R208-Q212 PolarHBondContact O-N 3.28Å; V209-Q212 WeakPolarHBondContact O-CB 3.49Å; V209-Q212 PolarHBondContact O-N 2.9Å; V209-Q212 VanDerWaalsContact O-N 3.16Å; Q212-R215 WeakPolarHBondContact O-CB 3.5Å; Q212-R215 PolarHBondContact O-N 3.24Å; Q212-R215 VanDerWaalsContact O-N 3.15Å; Q212-T216 PolarHBondContact O-N 3.24Å; Q212-T216 PolarHBondContact O-OG1 3.44Å
213	F	84.7	Confident	83.8	Confident	3 Å²	3	39.2 Å²	39.2	1%	0.013	17%	0.17	C	C	.	.	H	α-helix	trans	-56.8	-54.1	178.5	178.1	-116.9	0	0	0	112.6	V137 V138 M141 V209 R210 R211 R215 T216 E217	V137-F213 HydrophobicContact CG1-CB 3.79Å; V137-F213 HydrophobicContact CG1-CD2 4.22Å; V137-F213 HydrophobicContact CG1-CG 4.5Å; V138-F213 HydrophobicContact CG2-CD2 3.83Å; V138-F213 HydrophobicContact CG2-CE2 3.25Å; V138-F213 HydrophobicContact CG2-CZ 3.94Å; M141-F213 HydrophobicContact SD-CB 4.48Å; M141-F213 HydrophobicContact SD-CD1 4.36Å; M141-F213 HydrophobicContact SD-CG 4.41Å; V209-F213 WeakPolarHBondContact O-CB 3.37Å; V209-F213 PolarHBondContact O-N 3.49Å; R210-F213 WeakPolarHBondContact O-CB 3.47Å; R211-F213 VanDerWaalsContact C-N 3.32Å; F213-R215 PolarHBondContact O-N 2.94Å; F213-R215 VanDerWaalsContact O-N 3.12Å; F213-T216 WeakPolarHBondContact CA-OG1 3.34Å; F213-T216 PolarHBondContact O-N 2.92Å; F213-T216 PolarHBondContact O-OG1 2.84Å; F213-E217 HydrophobicContact CD1-CG 4.33Å; F213-E217 HydrophobicContact CD2-CG 4.11Å; F213-E217 HydrophobicContact CE1-CG 3.89Å; F213-E217 VanDerWaalsContact CE2-CD 3.45Å; F213-E217 HydrophobicContact CE2-CG 3.6Å; F213-E217 HydrophobicContact CG-CG 4.44Å; F213-E217 HydrophobicContact CZ-CG 3.5Å; F213-E217 WeakPolarHBondContact CZ-OE2 3.44Å; F213-E217 WeakPolarHBondContact O-CG 3.29Å; F213-E217 PolarHBondContact O-N 3.21Å
214	C	80.1	Confident	84.7	Confident	49 Å²	49	38 Å²	38	33%	0.331	16%	0.163	S	C	.	.	H	α-helix	trans	-58.9	-28.9	178.5	-63.2	0	0	0	0	113	R210 H218 Y291	R210-C214 PolarHBondContact O-N 3.11Å; R210-C214 VanDerWaalsContact O-N 3.12Å; R210-C214 PolarHBondContact O-SG 3Å; C214-H218 WeakPolarHBondContact O-CB 3.43Å; C214-H218 PolarHBondContact O-N 3.18Å; C214-Y291 VanDerWaalsContact SG-CE1 3.55Å
215	R	82.5	Confident	85.4	Confident	168 Å²	168	34.4 Å²	34.4	63%	0.634	15%	0.147	S	C	*	.	H	α-helix	trans	-76.6	-38.3	173.3	-64.5	170.8	-175.9	179.6	0.2	112.5	R93 R211 Q212 F213 H218 D219	R93-R215 PolarHBondContact NH2-O 2.94Å; R211-R215 WeakPolarHBondContact O-CG 3.25Å; R211-R215 PolarHBondContact O-N 3.38Å; Q212-R215 WeakPolarHBondContact O-CB 3.5Å; Q212-R215 PolarHBondContact O-N 3.24Å; Q212-R215 VanDerWaalsContact O-N 3.15Å; F213-R215 PolarHBondContact O-N 2.94Å; F213-R215 VanDerWaalsContact O-N 3.12Å; R215-H218 PolarHBondContact O-N 3.41Å; R215-D219 PolarHBondContact O-N 2.95Å; R215-D219 VanDerWaalsContact O-N 3.09Å; R215-D219 VanDerWaalsContact O-OD1 3.12Å
216	T	86	Confident	86	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-66.9	-36.4	172.8	42.4	0	0	0	0	112.2	E133 V137 Q212 F213 A220	E133-T216 HydrophobicContact CG-CG2 3.87Å; V137-T216 HydrophobicContact CG2-CG2 4.16Å; Q212-T216 PolarHBondContact O-N 3.24Å; Q212-T216 PolarHBondContact O-OG1 3.44Å; F213-T216 WeakPolarHBondContact CA-OG1 3.34Å; F213-T216 PolarHBondContact O-N 2.92Å; F213-T216 PolarHBondContact O-OG1 2.84Å; T216-A220 VanDerWaalsContact O-CB 3.23Å; T216-A220 WeakPolarHBondContact O-CB 3.43Å; T216-A220 PolarHBondContact O-N 3.02Å
217	E	85.7	Confident	86.8	Confident	11 Å²	11	32.7 Å²	32.7	5%	0.051	14%	0.139	C	C	.	.	H	α-helix	trans	-62.8	-42.9	173	-65	-64.3	68	0	0	111.6	K34 S134 F213 A220 A221 V282	K34-E217 VanDerWaalsContact CE-CD 3.48Å; K34-E217 WeakPolarHBondContact CE-OE1 3.28Å; K34-E217 WeakPolarHBondContact CE-OE2 3.25Å; K34-E217 IonicContact NZ-OE1 3.36Å; K34-E217 PolarHBondContact NZ-OE1 2.72Å; K34-E217 IonicContact NZ-OE2 2.78Å; K34-E217 PolarHBondContact NZ-OE2 3.43Å; S134-E217 WeakPolarHBondContact CB-OE1 3.37Å; S134-E217 PolarHBondContact OG-OE1 3.09Å; F213-E217 HydrophobicContact CD1-CG 4.33Å; F213-E217 HydrophobicContact CD2-CG 4.11Å; F213-E217 HydrophobicContact CE1-CG 3.89Å; F213-E217 VanDerWaalsContact CE2-CD 3.45Å; F213-E217 HydrophobicContact CE2-CG 3.6Å; F213-E217 HydrophobicContact CG-CG 4.44Å; F213-E217 HydrophobicContact CZ-CG 3.5Å; F213-E217 WeakPolarHBondContact CZ-OE2 3.44Å; F213-E217 WeakPolarHBondContact O-CG 3.29Å; F213-E217 PolarHBondContact O-N 3.21Å; E217-A220 PolarHBondContact O-N 2.94Å; E217-A221 VanDerWaalsContact O-CB 3.23Å; E217-A221 WeakPolarHBondContact O-CB 3.26Å; E217-A221 PolarHBondContact O-N 3.48Å; E217-V282 HydrophobicContact CB-CG1 4.11Å; E217-V282 HydrophobicContact CB-CG2 4.41Å
218	H	85.9	Confident	87.6	Confident	65 Å²	65	29.1 Å²	29.1	30%	0.301	13%	0.126	S	C	.	.	H	α-helix	trans	-66.5	-46.7	-179.7	-165.9	60.1	0	0	0	112.1	C214 R215 A220 A221 I222 V282	C214-H218 WeakPolarHBondContact O-CB 3.43Å; C214-H218 PolarHBondContact O-N 3.18Å; R215-H218 PolarHBondContact O-N 3.41Å; H218-A220 PolarHBondContact O-N 3.16Å; H218-A221 PolarHBondContact O-N 2.84Å; H218-I222 VanDerWaalsContact O-CG1 3.28Å; H218-I222 WeakPolarHBondContact O-CG1 3.45Å; H218-I222 PolarHBondContact O-N 2.83Å; H218-V282 HydrophobicContact CB-CG1 3.97Å
219	D	89.2	Confident	88.2	Confident	16 Å²	16	24.3 Å²	24.3	9%	0.086	11%	0.108	C	C	.	.	H	α-helix	trans	-57.1	-47.5	171.9	-79.6	44.4	0	0	0	111.8	I89 R93 R130 R215 A221 I222 I223	I89-D219 HydrophobicContact CG2-CB 4.41Å; I89-D219 VanDerWaalsContact CG2-CG 3.47Å; I89-D219 WeakPolarHBondContact CG2-OD2 3.22Å; R93-D219 IonicContact CZ-OD1 3.94Å; R93-D219 IonicContact CZ-OD2 3.67Å; R93-D219 IonicContact NE-OD2 3.66Å; R93-D219 PolarHBondContact NE-OD2 3.17Å; R93-D219 IonicContact NH2-OD1 2.62Å; R93-D219 PolarHBondContact NH2-OD1 3.43Å; R93-D219 IonicContact NH2-OD2 2.65Å; R93-D219 PolarHBondContact NH2-OD2 3.22Å; R130-D219 IonicContact CZ-OD2 3.86Å; R130-D219 IonicContact NH1-OD2 3.1Å; R130-D219 PolarHBondContact NH1-OD2 3.29Å; R130-D219 IonicContact NH2-OD2 3.6Å; R130-D219 PolarHBondContact NH2-OD2 3.47Å; R215-D219 PolarHBondContact O-N 2.95Å; R215-D219 VanDerWaalsContact O-N 3.09Å; R215-D219 VanDerWaalsContact O-OD1 3.12Å; D219-A221 PolarHBondContact O-N 2.78Å; D219-I222 PolarHBondContact O-N 2.86Å; D219-I223 WeakPolarHBondContact O-CG1 3.29Å; D219-I223 PolarHBondContact O-N 3.34Å
220	A	91.6	Very high	88.8	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-64.4	-39.1	-179.5	0	0	0	0	0	112.3	R130 Y131 T216 E217 H218 A224	R130-A220 HydrophobicContact CB-CB 3.77Å; Y131-A220 HydrophobicContact CD1-CB 4.43Å; T216-A220 VanDerWaalsContact O-CB 3.23Å; T216-A220 WeakPolarHBondContact O-CB 3.43Å; T216-A220 PolarHBondContact O-N 3.02Å; E217-A220 PolarHBondContact O-N 2.94Å; H218-A220 PolarHBondContact O-N 3.16Å; A220-A224 VanDerWaalsContact O-CB 3.23Å; A220-A224 WeakPolarHBondContact O-CB 3.45Å; A220-A224 PolarHBondContact O-N 3.3Å
221	A	90.6	Very high	89.5	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.1	-42.2	175.3	0	0	0	0	0	112.2	E217 H218 D219 L225 F279 V282	E217-A221 VanDerWaalsContact O-CB 3.23Å; E217-A221 WeakPolarHBondContact O-CB 3.26Å; E217-A221 PolarHBondContact O-N 3.48Å; H218-A221 PolarHBondContact O-N 2.84Å; D219-A221 PolarHBondContact O-N 2.78Å; A221-L225 VanDerWaalsContact O-CB 3.29Å; A221-L225 WeakPolarHBondContact O-CB 3.1Å; A221-L225 PolarHBondContact O-N 2.98Å; A221-F279 HydrophobicContact CB-CB 4.44Å; A221-F279 HydrophobicContact CB-CD2 3.73Å; A221-F279 HydrophobicContact CB-CE2 4.33Å; A221-F279 HydrophobicContact CB-CG 4.38Å; A221-V282 HydrophobicContact CB-CB 4.28Å; A221-V282 HydrophobicContact CB-CG1 4.36Å; A221-V282 HydrophobicContact CB-CG2 4.43Å
222	I	90.5	Very high	90.3	Very high	37 Å²	37	19.1 Å²	19.1	19%	0.19	9%	0.089	C	C	.	.	H	α-helix	trans	-59.9	-52.5	174.6	-66.1	163.1	0	0	0	110	I89 H218 D219 A224 L225 T226 F279	I89-I222 HydrophobicContact CD1-CB 4.23Å; I89-I222 HydrophobicContact CD1-CD1 4.3Å; I89-I222 HydrophobicContact CD1-CG2 3.71Å; H218-I222 VanDerWaalsContact O-CG1 3.28Å; H218-I222 WeakPolarHBondContact O-CG1 3.45Å; H218-I222 PolarHBondContact O-N 2.83Å; D219-I222 PolarHBondContact O-N 2.86Å; I222-A224 PolarHBondContact O-N 3Å; I222-L225 PolarHBondContact O-N 3.35Å; I222-L225 VanDerWaalsContact O-N 3.16Å; I222-T226 PolarHBondContact O-N 3.4Å; I222-T226 PolarHBondContact O-OG1 3.37Å; I222-T226 VanDerWaalsContact O-OG1 3.08Å; I222-F279 HydrophobicContact CG1-CE2 3.75Å
223	I	93.5	Very high	90.9	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.9	-37	-175.7	-63.3	-57	0	0	0	112.5	T82 V85 D86 I89 A126 P127 R130 D219 S227	T82-I223 HydrophobicContact CG2-CG2 4.26Å; V85-I223 HydrophobicContact CB-CD1 4.18Å; V85-I223 HydrophobicContact CG1-CD1 3.72Å; D86-I223 HydrophobicContact CB-CD1 3.88Å; D86-I223 HydrophobicContact CB-CG1 4.39Å; I89-I223 HydrophobicContact CD1-CD1 3.96Å; I89-I223 HydrophobicContact CD1-CG1 4.43Å; A126-I223 HydrophobicContact CB-CG2 4.06Å; P127-I223 HydrophobicContact CG-CG2 4.16Å; R130-I223 HydrophobicContact CG-CB 4.31Å; R130-I223 HydrophobicContact CG-CG1 4.25Å; R130-I223 HydrophobicContact CG-CG2 4.44Å; D219-I223 WeakPolarHBondContact O-CG1 3.29Å; D219-I223 PolarHBondContact O-N 3.34Å; I223-S227 VanDerWaalsContact O-CB 3.27Å; I223-S227 WeakPolarHBondContact O-CB 3.47Å; I223-S227 PolarHBondContact O-N 3.06Å
224	A	94.6	Very high	91.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.1	-45.8	171.1	0	0	0	0	0	111.5	Y131 A220 I222 S227 G228 W271 S275	Y131-A224 WeakPolarHBondContact OH-CB 2.95Å; A220-A224 VanDerWaalsContact O-CB 3.23Å; A220-A224 WeakPolarHBondContact O-CB 3.45Å; A220-A224 PolarHBondContact O-N 3.3Å; I222-A224 PolarHBondContact O-N 3Å; A224-S227 PolarHBondContact O-N 3.21Å; A224-G228 PolarHBondContact O-N 3.18Å; A224-W271 HydrophobicContact CB-CH2 3.66Å; A224-W271 HydrophobicContact CB-CZ2 4.06Å; A224-S275 WeakPolarHBondContact O-CB 3.17Å; A224-S275 PolarHBondContact O-OG 3.49Å; A224-S275 VanDerWaalsContact O-OG 3.11Å
225	L	93.9	Very high	92.1	Very high	4 Å²	4	17 Å²	17	2%	0.021	8%	0.077	C	C	.	.	H	α-helix	trans	-65.4	-42.8	178.4	-172.4	66.8	0	0	0	112.5	A221 I222 G228 V229 F276 F279 I383 F389	A221-L225 VanDerWaalsContact O-CB 3.29Å; A221-L225 WeakPolarHBondContact O-CB 3.1Å; A221-L225 PolarHBondContact O-N 2.98Å; I222-L225 PolarHBondContact O-N 3.35Å; I222-L225 VanDerWaalsContact O-N 3.16Å; L225-G228 PolarHBondContact O-N 3.13Å; L225-V229 HydrophobicContact CD1-CG2 3.88Å; L225-V229 HydrophobicContact CG-CG2 4.25Å; L225-V229 VanDerWaalsContact O-CB 3.23Å; L225-V229 WeakPolarHBondContact O-CB 3.33Å; L225-V229 WeakPolarHBondContact O-CG2 3.25Å; L225-V229 PolarHBondContact O-N 3.29Å; L225-F276 HydrophobicContact CD1-CD1 4.15Å; L225-F276 HydrophobicContact CD1-CD2 3.86Å; L225-F276 HydrophobicContact CD1-CE1 4.3Å; L225-F276 HydrophobicContact CD1-CE2 4.02Å; L225-F276 HydrophobicContact CD1-CG 3.93Å; L225-F276 HydrophobicContact CD1-CZ 4.25Å; L225-F279 HydrophobicContact CB-CD2 4.37Å; L225-F279 HydrophobicContact CD2-CB 4.35Å; L225-F279 HydrophobicContact CD2-CD2 3.86Å; L225-F279 HydrophobicContact CD2-CE2 4.39Å; L225-F279 HydrophobicContact CD2-CG 4.04Å; L225-I383 HydrophobicContact CD1-CG2 4.43Å; L225-I383 HydrophobicContact CD2-CD1 3.75Å; L225-I383 HydrophobicContact CD2-CG1 4.39Å; L225-I383 HydrophobicContact CD2-CG2 4.23Å; L225-I383 HydrophobicContact CG-CD1 4.24Å; L225-I383 HydrophobicContact CG-CG1 4.47Å; L225-I383 HydrophobicContact CG-CG2 4.5Å; L225-F389 HydrophobicContact CD2-CD2 3.89Å; L225-F389 HydrophobicContact CD2-CE2 3.27Å; L225-F389 HydrophobicContact CD2-CZ 3.87Å
226	T	93.5	Very high	92.7	Very high	2 Å²	2	9.1 Å²	9.1	1%	0.012	5%	0.048	C	C	.	.	H	α-helix	trans	-58.6	-46.4	172.6	-59.3	0	0	0	0	111.2	V85 I222 I230	V85-T226 HydrophobicContact CB-CG2 4.16Å; V85-T226 HydrophobicContact CG1-CG2 4.42Å; V85-T226 HydrophobicContact CG2-CG2 3.95Å; I222-T226 PolarHBondContact O-N 3.4Å; I222-T226 PolarHBondContact O-OG1 3.37Å; I222-T226 VanDerWaalsContact O-OG1 3.08Å; T226-I230 HydrophobicContact CG2-CD1 3.87Å; T226-I230 HydrophobicContact CG2-CG1 4.3Å; T226-I230 WeakPolarHBondContact O-CA 3.41Å; T226-I230 VanDerWaalsContact O-CB 3.31Å; T226-I230 WeakPolarHBondContact O-CB 3.4Å; T226-I230 WeakPolarHBondContact O-CG1 3.28Å; T226-I230 PolarHBondContact O-N 3.05Å
227	S	95.5	Very high	93.1	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.053	C	C	.	.	I	π-helix	trans	-63.2	-42.4	177.2	169.1	0	0	0	0	113	F41 Q78 I223 A224 G231 A232 W271	F41-S227 WeakPolarHBondContact CE2-OG 3.49Å; Q78-S227 VanDerWaalsContact CD-OG 3.25Å; Q78-S227 PolarHBondContact NE2-OG 2.64Å; Q78-S227 VanDerWaalsContact NE2-OG 3.08Å; Q78-S227 PolarHBondContact OE1-O 3.07Å; Q78-S227 PolarHBondContact OE1-OG 3.44Å; I223-S227 VanDerWaalsContact O-CB 3.27Å; I223-S227 WeakPolarHBondContact O-CB 3.47Å; I223-S227 PolarHBondContact O-N 3.06Å; A224-S227 PolarHBondContact O-N 3.21Å; S227-G231 CarbonylContact O-C 3.59Å; S227-G231 WeakPolarHBondContact O-CA 3.45Å; S227-G231 PolarHBondContact O-N 3.37Å; S227-A232 PolarHBondContact O-N 2.73Å; S227-W271 PolarHBondContact OG-NE1 3.19Å
228	G	95.6	Very high	93.5	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.054	C	C	.	.	I	π-helix	trans	-62.7	-57.4	174.2	0	0	0	0	0	111.3	A224 L225 A232 G233 I272	A224-G228 PolarHBondContact O-N 3.18Å; L225-G228 PolarHBondContact O-N 3.13Å; G228-A232 CarbonylContact O-C 3.56Å; G228-A232 PolarHBondContact O-N 2.86Å; G228-G233 PolarHBondContact O-N 2.82Å; G228-I272 WeakPolarHBondContact O-CG1 3.28Å
229	V	94.8	Very high	93.8	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.04	C	C	.	.	I	π-helix	trans	-73.2	-34	-169.8	168.1	0	0	0	0	113.8	L225 P234 F276 Y382 I383 Y386	L225-V229 HydrophobicContact CD1-CG2 3.88Å; L225-V229 HydrophobicContact CG-CG2 4.25Å; L225-V229 VanDerWaalsContact O-CB 3.23Å; L225-V229 WeakPolarHBondContact O-CB 3.33Å; L225-V229 WeakPolarHBondContact O-CG2 3.25Å; L225-V229 PolarHBondContact O-N 3.29Å; V229-P234 WeakPolarHBondContact O-CD 3.28Å; V229-F276 HydrophobicContact CG2-CE2 3.68Å; V229-F276 HydrophobicContact CG2-CZ 4Å; V229-Y382 HydrophobicContact CG1-CD1 3.6Å; V229-Y382 HydrophobicContact CG1-CE1 3.75Å; V229-I383 HydrophobicContact CB-CG1 4.37Å; V229-I383 HydrophobicContact CG1-CB 4.33Å; V229-I383 HydrophobicContact CG1-CG1 3.88Å; V229-I383 HydrophobicContact CG2-CG1 4.23Å; V229-I383 HydrophobicContact CG2-CG2 4.24Å; V229-Y386 HydrophobicContact CG1-CD2 3.82Å; V229-Y386 HydrophobicContact CG1-CE2 3.92Å; V229-Y386 VanDerWaalsContact O-CE2 3.31Å; V229-Y386 WeakPolarHBondContact O-CE2 3.46Å; V229-Y386 PolarHBondContact O-OH 3.22Å
230	I	94.4	Very high	93.9	Very high	21 Å²	21	7.3 Å²	7.3	11%	0.108	5%	0.046	C	C	.	.	I	π-helix	trans	-104.6	-30.3	-177.2	-45.7	-171.3	0	0	0	111.8	G77 I81 T226 P234 L379 Y382	G77-I230 WeakPolarHBondContact CA-O 3.31Å; I81-I230 HydrophobicContact CB-CG2 4.19Å; I81-I230 HydrophobicContact CD1-CG2 3.88Å; I81-I230 HydrophobicContact CG2-CD1 3.88Å; I81-I230 HydrophobicContact CG2-CG2 3.97Å; T226-I230 HydrophobicContact CG2-CD1 3.87Å; T226-I230 HydrophobicContact CG2-CG1 4.3Å; T226-I230 WeakPolarHBondContact O-CA 3.41Å; T226-I230 VanDerWaalsContact O-CB 3.31Å; T226-I230 WeakPolarHBondContact O-CB 3.4Å; T226-I230 WeakPolarHBondContact O-CG1 3.28Å; T226-I230 PolarHBondContact O-N 3.05Å; I230-P234 WeakPolarHBondContact O-CD 3.36Å; I230-P234 WeakPolarHBondContact O-CG 3.25Å; I230-L379 HydrophobicContact CD1-CD1 3.98Å; I230-Y382 HydrophobicContact CB-CE1 4.49Å; I230-Y382 HydrophobicContact CG1-CD1 4.07Å; I230-Y382 HydrophobicContact CG1-CE1 3.86Å
231	G	94.5	Very high	93.9	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	6%	0.055	C	C	.	.	I	π-helix	trans	-84.6	-75.6	174.1	0	0	0	0	0	112.2	S227 Y235	S227-G231 CarbonylContact O-C 3.59Å; S227-G231 WeakPolarHBondContact O-CA 3.45Å; S227-G231 PolarHBondContact O-N 3.37Å; G231-Y235 WeakPolarHBondContact O-CB 3.47Å; G231-Y235 PolarHBondContact O-N 3Å
232	A	95.8	Very high	93.8	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.058	C	C	.	.	I	π-helix	trans	-72.2	-30.4	-170.8	0	0	0	0	0	114.7	F44 S227 G228 A236 C268 I272	F44-A232 HydrophobicContact CD2-CB 4Å; F44-A232 HydrophobicContact CE1-CB 4.16Å; F44-A232 HydrophobicContact CE2-CB 3.62Å; F44-A232 HydrophobicContact CG-CB 4.43Å; F44-A232 HydrophobicContact CZ-CB 3.71Å; S227-A232 PolarHBondContact O-N 2.73Å; G228-A232 CarbonylContact O-C 3.56Å; G228-A232 PolarHBondContact O-N 2.86Å; A232-A236 VanDerWaalsContact O-CB 3.27Å; A232-A236 WeakPolarHBondContact O-CB 3.43Å; A232-A236 PolarHBondContact O-N 3.03Å; A232-C268 HydrophobicContact CB-CB 4.13Å; A232-I272 HydrophobicContact CB-CD1 4.44Å; A232-I272 HydrophobicContact CB-CG1 4.06Å
233	G	95	Very high	93.7	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-60.9	-59.4	178.9	0	0	0	0	0	113.1	G228 Y235 A236 I237 Y386	G228-G233 PolarHBondContact O-N 2.82Å; G233-Y235 VanDerWaalsContact C-N 3.25Å; G233-Y235 PolarHBondContact O-N 2.82Å; G233-A236 PolarHBondContact O-N 3.32Å; G233-I237 WeakPolarHBondContact O-CG1 3.25Å; G233-I237 PolarHBondContact O-N 3.37Å; G233-I237 VanDerWaalsContact O-N 3.09Å; G233-Y386 WeakPolarHBondContact CA-OH 3.48Å
234	P	94.9	Very high	93.4	Very high	30 Å²	30	12.2 Å²	12.2	20%	0.195	7%	0.068	C	C	.	.	H	α-helix	trans	-63.6	-33.9	177.6	-24.9	37.3	0	0	0	111.8	V73 V229 I230 I237 S238 Y386	V73-P234 HydrophobicContact CG1-CB 3.84Å; V229-P234 WeakPolarHBondContact O-CD 3.28Å; I230-P234 WeakPolarHBondContact O-CD 3.36Å; I230-P234 WeakPolarHBondContact O-CG 3.25Å; P234-I237 PolarHBondContact O-N 3.08Å; P234-S238 WeakPolarHBondContact O-CB 3.36Å; P234-S238 PolarHBondContact O-N 3.5Å; P234-S238 PolarHBondContact O-OG 3.42Å; P234-Y386 WeakPolarHBondContact CD-OH 3.07Å; P234-Y386 WeakPolarHBondContact CG-OH 3.14Å; P234-Y386 VanDerWaalsContact N-OH 3.14Å
235	Y	95.9	Very high	92.9	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-66.1	-45.1	176.9	-170	-85.9	0	0	0	112.2	S48 T51 S70 V73 L74 G231 G233 I237 S238 Q239	S48-Y235 WeakPolarHBondContact CA-OH 3.46Å; S48-Y235 PolarHBondContact O-OH 3.44Å; S48-Y235 VanDerWaalsContact O-OH 3.05Å; S48-Y235 VanDerWaalsContact OG-CE1 3.27Å; S48-Y235 WeakPolarHBondContact OG-CE1 3.44Å; T51-Y235 PolarHBondContact OG1-OH 3.31Å; S70-Y235 WeakPolarHBondContact O-CE2 3.23Å; V73-Y235 HydrophobicContact CG1-CD2 4.37Å; L74-Y235 HydrophobicContact CB-CD2 3.86Å; L74-Y235 HydrophobicContact CB-CE2 3.86Å; L74-Y235 HydrophobicContact CD1-CD2 4.25Å; L74-Y235 HydrophobicContact CD1-CE2 4.39Å; L74-Y235 HydrophobicContact CG-CE2 4.48Å; G231-Y235 WeakPolarHBondContact O-CB 3.47Å; G231-Y235 PolarHBondContact O-N 3Å; G233-Y235 VanDerWaalsContact C-N 3.25Å; G233-Y235 PolarHBondContact O-N 2.82Å; Y235-I237 VanDerWaalsContact C-N 3.32Å; Y235-I237 PolarHBondContact O-N 2.91Å; Y235-S238 WeakPolarHBondContact CA-OG 3.47Å; Y235-S238 PolarHBondContact O-N 3.16Å; Y235-S238 PolarHBondContact O-OG 3.17Å; Y235-Q239 HydrophobicContact CD1-CG 3.85Å; Y235-Q239 HydrophobicContact CE1-CG 3.47Å; Y235-Q239 VanDerWaalsContact CE1-CG 3.47Å; Y235-Q239 VanDerWaalsContact CZ-NE2 3.26Å; Y235-Q239 WeakPolarHBondContact O-CG 3.41Å; Y235-Q239 PolarHBondContact O-N 2.96Å; Y235-Q239 PolarHBondContact OH-NE2 2.95Å
236	A	95.7	Very high	92.3	Very high	3 Å²	3	19.4 Å²	19.4	3%	0.025	10%	0.095	C	C	.	.	H	α-helix	trans	-62.3	-40.7	175.5	0	0	0	0	0	112.1	A232 G233 G240 C268 M269	A232-A236 VanDerWaalsContact O-CB 3.27Å; A232-A236 WeakPolarHBondContact O-CB 3.43Å; A232-A236 PolarHBondContact O-N 3.03Å; G233-A236 PolarHBondContact O-N 3.32Å; A236-G240 PolarHBondContact O-N 2.9Å; A236-C268 HydrophobicContact CB-CB 3.63Å; A236-M269 HydrophobicContact CB-CE 3.77Å
237	I	94.7	Very high	91.7	Very high	22 Å²	22	21.9 Å²	21.9	11%	0.113	11%	0.106	C	C	.	.	H	α-helix	trans	-64.7	-44.8	175.7	-68.9	165.9	0	0	0	110.2	G233 P234 Y235 G240 I241 C318 I321 Y386	G233-I237 WeakPolarHBondContact O-CG1 3.25Å; G233-I237 PolarHBondContact O-N 3.37Å; G233-I237 VanDerWaalsContact O-N 3.09Å; P234-I237 PolarHBondContact O-N 3.08Å; Y235-I237 VanDerWaalsContact C-N 3.32Å; Y235-I237 PolarHBondContact O-N 2.91Å; I237-G240 PolarHBondContact O-N 3.47Å; I237-I241 HydrophobicContact CG2-CD1 3.73Å; I237-I241 WeakPolarHBondContact O-CD1 3.31Å; I237-I241 VanDerWaalsContact O-CG1 3.25Å; I237-I241 WeakPolarHBondContact O-CG1 3.19Å; I237-I241 PolarHBondContact O-N 2.88Å; I237-C318 HydrophobicContact CG1-CB 4.09Å; I237-I321 HydrophobicContact CD1-CD1 4.2Å; I237-I321 HydrophobicContact CD1-CG2 4.19Å; I237-I321 HydrophobicContact CG1-CG2 4.45Å; I237-I321 HydrophobicContact CG2-CG2 3.73Å; I237-Y386 HydrophobicContact CD1-CE1 3.85Å
238	S	93.4	Very high	90.8	Very high	11 Å²	11	23 Å²	23	8%	0.077	11%	0.113	C	C	.	.	H	α-helix	trans	-64.7	-43.7	177.4	64.7	0	0	0	0	112.2	P234 Y235 G240 I241 L242	P234-S238 WeakPolarHBondContact O-CB 3.36Å; P234-S238 PolarHBondContact O-N 3.5Å; P234-S238 PolarHBondContact O-OG 3.42Å; Y235-S238 WeakPolarHBondContact CA-OG 3.47Å; Y235-S238 PolarHBondContact O-N 3.16Å; Y235-S238 PolarHBondContact O-OG 3.17Å; S238-G240 VanDerWaalsContact C-N 3.32Å; S238-G240 PolarHBondContact O-N 2.92Å; S238-I241 PolarHBondContact O-N 3.43Å; S238-L242 VanDerWaalsContact O-CG 3.27Å; S238-L242 WeakPolarHBondContact O-CG 3.47Å; S238-L242 PolarHBondContact O-N 3.34Å
239	Q	92.5	Very high	89.6	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.009	14%	0.139	C	C	.	.	H	α-helix	trans	-61.8	-39.7	174.9	-63.3	-41.4	-39.1	0	0	112.1	S70 Y235 I241 L242 F243 L261	S70-Q239 PolarHBondContact OG-NE2 3.17Å; Y235-Q239 HydrophobicContact CD1-CG 3.85Å; Y235-Q239 HydrophobicContact CE1-CG 3.47Å; Y235-Q239 VanDerWaalsContact CE1-CG 3.47Å; Y235-Q239 VanDerWaalsContact CZ-NE2 3.26Å; Y235-Q239 WeakPolarHBondContact O-CG 3.41Å; Y235-Q239 PolarHBondContact O-N 2.96Å; Y235-Q239 PolarHBondContact OH-NE2 2.95Å; Q239-I241 PolarHBondContact O-N 2.91Å; Q239-L242 PolarHBondContact O-N 2.93Å; Q239-F243 VanDerWaalsContact O-CB 3.25Å; Q239-F243 WeakPolarHBondContact O-CB 3.21Å; Q239-F243 PolarHBondContact O-N 3.18Å; Q239-L261 HydrophobicContact CB-CD2 4.28Å; Q239-L261 HydrophobicContact CG-CD2 4.21Å; Q239-L261 VanDerWaalsContact OE1-CD2 3.28Å
240	G	91.7	Very high	88.1	Confident	20 Å²	20	35.1 Å²	35.1	21%	0.206	18%	0.175	C	C	.	.	H	α-helix	trans	-61.5	-41.4	174.5	0	0	0	0	0	113.3	A236 I237 S238 Y244	A236-G240 PolarHBondContact O-N 2.9Å; I237-G240 PolarHBondContact O-N 3.47Å; S238-G240 VanDerWaalsContact C-N 3.32Å; S238-G240 PolarHBondContact O-N 2.92Å; G240-Y244 VanDerWaalsContact O-CB 3.3Å; G240-Y244 WeakPolarHBondContact O-CB 3.13Å; G240-Y244 PolarHBondContact O-N 3.33Å
241	I	91.2	Very high	86.7	Confident	40 Å²	40	38.4 Å²	38.4	21%	0.205	19%	0.188	C	C	.	.	H	α-helix	trans	-67	-43.5	176.6	-66.2	159.3	0	0	0	111.2	I237 S238 Q239 R245 A322 T325	I237-I241 HydrophobicContact CG2-CD1 3.73Å; I237-I241 WeakPolarHBondContact O-CD1 3.31Å; I237-I241 VanDerWaalsContact O-CG1 3.25Å; I237-I241 WeakPolarHBondContact O-CG1 3.19Å; I237-I241 PolarHBondContact O-N 2.88Å; S238-I241 PolarHBondContact O-N 3.43Å; Q239-I241 PolarHBondContact O-N 2.91Å; I241-R245 WeakPolarHBondContact O-CB 3.27Å; I241-R245 PolarHBondContact O-N 2.86Å; I241-A322 HydrophobicContact CG1-CB 4.11Å; I241-T325 HydrophobicContact CD1-CG2 3.51Å; I241-T325 HydrophobicContact CG1-CG2 4.14Å
242	L	88.6	Confident	85.3	Confident	12 Å²	12	48.1 Å²	48.1	6%	0.063	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-43.5	179.1	-66.3	176.5	0	0	0	111.6	E66 V69 S238 Q239 R245 R246	E66-L242 HydrophobicContact CB-CD1 3.97Å; E66-L242 HydrophobicContact CG-CD1 4.41Å; E66-L242 HydrophobicContact CG-CD2 4.15Å; V69-L242 HydrophobicContact CG1-CD1 4.32Å; S238-L242 VanDerWaalsContact O-CG 3.27Å; S238-L242 WeakPolarHBondContact O-CG 3.47Å; S238-L242 PolarHBondContact O-N 3.34Å; Q239-L242 PolarHBondContact O-N 2.93Å; L242-R245 PolarHBondContact O-N 3.16Å; L242-R246 PolarHBondContact O-N 3.45Å
243	F	88.3	Confident	84.3	Confident	76 Å²	76	48.7 Å²	48.7	33%	0.333	23%	0.234	S	C	.	.	H	α-helix	trans	-58.3	-52.8	173.1	179.6	-94.1	0	0	0	111.5	Q239 R245 R246 E247 M253 K258 L261	Q239-F243 VanDerWaalsContact O-CB 3.25Å; Q239-F243 WeakPolarHBondContact O-CB 3.21Å; Q239-F243 PolarHBondContact O-N 3.18Å; F243-R245 VanDerWaalsContact C-N 3.32Å; F243-R245 PolarHBondContact O-N 3.21Å; F243-R246 PolarHBondContact O-N 2.95Å; F243-R246 VanDerWaalsContact O-N 3.16Å; F243-E247 HydrophobicContact CD1-CG 4.26Å; F243-E247 HydrophobicContact CE1-CG 3.82Å; F243-E247 HydrophobicContact CE2-CG 4.33Å; F243-E247 HydrophobicContact CZ-CG 3.85Å; F243-E247 WeakPolarHBondContact O-CG 3.5Å; F243-E247 PolarHBondContact O-N 3.01Å; F243-E247 VanDerWaalsContact O-N 3.07Å; F243-M253 HydrophobicContact CD2-CE 4.05Å; F243-M253 HydrophobicContact CE2-CE 4.19Å; F243-K258 HydrophobicContact CE2-CB 4.43Å; F243-K258 HydrophobicContact CE2-CG 4.25Å; F243-L261 HydrophobicContact CB-CD1 4.41Å; F243-L261 HydrophobicContact CD2-CD1 4.22Å
244	Y	86.7	Confident	83.8	Confident	14 Å²	14	51.8 Å²	51.8	6%	0.055	25%	0.253	C	S	.	.	H	α-helix	trans	-56	-45.8	176.6	173.1	-94.5	0	0	0	111.9	G240 R246 E247 T248 L323 W418 Y422	G240-Y244 VanDerWaalsContact O-CB 3.3Å; G240-Y244 WeakPolarHBondContact O-CB 3.13Å; G240-Y244 PolarHBondContact O-N 3.33Å; Y244-R246 PolarHBondContact O-N 3.13Å; Y244-E247 PolarHBondContact O-N 3.08Å; Y244-T248 HydrophobicContact CD1-CG2 4.24Å; Y244-T248 HydrophobicContact CD2-CG2 4.16Å; Y244-T248 HydrophobicContact CE1-CG2 3.88Å; Y244-T248 HydrophobicContact CE2-CG2 3.82Å; Y244-T248 HydrophobicContact CG-CG2 4.39Å; Y244-T248 WeakPolarHBondContact O-CG2 3.34Å; Y244-T248 PolarHBondContact O-N 3.29Å; Y244-T248 PolarHBondContact O-OG1 2.85Å; Y244-L323 HydrophobicContact CD2-CD2 3.35Å; Y244-L323 HydrophobicContact CE2-CD2 3.69Å; Y244-L323 HydrophobicContact CG-CD2 4.15Å; Y244-W418 HydrophobicContact CE2-CZ2 4.29Å; Y244-W418 AromaticContact CE2-NE1 3.5Å; Y244-W418 AromaticContact CZ-NE1 3.56Å; Y244-W418 PolarHBondContact OH-NE1 3.16Å; Y244-W418 VanDerWaalsContact OH-NE1 3.07Å; Y244-Y422 AromaticContact CE2-CE2 3.97Å; Y244-Y422 HydrophobicContact CE2-CE2 3.97Å; Y244-Y422 AromaticContact CZ-CE2 4Å; Y244-Y422 WeakPolarHBondContact OH-CD2 3.39Å; Y244-Y422 VanDerWaalsContact OH-CE2 3.3Å; Y244-Y422 WeakPolarHBondContact OH-CE2 3.19Å
245	R	83.9	Confident	83.3	Confident	122 Å²	122	56.3 Å²	56.3	46%	0.46	27%	0.274	S	S	.	.	H	α-helix	trans	-57	-46.7	176.7	176.8	176.6	169.1	160.7	-4	111.7	L65 I241 L242 F243 T248 M249	L65-R245 VanDerWaalsContact CD2-NH1 3.27Å; I241-R245 WeakPolarHBondContact O-CB 3.27Å; I241-R245 PolarHBondContact O-N 2.86Å; L242-R245 PolarHBondContact O-N 3.16Å; F243-R245 VanDerWaalsContact C-N 3.32Å; F243-R245 PolarHBondContact O-N 3.21Å; R245-T248 PolarHBondContact O-N 2.99Å; R245-T248 PolarHBondContact O-OG1 3.3Å; R245-M249 HydrophobicContact CG-CG 4.43Å; R245-M249 WeakPolarHBondContact O-CB 3.4Å; R245-M249 VanDerWaalsContact O-CG 3.24Å; R245-M249 WeakPolarHBondContact O-CG 3.45Å; R245-M249 PolarHBondContact O-N 3.3Å; R245-M249 VanDerWaalsContact O-N 3.12Å
246	R	81.5	Confident	82.9	Confident	33 Å²	33	61.2 Å²	61.2	13%	0.125	30%	0.3	C	S	.	.	H	α-helix	trans	-60.6	-49.2	177.9	-81	-175.1	168.8	-103.8	4.1	112.6	E66 L242 F243 Y244 T248 M249 L250 F251 M253	E66-R246 VanDerWaalsContact CD-NE 3.29Å; E66-R246 WeakPolarHBondContact OE1-CD 3.31Å; E66-R246 WeakPolarHBondContact OE1-CG 3.28Å; E66-R246 IonicContact OE1-CZ 3.58Å; E66-R246 IonicContact OE1-NE 2.72Å; E66-R246 PolarHBondContact OE1-NE 3.37Å; E66-R246 IonicContact OE1-NH2 3.67Å; E66-R246 IonicContact OE2-CZ 3.33Å; E66-R246 IonicContact OE2-NE 3.11Å; E66-R246 PolarHBondContact OE2-NE 2.94Å; E66-R246 VanDerWaalsContact OE2-NE 3.11Å; E66-R246 IonicContact OE2-NH2 2.7Å; E66-R246 PolarHBondContact OE2-NH2 3.45Å; L242-R246 PolarHBondContact O-N 3.45Å; F243-R246 PolarHBondContact O-N 2.95Å; F243-R246 VanDerWaalsContact O-N 3.16Å; Y244-R246 PolarHBondContact O-N 3.13Å; R246-T248 PolarHBondContact O-N 2.71Å; R246-M249 PolarHBondContact O-N 3.32Å; R246-L250 PolarHBondContact O-N 3.48Å; R246-F251 PolarHBondContact O-N 2.82Å; R246-M253 WeakPolarHBondContact CD-SD 3.44Å
247	E	81.2	Confident	82.4	Confident	53 Å²	53	61.3 Å²	61.3	25%	0.248	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-43.2	179.7	-58	-63.8	145.6	0	0	111.5	F243 Y244 M249 L250 K258	F243-E247 HydrophobicContact CD1-CG 4.26Å; F243-E247 HydrophobicContact CE1-CG 3.82Å; F243-E247 HydrophobicContact CE2-CG 4.33Å; F243-E247 HydrophobicContact CZ-CG 3.85Å; F243-E247 WeakPolarHBondContact O-CG 3.5Å; F243-E247 PolarHBondContact O-N 3.01Å; F243-E247 VanDerWaalsContact O-N 3.07Å; Y244-E247 PolarHBondContact O-N 3.08Å; E247-M249 VanDerWaalsContact C-N 3.27Å; E247-M249 PolarHBondContact O-N 2.84Å; E247-L250 PolarHBondContact O-N 2.91Å; E247-K258 WeakPolarHBondContact OE1-CE 3.35Å; E247-K258 IonicContact OE1-NZ 2.7Å; E247-K258 PolarHBondContact OE1-NZ 2.89Å; E247-K258 IonicContact OE2-NZ 2.77Å; E247-K258 PolarHBondContact OE2-NZ 3.42Å
248	T	77.3	Confident	82.1	Confident	24 Å²	24	63.6 Å²	63.6	15%	0.147	31%	0.309	C	S	.	.	H	α-helix	trans	-68.8	-20.2	178.4	56.7	0	0	0	0	115	Y244 R245 R246 Y422	Y244-T248 HydrophobicContact CD1-CG2 4.24Å; Y244-T248 HydrophobicContact CD2-CG2 4.16Å; Y244-T248 HydrophobicContact CE1-CG2 3.88Å; Y244-T248 HydrophobicContact CE2-CG2 3.82Å; Y244-T248 HydrophobicContact CG-CG2 4.39Å; Y244-T248 WeakPolarHBondContact O-CG2 3.34Å; Y244-T248 PolarHBondContact O-N 3.29Å; Y244-T248 PolarHBondContact O-OG1 2.85Å; R245-T248 PolarHBondContact O-N 2.99Å; R245-T248 PolarHBondContact O-OG1 3.3Å; R246-T248 PolarHBondContact O-N 2.71Å; T248-Y422 HydrophobicContact CG2-CE2 4.19Å
249	M	69.4	Low	81.9	Confident	111 Å²	111	67 Å²	67	55%	0.547	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	8.5	179.2	-70.6	-73.9	-169.8	0	0	112.9	R245 R246 E247 F251	R245-M249 HydrophobicContact CG-CG 4.43Å; R245-M249 WeakPolarHBondContact O-CB 3.4Å; R245-M249 VanDerWaalsContact O-CG 3.24Å; R245-M249 WeakPolarHBondContact O-CG 3.45Å; R245-M249 PolarHBondContact O-N 3.3Å; R245-M249 VanDerWaalsContact O-N 3.12Å; R246-M249 PolarHBondContact O-N 3.32Å; E247-M249 VanDerWaalsContact C-N 3.27Å; E247-M249 PolarHBondContact O-N 2.84Å; M249-F251 HydrophobicContact CB-CD2 3.44Å; M249-F251 VanDerWaalsContact CB-CD2 3.44Å; M249-F251 HydrophobicContact CB-CE2 3.67Å; M249-F251 HydrophobicContact CB-CG 4.47Å; M249-F251 HydrophobicContact CG-CD2 4.44Å; M249-F251 HydrophobicContact CG-CE2 4.38Å; M249-F251 PolarHBondContact O-N 3.35Å
250	L	63.6	Low	81.9	Confident	144 Å²	144	69.2 Å²	69.2	75%	0.754	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	16.9	-177.7	-80.7	159.6	0	0	0	115	R246 E247 F252	R246-L250 PolarHBondContact O-N 3.48Å; E247-L250 PolarHBondContact O-N 2.91Å; L250-F252 PolarHBondContact O-N 3.48Å
251	F	64.7	Low	81.9	Confident	89 Å²	89	68.5 Å²	68.5	39%	0.39	33%	0.329	S	S	.	.			trans	-72.5	115.5	177	-74.8	-61.4	0	0	0	110.7	E62 R246 M249 M253	E62-F251 WeakPolarHBondContact OE1-CZ 3.18Å; E62-F251 WeakPolarHBondContact OE2-CE1 3.13Å; E62-F251 WeakPolarHBondContact OE2-CZ 3.33Å; R246-F251 PolarHBondContact O-N 2.82Å; M249-F251 HydrophobicContact CB-CD2 3.44Å; M249-F251 VanDerWaalsContact CB-CD2 3.44Å; M249-F251 HydrophobicContact CB-CE2 3.67Å; M249-F251 HydrophobicContact CB-CG 4.47Å; M249-F251 HydrophobicContact CG-CD2 4.44Å; M249-F251 HydrophobicContact CG-CE2 4.38Å; M249-F251 PolarHBondContact O-N 3.35Å; F251-M253 VanDerWaalsContact C-N 3.33Å; F251-M253 PolarHBondContact O-N 3.01Å
252	F	65.4	Low	81.9	Confident	204 Å²	204	71.7 Å²	71.7	90%	0.895	35%	0.346	S	S	*	.			trans	-61.2	88.7	175.7	-73.1	-78.7	0	0	0	111.7	L250	L250-F252 PolarHBondContact O-N 3.48Å
253	M	75	Confident	82.2	Confident	13 Å²	13	74.3 Å²	74.3	6%	0.064	36%	0.359	C	S	.	.			trans	-81.8	133.6	168.1	-160.6	179.6	62.8	0	0	109.8	F243 R246 F251 T257 K258 L261	F243-M253 HydrophobicContact CD2-CE 4.05Å; F243-M253 HydrophobicContact CE2-CE 4.19Å; R246-M253 WeakPolarHBondContact CD-SD 3.44Å; F251-M253 VanDerWaalsContact C-N 3.33Å; F251-M253 PolarHBondContact O-N 3.01Å; M253-T257 HydrophobicContact CE-CG2 4.11Å; M253-T257 HydrophobicContact CG-CG2 3.94Å; M253-T257 HydrophobicContact SD-CG2 3.46Å; M253-T257 WeakPolarHBondContact SD-CG2 3.44Å; M253-K258 HydrophobicContact CE-CB 4.04Å; M253-K258 HydrophobicContact CE-CG 3.35Å; M253-K258 WeakPolarHBondContact O-CE 3.43Å; M253-L261 HydrophobicContact CE-CD1 3.93Å; M253-L261 HydrophobicContact SD-CD1 4.02Å
254	T	83.5	Confident	82.6	Confident	64 Å²	64	70.7 Å²	70.7	39%	0.393	34%	0.343	S	S	.	.			trans	-59.3	148.4	-178.7	63.8	0	0	0	0	111.7	D256 T257 K258	T254-D256 PolarHBondContact O-N 3Å; T254-T257 PolarHBondContact O-N 3.36Å; T254-T257 PolarHBondContact OG1-OG1 3.45Å; T254-K258 PolarHBondContact O-N 2.86Å
255	I	85.7	Confident	82.9	Confident	125 Å²	125	71.7 Å²	71.7	64%	0.641	35%	0.351	S	S	*	.	H	α-helix	trans	-56.5	-40.3	-178.7	-64.8	174	0	0	0	110.4	T257 K258 I259	I255-T257 VanDerWaalsContact C-N 3.31Å; I255-T257 PolarHBondContact O-N 3.1Å; I255-K258 WeakPolarHBondContact O-CB 3.34Å; I255-K258 PolarHBondContact O-N 2.88Å; I255-K258 VanDerWaalsContact O-N 3.14Å; I255-I259 HydrophobicContact CG2-CD1 3.73Å; I255-I259 HydrophobicContact CG2-CG1 4.32Å; I255-I259 WeakPolarHBondContact O-CG1 3.25Å; I255-I259 PolarHBondContact O-N 2.94Å
256	D	86	Confident	83.5	Confident	103 Å²	103	69.9 Å²	69.9	55%	0.551	35%	0.349	S	S	*	.	H	α-helix	trans	-60.3	-39.8	177.9	-45.9	-60.8	0	0	0	112.3	T254 I259 I260	T254-D256 PolarHBondContact O-N 3Å; D256-I259 PolarHBondContact O-N 3.37Å; D256-I260 WeakPolarHBondContact O-CB 3.49Å; D256-I260 WeakPolarHBondContact O-CG1 3.48Å; D256-I260 PolarHBondContact O-N 3.23Å
257	T	85.8	Confident	84.2	Confident	5 Å²	5	71.1 Å²	71.1	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-72.6	-35.3	177	-45.3	0	0	0	0	111.4	L54 N58 M253 T254 I255 I260 L261	L54-T257 HydrophobicContact CB-CG2 4.43Å; L54-T257 HydrophobicContact CD1-CG2 4.17Å; N58-T257 PolarHBondContact ND2-OG1 2.78Å; M253-T257 HydrophobicContact CE-CG2 4.11Å; M253-T257 HydrophobicContact CG-CG2 3.94Å; M253-T257 HydrophobicContact SD-CG2 3.46Å; M253-T257 WeakPolarHBondContact SD-CG2 3.44Å; T254-T257 PolarHBondContact O-N 3.36Å; T254-T257 PolarHBondContact OG1-OG1 3.45Å; I255-T257 VanDerWaalsContact C-N 3.31Å; I255-T257 PolarHBondContact O-N 3.1Å; T257-I260 PolarHBondContact O-N 3.32Å; T257-L261 WeakPolarHBondContact O-CB 3.31Å; T257-L261 WeakPolarHBondContact O-CG 3.4Å; T257-L261 PolarHBondContact O-N 2.9Å
258	K	87.9	Confident	85	Confident	70 Å²	70	68.6 Å²	68.6	30%	0.304	34%	0.344	S	S	.	.	H	α-helix	trans	-60.8	-45.6	171.3	-65.1	-168.4	-175.2	-150	0	110.6	F243 E247 M253 T254 I255 L262	F243-K258 HydrophobicContact CE2-CB 4.43Å; F243-K258 HydrophobicContact CE2-CG 4.25Å; E247-K258 WeakPolarHBondContact OE1-CE 3.35Å; E247-K258 IonicContact OE1-NZ 2.7Å; E247-K258 PolarHBondContact OE1-NZ 2.89Å; E247-K258 IonicContact OE2-NZ 2.77Å; E247-K258 PolarHBondContact OE2-NZ 3.42Å; M253-K258 HydrophobicContact CE-CB 4.04Å; M253-K258 HydrophobicContact CE-CG 3.35Å; M253-K258 WeakPolarHBondContact O-CE 3.43Å; T254-K258 PolarHBondContact O-N 2.86Å; I255-K258 WeakPolarHBondContact O-CB 3.34Å; I255-K258 PolarHBondContact O-N 2.88Å; I255-K258 VanDerWaalsContact O-N 3.14Å; K258-L262 WeakPolarHBondContact O-CB 3.31Å; K258-L262 PolarHBondContact O-N 3.27Å; K258-L262 VanDerWaalsContact O-N 3.1Å
259	I	90.6	Very high	85.9	Confident	82 Å²	82	68 Å²	68	42%	0.421	34%	0.34	S	S	.	.	H	α-helix	trans	-63.9	-46.9	178.1	-70.3	170.4	0	0	0	111.2	I255 D256 L262 I263	I255-I259 HydrophobicContact CG2-CD1 3.73Å; I255-I259 HydrophobicContact CG2-CG1 4.32Å; I255-I259 WeakPolarHBondContact O-CG1 3.25Å; I255-I259 PolarHBondContact O-N 2.94Å; D256-I259 PolarHBondContact O-N 3.37Å; I259-L262 PolarHBondContact O-N 3.22Å; I259-I263 HydrophobicContact CG2-CD1 3.62Å; I259-I263 HydrophobicContact CG2-CG1 4.36Å; I259-I263 WeakPolarHBondContact O-CB 3.3Å; I259-I263 VanDerWaalsContact O-CG1 3.28Å; I259-I263 WeakPolarHBondContact O-CG1 3.47Å; I259-I263 PolarHBondContact O-N 3.12Å
260	I	92	Very high	87.2	Confident	49 Å²	49	64.9 Å²	64.9	25%	0.251	33%	0.325	S	S	.	.	H	α-helix	trans	-74.2	-34.1	-174.4	-70.5	166.7	0	0	0	112	A50 T51 L54 D256 T257 C264	A50-I260 HydrophobicContact CB-CG2 4.2Å; T51-I260 HydrophobicContact CG2-CG2 3.85Å; L54-I260 HydrophobicContact CD1-CB 3.72Å; L54-I260 HydrophobicContact CD1-CD1 3.76Å; L54-I260 HydrophobicContact CD1-CG1 4.31Å; L54-I260 HydrophobicContact CD1-CG2 3.65Å; D256-I260 WeakPolarHBondContact O-CB 3.49Å; D256-I260 WeakPolarHBondContact O-CG1 3.48Å; D256-I260 PolarHBondContact O-N 3.23Å; T257-I260 PolarHBondContact O-N 3.32Å; I260-C264 VanDerWaalsContact O-CB 3.28Å; I260-C264 WeakPolarHBondContact O-CB 3.44Å; I260-C264 PolarHBondContact O-N 3.43Å
261	L	91.5	Very high	88.8	Confident	5 Å²	5	58 Å²	58	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-41.3	168.1	-75.9	-179.3	0	0	0	112.1	T51 Q239 F243 M253 T257 C264 T265	T51-L261 HydrophobicContact CG2-CD2 3.69Å; T51-L261 HydrophobicContact CG2-CG 4.44Å; Q239-L261 HydrophobicContact CB-CD2 4.28Å; Q239-L261 HydrophobicContact CG-CD2 4.21Å; Q239-L261 VanDerWaalsContact OE1-CD2 3.28Å; F243-L261 HydrophobicContact CB-CD1 4.41Å; F243-L261 HydrophobicContact CD2-CD1 4.22Å; M253-L261 HydrophobicContact CE-CD1 3.93Å; M253-L261 HydrophobicContact SD-CD1 4.02Å; T257-L261 WeakPolarHBondContact O-CB 3.31Å; T257-L261 WeakPolarHBondContact O-CG 3.4Å; T257-L261 PolarHBondContact O-N 2.9Å; L261-C264 PolarHBondContact O-N 2.86Å; L261-T265 WeakPolarHBondContact O-CB 3.34Å; L261-T265 PolarHBondContact O-N 3.49Å; L261-T265 PolarHBondContact O-OG1 3.3Å
262	L	92.2	Very high	90.3	Very high	108 Å²	108	53.8 Å²	53.8	57%	0.565	27%	0.27	S	S	*	.	H	α-helix	trans	-62.9	-48.5	176.3	176.6	61.5	0	0	0	111.5	K258 I259 C264 T265 I266	K258-L262 WeakPolarHBondContact O-CB 3.31Å; K258-L262 PolarHBondContact O-N 3.27Å; K258-L262 VanDerWaalsContact O-N 3.1Å; I259-L262 PolarHBondContact O-N 3.22Å; L262-C264 VanDerWaalsContact C-N 3.35Å; L262-C264 PolarHBondContact O-N 3.31Å; L262-T265 PolarHBondContact O-N 2.84Å; L262-I266 HydrophobicContact CD1-CD1 4.11Å; L262-I266 HydrophobicContact CD1-CG1 4.44Å; L262-I266 HydrophobicContact CG-CD1 4.03Å; L262-I266 WeakPolarHBondContact O-CG1 3.34Å; L262-I266 PolarHBondContact O-N 2.84Å
263	I	94.8	Very high	91.7	Very high	67 Å²	67	44 Å²	44	34%	0.344	23%	0.228	S	C	.	.	H	α-helix	trans	-59.4	-45.6	176.3	-69.7	169.7	0	0	0	110.6	T47 I259 T265 I266 F267	T47-I263 HydrophobicContact CG2-CG2 3.79Å; I259-I263 HydrophobicContact CG2-CD1 3.62Å; I259-I263 HydrophobicContact CG2-CG1 4.36Å; I259-I263 WeakPolarHBondContact O-CB 3.3Å; I259-I263 VanDerWaalsContact O-CG1 3.28Å; I259-I263 WeakPolarHBondContact O-CG1 3.47Å; I259-I263 PolarHBondContact O-N 3.12Å; I263-T265 VanDerWaalsContact C-N 3.34Å; I263-T265 PolarHBondContact O-N 2.94Å; I263-I266 PolarHBondContact O-N 2.84Å; I263-F267 HydrophobicContact CG2-CD2 3.8Å; I263-F267 HydrophobicContact CG2-CE2 3.87Å; I263-F267 WeakPolarHBondContact O-CD2 3.41Å; I263-F267 PolarHBondContact O-N 3.49Å
264	C	95.2	Very high	92.7	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-43.1	177.1	-169.5	0	0	0	0	111.9	S48 T51 I260 L261 L262 I266 F267 C268	S48-C264 PolarHBondContact OG-SG 3.04Å; S48-C264 VanDerWaalsContact OG-SG 3.32Å; T51-C264 HydrophobicContact CG2-CB 3.76Å; I260-C264 VanDerWaalsContact O-CB 3.28Å; I260-C264 WeakPolarHBondContact O-CB 3.44Å; I260-C264 PolarHBondContact O-N 3.43Å; L261-C264 PolarHBondContact O-N 2.86Å; L262-C264 VanDerWaalsContact C-N 3.35Å; L262-C264 PolarHBondContact O-N 3.31Å; C264-I266 VanDerWaalsContact C-N 3.35Å; C264-I266 PolarHBondContact O-N 3.34Å; C264-F267 PolarHBondContact O-N 3.01Å; C264-C268 PolarHBondContact O-N 3.45Å; C264-C268 PolarHBondContact O-SG 3.37Å
265	T	94.3	Very high	93.2	Very high	35 Å²	35	41 Å²	41	22%	0.215	21%	0.21	C	C	.	.	H	α-helix	trans	-61.7	-43.1	177.2	-56.6	0	0	0	0	111.1	L261 L262 I263 C268 M269	L261-T265 WeakPolarHBondContact O-CB 3.34Å; L261-T265 PolarHBondContact O-N 3.49Å; L261-T265 PolarHBondContact O-OG1 3.3Å; L262-T265 PolarHBondContact O-N 2.84Å; I263-T265 VanDerWaalsContact C-N 3.34Å; I263-T265 PolarHBondContact O-N 2.94Å; T265-C268 WeakPolarHBondContact O-CB 3.26Å; T265-C268 PolarHBondContact O-N 2.85Å; T265-M269 HydrophobicContact CG2-CE 3.93Å; T265-M269 WeakPolarHBondContact O-CG 3.3Å; T265-M269 PolarHBondContact O-N 3.42Å
266	I	95.7	Very high	93.4	Very high	83 Å²	83	35.4 Å²	35.4	43%	0.426	18%	0.181	S	C	.	.	H	α-helix	trans	-59.8	-48.5	174.8	-69.3	163.9	0	0	0	110.8	L262 I263 C264 C268 M269 L270	L262-I266 HydrophobicContact CD1-CD1 4.11Å; L262-I266 HydrophobicContact CD1-CG1 4.44Å; L262-I266 HydrophobicContact CG-CD1 4.03Å; L262-I266 WeakPolarHBondContact O-CG1 3.34Å; L262-I266 PolarHBondContact O-N 2.84Å; I263-I266 PolarHBondContact O-N 2.84Å; C264-I266 VanDerWaalsContact C-N 3.35Å; C264-I266 PolarHBondContact O-N 3.34Å; I266-C268 VanDerWaalsContact C-N 3.31Å; I266-C268 PolarHBondContact O-N 2.89Å; I266-M269 PolarHBondContact O-N 3.36Å; I266-L270 HydrophobicContact CG2-CD1 3.79Å; I266-L270 HydrophobicContact CG2-CG 4.27Å; I266-L270 WeakPolarHBondContact O-CB 3.5Å; I266-L270 VanDerWaalsContact O-CG 3.27Å; I266-L270 WeakPolarHBondContact O-CG 3.41Å; I266-L270 PolarHBondContact O-N 3.41Å
267	F	96.9	Very high	93.6	Very high	60 Å²	60	31.1 Å²	31.1	26%	0.263	16%	0.159	S	C	.	.	H	α-helix	trans	-62.9	-35.2	177.7	-87.4	-75.9	0	0	0	113	F44 T47 I263 C264 W271	F44-F267 HydrophobicContact CB-CB 4.38Å; T47-F267 HydrophobicContact CG2-CD2 3.86Å; T47-F267 HydrophobicContact CG2-CE2 4.3Å; I263-F267 HydrophobicContact CG2-CD2 3.8Å; I263-F267 HydrophobicContact CG2-CE2 3.87Å; I263-F267 WeakPolarHBondContact O-CD2 3.41Å; I263-F267 PolarHBondContact O-N 3.49Å; C264-F267 PolarHBondContact O-N 3.01Å; F267-W271 WeakPolarHBondContact O-CB 3.19Å; F267-W271 PolarHBondContact O-N 3.01Å
268	C	96.9	Very high	93.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.3	-52.3	171	-65.9	0	0	0	0	111.8	F44 A232 A236 C264 T265 I266 L270 W271 I272	F44-C268 VanDerWaalsContact CD2-SG 3.51Å; A232-C268 HydrophobicContact CB-CB 4.13Å; A236-C268 HydrophobicContact CB-CB 3.63Å; C264-C268 PolarHBondContact O-N 3.45Å; C264-C268 PolarHBondContact O-SG 3.37Å; T265-C268 WeakPolarHBondContact O-CB 3.26Å; T265-C268 PolarHBondContact O-N 2.85Å; I266-C268 VanDerWaalsContact C-N 3.31Å; I266-C268 PolarHBondContact O-N 2.89Å; C268-L270 VanDerWaalsContact C-N 3.31Å; C268-L270 PolarHBondContact O-N 2.99Å; C268-W271 PolarHBondContact O-N 2.78Å; C268-W271 VanDerWaalsContact O-N 3.12Å; C268-I272 WeakPolarHBondContact O-CD1 3.4Å; C268-I272 WeakPolarHBondContact O-CG1 3.48Å; C268-I272 PolarHBondContact O-N 3.2Å
269	M	96.4	Very high	93.6	Very high	12 Å²	12	28.6 Å²	28.6	6%	0.059	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-41.6	-180	-59.8	-47.9	167.5	0	0	111.7	A236 T265 I266 I272 S273 L311 I314 T315 C318	A236-M269 HydrophobicContact CB-CE 3.77Å; T265-M269 HydrophobicContact CG2-CE 3.93Å; T265-M269 WeakPolarHBondContact O-CG 3.3Å; T265-M269 PolarHBondContact O-N 3.42Å; I266-M269 PolarHBondContact O-N 3.36Å; M269-I272 HydrophobicContact SD-CD1 4.31Å; M269-S273 VanDerWaalsContact O-CB 3.26Å; M269-S273 WeakPolarHBondContact O-CB 3.11Å; M269-S273 PolarHBondContact O-N 3.08Å; M269-S273 PolarHBondContact O-OG 3Å; M269-L311 HydrophobicContact CB-CD1 4Å; M269-I314 HydrophobicContact SD-CG2 4.09Å; M269-T315 HydrophobicContact CG-CG2 4.41Å; M269-C318 HydrophobicContact CE-CB 3.39Å; M269-C318 HydrophobicContact SD-CB 4.1Å
270	L	97.1	Very high	92.9	Very high	44 Å²	44	25.7 Å²	25.7	23%	0.23	13%	0.131	C	C	.	.	H	α-helix	trans	-61.4	-42.2	174.5	-69.7	173.8	0	0	0	111.9	I40 I266 C268 T274 F307 L311	I40-L270 HydrophobicContact CG2-CB 3.9Å; I266-L270 HydrophobicContact CG2-CD1 3.79Å; I266-L270 HydrophobicContact CG2-CG 4.27Å; I266-L270 WeakPolarHBondContact O-CB 3.5Å; I266-L270 VanDerWaalsContact O-CG 3.27Å; I266-L270 WeakPolarHBondContact O-CG 3.41Å; I266-L270 PolarHBondContact O-N 3.41Å; C268-L270 VanDerWaalsContact C-N 3.31Å; C268-L270 PolarHBondContact O-N 2.99Å; L270-T274 WeakPolarHBondContact O-CB 3.47Å; L270-T274 PolarHBondContact O-N 3.43Å; L270-T274 PolarHBondContact O-OG1 2.91Å; L270-F307 HydrophobicContact CD2-CZ 3.88Å; L270-L311 HydrophobicContact CD2-CD1 4.27Å; L270-L311 HydrophobicContact CD2-CD2 4.38Å
271	W	97.4	Very high	91.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.2	-46.5	178.9	176.8	-130.9	0	0	0	113	I40 F41 F44 P127 Y131 A224 S227 F267 C268 T274 S275	I40-W271 HydrophobicContact CG2-CB 3.95Å; I40-W271 HydrophobicContact CG2-CE3 4.37Å; F41-W271 HydrophobicContact CB-CD2 4.1Å; F41-W271 HydrophobicContact CB-CE3 3.84Å; F41-W271 HydrophobicContact CB-CH2 4.04Å; F41-W271 HydrophobicContact CB-CZ2 4.26Å; F41-W271 HydrophobicContact CB-CZ3 3.82Å; F41-W271 AromaticContact CD2-CD2 3.96Å; F41-W271 HydrophobicContact CD2-CD2 3.96Å; F41-W271 AromaticContact CD2-CE2 3.43Å; F41-W271 VanDerWaalsContact CD2-CE2 3.43Å; F41-W271 HydrophobicContact CD2-CE3 4.48Å; F41-W271 HydrophobicContact CD2-CG 4.45Å; F41-W271 HydrophobicContact CD2-CH2 4.16Å; F41-W271 AromaticContact CD2-CZ2 3.55Å; F41-W271 HydrophobicContact CD2-CZ2 3.55Å; F41-W271 AromaticContact CD2-NE1 3.6Å; F41-W271 HydrophobicContact CE2-CZ2 4.25Å; F41-W271 HydrophobicContact CG-CH2 4.27Å; F41-W271 HydrophobicContact CG-CZ2 4.11Å; F44-W271 HydrophobicContact CB-CB 4.41Å; F44-W271 AromaticContact CD1-CD1 3.9Å; P127-W271 HydrophobicContact CB-CH2 4.05Å; P127-W271 HydrophobicContact CB-CZ2 4.01Å; P127-W271 HydrophobicContact CG-CZ2 3.99Å; Y131-W271 AromaticContact CE2-CH2 4Å; Y131-W271 HydrophobicContact CE2-CH2 4Å; Y131-W271 HydrophobicContact CE2-CZ3 4.37Å; A224-W271 HydrophobicContact CB-CH2 3.66Å; A224-W271 HydrophobicContact CB-CZ2 4.06Å; S227-W271 PolarHBondContact OG-NE1 3.19Å; F267-W271 WeakPolarHBondContact O-CB 3.19Å; F267-W271 PolarHBondContact O-N 3.01Å; C268-W271 PolarHBondContact O-N 2.78Å; C268-W271 VanDerWaalsContact O-N 3.12Å; W271-T274 PolarHBondContact O-N 3.43Å; W271-S275 WeakPolarHBondContact O-CB 3.4Å; W271-S275 PolarHBondContact O-N 2.89Å; W271-S275 PolarHBondContact O-OG 2.93Å
272	I	96	Very high	90.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.6	-50.5	178.2	-53.7	153.8	0	0	0	109.1	G228 A232 C268 M269 T274 S275 F276 I314	G228-I272 WeakPolarHBondContact O-CG1 3.28Å; A232-I272 HydrophobicContact CB-CD1 4.44Å; A232-I272 HydrophobicContact CB-CG1 4.06Å; C268-I272 WeakPolarHBondContact O-CD1 3.4Å; C268-I272 WeakPolarHBondContact O-CG1 3.48Å; C268-I272 PolarHBondContact O-N 3.2Å; M269-I272 HydrophobicContact SD-CD1 4.31Å; I272-T274 VanDerWaalsContact C-N 3.34Å; I272-T274 PolarHBondContact O-N 2.9Å; I272-S275 WeakPolarHBondContact O-CB 3.26Å; I272-S275 PolarHBondContact O-N 2.78Å; I272-F276 HydrophobicContact CG2-CD2 3.95Å; I272-F276 HydrophobicContact CG2-CE2 3.81Å; I272-F276 WeakPolarHBondContact O-CD2 3.34Å; I272-F276 PolarHBondContact O-N 3.21Å; I272-I314 HydrophobicContact CB-CD1 4.45Å; I272-I314 HydrophobicContact CB-CG2 4.21Å; I272-I314 HydrophobicContact CD1-CG2 4.13Å; I272-I314 HydrophobicContact CG2-CD1 3.88Å; I272-I314 HydrophobicContact CG2-CG1 4.47Å; I272-I314 HydrophobicContact CG2-CG2 3.98Å
273	S	95.8	Very high	89.5	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63	-38	-179.4	-50.8	0	0	0	0	112.7	M269 S275 T277 L311	M269-S273 VanDerWaalsContact O-CB 3.26Å; M269-S273 WeakPolarHBondContact O-CB 3.11Å; M269-S273 PolarHBondContact O-N 3.08Å; M269-S273 PolarHBondContact O-OG 3Å; S273-S275 VanDerWaalsContact C-N 3.3Å; S273-S275 PolarHBondContact O-N 3.42Å; S273-T277 VanDerWaalsContact O-CB 3.31Å; S273-T277 WeakPolarHBondContact O-CB 3.37Å; S273-T277 PolarHBondContact O-N 3.38Å; S273-T277 PolarHBondContact O-OG1 3.06Å; S273-L311 VanDerWaalsContact OG-CA 3.28Å; S273-L311 WeakPolarHBondContact OG-CA 3.36Å
274	T	94.6	Very high	87.9	Confident	13 Å²	13	23 Å²	23	8%	0.08	11%	0.114	C	C	.	.	H	α-helix	trans	-62.3	-39.8	173.4	-64.4	0	0	0	0	111	S37 I40 L270 W271 I272 T277 H278	S37-T274 WeakPolarHBondContact OG-CG2 3.45Å; I40-T274 HydrophobicContact CD1-CG2 4.49Å; I40-T274 WeakPolarHBondContact CD1-OG1 3.28Å; L270-T274 WeakPolarHBondContact O-CB 3.47Å; L270-T274 PolarHBondContact O-N 3.43Å; L270-T274 PolarHBondContact O-OG1 2.91Å; W271-T274 PolarHBondContact O-N 3.43Å; I272-T274 VanDerWaalsContact C-N 3.34Å; I272-T274 PolarHBondContact O-N 2.9Å; T274-T277 PolarHBondContact O-N 3.5Å; T274-H278 VanDerWaalsContact O-CB 3.25Å; T274-H278 WeakPolarHBondContact O-CB 3.46Å; T274-H278 PolarHBondContact O-N 2.9Å
275	S	93.6	Very high	85.9	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-72.4	-41	-177.9	-62.4	0	0	0	0	112.9	A224 W271 I272 S273 H278 F279	A224-S275 WeakPolarHBondContact O-CB 3.17Å; A224-S275 PolarHBondContact O-OG 3.49Å; A224-S275 VanDerWaalsContact O-OG 3.11Å; W271-S275 WeakPolarHBondContact O-CB 3.4Å; W271-S275 PolarHBondContact O-N 2.89Å; W271-S275 PolarHBondContact O-OG 2.93Å; I272-S275 WeakPolarHBondContact O-CB 3.26Å; I272-S275 PolarHBondContact O-N 2.78Å; S273-S275 VanDerWaalsContact C-N 3.3Å; S273-S275 PolarHBondContact O-N 3.42Å; S275-H278 PolarHBondContact O-N 3.03Å; S275-F279 WeakPolarHBondContact O-CB 3.39Å; S275-F279 PolarHBondContact O-N 3.05Å
276	F	91.5	Very high	84	Confident	7 Å²	7	33.1 Å²	33.1	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-59.8	-48	168.8	-84.5	-89.5	0	0	0	111.4	L225 V229 I272 H278 F279 Y280 I314 I383 E387 F389	L225-F276 HydrophobicContact CD1-CD1 4.15Å; L225-F276 HydrophobicContact CD1-CD2 3.86Å; L225-F276 HydrophobicContact CD1-CE1 4.3Å; L225-F276 HydrophobicContact CD1-CE2 4.02Å; L225-F276 HydrophobicContact CD1-CG 3.93Å; L225-F276 HydrophobicContact CD1-CZ 4.25Å; V229-F276 HydrophobicContact CG2-CE2 3.68Å; V229-F276 HydrophobicContact CG2-CZ 4Å; I272-F276 HydrophobicContact CG2-CD2 3.95Å; I272-F276 HydrophobicContact CG2-CE2 3.81Å; I272-F276 WeakPolarHBondContact O-CD2 3.34Å; I272-F276 PolarHBondContact O-N 3.21Å; F276-H278 VanDerWaalsContact C-N 3.31Å; F276-H278 PolarHBondContact O-N 3.28Å; F276-F279 PolarHBondContact O-N 3.36Å; F276-Y280 PolarHBondContact O-N 2.97Å; F276-I314 HydrophobicContact CD2-CD1 3.79Å; F276-I314 HydrophobicContact CE2-CD1 4.14Å; F276-I314 HydrophobicContact CG-CD1 4.49Å; F276-I383 HydrophobicContact CE1-CG2 3.59Å; F276-I383 HydrophobicContact CZ-CG2 3.53Å; F276-E387 HydrophobicContact CD1-CB 4.43Å; F276-E387 HydrophobicContact CE1-CB 3.89Å; F276-E387 HydrophobicContact CE2-CB 4.49Å; F276-E387 HydrophobicContact CZ-CB 3.92Å; F276-F389 HydrophobicContact CE1-CB 4.43Å; F276-F389 HydrophobicContact CE1-CD2 4.31Å
277	T	89.8	Confident	81.9	Confident	14 Å²	14	34.3 Å²	34.3	9%	0.086	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-40.9	177.5	-56.8	0	0	0	0	112.3	S273 T274 P281 L303 F307 H310	S273-T277 VanDerWaalsContact O-CB 3.31Å; S273-T277 WeakPolarHBondContact O-CB 3.37Å; S273-T277 PolarHBondContact O-N 3.38Å; S273-T277 PolarHBondContact O-OG1 3.06Å; T274-T277 PolarHBondContact O-N 3.5Å; T277-P281 WeakPolarHBondContact O-CD 3.42Å; T277-L303 HydrophobicContact CG2-CD1 3.62Å; T277-L303 HydrophobicContact CG2-CG 3.76Å; T277-F307 HydrophobicContact CG2-CB 4.05Å; T277-F307 WeakPolarHBondContact OG1-CA 3.23Å; T277-F307 WeakPolarHBondContact OG1-CB 3.27Å; T277-F307 WeakPolarHBondContact OG1-CD2 3.44Å; T277-H310 PolarHBondContact OG1-CD2 3.2Å
278	H	87.3	Confident	79.8	Confident	8 Å²	8	36.4 Å²	36.4	4%	0.037	17%	0.173	C	C	.	.	H	α-helix	trans	-69.6	-38.2	178.6	-178.7	-129.4	0	0	0	111.8	Y131 T274 S275 F276 P281 V282	Y131-H278 AromaticContact CE1-CE1 3.68Å; Y131-H278 AromaticContact CE1-ND1 3.99Å; T274-H278 VanDerWaalsContact O-CB 3.25Å; T274-H278 WeakPolarHBondContact O-CB 3.46Å; T274-H278 PolarHBondContact O-N 2.9Å; S275-H278 PolarHBondContact O-N 3.03Å; F276-H278 VanDerWaalsContact C-N 3.31Å; F276-H278 PolarHBondContact O-N 3.28Å; H278-P281 WeakPolarHBondContact O-CD 3.05Å; H278-V282 WeakPolarHBondContact O-CG2 3.08Å
279	F	85.2	Confident	77.7	Confident	13 Å²	13	41.3 Å²	41.3	6%	0.057	20%	0.199	C	C	.	.	H	α-helix	trans	-69.4	-42.6	179.9	-163.6	-78.7	0	0	0	113	A221 I222 L225 S275 F276 V282 Q283 F389	A221-F279 HydrophobicContact CB-CB 4.44Å; A221-F279 HydrophobicContact CB-CD2 3.73Å; A221-F279 HydrophobicContact CB-CE2 4.33Å; A221-F279 HydrophobicContact CB-CG 4.38Å; I222-F279 HydrophobicContact CG1-CE2 3.75Å; L225-F279 HydrophobicContact CB-CD2 4.37Å; L225-F279 HydrophobicContact CD2-CB 4.35Å; L225-F279 HydrophobicContact CD2-CD2 3.86Å; L225-F279 HydrophobicContact CD2-CE2 4.39Å; L225-F279 HydrophobicContact CD2-CG 4.04Å; S275-F279 WeakPolarHBondContact O-CB 3.39Å; S275-F279 PolarHBondContact O-N 3.05Å; F276-F279 PolarHBondContact O-N 3.36Å; F279-V282 CarbonylContact O-C 3.5Å; F279-V282 WeakPolarHBondContact O-CA 3.46Å; F279-V282 PolarHBondContact O-N 3.35Å; F279-Q283 HydrophobicContact CD1-CB 3.83Å; F279-Q283 HydrophobicContact CE1-CB 3.55Å; F279-Q283 HydrophobicContact CE1-CG 3.88Å; F279-Q283 PolarHBondContact O-N 2.87Å; F279-F389 AromaticContact CD1-CE2 3.39Å; F279-F389 HydrophobicContact CD1-CE2 3.39Å; F279-F389 AromaticContact CD1-CZ 3.59Å; F279-F389 HydrophobicContact CD1-CZ 3.59Å; F279-F389 HydrophobicContact CD2-CE2 4.41Å; F279-F389 HydrophobicContact CE1-CE1 4.36Å; F279-F389 AromaticContact CE1-CE2 3.61Å; F279-F389 HydrophobicContact CE1-CE2 3.61Å; F279-F389 AromaticContact CE1-CZ 3.25Å; F279-F389 HydrophobicContact CE1-CZ 3.25Å; F279-F389 HydrophobicContact CE2-CZ 4.23Å; F279-F389 AromaticContact CG-CE2 3.85Å; F279-F389 HydrophobicContact CG-CE2 3.85Å; F279-F389 HydrophobicContact CG-CZ 4.24Å; F279-F389 HydrophobicContact CZ-CE2 4.22Å; F279-F389 AromaticContact CZ-CZ 3.62Å; F279-F389 HydrophobicContact CZ-CZ 3.62Å
280	Y	76.8	Confident	75.8	Confident	22 Å²	22	44.3 Å²	44.3	9%	0.086	21%	0.213	C	C	.	.	H	α-helix	trans	-47.3	-51.7	-172.4	-168	-85.3	0	0	0	115.2	F276 V282 Q283 Y284 L306 Y451	F276-Y280 PolarHBondContact O-N 2.97Å; Y280-V282 VanDerWaalsContact C-N 3.32Å; Y280-V282 PolarHBondContact O-N 2.54Å; Y280-Q283 WeakPolarHBondContact O-CB 3.5Å; Y280-Q283 PolarHBondContact O-N 2.83Å; Y280-Y284 HydrophobicContact CD1-CE2 4.17Å; Y280-Y284 AromaticContact CE1-CE2 3.72Å; Y280-Y284 HydrophobicContact CE1-CE2 3.72Å; Y280-Y284 AromaticContact CZ-CE2 3.93Å; Y280-Y284 WeakPolarHBondContact O-CD2 3.23Å; Y280-Y284 PolarHBondContact OH-OH 3.16Å; Y280-L306 HydrophobicContact CD1-CD2 3.75Å; Y280-L306 HydrophobicContact CD2-CD2 3.96Å; Y280-L306 HydrophobicContact CE1-CD2 4.33Å; Y280-L306 HydrophobicContact CE2-CD2 4.5Å; Y280-L306 HydrophobicContact CG-CD2 3.55Å; Y280-Y451 WeakPolarHBondContact CE1-OH 3.26Å
281	P	71	Confident	73.9	Confident	26 Å²	26	44.5 Å²	44.5	17%	0.169	21%	0.211	C	C	.	.	H	α-helix	trans	-71	-24.3	178.2	28.9	-36	0	0	0	113.8	T277 H278	T277-P281 WeakPolarHBondContact O-CD 3.42Å; H278-P281 WeakPolarHBondContact O-CD 3.05Å
282	V	69.5	Low	71.7	Confident	28 Å²	28	46.4 Å²	46.4	17%	0.17	22%	0.22	C	C	.	.	H	α-helix	trans	-85.6	-20.2	-178.7	-170.3	0	0	0	0	111.6	E217 H218 A221 H278 F279 Y280	E217-V282 HydrophobicContact CB-CG1 4.11Å; E217-V282 HydrophobicContact CB-CG2 4.41Å; H218-V282 HydrophobicContact CB-CG1 3.97Å; A221-V282 HydrophobicContact CB-CB 4.28Å; A221-V282 HydrophobicContact CB-CG1 4.36Å; A221-V282 HydrophobicContact CB-CG2 4.43Å; H278-V282 WeakPolarHBondContact O-CG2 3.08Å; F279-V282 CarbonylContact O-C 3.5Å; F279-V282 WeakPolarHBondContact O-CA 3.46Å; F279-V282 PolarHBondContact O-N 3.35Å; Y280-V282 VanDerWaalsContact C-N 3.32Å; Y280-V282 PolarHBondContact O-N 2.54Å
283	Q	64.8	Low	69.5	Low	24 Å²	24	54.4 Å²	54.4	11%	0.112	25%	0.25	C	S	.	.	H	α-helix	trans	-60.2	-44.1	174.4	-177.3	169.4	26.4	0	0	113	F279 Y280 K285 N390 G392	F279-Q283 HydrophobicContact CD1-CB 3.83Å; F279-Q283 HydrophobicContact CE1-CB 3.55Å; F279-Q283 HydrophobicContact CE1-CG 3.88Å; F279-Q283 PolarHBondContact O-N 2.87Å; Y280-Q283 WeakPolarHBondContact O-CB 3.5Å; Y280-Q283 PolarHBondContact O-N 2.83Å; Q283-K285 PolarHBondContact O-N 3.17Å; Q283-N390 PolarHBondContact NE2-O 3.46Å; Q283-G392 VanDerWaalsContact NE2-N 3.12Å
284	Y	60.5	Low	67.4	Low	95 Å²	95	55.4 Å²	55.4	37%	0.373	26%	0.26	S	S	.	.	S	Bend	trans	-71.1	103.8	-176.1	-69.7	-85.5	0	0	0	108.7	Y280 Q286	Y280-Y284 HydrophobicContact CD1-CE2 4.17Å; Y280-Y284 AromaticContact CE1-CE2 3.72Å; Y280-Y284 HydrophobicContact CE1-CE2 3.72Å; Y280-Y284 AromaticContact CZ-CE2 3.93Å; Y280-Y284 WeakPolarHBondContact O-CD2 3.23Å; Y280-Y284 PolarHBondContact OH-OH 3.16Å; Y284-Q286 PolarHBondContact O-N 3.4Å
285	K	52.8	Low	65.2	Low	197 Å²	197	59.6 Å²	59.6	86%	0.857	28%	0.281	S	S	*	.			trans	-64.3	72.6	166.5	-69.2	-179.9	179.4	173.5	0	109.7	Q283	Q283-K285 PolarHBondContact O-N 3.17Å
286	Q	53.7	Low	63.2	Low	49 Å²	49	61.6 Å²	61.6	23%	0.229	30%	0.302	C	S	.	.			trans	-57.1	136.7	169.9	-68.6	173	16.7	0	0	108	Y284 E290 G296	Y284-Q286 PolarHBondContact O-N 3.4Å; Q286-E290 HydrophobicContact CB-CB 4.25Å; Q286-G296 PolarHBondContact NE2-O 3.42Å; Q286-G296 VanDerWaalsContact NE2-O 3.14Å
287	N	51.9	Low	61.8	Low	108 Å²	108	64.8 Å²	64.8	58%	0.578	32%	0.317	S	S	*	.			trans	-60.3	151.6	169.4	-68.3	-77.4	0	0	0	108.8	L289 E290 Y291	N287-L289 PolarHBondContact O-N 2.84Å; N287-E290 HydrophobicContact CB-CG 4.17Å; N287-E290 WeakPolarHBondContact CB-OE2 3.33Å; N287-E290 PolarHBondContact N-OE2 2.66Å; N287-E290 PolarHBondContact ND2-OE2 2.87Å; N287-E290 WeakPolarHBondContact O-CA 3.29Å; N287-E290 WeakPolarHBondContact O-CB 3.28Å; N287-E290 PolarHBondContact O-N 3.24Å; N287-Y291 PolarHBondContact O-N 3.24Å
288	E	54.3	Low	60.7	Low	105 Å²	105	66.2 Å²	66.2	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-55.7	-34	-178.7	-57.5	-170.1	149.2	0	0	111.6	R211 Y291 E292	R211-E288 IonicContact CZ-OE1 3.37Å; R211-E288 IonicContact CZ-OE2 3.57Å; R211-E288 IonicContact NE-OE1 2.69Å; R211-E288 PolarHBondContact NE-OE1 2.95Å; R211-E288 IonicContact NE-OE2 3.62Å; R211-E288 IonicContact NH2-OE1 3.84Å; R211-E288 PolarHBondContact NH2-OE1 2.84Å; R211-E288 IonicContact NH2-OE2 3.69Å; R211-E288 PolarHBondContact NH2-OE2 3.34Å; E288-Y291 PolarHBondContact O-N 3.42Å; E288-E292 VanDerWaalsContact O-CB 3.28Å; E288-E292 WeakPolarHBondContact O-CB 3.31Å; E288-E292 WeakPolarHBondContact O-CG 3.47Å; E288-E292 PolarHBondContact O-N 3.28Å
289	L	51.4	Low	60.1	Low	103 Å²	103	71.8 Å²	71.8	54%	0.539	35%	0.351	S	S	.	.	H	α-helix	trans	-76.6	-16.9	177.4	-169.4	141.7	0	0	0	114.4	N287 R293	N287-L289 PolarHBondContact O-N 2.84Å; L289-R293 VanDerWaalsContact O-CD 3.26Å; L289-R293 WeakPolarHBondContact O-CD 3.39Å; L289-R293 WeakPolarHBondContact O-CG 3.17Å
290	E	56.7	Low	60	Low	74 Å²	74	77.7 Å²	77.7	35%	0.346	38%	0.382	S	S	.	.	H	α-helix	trans	-84.6	-42.9	169.6	-66.7	169.5	139.3	0	0	109.8	Q286 N287 R293 G294 I295	Q286-E290 HydrophobicContact CB-CB 4.25Å; N287-E290 HydrophobicContact CB-CG 4.17Å; N287-E290 WeakPolarHBondContact CB-OE2 3.33Å; N287-E290 PolarHBondContact N-OE2 2.66Å; N287-E290 PolarHBondContact ND2-OE2 2.87Å; N287-E290 WeakPolarHBondContact O-CA 3.29Å; N287-E290 WeakPolarHBondContact O-CB 3.28Å; N287-E290 PolarHBondContact O-N 3.24Å; E290-R293 CarbonylContact O-C 3.58Å; E290-R293 PolarHBondContact O-N 3.32Å; E290-R293 VanDerWaalsContact O-N 3.12Å; E290-G294 PolarHBondContact O-N 2.86Å; E290-I295 PolarHBondContact O-N 3.04Å
291	Y	56.4	Low	60.4	Low	48 Å²	48	77.8 Å²	77.8	19%	0.188	39%	0.39	C	S	.	.	H	α-helix	trans	-68.1	-32.6	175.5	-170	-109	0	0	0	113.4	I26 R210 C214 N287 E288 R293	I26-Y291 HydrophobicContact CD1-CE2 4.42Å; R210-Y291 HydrophobicContact CG-CD1 4.4Å; R210-Y291 HydrophobicContact CG-CE1 3.84Å; R210-Y291 PolarHBondContact NH2-O 2.87Å; C214-Y291 VanDerWaalsContact SG-CE1 3.55Å; N287-Y291 PolarHBondContact O-N 3.24Å; E288-Y291 PolarHBondContact O-N 3.42Å; Y291-R293 VanDerWaalsContact C-N 3.26Å; Y291-R293 PolarHBondContact O-N 3.29Å
292	E	52.2	Low	61.1	Low	41 Å²	41	76.6 Å²	76.6	19%	0.192	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-14.1	170.7	-80.4	-172.9	166.6	0	0	112.9	R207 E288	R207-E292 IonicContact CZ-OE1 2.86Å; R207-E292 IonicContact NE-OE1 3.23Å; R207-E292 PolarHBondContact NE-OE1 3.39Å; R207-E292 IonicContact NH2-OE1 3.61Å; R207-E292 PolarHBondContact NH2-OE1 3.24Å; R207-E292 IonicContact NH2-OE2 3.52Å; R207-E292 PolarHBondContact NH2-OE2 3.26Å; E288-E292 VanDerWaalsContact O-CB 3.28Å; E288-E292 WeakPolarHBondContact O-CB 3.31Å; E288-E292 WeakPolarHBondContact O-CG 3.47Å; E288-E292 PolarHBondContact O-N 3.28Å
293	R	50.6	Low	61.9	Low	168 Å²	168	76.3 Å²	76.3	63%	0.634	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	3.5	178.5	-70.1	178.1	174	177.7	-3.6	113.9	L289 E290 Y291 I295	L289-R293 VanDerWaalsContact O-CD 3.26Å; L289-R293 WeakPolarHBondContact O-CD 3.39Å; L289-R293 WeakPolarHBondContact O-CG 3.17Å; E290-R293 CarbonylContact O-C 3.58Å; E290-R293 PolarHBondContact O-N 3.32Å; E290-R293 VanDerWaalsContact O-N 3.12Å; Y291-R293 VanDerWaalsContact C-N 3.26Å; Y291-R293 PolarHBondContact O-N 3.29Å; R293-I295 HydrophobicContact CB-CD1 3.71Å; R293-I295 HydrophobicContact CB-CG1 3.73Å; R293-I295 HydrophobicContact CG-CD1 4.42Å; R293-I295 PolarHBondContact O-N 2.95Å; R293-I295 VanDerWaalsContact O-N 3.12Å
294	G	51.1	Low	63.1	Low	21 Å²	21	80.1 Å²	80.1	22%	0.216	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	9.3	-171.4	0	0	0	0	0	115.1	E290 G296 Q297	E290-G294 PolarHBondContact O-N 2.86Å; G294-G296 PolarHBondContact O-N 3.42Å; G294-Q297 PolarHBondContact O-N 2.86Å
295	I	48.1	Very low	64.6	Low	101 Å²	101	77 Å²	77	52%	0.518	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	87.9	-174.2	-60.4	173.5	0	0	0	108.9	E290 R293	E290-I295 PolarHBondContact O-N 3.04Å; R293-I295 HydrophobicContact CB-CD1 3.71Å; R293-I295 HydrophobicContact CB-CG1 3.73Å; R293-I295 HydrophobicContact CG-CD1 4.42Å; R293-I295 PolarHBondContact O-N 2.95Å; R293-I295 VanDerWaalsContact O-N 3.12Å
296	G	51.8	Low	66.5	Low	42 Å²	42	67.8 Å²	67.8	43%	0.433	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	133.9	0.1	-178.2	0	0	0	0	0	114.5	Q286 G294 V298	Q286-G296 PolarHBondContact NE2-O 3.42Å; Q286-G296 VanDerWaalsContact NE2-O 3.14Å; G294-G296 PolarHBondContact O-N 3.42Å; G296-V298 PolarHBondContact O-N 3.5Å
297	Q	60.9	Low	68.4	Low	73 Å²	73	67.6 Å²	67.6	34%	0.341	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-62.9	117.8	165.5	-64.4	-174.3	36	0	0	109.4	D24 G294 H299	D24-Q297 VanDerWaalsContact CG-NE2 3.31Å; D24-Q297 PolarHBondContact OD1-NE2 2.94Å; D24-Q297 PolarHBondContact OD2-NE2 3.49Å; D24-Q297 VanDerWaalsContact OD2-NE2 3.09Å; G294-Q297 PolarHBondContact O-N 2.86Å; Q297-H299 PolarHBondContact O-N 2.86Å
298	V	67.7	Low	70.5	Confident	44 Å²	44	65.8 Å²	65.8	27%	0.267	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-66.3	127.3	170.5	-178	0	0	0	0	107.9	G296 L303 Y451	G296-V298 PolarHBondContact O-N 3.5Å; V298-L303 HydrophobicContact CG1-CB 4.38Å; V298-Y451 HydrophobicContact CG1-CE2 4.5Å
299	H	75.6	Confident	72.4	Confident	125 Å²	125	60.8 Å²	60.8	58%	0.579	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-60.1	147.7	178.7	-171.1	-110.6	0	0	0	110.8	Q297 G301 G302 L303 Y455	Q297-H299 PolarHBondContact O-N 2.86Å; H299-G301 VanDerWaalsContact C-N 3.29Å; H299-G301 PolarHBondContact O-N 2.79Å; H299-G302 CarbonylContact O-C 3.58Å; H299-G302 WeakPolarHBondContact O-CA 3.26Å; H299-G302 PolarHBondContact O-N 3.29Å; H299-L303 PolarHBondContact O-N 2.94Å; H299-Y455 HydrophobicContact CB-CD1 4.31Å; H299-Y455 HydrophobicContact CB-CE1 4.13Å
300	I	81.4	Confident	74.4	Confident	137 Å²	137	56.3 Å²	56.3	70%	0.703	29%	0.291	S	S	*	.	H	α-helix	trans	-58.6	-38.6	-173.3	-167.7	167.1	0	0	0	112.9	G302 L303 L304	I300-G302 VanDerWaalsContact C-N 3.32Å; I300-G302 PolarHBondContact O-N 3.01Å; I300-L303 PolarHBondContact O-N 3.12Å; I300-L304 WeakPolarHBondContact O-CB 3.34Å; I300-L304 PolarHBondContact O-N 2.95Å
301	G	86.1	Confident	76.3	Confident	25 Å²	25	55 Å²	55	26%	0.258	29%	0.286	S	S	.	.	H	α-helix	trans	-65.9	-30.1	172.6	0	0	0	0	0	114.1	H299 L305	H299-G301 VanDerWaalsContact C-N 3.29Å; H299-G301 PolarHBondContact O-N 2.79Å; G301-L305 VanDerWaalsContact O-CB 3.31Å; G301-L305 WeakPolarHBondContact O-CB 3.44Å; G301-L305 PolarHBondContact O-N 3.34Å
302	G	85.6	Confident	78.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-73.5	-35.6	172.5	0	0	0	0	0	112.5	H299 I300 L306 Y451	H299-G302 CarbonylContact O-C 3.58Å; H299-G302 WeakPolarHBondContact O-CA 3.26Å; H299-G302 PolarHBondContact O-N 3.29Å; I300-G302 VanDerWaalsContact C-N 3.32Å; I300-G302 PolarHBondContact O-N 3.01Å; G302-L306 VanDerWaalsContact O-CB 3.26Å; G302-L306 WeakPolarHBondContact O-CB 3.48Å; G302-L306 PolarHBondContact O-N 2.95Å; G302-Y451 VanDerWaalsContact O-CE2 3.3Å; G302-Y451 WeakPolarHBondContact O-CE2 3.48Å
303	L	85.9	Confident	80.2	Confident	23 Å²	23	52.1 Å²	52.1	12%	0.12	28%	0.275	C	S	.	.	H	α-helix	trans	-69	-38.4	174	-167	71.3	0	0	0	111.5	T277 V298 H299 I300 L306 F307	T277-L303 HydrophobicContact CG2-CD1 3.62Å; T277-L303 HydrophobicContact CG2-CG 3.76Å; V298-L303 HydrophobicContact CG1-CB 4.38Å; H299-L303 PolarHBondContact O-N 2.94Å; I300-L303 PolarHBondContact O-N 3.12Å; L303-L306 PolarHBondContact O-N 2.86Å; L303-F307 PolarHBondContact O-N 3.4Å
304	L	91.1	Very high	82.4	Confident	104 Å²	104	44.1 Å²	44.1	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-66.5	-45.6	174	-179.5	63.1	0	0	0	111.8	I300 L306 F307 I308	I300-L304 WeakPolarHBondContact O-CB 3.34Å; I300-L304 PolarHBondContact O-N 2.95Å; L304-L306 VanDerWaalsContact C-N 3.32Å; L304-L306 PolarHBondContact O-N 3.47Å; L304-F307 PolarHBondContact O-N 3.09Å; L304-I308 HydrophobicContact CD1-CD1 4.35Å; L304-I308 HydrophobicContact CG-CD1 4.13Å; L304-I308 WeakPolarHBondContact O-CG1 3.45Å; L304-I308 PolarHBondContact O-N 3.09Å
305	L	92.4	Very high	84.5	Confident	29 Å²	29	44.9 Å²	44.9	15%	0.152	25%	0.245	C	C	.	.	H	α-helix	trans	-59.9	-43.2	174.3	177.6	59.5	0	0	0	111.2	G301 I308 I309 L447 I450 Y451 Y455	G301-L305 VanDerWaalsContact O-CB 3.31Å; G301-L305 WeakPolarHBondContact O-CB 3.44Å; G301-L305 PolarHBondContact O-N 3.34Å; L305-I308 PolarHBondContact O-N 3.44Å; L305-I309 HydrophobicContact CD1-CD1 4.17Å; L305-I309 HydrophobicContact CD1-CG1 4.42Å; L305-I309 HydrophobicContact CG-CD1 3.91Å; L305-I309 WeakPolarHBondContact O-CD1 3.36Å; L305-I309 VanDerWaalsContact O-CG1 3.28Å; L305-I309 WeakPolarHBondContact O-CG1 3.41Å; L305-I309 PolarHBondContact O-N 2.7Å; L305-L447 HydrophobicContact CD1-CB 4.34Å; L305-L447 HydrophobicContact CD1-CD2 4.13Å; L305-I450 HydrophobicContact CD2-CG2 4.45Å; L305-Y451 HydrophobicContact CD2-CD2 4.33Å; L305-Y455 HydrophobicContact CD2-CD2 4.1Å; L305-Y455 HydrophobicContact CD2-CE2 3.84Å
306	L	91	Very high	86.7	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-43.1	175.9	-175.3	64.7	0	0	0	112.1	Y280 G302 L303 L304 I308 I309 H310 Y451	Y280-L306 HydrophobicContact CD1-CD2 3.75Å; Y280-L306 HydrophobicContact CD2-CD2 3.96Å; Y280-L306 HydrophobicContact CE1-CD2 4.33Å; Y280-L306 HydrophobicContact CE2-CD2 4.5Å; Y280-L306 HydrophobicContact CG-CD2 3.55Å; G302-L306 VanDerWaalsContact O-CB 3.26Å; G302-L306 WeakPolarHBondContact O-CB 3.48Å; G302-L306 PolarHBondContact O-N 2.95Å; L303-L306 PolarHBondContact O-N 2.86Å; L304-L306 VanDerWaalsContact C-N 3.32Å; L304-L306 PolarHBondContact O-N 3.47Å; L306-I308 VanDerWaalsContact C-N 3.34Å; L306-I308 PolarHBondContact O-N 2.73Å; L306-I309 PolarHBondContact O-N 2.95Å; L306-H310 WeakPolarHBondContact CG-NE2 3.49Å; L306-H310 WeakPolarHBondContact O-CB 3.3Å; L306-H310 PolarHBondContact O-CD2 3.47Å; L306-H310 PolarHBondContact O-N 3.02Å; L306-Y451 HydrophobicContact CB-CD2 4.4Å; L306-Y451 HydrophobicContact CB-CE2 4.05Å; L306-Y451 HydrophobicContact CD1-CD1 4.31Å; L306-Y451 HydrophobicContact CD1-CE1 3.95Å
307	F	93.8	Very high	88.8	Confident	45 Å²	45	38.5 Å²	38.5	20%	0.197	20%	0.202	C	C	.	.	H	α-helix	trans	-59.9	-41.5	173.5	174.7	-97.1	0	0	0	112.6	L270 T277 L303 L304 H310 L311	L270-F307 HydrophobicContact CD2-CZ 3.88Å; T277-F307 HydrophobicContact CG2-CB 4.05Å; T277-F307 WeakPolarHBondContact OG1-CA 3.23Å; T277-F307 WeakPolarHBondContact OG1-CB 3.27Å; T277-F307 WeakPolarHBondContact OG1-CD2 3.44Å; L303-F307 PolarHBondContact O-N 3.4Å; L304-F307 PolarHBondContact O-N 3.09Å; F307-H310 PolarHBondContact O-N 2.74Å; F307-L311 HydrophobicContact CE1-CD2 4.16Å; F307-L311 HydrophobicContact CZ-CD2 4.49Å; F307-L311 VanDerWaalsContact O-CB 3.27Å; F307-L311 WeakPolarHBondContact O-CB 3.45Å; F307-L311 PolarHBondContact O-N 3.48Å
308	I	95.6	Very high	90.4	Very high	70 Å²	70	35.1 Å²	35.1	36%	0.359	19%	0.187	S	C	.	.	H	α-helix	trans	-66.4	-40.7	177.7	-68	163.8	0	0	0	111.1	L304 L305 L306 L311 I312	L304-I308 HydrophobicContact CD1-CD1 4.35Å; L304-I308 HydrophobicContact CG-CD1 4.13Å; L304-I308 WeakPolarHBondContact O-CG1 3.45Å; L304-I308 PolarHBondContact O-N 3.09Å; L305-I308 PolarHBondContact O-N 3.44Å; L306-I308 VanDerWaalsContact C-N 3.34Å; L306-I308 PolarHBondContact O-N 2.73Å; I308-L311 PolarHBondContact O-N 2.71Å; I308-I312 HydrophobicContact CG2-CD1 3.94Å; I308-I312 WeakPolarHBondContact O-CB 3.41Å; I308-I312 VanDerWaalsContact O-CG1 3.31Å; I308-I312 WeakPolarHBondContact O-CG1 3.46Å; I308-I312 PolarHBondContact O-N 2.89Å
309	I	94.2	Very high	91.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-51	174.5	-67.5	155.1	0	0	0	110.4	L305 L306 L311 I312 H313 L447 L448 Y451	L305-I309 HydrophobicContact CD1-CD1 4.17Å; L305-I309 HydrophobicContact CD1-CG1 4.42Å; L305-I309 HydrophobicContact CG-CD1 3.91Å; L305-I309 WeakPolarHBondContact O-CD1 3.36Å; L305-I309 VanDerWaalsContact O-CG1 3.28Å; L305-I309 WeakPolarHBondContact O-CG1 3.41Å; L305-I309 PolarHBondContact O-N 2.7Å; L306-I309 PolarHBondContact O-N 2.95Å; I309-L311 VanDerWaalsContact C-N 3.35Å; I309-L311 PolarHBondContact O-N 2.86Å; I309-I312 PolarHBondContact O-N 2.86Å; I309-H313 PolarHBondContact O-N 2.95Å; I309-L447 HydrophobicContact CD1-CB 4.29Å; I309-L447 HydrophobicContact CG1-CB 3.76Å; I309-L448 HydrophobicContact CD1-CB 4.38Å; I309-L448 HydrophobicContact CG2-CB 4.05Å; I309-L448 HydrophobicContact CG2-CD1 4.33Å; I309-Y451 HydrophobicContact CD1-CG 4.27Å
310	H	94.5	Very high	92.6	Very high	10 Å²	10	30 Å²	30	5%	0.046	16%	0.161	C	C	.	.	H	α-helix	trans	-56.6	-48.4	177.3	-67	-29	0	0	0	111.1	T277 L306 F307 I312 H313 I314 E387	T277-H310 PolarHBondContact OG1-CD2 3.2Å; L306-H310 WeakPolarHBondContact CG-NE2 3.49Å; L306-H310 WeakPolarHBondContact O-CB 3.3Å; L306-H310 PolarHBondContact O-CD2 3.47Å; L306-H310 PolarHBondContact O-N 3.02Å; F307-H310 PolarHBondContact O-N 2.74Å; H310-I312 VanDerWaalsContact C-N 3.33Å; H310-I312 PolarHBondContact O-N 3.37Å; H310-H313 PolarHBondContact O-N 3.38Å; H310-I314 HydrophobicContact CB-CD1 4.11Å; H310-I314 VanDerWaalsContact O-CB 3.29Å; H310-I314 WeakPolarHBondContact O-CB 3.45Å; H310-I314 WeakPolarHBondContact O-CD1 3.11Å; H310-I314 VanDerWaalsContact O-CG1 3.26Å; H310-I314 WeakPolarHBondContact O-CG1 3.04Å; H310-I314 PolarHBondContact O-N 2.84Å; H310-E387 WeakPolarHBondContact CA-OE2 3.33Å; H310-E387 WeakPolarHBondContact CB-OE2 3.34Å; H310-E387 IonicContact CE1-OE1 2.85Å; H310-E387 IonicContact CE1-OE2 3.22Å; H310-E387 IonicContact CG-OE1 2.84Å; H310-E387 IonicContact CG-OE2 3.6Å; H310-E387 IonicContact ND1-OE1 3.71Å; H310-E387 PolarHBondContact ND1-OE1 3.05Å; H310-E387 IonicContact ND1-OE2 2.69Å; H310-E387 PolarHBondContact ND1-OE2 3.38Å
311	L	96.3	Very high	93.3	Very high	47 Å²	47	23.8 Å²	23.8	25%	0.246	13%	0.129	C	C	.	.	H	α-helix	trans	-59.4	-41.3	178.4	-175.2	63.7	0	0	0	112.5	M269 L270 S273 F307 I308 I309 T315	M269-L311 HydrophobicContact CB-CD1 4Å; L270-L311 HydrophobicContact CD2-CD1 4.27Å; L270-L311 HydrophobicContact CD2-CD2 4.38Å; S273-L311 VanDerWaalsContact OG-CA 3.28Å; S273-L311 WeakPolarHBondContact OG-CA 3.36Å; F307-L311 HydrophobicContact CE1-CD2 4.16Å; F307-L311 HydrophobicContact CZ-CD2 4.49Å; F307-L311 VanDerWaalsContact O-CB 3.27Å; F307-L311 WeakPolarHBondContact O-CB 3.45Å; F307-L311 PolarHBondContact O-N 3.48Å; I308-L311 PolarHBondContact O-N 2.71Å; I309-L311 VanDerWaalsContact C-N 3.35Å; I309-L311 PolarHBondContact O-N 2.86Å; L311-T315 WeakPolarHBondContact O-CB 3.42Å; L311-T315 PolarHBondContact O-N 2.92Å; L311-T315 PolarHBondContact O-OG1 3.09Å
312	I	95.7	Very high	93.6	Very high	28 Å²	28	22.9 Å²	22.9	14%	0.144	12%	0.12	C	C	.	.	H	α-helix	trans	-64.2	-54.8	174.7	-73.1	166.1	0	0	0	110.7	I308 I309 H310 T315 L316 V440 L447	I308-I312 HydrophobicContact CG2-CD1 3.94Å; I308-I312 WeakPolarHBondContact O-CB 3.41Å; I308-I312 VanDerWaalsContact O-CG1 3.31Å; I308-I312 WeakPolarHBondContact O-CG1 3.46Å; I308-I312 PolarHBondContact O-N 2.89Å; I309-I312 PolarHBondContact O-N 2.86Å; H310-I312 VanDerWaalsContact C-N 3.33Å; H310-I312 PolarHBondContact O-N 3.37Å; I312-T315 PolarHBondContact O-N 3.39Å; I312-L316 HydrophobicContact CG2-CD1 3.89Å; I312-L316 VanDerWaalsContact O-CG 3.27Å; I312-L316 WeakPolarHBondContact O-CG 3.16Å; I312-L316 PolarHBondContact O-N 2.83Å; I312-L316 VanDerWaalsContact O-N 3.09Å; I312-V440 HydrophobicContact CG1-CG1 4.43Å; I312-V440 HydrophobicContact CG2-CG1 3.95Å; I312-V440 WeakPolarHBondContact CG2-O 3.49Å; I312-L447 HydrophobicContact CD1-CD1 3.87Å
313	H	95.2	Very high	94	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.3	-47.2	-173.5	-71.4	166.4	0	0	0	112.5	I309 H310 T315 R317 E387 Y404 Y407 Q441 G444 F445	I309-H313 PolarHBondContact O-N 2.95Å; H310-H313 PolarHBondContact O-N 3.38Å; H313-T315 PolarHBondContact O-N 3.02Å; H313-R317 WeakPolarHBondContact O-CB 3.36Å; H313-R317 PolarHBondContact O-N 2.96Å; H313-E387 IonicContact ND1-OE1 3.68Å; H313-Y404 AromaticContact CE1-CD1 3.95Å; H313-Y404 AromaticContact CE1-CE1 3.5Å; H313-Y404 VanDerWaalsContact CE1-CE1 3.5Å; H313-Y404 WeakPolarHBondContact CE1-CE1 3.29Å; H313-Y404 AromaticContact CG-CE1 3.97Å; H313-Y404 AromaticContact ND1-CE1 3.15Å; H313-Y404 WeakPolarHBondContact ND1-CE1 3.34Å; H313-Y404 AromaticContact ND1-CZ 3.65Å; H313-Y407 PolarHBondContact O-OH 2.93Å; H313-Q441 PolarHBondContact CD2-NE2 2.86Å; H313-Q441 PolarHBondContact NE2-NE2 3.29Å; H313-G444 PolarHBondContact CE1-O 3.46Å; H313-G444 WeakPolarHBondContact NE2-CA 3.46Å; H313-F445 PolarHBondContact NE2-N 2.7Å
314	I	95.7	Very high	94.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.9	-46	178.1	-64.7	159.8	0	0	0	110.9	M269 I272 F276 H310 L316 R317 C318 E387	M269-I314 HydrophobicContact SD-CG2 4.09Å; I272-I314 HydrophobicContact CB-CD1 4.45Å; I272-I314 HydrophobicContact CB-CG2 4.21Å; I272-I314 HydrophobicContact CD1-CG2 4.13Å; I272-I314 HydrophobicContact CG2-CD1 3.88Å; I272-I314 HydrophobicContact CG2-CG1 4.47Å; I272-I314 HydrophobicContact CG2-CG2 3.98Å; F276-I314 HydrophobicContact CD2-CD1 3.79Å; F276-I314 HydrophobicContact CE2-CD1 4.14Å; F276-I314 HydrophobicContact CG-CD1 4.49Å; H310-I314 HydrophobicContact CB-CD1 4.11Å; H310-I314 VanDerWaalsContact O-CB 3.29Å; H310-I314 WeakPolarHBondContact O-CB 3.45Å; H310-I314 WeakPolarHBondContact O-CD1 3.11Å; H310-I314 VanDerWaalsContact O-CG1 3.26Å; H310-I314 WeakPolarHBondContact O-CG1 3.04Å; H310-I314 PolarHBondContact O-N 2.84Å; I314-L316 PolarHBondContact O-N 3.16Å; I314-R317 PolarHBondContact O-N 3.34Å; I314-C318 WeakPolarHBondContact O-CB 3.49Å; I314-C318 PolarHBondContact O-N 3.45Å; I314-C318 PolarHBondContact O-SG 3.07Å; I314-C318 VanDerWaalsContact O-SG 3.34Å; I314-E387 WeakPolarHBondContact CD1-OE2 3.38Å; I314-E387 HydrophobicContact CG1-CB 4.28Å
315	T	95.5	Very high	94.5	Very high	37 Å²	37	19.1 Å²	19.1	23%	0.227	10%	0.101	C	C	.	.	H	α-helix	trans	-62.5	-47.7	-178.3	-58.8	0	0	0	0	111.4	M269 L311 I312 H313 R317 C318 I319	M269-T315 HydrophobicContact CG-CG2 4.41Å; L311-T315 WeakPolarHBondContact O-CB 3.42Å; L311-T315 PolarHBondContact O-N 2.92Å; L311-T315 PolarHBondContact O-OG1 3.09Å; I312-T315 PolarHBondContact O-N 3.39Å; H313-T315 PolarHBondContact O-N 3.02Å; T315-R317 PolarHBondContact O-N 3.03Å; T315-C318 PolarHBondContact O-N 2.98Å; T315-I319 HydrophobicContact CG2-CD1 3.82Å; T315-I319 VanDerWaalsContact O-CG1 3.29Å; T315-I319 WeakPolarHBondContact O-CG1 3.37Å; T315-I319 PolarHBondContact O-N 3.1Å
316	L	95.1	Very high	94.3	Very high	8 Å²	8	19.3 Å²	19.3	4%	0.042	11%	0.11	C	C	.	.	H	α-helix	trans	-69.3	-34.1	-178.9	-61.6	176.7	0	0	0	112.4	I312 I314 S320 V436 V437 V440 Q441	I312-L316 HydrophobicContact CG2-CD1 3.89Å; I312-L316 VanDerWaalsContact O-CG 3.27Å; I312-L316 WeakPolarHBondContact O-CG 3.16Å; I312-L316 PolarHBondContact O-N 2.83Å; I312-L316 VanDerWaalsContact O-N 3.09Å; I314-L316 PolarHBondContact O-N 3.16Å; L316-S320 WeakPolarHBondContact O-CB 3.29Å; L316-S320 PolarHBondContact O-N 2.97Å; L316-S320 PolarHBondContact O-OG 2.79Å; L316-V436 HydrophobicContact CD2-CG1 4.21Å; L316-V437 HydrophobicContact CD2-CG2 4.43Å; L316-V440 VanDerWaalsContact CD1-C 3.43Å; L316-V440 HydrophobicContact CD1-CB 3.8Å; L316-V440 HydrophobicContact CD1-CG1 4.02Å; L316-Q441 HydrophobicContact CD1-CB 3.87Å
317	R	95.4	Very high	94.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.3	-48.6	171.3	-180	61.8	168.8	-164.2	4.9	111.6	H313 I314 T315 S320 I321 L385 Y407 E410 N411	H313-R317 WeakPolarHBondContact O-CB 3.36Å; H313-R317 PolarHBondContact O-N 2.96Å; I314-R317 PolarHBondContact O-N 3.34Å; T315-R317 PolarHBondContact O-N 3.03Å; R317-S320 PolarHBondContact O-N 2.78Å; R317-I321 HydrophobicContact CG-CD1 3.98Å; R317-I321 VanDerWaalsContact O-CG1 3.29Å; R317-I321 WeakPolarHBondContact O-CG1 3.4Å; R317-I321 PolarHBondContact O-N 2.95Å; R317-L385 PolarHBondContact NE-O 3.49Å; R317-Y407 HydrophobicContact CB-CE1 4.46Å; R317-Y407 VanDerWaalsContact CB-OH 3.29Å; R317-Y407 WeakPolarHBondContact CB-OH 3.49Å; R317-Y407 HydrophobicContact CG-CE2 4.21Å; R317-E410 IonicContact CZ-OE1 3.18Å; R317-E410 IonicContact CZ-OE2 3.59Å; R317-E410 VanDerWaalsContact CZ-OE2 3.22Å; R317-E410 IonicContact NH1-OE1 2.7Å; R317-E410 IonicContact NH1-OE2 3.54Å; R317-E410 PolarHBondContact NH1-OE2 2.75Å; R317-E410 IonicContact NH2-OE1 2.89Å; R317-E410 PolarHBondContact NH2-OE1 3.31Å; R317-E410 IonicContact NH2-OE2 2.85Å; R317-E410 PolarHBondContact NH2-OE2 2.93Å; R317-N411 WeakPolarHBondContact CD-OD1 3.4Å; R317-N411 PolarHBondContact NH1-OD1 3.13Å
318	C	95	Very high	94	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.02	12%	0.123	C	C	.	.	H	α-helix	trans	-65.3	-38.7	178.2	-70.3	0	0	0	0	112.5	I237 M269 I314 T315 A322	I237-C318 HydrophobicContact CG1-CB 4.09Å; M269-C318 HydrophobicContact CE-CB 3.39Å; M269-C318 HydrophobicContact SD-CB 4.1Å; I314-C318 WeakPolarHBondContact O-CB 3.49Å; I314-C318 PolarHBondContact O-N 3.45Å; I314-C318 PolarHBondContact O-SG 3.07Å; I314-C318 VanDerWaalsContact O-SG 3.34Å; T315-C318 PolarHBondContact O-N 2.98Å; C318-A322 VanDerWaalsContact O-CB 3.24Å; C318-A322 WeakPolarHBondContact O-CB 3.26Å; C318-A322 PolarHBondContact O-N 2.86Å
319	I	93.9	Very high	93.6	Very high	60 Å²	60	27.2 Å²	27.2	31%	0.308	14%	0.136	S	C	.	.	H	α-helix	trans	-61.6	-49.2	172.3	-71.2	168.2	0	0	0	110.7	T315 I321 A322 L323 V437	T315-I319 HydrophobicContact CG2-CD1 3.82Å; T315-I319 VanDerWaalsContact O-CG1 3.29Å; T315-I319 WeakPolarHBondContact O-CG1 3.37Å; T315-I319 PolarHBondContact O-N 3.1Å; I319-I321 PolarHBondContact O-N 2.57Å; I319-A322 PolarHBondContact O-N 3.45Å; I319-L323 HydrophobicContact CG2-CD1 3.7Å; I319-L323 HydrophobicContact CG2-CG 4.33Å; I319-L323 WeakPolarHBondContact O-CB 3.47Å; I319-L323 WeakPolarHBondContact O-CG 3.47Å; I319-L323 PolarHBondContact O-N 3.23Å; I319-V437 HydrophobicContact CG2-CG2 4.14Å
320	S	95	Very high	93.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.9	-45.8	179.7	-56.6	0	0	0	0	111.6	L316 R317 F324 V437	L316-S320 WeakPolarHBondContact O-CB 3.29Å; L316-S320 PolarHBondContact O-N 2.97Å; L316-S320 PolarHBondContact O-OG 2.79Å; R317-S320 PolarHBondContact O-N 2.78Å; S320-F324 WeakPolarHBondContact O-CB 3.32Å; S320-F324 PolarHBondContact O-N 3.17Å; S320-V437 WeakPolarHBondContact OG-CG1 3.11Å
321	I	95.4	Very high	93.3	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.036	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-46.1	176.4	-67.8	168.1	0	0	0	110.8	I237 R317 I319 T325 I332 L336 M414	I237-I321 HydrophobicContact CD1-CD1 4.2Å; I237-I321 HydrophobicContact CD1-CG2 4.19Å; I237-I321 HydrophobicContact CG1-CG2 4.45Å; I237-I321 HydrophobicContact CG2-CG2 3.73Å; R317-I321 HydrophobicContact CG-CD1 3.98Å; R317-I321 VanDerWaalsContact O-CG1 3.29Å; R317-I321 WeakPolarHBondContact O-CG1 3.4Å; R317-I321 PolarHBondContact O-N 2.95Å; I319-I321 PolarHBondContact O-N 2.57Å; I321-T325 WeakPolarHBondContact O-CB 3.49Å; I321-T325 PolarHBondContact O-N 3.32Å; I321-T325 PolarHBondContact O-OG1 2.88Å; I321-I332 HydrophobicContact CG1-CD1 4.36Å; I321-I332 HydrophobicContact CG2-CD1 4.02Å; I321-I332 HydrophobicContact CG2-CG1 4.3Å; I321-L336 HydrophobicContact CD1-CD2 4.09Å; I321-L336 HydrophobicContact CG1-CD2 4.43Å; I321-M414 HydrophobicContact CG1-CE 4.11Å; I321-M414 HydrophobicContact CG1-SD 4.24Å
322	A	93.8	Very high	93.1	Very high	7 Å²	7	35.9 Å²	35.9	6%	0.058	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-47.4	-176	0	0	0	0	0	112.3	I241 C318 I319 T325 G326	I241-A322 HydrophobicContact CG1-CB 4.11Å; C318-A322 VanDerWaalsContact O-CB 3.24Å; C318-A322 WeakPolarHBondContact O-CB 3.26Å; C318-A322 PolarHBondContact O-N 2.86Å; I319-A322 PolarHBondContact O-N 3.45Å; A322-T325 PolarHBondContact O-N 3.43Å; A322-G326 PolarHBondContact O-N 2.89Å
323	L	92.9	Very high	92.9	Very high	23 Å²	23	41 Å²	41	12%	0.12	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-46.2	178.9	-66.4	175.9	0	0	0	111.9	Y244 I319 T325 G326 R327 I415 W418 C433	Y244-L323 HydrophobicContact CD2-CD2 3.35Å; Y244-L323 HydrophobicContact CE2-CD2 3.69Å; Y244-L323 HydrophobicContact CG-CD2 4.15Å; I319-L323 HydrophobicContact CG2-CD1 3.7Å; I319-L323 HydrophobicContact CG2-CG 4.33Å; I319-L323 WeakPolarHBondContact O-CB 3.47Å; I319-L323 WeakPolarHBondContact O-CG 3.47Å; I319-L323 PolarHBondContact O-N 3.23Å; L323-T325 PolarHBondContact O-N 2.91Å; L323-G326 PolarHBondContact O-N 3Å; L323-R327 PolarHBondContact O-N 2.96Å; L323-I415 HydrophobicContact CD1-CD1 3.88Å; L323-W418 HydrophobicContact CB-CD2 4.15Å; L323-W418 HydrophobicContact CB-CG 4Å; L323-W418 HydrophobicContact CD1-CD2 4.43Å; L323-W418 HydrophobicContact CD1-CH2 4.48Å; L323-W418 HydrophobicContact CD1-CZ2 4.35Å; L323-W418 HydrophobicContact CD2-CZ2 4.27Å; L323-W418 VanDerWaalsContact O-CD1 3.23Å; L323-C433 WeakPolarHBondContact CD1-SG 3.45Å
324	F	94.4	Very high	92.8	Very high	3 Å²	3	46.6 Å²	46.6	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-43.9	176.8	-177.4	-96.5	0	0	0	111.7	S320 G326 R327 F328 F331 I332 I335 M414 L417	S320-F324 WeakPolarHBondContact O-CB 3.32Å; S320-F324 PolarHBondContact O-N 3.17Å; F324-G326 VanDerWaalsContact C-N 3.3Å; F324-G326 PolarHBondContact O-N 3.43Å; F324-R327 PolarHBondContact O-N 2.75Å; F324-R327 VanDerWaalsContact O-N 3.09Å; F324-F328 HydrophobicContact CD1-CB 4.21Å; F324-F328 HydrophobicContact CD2-CB 4.41Å; F324-F328 AromaticContact CD2-CD2 3.64Å; F324-F328 HydrophobicContact CD2-CD2 3.64Å; F324-F328 HydrophobicContact CD2-CE2 4.34Å; F324-F328 HydrophobicContact CD2-CG 4.39Å; F324-F328 HydrophobicContact CE1-CB 3.74Å; F324-F328 HydrophobicContact CE2-CB 3.98Å; F324-F328 AromaticContact CE2-CD2 3.4Å; F324-F328 HydrophobicContact CE2-CD2 3.4Å; F324-F328 VanDerWaalsContact CE2-CD2 3.4Å; F324-F328 HydrophobicContact CE2-CE2 4.05Å; F324-F328 AromaticContact CE2-CG 3.87Å; F324-F328 HydrophobicContact CE2-CG 3.87Å; F324-F328 HydrophobicContact CG-CD2 4.37Å; F324-F328 HydrophobicContact CZ-CB 3.62Å; F324-F328 AromaticContact CZ-CD2 3.96Å; F324-F328 HydrophobicContact CZ-CD2 3.96Å; F324-F328 AromaticContact CZ-CG 3.94Å; F324-F328 HydrophobicContact CZ-CG 3.94Å; F324-F328 WeakPolarHBondContact O-CB 3.43Å; F324-F328 PolarHBondContact O-N 3.34Å; F324-F331 HydrophobicContact CE1-CB 4.08Å; F324-F331 HydrophobicContact CZ-CB 4Å; F324-I332 HydrophobicContact CD1-CB 4.13Å; F324-I332 HydrophobicContact CD1-CD1 4.03Å; F324-I332 HydrophobicContact CE1-CB 4.23Å; F324-I335 HydrophobicContact CD1-CD1 4.39Å; F324-I335 HydrophobicContact CE1-CD1 3.56Å; F324-I335 HydrophobicContact CE2-CD1 4.46Å; F324-I335 HydrophobicContact CZ-CD1 3.6Å; F324-M414 HydrophobicContact CB-CB 3.98Å; F324-M414 HydrophobicContact CB-CG 4.25Å; F324-M414 HydrophobicContact CB-SD 4.49Å; F324-M414 HydrophobicContact CD1-CG 4.17Å; F324-M414 HydrophobicContact CD1-SD 4.38Å; F324-M414 HydrophobicContact CD2-CB 4.12Å; F324-M414 HydrophobicContact CD2-CG 4.23Å; F324-M414 WeakPolarHBondContact CD2-O 3.27Å; F324-M414 HydrophobicContact CG-CB 4.03Å; F324-M414 HydrophobicContact CG-CG 3.94Å; F324-M414 HydrophobicContact CG-SD 4.48Å; F324-L417 HydrophobicContact CD2-CB 4.34Å; F324-L417 HydrophobicContact CE2-CB 3.91Å; F324-L417 HydrophobicContact CE2-CD1 4.01Å
325	T	93.5	Very high	92.7	Very high	22 Å²	22	48.5 Å²	48.5	14%	0.135	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-36.9	176.7	-56.2	0	0	0	0	112	I241 I321 A322 L323 R327 F328 Y329 I332	I241-T325 HydrophobicContact CD1-CG2 3.51Å; I241-T325 HydrophobicContact CG1-CG2 4.14Å; I321-T325 WeakPolarHBondContact O-CB 3.49Å; I321-T325 PolarHBondContact O-N 3.32Å; I321-T325 PolarHBondContact O-OG1 2.88Å; A322-T325 PolarHBondContact O-N 3.43Å; L323-T325 PolarHBondContact O-N 2.91Å; T325-R327 PolarHBondContact O-N 3.09Å; T325-R327 VanDerWaalsContact O-N 3.15Å; T325-F328 PolarHBondContact O-N 3.14Å; T325-Y329 WeakPolarHBondContact O-CA 3.33Å; T325-Y329 PolarHBondContact O-N 3.25Å; T325-I332 HydrophobicContact CG2-CG2 4.01Å; T325-I332 WeakPolarHBondContact OG1-CG1 3.49Å
326	G	87.8	Confident	92.6	Very high	33 Å²	33	48.8 Å²	48.8	34%	0.34	24%	0.236	S	C	.	.	H	α-helix	trans	-59.9	-20.1	174.9	0	0	0	0	0	114.4	A322 L323 F324	A322-G326 PolarHBondContact O-N 2.89Å; L323-G326 PolarHBondContact O-N 3Å; F324-G326 VanDerWaalsContact C-N 3.3Å; F324-G326 PolarHBondContact O-N 3.43Å
327	R	89.2	Confident	92.6	Very high	87 Å²	87	52.9 Å²	52.9	33%	0.328	26%	0.257	S	S	.	.	H	α-helix	trans	-109.2	-34.7	175.1	-171.9	63.7	176.7	105.5	-4.1	113.9	L323 F324 T325 Y421	L323-R327 PolarHBondContact O-N 2.96Å; F324-R327 PolarHBondContact O-N 2.75Å; F324-R327 VanDerWaalsContact O-N 3.09Å; T325-R327 PolarHBondContact O-N 3.09Å; T325-R327 VanDerWaalsContact O-N 3.15Å; R327-Y421 PolarHBondContact NE-O 2.75Å; R327-Y421 PolarHBondContact NH2-O 3.24Å
328	F	91	Very high	92.5	Very high	35 Å²	35	54.3 Å²	54.3	15%	0.154	27%	0.272	C	S	.	.			trans	-129.4	49.9	-166.3	-64.4	-75.2	0	0	0	112.8	F324 T325 L330 F331 I332 L417 Y421	F324-F328 HydrophobicContact CD1-CB 4.21Å; F324-F328 HydrophobicContact CD2-CB 4.41Å; F324-F328 AromaticContact CD2-CD2 3.64Å; F324-F328 HydrophobicContact CD2-CD2 3.64Å; F324-F328 HydrophobicContact CD2-CE2 4.34Å; F324-F328 HydrophobicContact CD2-CG 4.39Å; F324-F328 HydrophobicContact CE1-CB 3.74Å; F324-F328 HydrophobicContact CE2-CB 3.98Å; F324-F328 AromaticContact CE2-CD2 3.4Å; F324-F328 HydrophobicContact CE2-CD2 3.4Å; F324-F328 VanDerWaalsContact CE2-CD2 3.4Å; F324-F328 HydrophobicContact CE2-CE2 4.05Å; F324-F328 AromaticContact CE2-CG 3.87Å; F324-F328 HydrophobicContact CE2-CG 3.87Å; F324-F328 HydrophobicContact CG-CD2 4.37Å; F324-F328 HydrophobicContact CZ-CB 3.62Å; F324-F328 AromaticContact CZ-CD2 3.96Å; F324-F328 HydrophobicContact CZ-CD2 3.96Å; F324-F328 AromaticContact CZ-CG 3.94Å; F324-F328 HydrophobicContact CZ-CG 3.94Å; F324-F328 WeakPolarHBondContact O-CB 3.43Å; F324-F328 PolarHBondContact O-N 3.34Å; T325-F328 PolarHBondContact O-N 3.14Å; F328-L330 PolarHBondContact O-N 2.76Å; F328-F331 HydrophobicContact CB-CB 4.25Å; F328-F331 HydrophobicContact CB-CD2 4.23Å; F328-F331 HydrophobicContact CD1-CD2 4.01Å; F328-F331 HydrophobicContact CD1-CE2 4.46Å; F328-F331 PolarHBondContact O-N 3.14Å; F328-I332 PolarHBondContact O-N 2.96Å; F328-L417 HydrophobicContact CE2-CB 4.3Å; F328-L417 WeakPolarHBondContact CE2-O 3.47Å; F328-Y421 HydrophobicContact CE2-CD2 4.45Å; F328-Y421 AromaticContact CZ-CD2 3.69Å; F328-Y421 HydrophobicContact CZ-CD2 3.69Å; F328-Y421 AromaticContact CZ-CG 3.75Å; F328-Y421 HydrophobicContact CZ-CG 3.75Å
329	Y	86.2	Confident	92.4	Very high	162 Å²	162	54.9 Å²	54.9	64%	0.635	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-20.3	-171.6	70.1	-86	0	0	0	116.8	T325 I332 F333	T325-Y329 WeakPolarHBondContact O-CA 3.33Å; T325-Y329 PolarHBondContact O-N 3.25Å; Y329-I332 WeakPolarHBondContact O-CG2 3.26Å; Y329-F333 WeakPolarHBondContact O-CD2 3.46Å; Y329-F333 WeakPolarHBondContact O-CE2 3.34Å
330	L	89.2	Confident	92.4	Very high	109 Å²	109	54.3 Å²	54.3	57%	0.571	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-39.5	171.8	-64.2	-178.8	0	0	0	113.2	F328 I332 F333	F328-L330 PolarHBondContact O-N 2.76Å; L330-I332 VanDerWaalsContact C-N 3.31Å; L330-I332 PolarHBondContact O-N 3.49Å; L330-F333 PolarHBondContact O-N 3.48Å
331	F	92.6	Very high	92.4	Very high	121 Å²	121	58.2 Å²	58.2	53%	0.531	29%	0.289	S	S	.	.	H	α-helix	trans	-70.8	-26.4	-175	-69.2	-82.6	0	0	0	112.9	F324 F328 F333 I334 I335	F324-F331 HydrophobicContact CE1-CB 4.08Å; F324-F331 HydrophobicContact CZ-CB 4Å; F328-F331 HydrophobicContact CB-CB 4.25Å; F328-F331 HydrophobicContact CB-CD2 4.23Å; F328-F331 HydrophobicContact CD1-CD2 4.01Å; F328-F331 HydrophobicContact CD1-CE2 4.46Å; F328-F331 PolarHBondContact O-N 3.14Å; F331-F333 PolarHBondContact O-N 3.06Å; F331-I334 HydrophobicContact CD1-CD1 4.12Å; F331-I334 WeakPolarHBondContact O-CB 3.41Å; F331-I334 PolarHBondContact O-N 3.09Å; F331-I335 PolarHBondContact O-N 2.78Å
332	I	92.1	Very high	92.2	Very high	9 Å²	9	62.5 Å²	62.5	5%	0.046	31%	0.311	C	S	.	.	H	α-helix	trans	-58.9	-34.5	175.9	-173.5	65.6	0	0	0	112.1	I321 F324 T325 F328 Y329 L330 I334 I335 L336 M414	I321-I332 HydrophobicContact CG1-CD1 4.36Å; I321-I332 HydrophobicContact CG2-CD1 4.02Å; I321-I332 HydrophobicContact CG2-CG1 4.3Å; F324-I332 HydrophobicContact CD1-CB 4.13Å; F324-I332 HydrophobicContact CD1-CD1 4.03Å; F324-I332 HydrophobicContact CE1-CB 4.23Å; T325-I332 HydrophobicContact CG2-CG2 4.01Å; T325-I332 WeakPolarHBondContact OG1-CG1 3.49Å; F328-I332 PolarHBondContact O-N 2.96Å; Y329-I332 WeakPolarHBondContact O-CG2 3.26Å; L330-I332 VanDerWaalsContact C-N 3.31Å; L330-I332 PolarHBondContact O-N 3.49Å; I332-I334 PolarHBondContact O-N 3.16Å; I332-I335 PolarHBondContact O-N 3.37Å; I332-L336 HydrophobicContact CD1-CD1 3.89Å; I332-L336 HydrophobicContact CD1-CD2 4.2Å; I332-L336 HydrophobicContact CD1-CG 3.74Å; I332-L336 HydrophobicContact CG1-CD1 3.69Å; I332-L336 HydrophobicContact CG1-CG 3.94Å; I332-L336 WeakPolarHBondContact O-CB 3.37Å; I332-L336 WeakPolarHBondContact O-CG 3.41Å; I332-L336 PolarHBondContact O-N 3.34Å; I332-M414 HydrophobicContact CD1-SD 3.85Å
333	F	91.5	Very high	92.1	Very high	135 Å²	135	62.7 Å²	62.7	59%	0.592	31%	0.311	S	S	*	.	H	α-helix	trans	-63.4	-42.5	174.9	-70.9	-78.4	0	0	0	111.6	Y329 L330 F331 I337	Y329-F333 WeakPolarHBondContact O-CD2 3.46Å; Y329-F333 WeakPolarHBondContact O-CE2 3.34Å; L330-F333 PolarHBondContact O-N 3.48Å; F331-F333 PolarHBondContact O-N 3.06Å; F333-I337 HydrophobicContact CB-CD1 4.45Å; F333-I337 WeakPolarHBondContact O-CB 3.37Å; F333-I337 WeakPolarHBondContact O-CD1 3.4Å; F333-I337 WeakPolarHBondContact O-CG1 3.28Å; F333-I337 PolarHBondContact O-N 2.84Å
334	I	94	Very high	92	Very high	118 Å²	118	62.4 Å²	62.4	61%	0.605	31%	0.31	S	S	*	.	H	α-helix	trans	-62.8	-45.5	178.2	-60.5	170	0	0	0	110.3	F331 I332 G338	F331-I334 HydrophobicContact CD1-CD1 4.12Å; F331-I334 WeakPolarHBondContact O-CB 3.41Å; F331-I334 PolarHBondContact O-N 3.09Å; I332-I334 PolarHBondContact O-N 3.16Å; I334-G338 PolarHBondContact O-N 3Å
335	I	93.6	Very high	91.9	Very high	40 Å²	40	66.7 Å²	66.7	21%	0.205	33%	0.332	C	S	.	.	H	α-helix	trans	-64	-54	179.6	-66.2	175.9	0	0	0	111	F324 F331 I332 I337 G338 H339 E410 M414	F324-I335 HydrophobicContact CD1-CD1 4.39Å; F324-I335 HydrophobicContact CE1-CD1 3.56Å; F324-I335 HydrophobicContact CE2-CD1 4.46Å; F324-I335 HydrophobicContact CZ-CD1 3.6Å; F331-I335 PolarHBondContact O-N 2.78Å; I332-I335 PolarHBondContact O-N 3.37Å; I335-I337 PolarHBondContact O-N 3.41Å; I335-G338 PolarHBondContact O-N 3.24Å; I335-G338 VanDerWaalsContact O-N 3.17Å; I335-H339 PolarHBondContact O-N 2.96Å; I335-E410 HydrophobicContact CG2-CG 3.73Å; I335-E410 VanDerWaalsContact CG2-OE1 3.25Å; I335-E410 WeakPolarHBondContact CG2-OE1 3.49Å; I335-M414 HydrophobicContact CD1-CG 4.11Å; I335-M414 HydrophobicContact CG2-SD 4.25Å
336	L	93.4	Very high	91.6	Very high	43 Å²	43	68.8 Å²	68.8	23%	0.225	35%	0.345	C	S	.	.	H	α-helix	trans	-67.9	-36.5	-176.6	-65.5	-178.5	0	0	0	112.7	I321 I332 Y340 L385	I321-L336 HydrophobicContact CD1-CD2 4.09Å; I321-L336 HydrophobicContact CG1-CD2 4.43Å; I332-L336 HydrophobicContact CD1-CD1 3.89Å; I332-L336 HydrophobicContact CD1-CD2 4.2Å; I332-L336 HydrophobicContact CD1-CG 3.74Å; I332-L336 HydrophobicContact CG1-CD1 3.69Å; I332-L336 HydrophobicContact CG1-CG 3.94Å; I332-L336 WeakPolarHBondContact O-CB 3.37Å; I332-L336 WeakPolarHBondContact O-CG 3.41Å; I332-L336 PolarHBondContact O-N 3.34Å; L336-Y340 WeakPolarHBondContact O-CB 3.42Å; L336-Y340 PolarHBondContact O-N 2.63Å; L336-L385 HydrophobicContact CB-CD2 4.15Å; L336-L385 HydrophobicContact CD2-CD2 4.03Å; L336-L385 WeakPolarHBondContact O-CD2 3.33Å
337	I	94.1	Very high	91.5	Very high	94 Å²	94	67.4 Å²	67.4	48%	0.482	33%	0.329	S	S	.	.	H	α-helix	trans	-66.5	-40.6	172.7	-67.7	168.2	0	0	0	110	F333 I335 Y340 L341	F333-I337 HydrophobicContact CB-CD1 4.45Å; F333-I337 WeakPolarHBondContact O-CB 3.37Å; F333-I337 WeakPolarHBondContact O-CD1 3.4Å; F333-I337 WeakPolarHBondContact O-CG1 3.28Å; F333-I337 PolarHBondContact O-N 2.84Å; I335-I337 PolarHBondContact O-N 3.41Å; I337-Y340 PolarHBondContact O-N 2.8Å; I337-L341 HydrophobicContact CG2-CD1 3.79Å; I337-L341 HydrophobicContact CG2-CG 4.22Å; I337-L341 WeakPolarHBondContact O-CB 3.12Å; I337-L341 VanDerWaalsContact O-CG 3.26Å; I337-L341 WeakPolarHBondContact O-CG 3.5Å; I337-L341 PolarHBondContact O-N 2.73Å
338	G	93.6	Very high	91.3	Very high	29 Å²	29	66.1 Å²	66.1	30%	0.299	33%	0.329	S	S	.	.	H	α-helix	trans	-56.7	-54.3	174.2	0	0	0	0	0	112.5	I334 I335 Y340 L341 I342	I334-G338 PolarHBondContact O-N 3Å; I335-G338 PolarHBondContact O-N 3.24Å; I335-G338 VanDerWaalsContact O-N 3.17Å; G338-Y340 PolarHBondContact O-N 3.45Å; G338-L341 PolarHBondContact O-N 3.3Å; G338-I342 WeakPolarHBondContact O-CD1 3.36Å; G338-I342 VanDerWaalsContact O-CG1 3.26Å; G338-I342 WeakPolarHBondContact O-CG1 3.33Å; G338-I342 PolarHBondContact O-N 2.99Å
339	H	93.9	Very high	91.1	Very high	15 Å²	15	68.2 Å²	68.2	7%	0.069	34%	0.341	C	S	.	.	H	α-helix	trans	-60.8	-45.3	176.8	180	84.4	0	0	0	112.2	I335 L341 I342 V343 N384 Y403 E410	I335-H339 PolarHBondContact O-N 2.96Å; H339-L341 VanDerWaalsContact C-N 3.34Å; H339-L341 PolarHBondContact O-N 2.72Å; H339-I342 PolarHBondContact O-N 3.5Å; H339-V343 WeakPolarHBondContact O-CB 3.3Å; H339-V343 WeakPolarHBondContact O-CG2 3.46Å; H339-V343 PolarHBondContact O-N 3.43Å; H339-N384 PolarHBondContact NE2-O 3.42Å; H339-Y403 AromaticContact CE1-CE2 3.65Å; H339-Y403 AromaticContact NE2-CE2 3.7Å; H339-E410 IonicContact CE1-OE2 3.11Å; H339-E410 IonicContact CG-OE2 3.02Å; H339-E410 IonicContact ND1-OE2 2.95Å; H339-E410 PolarHBondContact ND1-OE2 2.99Å
340	Y	94.1	Very high	90.8	Very high	48 Å²	48	61.2 Å²	61.2	19%	0.188	32%	0.316	C	S	.	.	H	α-helix	trans	-56.6	-45.2	176.4	178.1	-94.4	0	0	0	112.3	L336 I337 G338 V343 L344 L378 S381 L385	L336-Y340 WeakPolarHBondContact O-CB 3.42Å; L336-Y340 PolarHBondContact O-N 2.63Å; I337-Y340 PolarHBondContact O-N 2.8Å; G338-Y340 PolarHBondContact O-N 3.45Å; Y340-V343 PolarHBondContact O-N 3.11Å; Y340-L344 HydrophobicContact CE1-CD2 4.04Å; Y340-L344 VanDerWaalsContact O-CB 3.26Å; Y340-L344 WeakPolarHBondContact O-CB 3.23Å; Y340-L344 PolarHBondContact O-N 3.17Å; Y340-L378 WeakPolarHBondContact OH-CA 3.47Å; Y340-L378 WeakPolarHBondContact OH-CD2 3.24Å; Y340-L378 PolarHBondContact OH-O 2.8Å; Y340-S381 VanDerWaalsContact CE2-CB 3.48Å; Y340-L385 HydrophobicContact CD2-CD1 4.09Å; Y340-L385 HydrophobicContact CD2-CG 4.49Å
341	L	94.2	Very high	90.2	Very high	83 Å²	83	58.1 Å²	58.1	44%	0.435	30%	0.297	S	S	.	.	H	α-helix	trans	-68.7	-42.3	178.3	-70.8	174.6	0	0	0	112.1	I337 G338 H339 V343 L344 I345	I337-L341 HydrophobicContact CG2-CD1 3.79Å; I337-L341 HydrophobicContact CG2-CG 4.22Å; I337-L341 WeakPolarHBondContact O-CB 3.12Å; I337-L341 VanDerWaalsContact O-CG 3.26Å; I337-L341 WeakPolarHBondContact O-CG 3.5Å; I337-L341 PolarHBondContact O-N 2.73Å; G338-L341 PolarHBondContact O-N 3.3Å; H339-L341 VanDerWaalsContact C-N 3.34Å; H339-L341 PolarHBondContact O-N 2.72Å; L341-V343 VanDerWaalsContact C-N 3.31Å; L341-V343 PolarHBondContact O-N 2.69Å; L341-L344 PolarHBondContact O-N 2.86Å; L341-I345 VanDerWaalsContact O-CB 3.31Å; L341-I345 WeakPolarHBondContact O-CB 3.44Å; L341-I345 WeakPolarHBondContact O-CD1 3.47Å; L341-I345 WeakPolarHBondContact O-CG1 3.43Å; L341-I345 PolarHBondContact O-N 2.83Å
342	I	92	Very high	89.6	Confident	97 Å²	97	58.9 Å²	58.9	50%	0.497	30%	0.302	S	S	.	.	H	α-helix	trans	-58	-45.2	175.3	-71	164	0	0	0	110.6	G338 H339 T346	G338-I342 WeakPolarHBondContact O-CD1 3.36Å; G338-I342 VanDerWaalsContact O-CG1 3.26Å; G338-I342 WeakPolarHBondContact O-CG1 3.33Å; G338-I342 PolarHBondContact O-N 2.99Å; H339-I342 PolarHBondContact O-N 3.5Å; I342-T346 VanDerWaalsContact O-CB 3.3Å; I342-T346 WeakPolarHBondContact O-CB 3.33Å; I342-T346 PolarHBondContact O-N 3.12Å; I342-T346 PolarHBondContact O-OG1 3.19Å
343	V	91.3	Very high	88.8	Confident	10 Å²	10	66.3 Å²	66.3	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-64	-49.3	175.4	168.2	0	0	0	0	111.5	H339 Y340 L341 I345 T346 I347 N384 Y403	H339-V343 WeakPolarHBondContact O-CB 3.3Å; H339-V343 WeakPolarHBondContact O-CG2 3.46Å; H339-V343 PolarHBondContact O-N 3.43Å; Y340-V343 PolarHBondContact O-N 3.11Å; L341-V343 VanDerWaalsContact C-N 3.31Å; L341-V343 PolarHBondContact O-N 2.69Å; V343-I345 PolarHBondContact O-N 3.31Å; V343-T346 CarbonylContact O-C 3.57Å; V343-T346 WeakPolarHBondContact O-CA 3.28Å; V343-T346 WeakPolarHBondContact O-CB 3.28Å; V343-T346 PolarHBondContact O-N 2.92Å; V343-T346 VanDerWaalsContact O-N 3.11Å; V343-I347 HydrophobicContact CG1-CD1 3.81Å; V343-I347 HydrophobicContact CG1-CG1 4.41Å; V343-I347 WeakPolarHBondContact O-CG1 3.41Å; V343-I347 PolarHBondContact O-N 2.85Å; V343-N384 HydrophobicContact CB-CB 4.42Å; V343-N384 HydrophobicContact CG1-CB 3.49Å; V343-N384 VanDerWaalsContact CG1-CB 3.49Å; V343-N384 HydrophobicContact CG2-CB 4.17Å; V343-Y403 HydrophobicContact CG2-CD2 4.31Å; V343-Y403 HydrophobicContact CG2-CE2 4.12Å
344	L	91.3	Very high	87.7	Confident	17 Å²	17	61.3 Å²	61.3	9%	0.089	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-47.2	-178.4	177.8	61.5	0	0	0	111.1	Y340 L341 T346 I347 L348 D377 L378 S381	Y340-L344 HydrophobicContact CE1-CD2 4.04Å; Y340-L344 VanDerWaalsContact O-CB 3.26Å; Y340-L344 WeakPolarHBondContact O-CB 3.23Å; Y340-L344 PolarHBondContact O-N 3.17Å; L341-L344 PolarHBondContact O-N 2.86Å; L344-T346 VanDerWaalsContact C-N 3.32Å; L344-T346 PolarHBondContact O-N 3.41Å; L344-I347 PolarHBondContact O-N 3.46Å; L344-L348 HydrophobicContact CD1-CD1 4.19Å; L344-L348 HydrophobicContact CD1-CG 4.28Å; L344-L348 HydrophobicContact CG-CD1 4.02Å; L344-L348 WeakPolarHBondContact O-CB 3.26Å; L344-L348 VanDerWaalsContact O-CG 3.27Å; L344-L348 WeakPolarHBondContact O-CG 3.49Å; L344-L348 PolarHBondContact O-N 3.42Å; L344-D377 HydrophobicContact CD1-CB 4.17Å; L344-L378 HydrophobicContact CD1-CD2 4.31Å; L344-L378 HydrophobicContact CD2-CD2 4.04Å; L344-S381 WeakPolarHBondContact CA-OG 3.44Å; L344-S381 WeakPolarHBondContact CB-OG 3.17Å; L344-S381 WeakPolarHBondContact CD1-OG 3.27Å
345	I	90.5	Very high	86.4	Confident	93 Å²	93	59.8 Å²	59.8	48%	0.477	31%	0.305	S	S	.	.	H	α-helix	trans	-58.8	-44.4	174.2	-68.8	165.2	0	0	0	110.3	L341 V343 I347 L348 I349	L341-I345 VanDerWaalsContact O-CB 3.31Å; L341-I345 WeakPolarHBondContact O-CB 3.44Å; L341-I345 WeakPolarHBondContact O-CD1 3.47Å; L341-I345 WeakPolarHBondContact O-CG1 3.43Å; L341-I345 PolarHBondContact O-N 2.83Å; V343-I345 PolarHBondContact O-N 3.31Å; I345-I347 VanDerWaalsContact C-N 3.34Å; I345-I347 PolarHBondContact O-N 2.86Å; I345-L348 PolarHBondContact O-N 2.88Å; I345-I349 HydrophobicContact CG2-CD1 3.6Å; I345-I349 HydrophobicContact CG2-CG1 4.34Å; I345-I349 WeakPolarHBondContact O-CB 3.48Å; I345-I349 VanDerWaalsContact O-CG1 3.25Å; I345-I349 WeakPolarHBondContact O-CG1 3.08Å; I345-I349 PolarHBondContact O-N 3.16Å
346	T	87.8	Confident	85	Confident	67 Å²	67	67.1 Å²	67.1	41%	0.411	33%	0.33	S	S	.	.	H	α-helix	trans	-61.6	-39	176.7	-61.1	0	0	0	0	112.6	I342 V343 L344 A350	I342-T346 VanDerWaalsContact O-CB 3.3Å; I342-T346 WeakPolarHBondContact O-CB 3.33Å; I342-T346 PolarHBondContact O-N 3.12Å; I342-T346 PolarHBondContact O-OG1 3.19Å; V343-T346 CarbonylContact O-C 3.57Å; V343-T346 WeakPolarHBondContact O-CA 3.28Å; V343-T346 WeakPolarHBondContact O-CB 3.28Å; V343-T346 PolarHBondContact O-N 2.92Å; V343-T346 VanDerWaalsContact O-N 3.11Å; L344-T346 VanDerWaalsContact C-N 3.32Å; L344-T346 PolarHBondContact O-N 3.41Å; T346-A350 WeakPolarHBondContact O-CB 3.34Å; T346-A350 PolarHBondContact O-N 2.91Å
347	I	85.3	Confident	83.3	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.015	34%	0.34	C	S	.	.	H	α-helix	trans	-69.4	-46.5	176.7	-70.1	172.3	0	0	0	110.8	V343 L344 I345 A350 R351 D377 H380 A391	V343-I347 HydrophobicContact CG1-CD1 3.81Å; V343-I347 HydrophobicContact CG1-CG1 4.41Å; V343-I347 WeakPolarHBondContact O-CG1 3.41Å; V343-I347 PolarHBondContact O-N 2.85Å; L344-I347 PolarHBondContact O-N 3.46Å; I345-I347 VanDerWaalsContact C-N 3.34Å; I345-I347 PolarHBondContact O-N 2.86Å; I347-A350 PolarHBondContact O-N 2.98Å; I347-R351 WeakPolarHBondContact O-CB 3.22Å; I347-R351 PolarHBondContact O-N 2.68Å; I347-D377 HydrophobicContact CG2-CB 4.19Å; I347-D377 WeakPolarHBondContact CG2-OD1 3.44Å; I347-H380 HydrophobicContact CD1-CB 4.11Å; I347-A391 HydrophobicContact CG2-CB 4.16Å
348	L	86.3	Confident	81.5	Confident	61 Å²	61	68 Å²	68	32%	0.319	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-47.3	178.4	-70.5	170	0	0	0	111.5	L344 I345 R351 Q352	L344-L348 HydrophobicContact CD1-CD1 4.19Å; L344-L348 HydrophobicContact CD1-CG 4.28Å; L344-L348 HydrophobicContact CG-CD1 4.02Å; L344-L348 WeakPolarHBondContact O-CB 3.26Å; L344-L348 VanDerWaalsContact O-CG 3.27Å; L344-L348 WeakPolarHBondContact O-CG 3.49Å; L344-L348 PolarHBondContact O-N 3.42Å; I345-L348 PolarHBondContact O-N 2.88Å; L348-R351 PolarHBondContact O-N 3.06Å; L348-Q352 WeakPolarHBondContact O-CG 3.21Å; L348-Q352 PolarHBondContact O-N 2.79Å
349	I	85.5	Confident	79.7	Confident	78 Å²	78	73.8 Å²	73.8	40%	0.4	35%	0.354	S	S	.	.	H	α-helix	trans	-60.6	-49.1	175.5	-70.1	171.1	0	0	0	110.6	I345 R351 Q352 Y353	I345-I349 HydrophobicContact CG2-CD1 3.6Å; I345-I349 HydrophobicContact CG2-CG1 4.34Å; I345-I349 WeakPolarHBondContact O-CB 3.48Å; I345-I349 VanDerWaalsContact O-CG1 3.25Å; I345-I349 WeakPolarHBondContact O-CG1 3.08Å; I345-I349 PolarHBondContact O-N 3.16Å; I349-R351 VanDerWaalsContact C-N 3.27Å; I349-R351 PolarHBondContact O-N 3.15Å; I349-Q352 PolarHBondContact O-N 3.41Å; I349-Y353 HydrophobicContact CG2-CD2 3.73Å; I349-Y353 HydrophobicContact CG2-CE2 3.5Å; I349-Y353 VanDerWaalsContact CG2-CE2 3.5Å; I349-Y353 VanDerWaalsContact O-CD2 3.26Å; I349-Y353 WeakPolarHBondContact O-CD2 3.38Å; I349-Y353 PolarHBondContact O-N 2.96Å
350	A	80.5	Confident	77.8	Confident	15 Å²	15	79.9 Å²	79.9	12%	0.124	39%	0.386	C	S	.	.	H	α-helix	trans	-63.1	-32.8	179.7	0	0	0	0	0	112.7	T346 I347 T354 I393	T346-A350 WeakPolarHBondContact O-CB 3.34Å; T346-A350 PolarHBondContact O-N 2.91Å; I347-A350 PolarHBondContact O-N 2.98Å; A350-T354 WeakPolarHBondContact O-CB 3.34Å; A350-T354 PolarHBondContact O-N 2.65Å; A350-T354 VanDerWaalsContact O-N 3.1Å; A350-T354 PolarHBondContact O-OG1 3.28Å; A350-I393 HydrophobicContact CB-CD1 3.78Å; A350-I393 HydrophobicContact CB-CG2 4.26Å
351	R	77.5	Confident	75.7	Confident	45 Å²	45	82.3 Å²	82.3	17%	0.17	40%	0.403	C	S	.	.	H	α-helix	trans	-69.9	-44.6	172.6	178.2	171.2	-74.6	175.4	-0.2	112	I347 L348 I349 Y353 T354 N355 N373 D377	I347-R351 WeakPolarHBondContact O-CB 3.22Å; I347-R351 PolarHBondContact O-N 2.68Å; L348-R351 PolarHBondContact O-N 3.06Å; I349-R351 VanDerWaalsContact C-N 3.27Å; I349-R351 PolarHBondContact O-N 3.15Å; R351-Y353 PolarHBondContact O-N 3.13Å; R351-T354 PolarHBondContact O-N 3Å; R351-T354 VanDerWaalsContact O-N 3.13Å; R351-N355 WeakPolarHBondContact O-CB 3.43Å; R351-N355 VanDerWaalsContact O-CG 3.29Å; R351-N355 PolarHBondContact O-N 3.46Å; R351-N355 PolarHBondContact O-OD1 2.95Å; R351-N373 PolarHBondContact NH1-O 3.25Å; R351-D377 IonicContact CZ-OD1 3.07Å; R351-D377 IonicContact CZ-OD2 3.63Å; R351-D377 IonicContact NE-OD1 3.41Å; R351-D377 IonicContact NE-OD2 3.3Å; R351-D377 IonicContact NH1-OD1 3.21Å; R351-D377 PolarHBondContact NH1-OD1 3.14Å; R351-D377 IonicContact NH1-OD2 3.97Å; R351-D377 PolarHBondContact NH1-OD2 3.18Å; R351-D377 IonicContact NH2-OD1 3.38Å; R351-D377 PolarHBondContact NH2-OD1 3.1Å; R351-D377 IonicContact NH2-OD2 2.82Å
352	Q	78.4	Confident	73.4	Confident	137 Å²	137	86.3 Å²	86.3	64%	0.64	42%	0.419	S	S	*	.	H	α-helix	trans	-57.2	-46.8	175.8	-74.2	176.5	0.9	0	0	111.7	L348 I349 T354 R356	L348-Q352 WeakPolarHBondContact O-CG 3.21Å; L348-Q352 PolarHBondContact O-N 2.79Å; I349-Q352 PolarHBondContact O-N 3.41Å; Q352-T354 PolarHBondContact O-N 3.08Å; Q352-R356 WeakPolarHBondContact O-CB 3.38Å; Q352-R356 PolarHBondContact O-N 2.96Å
353	Y	75.3	Confident	70.9	Confident	165 Å²	165	90.3 Å²	90.3	65%	0.647	44%	0.435	S	S	*	.	H	α-helix	trans	-61.8	-40.2	174.5	-77.4	-64.1	0	0	0	112.9	I349 R351 L357	I349-Y353 HydrophobicContact CG2-CD2 3.73Å; I349-Y353 HydrophobicContact CG2-CE2 3.5Å; I349-Y353 VanDerWaalsContact CG2-CE2 3.5Å; I349-Y353 VanDerWaalsContact O-CD2 3.26Å; I349-Y353 WeakPolarHBondContact O-CD2 3.38Å; I349-Y353 PolarHBondContact O-N 2.96Å; R351-Y353 PolarHBondContact O-N 3.13Å; Y353-L357 PolarHBondContact O-N 3.36Å
354	T	69.7	Low	68.3	Low	29 Å²	29	93 Å²	93	18%	0.178	46%	0.459	C	S	.	.	H	α-helix	trans	-68.5	-46.4	179.9	-57	0	0	0	0	111.7	A350 R351 Q352 R356 L357 D358 I393	A350-T354 WeakPolarHBondContact O-CB 3.34Å; A350-T354 PolarHBondContact O-N 2.65Å; A350-T354 VanDerWaalsContact O-N 3.1Å; A350-T354 PolarHBondContact O-OG1 3.28Å; R351-T354 PolarHBondContact O-N 3Å; R351-T354 VanDerWaalsContact O-N 3.13Å; Q352-T354 PolarHBondContact O-N 3.08Å; T354-R356 VanDerWaalsContact C-N 3.31Å; T354-R356 PolarHBondContact O-N 2.63Å; T354-L357 WeakPolarHBondContact O-CB 3.29Å; T354-L357 PolarHBondContact O-N 3.16Å; T354-D358 PolarHBondContact O-N 3.45Å; T354-I393 WeakPolarHBondContact OG1-CG2 3.34Å
355	N	67	Low	65.9	Low	87 Å²	87	99.3 Å²	99.3	47%	0.465	49%	0.493	S	S	.	.	H	α-helix	trans	-60.1	-42.2	177.6	-69.6	4.4	0	0	0	111	R351 L357 D358 H359	R351-N355 WeakPolarHBondContact O-CB 3.43Å; R351-N355 VanDerWaalsContact O-CG 3.29Å; R351-N355 PolarHBondContact O-N 3.46Å; R351-N355 PolarHBondContact O-OD1 2.95Å; N355-L357 VanDerWaalsContact C-N 3.25Å; N355-L357 PolarHBondContact O-N 2.87Å; N355-D358 PolarHBondContact O-N 2.97Å; N355-H359 WeakPolarHBondContact O-CB 3.46Å; N355-H359 PolarHBondContact O-CD2 3.31Å; N355-H359 VanDerWaalsContact O-CD2 3.25Å; N355-H359 PolarHBondContact O-N 3.49Å
356	R	62.7	Low	63.6	Low	194 Å²	194	104 Å²	104	73%	0.732	51%	0.509	S	S	*	.	H	α-helix	trans	-62.6	-30.7	175.6	-169.8	174.8	-177.2	176.6	1.7	112.8	Q352 T354	Q352-R356 WeakPolarHBondContact O-CB 3.38Å; Q352-R356 PolarHBondContact O-N 2.96Å; T354-R356 VanDerWaalsContact C-N 3.31Å; T354-R356 PolarHBondContact O-N 2.63Å
357	L	58	Low	61.5	Low	84 Å²	84	109.7 Å²	109.7	44%	0.44	53%	0.531	S	S	.	.	H	α-helix	trans	-77.8	-43.1	176.7	-135.4	78.8	0	0	0	112.6	Y353 T354 N355 L360	Y353-L357 PolarHBondContact O-N 3.36Å; T354-L357 WeakPolarHBondContact O-CB 3.29Å; T354-L357 PolarHBondContact O-N 3.16Å; N355-L357 VanDerWaalsContact C-N 3.25Å; N355-L357 PolarHBondContact O-N 2.87Å; L357-L360 PolarHBondContact O-N 3.17Å
358	D	57.1	Low	59.9	Low	70 Å²	70	112.7 Å²	112.7	37%	0.374	55%	0.552	S	S	.	*	H	α-helix	trans	-75	-28.4	-177.9	-70.8	-24	0	0	0	111.4	T354 N355 L360 N361 H362 K394	T354-D358 PolarHBondContact O-N 3.45Å; N355-D358 PolarHBondContact O-N 2.97Å; D358-L360 PolarHBondContact O-N 3.24Å; D358-N361 PolarHBondContact O-N 2.78Å; D358-H362 PolarHBondContact O-N 2.82Å; D358-H362 VanDerWaalsContact O-N 3.08Å; D358-K394 VanDerWaalsContact CG-NZ 3.25Å; D358-K394 IonicContact OD1-NZ 2.71Å; D358-K394 PolarHBondContact OD1-NZ 3.31Å; D358-K394 IonicContact OD2-NZ 2.73Å; D358-K394 PolarHBondContact OD2-NZ 3.04Å
359	H	55.9	Low	58.4	Low	152 Å²	152	114.9 Å²	114.9	70%	0.704	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-29.8	168.6	-97.5	-69.4	0	0	0	114.1	N355 N361	N355-H359 WeakPolarHBondContact O-CB 3.46Å; N355-H359 PolarHBondContact O-CD2 3.31Å; N355-H359 VanDerWaalsContact O-CD2 3.25Å; N355-H359 PolarHBondContact O-N 3.49Å; H359-N361 VanDerWaalsContact C-N 3.31Å
360	L	52.7	Low	57.3	Low	143 Å²	143	118.7 Å²	118.7	75%	0.749	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-17.9	176.5	-68.3	168	0	0	0	112.7	L357 D358	L357-L360 PolarHBondContact O-N 3.17Å; D358-L360 PolarHBondContact O-N 3.24Å
361	N	51.9	Low	56.4	Low	99 Å²	99	121.6 Å²	121.6	53%	0.529	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.7	-35.1	-171.4	-88.7	-68.7	0	0	0	114.4	D358 H359	D358-N361 PolarHBondContact O-N 2.78Å; H359-N361 VanDerWaalsContact C-N 3.31Å
362	H	45.6	Very low	55.9	Low	166 Å²	166	122.5 Å²	122.5	77%	0.769	61%	0.609	S	S	*	*			trans	-145	118.7	173.9	-92.5	-16.3	0	0	0	115.1	D358 A364	D358-H362 PolarHBondContact O-N 2.82Å; D358-H362 VanDerWaalsContact O-N 3.08Å; H362-A364 PolarHBondContact O-N 2.76Å
363	Q	37.9	Very low	55.8	Low	181 Å²	181	118 Å²	118	85%	0.846	59%	0.59	S	S	*	*			trans	-71.5	13.3	-178.3	-158.7	-175.9	-9	0	0	114.8
364	A	38.2	Very low	56.2	Low	68 Å²	68	114.8 Å²	114.8	56%	0.562	58%	0.579	S	S	*	*			trans	-153.9	101.9	-169.9	0	0	0	0	0	114.7	H362	H362-A364 PolarHBondContact O-N 2.76Å
365	N	39.3	Very low	56.8	Low	148 Å²	148	119.7 Å²	119.7	79%	0.791	60%	0.598	S	S	*	*				-179.4	129.4	91.7	-96.5	-77.7	0	0	0	113.1
366	K	44.1	Very low	57.5	Low	191 Å²	191	118.5 Å²	118.5	83%	0.83	59%	0.592	S	S	*	*			trans	59.2	137.2	160.6	-71.2	-166.6	167.9	-163.5	0	119.5	S368	K366-S368 PolarHBondContact O-N 3.35Å
367	H	42.2	Very low	58.6	Low	188 Å²	188	109.4 Å²	109.4	87%	0.87	56%	0.558	S	S	*	*			trans	-54.1	108.2	149.1	-57.4	-105.1	0	0	0	108.6
368	S	51.6	Low	60.2	Low	66 Å²	66	107.4 Å²	107.4	46%	0.462	55%	0.547	S	S	.	.			trans	-84.7	135	147.1	45.8	0	0	0	0	105.7	K366 L370 N373	K366-S368 PolarHBondContact O-N 3.35Å; S368-L370 PolarHBondContact O-N 3.1Å; S368-N373 PolarHBondContact O-ND2 3.22Å; S368-N373 PolarHBondContact OG-ND2 3.39Å
369	D	55.8	Low	61.7	Low	107 Å²	107	105.9 Å²	105.9	57%	0.572	54%	0.539	S	S	*	.			trans	-59.2	134.6	-166.5	-65.9	-51	0	0	0	110.8	C371 E372 N373	D369-C371 PolarHBondContact O-N 3.32Å; D369-C371 VanDerWaalsContact O-N 3.13Å; D369-E372 HydrophobicContact CB-CB 4.27Å; D369-E372 PolarHBondContact O-N 3.42Å; D369-N373 PolarHBondContact O-N 2.68Å; D369-N373 PolarHBondContact O-ND2 2.78Å; D369-N373 VanDerWaalsContact O-ND2 3.15Å
370	L	62.3	Low	63.2	Low	158 Å²	158	100 Å²	100	83%	0.827	51%	0.512	S	S	*	.	H	α-helix	trans	-54.3	-35.2	176.8	-68.3	170.3	0	0	0	110.5	S368 N373 F374	S368-L370 PolarHBondContact O-N 3.1Å; L370-N373 PolarHBondContact O-N 2.93Å; L370-F374 VanDerWaalsContact O-CB 3.26Å; L370-F374 WeakPolarHBondContact O-CB 3.45Å; L370-F374 PolarHBondContact O-N 3.02Å
371	C	61.2	Low	65.1	Low	76 Å²	76	93.2 Å²	93.2	51%	0.514	48%	0.476	S	S	.	.	H	α-helix	trans	-63.3	-45.9	174	-168.1	0	0	0	0	113.3	D369 N373 F374 F375	D369-C371 PolarHBondContact O-N 3.32Å; D369-C371 VanDerWaalsContact O-N 3.13Å; C371-N373 PolarHBondContact O-N 3.46Å; C371-F374 PolarHBondContact O-N 3.09Å; C371-F375 WeakPolarHBondContact O-CD2 3.33Å; C371-F375 PolarHBondContact O-N 3.19Å; C371-F375 WeakPolarHBondContact SG-CE2 3.24Å
372	E	68.1	Low	67	Low	63 Å²	63	91.9 Å²	91.9	29%	0.294	46%	0.464	S	S	.	.	H	α-helix	trans	-61.7	-45.4	175.6	173.6	174.7	-153.4	0	0	111	R92 D369 F374 L376	R92-E372 IonicContact CZ-OE1 3.72Å; R92-E372 IonicContact NE-OE1 2.7Å; R92-E372 IonicContact NH1-OE1 2.71Å; R92-E372 PolarHBondContact NH1-OE1 3.3Å; R92-E372 IonicContact NH2-OE1 2.7Å; D369-E372 HydrophobicContact CB-CB 4.27Å; D369-E372 PolarHBondContact O-N 3.42Å; E372-F374 VanDerWaalsContact C-N 3.33Å; E372-F374 PolarHBondContact O-N 2.79Å; E372-L376 HydrophobicContact CG-CD1 4.23Å; E372-L376 WeakPolarHBondContact O-CG 3.32Å; E372-L376 PolarHBondContact O-N 3.41Å; E372-L376 VanDerWaalsContact O-N 3.16Å
373	N	75.9	Confident	69.3	Low	43 Å²	43	84.2 Å²	84.2	23%	0.23	43%	0.429	C	S	.	.	H	α-helix	trans	-63.6	-38	178.2	-77.9	-64.3	0	0	0	112.1	R351 S368 D369 L370 C371 D377	R351-N373 PolarHBondContact NH1-O 3.25Å; S368-N373 PolarHBondContact O-ND2 3.22Å; S368-N373 PolarHBondContact OG-ND2 3.39Å; D369-N373 PolarHBondContact O-N 2.68Å; D369-N373 PolarHBondContact O-ND2 2.78Å; D369-N373 VanDerWaalsContact O-ND2 3.15Å; L370-N373 PolarHBondContact O-N 2.93Å; C371-N373 PolarHBondContact O-N 3.46Å; N373-D377 PolarHBondContact O-N 3.02Å
374	F	82.4	Confident	71.9	Confident	98 Å²	98	75.7 Å²	75.7	43%	0.43	39%	0.389	S	S	.	.	H	α-helix	trans	-70.7	-47.2	178	-179	-111.3	0	0	0	112.8	L370 C371 E372 L376 D377 L378	L370-F374 VanDerWaalsContact O-CB 3.26Å; L370-F374 WeakPolarHBondContact O-CB 3.45Å; L370-F374 PolarHBondContact O-N 3.02Å; C371-F374 PolarHBondContact O-N 3.09Å; E372-F374 VanDerWaalsContact C-N 3.33Å; E372-F374 PolarHBondContact O-N 2.79Å; F374-L376 PolarHBondContact O-N 3.44Å; F374-D377 WeakPolarHBondContact O-CA 3.46Å; F374-D377 PolarHBondContact O-N 3.48Å; F374-L378 HydrophobicContact CD1-CD1 4.07Å; F374-L378 HydrophobicContact CD1-CG 4.4Å; F374-L378 HydrophobicContact CE1-CD1 3.66Å; F374-L378 HydrophobicContact CE1-CD2 4.26Å; F374-L378 HydrophobicContact CE1-CG 4.1Å; F374-L378 HydrophobicContact CE2-CD2 4.21Å; F374-L378 HydrophobicContact CZ-CD1 4.12Å; F374-L378 HydrophobicContact CZ-CD2 3.86Å; F374-L378 HydrophobicContact CZ-CG 4.16Å; F374-L378 PolarHBondContact O-N 3.32Å
375	F	83	Confident	74.5	Confident	131 Å²	131	73.3 Å²	73.3	58%	0.575	37%	0.367	S	S	*	.	H	α-helix	trans	-59.5	-35.7	175.8	-85.5	-63.5	0	0	0	112.5	C371 L378 L379	C371-F375 WeakPolarHBondContact O-CD2 3.33Å; C371-F375 PolarHBondContact O-N 3.19Å; C371-F375 WeakPolarHBondContact SG-CE2 3.24Å; F375-L378 HydrophobicContact CD1-CD1 4.17Å; F375-L379 PolarHBondContact O-N 3.12Å; F375-L379 VanDerWaalsContact O-N 3.09Å
376	L	82.1	Confident	77	Confident	63 Å²	63	66.8 Å²	66.8	33%	0.33	33%	0.331	S	S	.	.	H	α-helix	trans	-65.2	-38.4	171.8	-72.3	170.8	0	0	0	112.1	E372 F374 L379 H380	E372-L376 HydrophobicContact CG-CD1 4.23Å; E372-L376 WeakPolarHBondContact O-CG 3.32Å; E372-L376 PolarHBondContact O-N 3.41Å; E372-L376 VanDerWaalsContact O-N 3.16Å; F374-L376 PolarHBondContact O-N 3.44Å; L376-L379 PolarHBondContact O-N 2.99Å; L376-H380 WeakPolarHBondContact O-CB 3.48Å; L376-H380 PolarHBondContact O-N 3.34Å; L376-H380 PolarHBondContact O-ND1 3.28Å
377	D	86.2	Confident	79.3	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.011	29%	0.292	C	S	.	.	H	α-helix	trans	-69.3	-36.1	176.4	-74.7	-9.3	0	0	0	113.1	L344 I347 R351 N373 F374 H380 S381	L344-D377 HydrophobicContact CD1-CB 4.17Å; I347-D377 HydrophobicContact CG2-CB 4.19Å; I347-D377 WeakPolarHBondContact CG2-OD1 3.44Å; R351-D377 IonicContact CZ-OD1 3.07Å; R351-D377 IonicContact CZ-OD2 3.63Å; R351-D377 IonicContact NE-OD1 3.41Å; R351-D377 IonicContact NE-OD2 3.3Å; R351-D377 IonicContact NH1-OD1 3.21Å; R351-D377 PolarHBondContact NH1-OD1 3.14Å; R351-D377 IonicContact NH1-OD2 3.97Å; R351-D377 PolarHBondContact NH1-OD2 3.18Å; R351-D377 IonicContact NH2-OD1 3.38Å; R351-D377 PolarHBondContact NH2-OD1 3.1Å; R351-D377 IonicContact NH2-OD2 2.82Å; N373-D377 PolarHBondContact O-N 3.02Å; F374-D377 WeakPolarHBondContact O-CA 3.46Å; F374-D377 PolarHBondContact O-N 3.48Å; D377-H380 PolarHBondContact O-N 2.89Å; D377-H380 IonicContact OD1-ND1 2.82Å; D377-S381 VanDerWaalsContact O-CB 3.3Å; D377-S381 WeakPolarHBondContact O-CB 3.34Å; D377-S381 PolarHBondContact O-N 2.92Å; D377-S381 PolarHBondContact O-OG 2.8Å
378	L	90.7	Very high	81.5	Confident	42 Å²	42	49.4 Å²	49.4	22%	0.22	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-47.8	171.1	-62.6	177.3	0	0	0	110.8	Y340 L344 F374 F375 S381 Y382	Y340-L378 WeakPolarHBondContact OH-CA 3.47Å; Y340-L378 WeakPolarHBondContact OH-CD2 3.24Å; Y340-L378 PolarHBondContact OH-O 2.8Å; L344-L378 HydrophobicContact CD1-CD2 4.31Å; L344-L378 HydrophobicContact CD2-CD2 4.04Å; F374-L378 HydrophobicContact CD1-CD1 4.07Å; F374-L378 HydrophobicContact CD1-CG 4.4Å; F374-L378 HydrophobicContact CE1-CD1 3.66Å; F374-L378 HydrophobicContact CE1-CD2 4.26Å; F374-L378 HydrophobicContact CE1-CG 4.1Å; F374-L378 HydrophobicContact CE2-CD2 4.21Å; F374-L378 HydrophobicContact CZ-CD1 4.12Å; F374-L378 HydrophobicContact CZ-CD2 3.86Å; F374-L378 HydrophobicContact CZ-CG 4.16Å; F374-L378 PolarHBondContact O-N 3.32Å; F375-L378 HydrophobicContact CD1-CD1 4.17Å; L378-S381 PolarHBondContact O-N 3.47Å; L378-Y382 PolarHBondContact O-N 3.49Å
379	L	88.2	Confident	83	Confident	38 Å²	38	46.8 Å²	46.8	20%	0.199	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-45.6	177.3	179.1	60.7	0	0	0	112	I230 F375 L376 S381 Y382 I383	I230-L379 HydrophobicContact CD1-CD1 3.98Å; F375-L379 PolarHBondContact O-N 3.12Å; F375-L379 VanDerWaalsContact O-N 3.09Å; L376-L379 PolarHBondContact O-N 2.99Å; L379-S381 VanDerWaalsContact C-N 3.3Å; L379-S381 PolarHBondContact O-N 3.4Å; L379-Y382 PolarHBondContact O-N 3.42Å; L379-I383 HydrophobicContact CD1-CD1 4.26Å; L379-I383 HydrophobicContact CD1-CG1 4.5Å; L379-I383 HydrophobicContact CG-CD1 4Å; L379-I383 WeakPolarHBondContact O-CD1 3.2Å; L379-I383 VanDerWaalsContact O-CG1 3.28Å; L379-I383 WeakPolarHBondContact O-CG1 3.49Å; L379-I383 PolarHBondContact O-N 2.98Å
380	H	88.5	Confident	83.9	Confident	30 Å²	30	41.9 Å²	41.9	14%	0.139	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-38.1	175.3	-65	139.8	0	0	0	112.1	I347 L376 D377 Y382 I383 N384 F389	I347-H380 HydrophobicContact CD1-CB 4.11Å; L376-H380 WeakPolarHBondContact O-CB 3.48Å; L376-H380 PolarHBondContact O-N 3.34Å; L376-H380 PolarHBondContact O-ND1 3.28Å; D377-H380 PolarHBondContact O-N 2.89Å; D377-H380 IonicContact OD1-ND1 2.82Å; H380-Y382 VanDerWaalsContact C-N 3.33Å; H380-I383 PolarHBondContact O-N 3.42Å; H380-N384 WeakPolarHBondContact O-CB 3.48Å; H380-N384 PolarHBondContact O-N 3.49Å; H380-N384 VanDerWaalsContact O-N 3.08Å; H380-N384 PolarHBondContact O-ND2 3.17Å; H380-F389 HydrophobicContact CB-CD1 4.48Å; H380-F389 AromaticContact CD2-CD1 3.71Å; H380-F389 AromaticContact CD2-CE1 3.24Å; H380-F389 WeakPolarHBondContact CD2-CE1 3.29Å; H380-F389 AromaticContact NE2-CE1 3.67Å
381	S	91.7	Very high	84.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.9	-35.2	177.4	-55.1	0	0	0	0	111.7	Y340 L344 D377 L378 L379 N384	Y340-S381 VanDerWaalsContact CE2-CB 3.48Å; L344-S381 WeakPolarHBondContact CA-OG 3.44Å; L344-S381 WeakPolarHBondContact CB-OG 3.17Å; L344-S381 WeakPolarHBondContact CD1-OG 3.27Å; D377-S381 VanDerWaalsContact O-CB 3.3Å; D377-S381 WeakPolarHBondContact O-CB 3.34Å; D377-S381 PolarHBondContact O-N 2.92Å; D377-S381 PolarHBondContact O-OG 2.8Å; L378-S381 PolarHBondContact O-N 3.47Å; L379-S381 VanDerWaalsContact C-N 3.3Å; L379-S381 PolarHBondContact O-N 3.4Å; S381-N384 PolarHBondContact O-N 2.89Å
382	Y	92.9	Very high	84.1	Confident	71 Å²	71	34.2 Å²	34.2	28%	0.278	18%	0.178	S	C	.	.	H	α-helix	trans	-69.2	-42.1	174.6	-170.8	-93.2	0	0	0	112.1	V229 I230 L378 L379 H380 N384 L385 Y386	V229-Y382 HydrophobicContact CG1-CD1 3.6Å; V229-Y382 HydrophobicContact CG1-CE1 3.75Å; I230-Y382 HydrophobicContact CB-CE1 4.49Å; I230-Y382 HydrophobicContact CG1-CD1 4.07Å; I230-Y382 HydrophobicContact CG1-CE1 3.86Å; L378-Y382 PolarHBondContact O-N 3.49Å; L379-Y382 PolarHBondContact O-N 3.42Å; H380-Y382 VanDerWaalsContact C-N 3.33Å; Y382-N384 PolarHBondContact O-N 2.72Å; Y382-L385 HydrophobicContact CD2-CD1 3.67Å; Y382-L385 HydrophobicContact CE2-CD1 3.95Å; Y382-L385 HydrophobicContact CG-CD1 4.29Å; Y382-L385 VanDerWaalsContact O-CB 3.31Å; Y382-L385 WeakPolarHBondContact O-CB 3.28Å; Y382-L385 PolarHBondContact O-N 2.95Å; Y382-Y386 HydrophobicContact CE1-CE2 4.2Å
383	I	92.8	Very high	83.6	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-57.5	-39.7	172.8	-65.5	158.5	0	0	0	111	L225 V229 F276 L379 H380 L385 Y386 E387 F389	L225-I383 HydrophobicContact CD1-CG2 4.43Å; L225-I383 HydrophobicContact CD2-CD1 3.75Å; L225-I383 HydrophobicContact CD2-CG1 4.39Å; L225-I383 HydrophobicContact CD2-CG2 4.23Å; L225-I383 HydrophobicContact CG-CD1 4.24Å; L225-I383 HydrophobicContact CG-CG1 4.47Å; L225-I383 HydrophobicContact CG-CG2 4.5Å; V229-I383 HydrophobicContact CB-CG1 4.37Å; V229-I383 HydrophobicContact CG1-CB 4.33Å; V229-I383 HydrophobicContact CG1-CG1 3.88Å; V229-I383 HydrophobicContact CG2-CG1 4.23Å; V229-I383 HydrophobicContact CG2-CG2 4.24Å; F276-I383 HydrophobicContact CE1-CG2 3.59Å; F276-I383 HydrophobicContact CZ-CG2 3.53Å; L379-I383 HydrophobicContact CD1-CD1 4.26Å; L379-I383 HydrophobicContact CD1-CG1 4.5Å; L379-I383 HydrophobicContact CG-CD1 4Å; L379-I383 WeakPolarHBondContact O-CD1 3.2Å; L379-I383 VanDerWaalsContact O-CG1 3.28Å; L379-I383 WeakPolarHBondContact O-CG1 3.49Å; L379-I383 PolarHBondContact O-N 2.98Å; H380-I383 PolarHBondContact O-N 3.42Å; I383-L385 PolarHBondContact O-N 3.2Å; I383-L385 VanDerWaalsContact O-N 3.17Å; I383-Y386 PolarHBondContact O-N 3.12Å; I383-Y386 VanDerWaalsContact O-N 3.13Å; I383-E387 PolarHBondContact O-N 2.78Å; I383-F389 HydrophobicContact CB-CB 4.36Å; I383-F389 HydrophobicContact CB-CG 4.48Å; I383-F389 HydrophobicContact CG2-CB 3.58Å; I383-F389 HydrophobicContact CG2-CD2 3.75Å; I383-F389 HydrophobicContact CG2-CG 3.71Å
384	N	92.1	Very high	82.7	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.016	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-0.9	176.3	-85.2	-82.5	0	0	0	115.2	H339 V343 H380 S381 Y382 Y386 E387 F388 F389 Y403	H339-N384 PolarHBondContact NE2-O 3.42Å; V343-N384 HydrophobicContact CB-CB 4.42Å; V343-N384 HydrophobicContact CG1-CB 3.49Å; V343-N384 VanDerWaalsContact CG1-CB 3.49Å; V343-N384 HydrophobicContact CG2-CB 4.17Å; H380-N384 WeakPolarHBondContact O-CB 3.48Å; H380-N384 PolarHBondContact O-N 3.49Å; H380-N384 VanDerWaalsContact O-N 3.08Å; H380-N384 PolarHBondContact O-ND2 3.17Å; S381-N384 PolarHBondContact O-N 2.89Å; Y382-N384 PolarHBondContact O-N 2.72Å; N384-Y386 VanDerWaalsContact C-N 3.34Å; N384-E387 WeakPolarHBondContact CA-O 3.3Å; N384-F388 WeakPolarHBondContact OD1-CA 3.48Å; N384-F389 PolarHBondContact ND2-O 3.07Å; N384-F389 PolarHBondContact OD1-N 2.97Å; N384-Y403 HydrophobicContact CB-CE2 4.2Å; N384-Y403 WeakPolarHBondContact O-CE2 3.32Å; N384-Y403 PolarHBondContact O-OH 3.08Å
385	L	93.5	Very high	81.5	Confident	18 Å²	18	35.9 Å²	35.9	9%	0.094	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-26.5	166	-74.3	159.7	0	0	0	112.6	R317 L336 Y340 Y382 I383	R317-L385 PolarHBondContact NE-O 3.49Å; L336-L385 HydrophobicContact CB-CD2 4.15Å; L336-L385 HydrophobicContact CD2-CD2 4.03Å; L336-L385 WeakPolarHBondContact O-CD2 3.33Å; Y340-L385 HydrophobicContact CD2-CD1 4.09Å; Y340-L385 HydrophobicContact CD2-CG 4.49Å; Y382-L385 HydrophobicContact CD2-CD1 3.67Å; Y382-L385 HydrophobicContact CE2-CD1 3.95Å; Y382-L385 HydrophobicContact CG-CD1 4.29Å; Y382-L385 VanDerWaalsContact O-CB 3.31Å; Y382-L385 WeakPolarHBondContact O-CB 3.28Å; Y382-L385 PolarHBondContact O-N 2.95Å; I383-L385 PolarHBondContact O-N 3.2Å; I383-L385 VanDerWaalsContact O-N 3.17Å
386	Y	92.9	Very high	80.7	Confident	11 Å²	11	31.4 Å²	31.4	4%	0.043	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-49.1	178.9	-66.9	-91.5	0	0	0	111.4	V229 G233 P234 I237 Y382 I383 N384 Y407	V229-Y386 HydrophobicContact CG1-CD2 3.82Å; V229-Y386 HydrophobicContact CG1-CE2 3.92Å; V229-Y386 VanDerWaalsContact O-CE2 3.31Å; V229-Y386 WeakPolarHBondContact O-CE2 3.46Å; V229-Y386 PolarHBondContact O-OH 3.22Å; G233-Y386 WeakPolarHBondContact CA-OH 3.48Å; P234-Y386 WeakPolarHBondContact CD-OH 3.07Å; P234-Y386 WeakPolarHBondContact CG-OH 3.14Å; P234-Y386 VanDerWaalsContact N-OH 3.14Å; I237-Y386 HydrophobicContact CD1-CE1 3.85Å; Y382-Y386 HydrophobicContact CE1-CE2 4.2Å; I383-Y386 PolarHBondContact O-N 3.12Å; I383-Y386 VanDerWaalsContact O-N 3.13Å; N384-Y386 VanDerWaalsContact C-N 3.34Å; Y386-Y407 VanDerWaalsContact O-CE2 3.26Å; Y386-Y407 WeakPolarHBondContact O-CE2 3.38Å; Y386-Y407 PolarHBondContact O-OH 3Å
387	E	92.2	Very high	80.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	-161.5	156.9	-178.6	-162.9	174	-179	0	0	112.8	F276 H310 H313 I314 I383 N384 F389 Y403 Y404	F276-E387 HydrophobicContact CD1-CB 4.43Å; F276-E387 HydrophobicContact CE1-CB 3.89Å; F276-E387 HydrophobicContact CE2-CB 4.49Å; F276-E387 HydrophobicContact CZ-CB 3.92Å; H310-E387 WeakPolarHBondContact CA-OE2 3.33Å; H310-E387 WeakPolarHBondContact CB-OE2 3.34Å; H310-E387 IonicContact CE1-OE1 2.85Å; H310-E387 IonicContact CE1-OE2 3.22Å; H310-E387 IonicContact CG-OE1 2.84Å; H310-E387 IonicContact CG-OE2 3.6Å; H310-E387 IonicContact ND1-OE1 3.71Å; H310-E387 PolarHBondContact ND1-OE1 3.05Å; H310-E387 IonicContact ND1-OE2 2.69Å; H310-E387 PolarHBondContact ND1-OE2 3.38Å; H313-E387 IonicContact ND1-OE1 3.68Å; I314-E387 WeakPolarHBondContact CD1-OE2 3.38Å; I314-E387 HydrophobicContact CG1-CB 4.28Å; I383-E387 PolarHBondContact O-N 2.78Å; N384-E387 WeakPolarHBondContact CA-O 3.3Å; E387-F389 PolarHBondContact O-N 2.83Å; E387-Y403 WeakPolarHBondContact CA-OH 3.04Å; E387-Y404 HydrophobicContact CG-CE1 4.41Å; E387-Y404 WeakPolarHBondContact CG-OH 3.43Å; E387-Y404 PolarHBondContact OE1-OH 3.26Å
388	F	88	Confident	79.7	Confident	13 Å²	13	34.3 Å²	34.3	6%	0.057	18%	0.178	C	C	.	.			trans	-57.6	114.9	-177.5	-174.9	-94	0	0	0	112.6	N384 N390 R399 Y400 Y403 Y404	N384-F388 WeakPolarHBondContact OD1-CA 3.48Å; F388-N390 HydrophobicContact CE1-CB 3.97Å; F388-R399 HydrophobicContact CE2-CB 4.22Å; F388-R399 HydrophobicContact CZ-CB 3.99Å; F388-Y400 HydrophobicContact CB-CD1 4.37Å; F388-Y400 HydrophobicContact CB-CE1 4.21Å; F388-Y400 AromaticContact CD1-CD1 3.61Å; F388-Y400 HydrophobicContact CD1-CD1 3.61Å; F388-Y400 HydrophobicContact CD1-CD2 4.03Å; F388-Y400 AromaticContact CD1-CE1 3.25Å; F388-Y400 HydrophobicContact CD1-CE1 3.25Å; F388-Y400 AromaticContact CD1-CE2 3.73Å; F388-Y400 HydrophobicContact CD1-CE2 3.73Å; F388-Y400 AromaticContact CD1-CG 3.96Å; F388-Y400 HydrophobicContact CD1-CG 3.96Å; F388-Y400 AromaticContact CD1-CZ 3.29Å; F388-Y400 HydrophobicContact CE1-CD1 4.09Å; F388-Y400 AromaticContact CE1-CD2 3.65Å; F388-Y400 HydrophobicContact CE1-CD2 3.65Å; F388-Y400 AromaticContact CE1-CE1 3.88Å; F388-Y400 HydrophobicContact CE1-CE1 3.88Å; F388-Y400 AromaticContact CE1-CE2 3.42Å; F388-Y400 HydrophobicContact CE1-CE2 3.42Å; F388-Y400 VanDerWaalsContact CE1-CE2 3.42Å; F388-Y400 AromaticContact CE1-CG 3.96Å; F388-Y400 HydrophobicContact CE1-CG 3.96Å; F388-Y400 AromaticContact CE1-CZ 3.51Å; F388-Y400 HydrophobicContact CG-CD1 4.08Å; F388-Y400 HydrophobicContact CG-CE1 4.01Å; F388-Y400 HydrophobicContact CZ-CD2 4.33Å; F388-Y400 HydrophobicContact CZ-CE2 4.45Å; F388-Y403 HydrophobicContact CB-CD1 3.59Å; F388-Y403 HydrophobicContact CB-CE1 3.65Å; F388-Y403 HydrophobicContact CB-CG 4.12Å; F388-Y403 AromaticContact CD2-CD1 3.87Å; F388-Y403 HydrophobicContact CD2-CD1 3.87Å; F388-Y403 AromaticContact CD2-CD2 3.85Å; F388-Y403 HydrophobicContact CD2-CD2 3.85Å; F388-Y403 HydrophobicContact CD2-CE2 4.47Å; F388-Y403 AromaticContact CD2-CG 3.49Å; F388-Y403 HydrophobicContact CD2-CG 3.49Å; F388-Y403 VanDerWaalsContact CD2-CG 3.49Å; F388-Y403 HydrophobicContact CE2-CG 4.39Å; F388-Y403 HydrophobicContact CG-CD1 4.19Å; F388-Y403 HydrophobicContact CG-CG 4.26Å; F388-Y403 PolarHBondContact N-OH 3.47Å; F388-Y404 HydrophobicContact CB-CD2 4.35Å; F388-Y404 HydrophobicContact CB-CE2 3.59Å; F388-Y404 HydrophobicContact CG-CE2 4.5Å
389	F	82.2	Confident	79.2	Confident	11 Å²	11	34.2 Å²	34.2	5%	0.048	18%	0.175	C	C	.	.			trans	-117	111.3	174.4	-171.8	-86.1	0	0	0	109.3	L225 F276 F279 H380 I383 N384 E387	L225-F389 HydrophobicContact CD2-CD2 3.89Å; L225-F389 HydrophobicContact CD2-CE2 3.27Å; L225-F389 HydrophobicContact CD2-CZ 3.87Å; F276-F389 HydrophobicContact CE1-CB 4.43Å; F276-F389 HydrophobicContact CE1-CD2 4.31Å; F279-F389 AromaticContact CD1-CE2 3.39Å; F279-F389 HydrophobicContact CD1-CE2 3.39Å; F279-F389 AromaticContact CD1-CZ 3.59Å; F279-F389 HydrophobicContact CD1-CZ 3.59Å; F279-F389 HydrophobicContact CD2-CE2 4.41Å; F279-F389 HydrophobicContact CE1-CE1 4.36Å; F279-F389 AromaticContact CE1-CE2 3.61Å; F279-F389 HydrophobicContact CE1-CE2 3.61Å; F279-F389 AromaticContact CE1-CZ 3.25Å; F279-F389 HydrophobicContact CE1-CZ 3.25Å; F279-F389 HydrophobicContact CE2-CZ 4.23Å; F279-F389 AromaticContact CG-CE2 3.85Å; F279-F389 HydrophobicContact CG-CE2 3.85Å; F279-F389 HydrophobicContact CG-CZ 4.24Å; F279-F389 HydrophobicContact CZ-CE2 4.22Å; F279-F389 AromaticContact CZ-CZ 3.62Å; F279-F389 HydrophobicContact CZ-CZ 3.62Å; H380-F389 HydrophobicContact CB-CD1 4.48Å; H380-F389 AromaticContact CD2-CD1 3.71Å; H380-F389 AromaticContact CD2-CE1 3.24Å; H380-F389 WeakPolarHBondContact CD2-CE1 3.29Å; H380-F389 AromaticContact NE2-CE1 3.67Å; I383-F389 HydrophobicContact CB-CB 4.36Å; I383-F389 HydrophobicContact CB-CG 4.48Å; I383-F389 HydrophobicContact CG2-CB 3.58Å; I383-F389 HydrophobicContact CG2-CD2 3.75Å; I383-F389 HydrophobicContact CG2-CG 3.71Å; N384-F389 PolarHBondContact ND2-O 3.07Å; N384-F389 PolarHBondContact OD1-N 2.97Å; E387-F389 PolarHBondContact O-N 2.83Å
390	N	75.8	Confident	78.9	Confident	5 Å²	5	33 Å²	33	3%	0.027	17%	0.168	C	C	.	.			trans	-62.4	142.9	172.6	-172.5	20.2	0	0	0	109.3	Q283 F388 G392 I393 R399	Q283-N390 PolarHBondContact NE2-O 3.46Å; F388-N390 HydrophobicContact CE1-CB 3.97Å; N390-G392 PolarHBondContact O-N 3.06Å; N390-I393 PolarHBondContact ND2-N 3.24Å; N390-I393 PolarHBondContact ND2-O 3.5Å; N390-I393 PolarHBondContact OD1-N 2.65Å; N390-I393 PolarHBondContact OD1-O 2.84Å; N390-R399 PolarHBondContact OD1-NH1 3.41Å
391	A	66.1	Low	78.7	Confident	17 Å²	17	34.3 Å²	34.3	14%	0.14	18%	0.176	C	C	.	.			trans	-89.4	32.6	174.4	0	0	0	0	0	112.4	I347 I393	I347-A391 HydrophobicContact CG2-CB 4.16Å; A391-I393 HydrophobicContact CB-CD1 4.04Å; A391-I393 HydrophobicContact CB-CG1 4.18Å; A391-I393 PolarHBondContact O-N 3.32Å
392	G	60.5	Low	78.4	Confident	56 Å²	56	38.4 Å²	38.4	58%	0.577	20%	0.197	S	C	*	.	S	Bend	trans	71.6	9.3	-172.3	0	0	0	0	0	114.9	Q283 N390	Q283-G392 VanDerWaalsContact NE2-N 3.12Å; N390-G392 PolarHBondContact O-N 3.06Å
393	I	59.1	Low	78.3	Confident	18 Å²	18	36 Å²	36	9%	0.092	19%	0.187	C	C	.	.			trans	-81	144.9	-173.3	-58.2	173.6	0	0	0	110.6	A350 T354 N390 A391	A350-I393 HydrophobicContact CB-CD1 3.78Å; A350-I393 HydrophobicContact CB-CG2 4.26Å; T354-I393 WeakPolarHBondContact OG1-CG2 3.34Å; N390-I393 PolarHBondContact ND2-N 3.24Å; N390-I393 PolarHBondContact ND2-O 3.5Å; N390-I393 PolarHBondContact OD1-N 2.65Å; N390-I393 PolarHBondContact OD1-O 2.84Å; A391-I393 HydrophobicContact CB-CD1 4.04Å; A391-I393 HydrophobicContact CB-CG1 4.18Å; A391-I393 PolarHBondContact O-N 3.32Å
394	K	55.6	Low	78.2	Confident	107 Å²	107	36 Å²	36	47%	0.465	19%	0.187	S	C	.	.	S	Bend	trans	-64.4	159.8	175.4	-62.1	157.3	-175.2	157.9	0	109.9	D358	D358-K394 VanDerWaalsContact CG-NZ 3.25Å; D358-K394 IonicContact OD1-NZ 2.71Å; D358-K394 PolarHBondContact OD1-NZ 3.31Å; D358-K394 IonicContact OD2-NZ 2.73Å; D358-K394 PolarHBondContact OD2-NZ 3.04Å
395	Y	57	Low	78	Confident	114 Å²	114	41.5 Å²	41.5	45%	0.447	21%	0.211	S	C	.	.			trans	64.5	75.6	-176.4	-48.6	-81.4	0	0	0	115	M470	Y395-M470 HydrophobicContact CE1-CE 4.01Å; Y395-M470 HydrophobicContact CE1-SD 4.32Å; Y395-M470 WeakPolarHBondContact OH-CE 3.45Å
396	T	67.8	Low	77.9	Confident	37 Å²	37	45.8 Å²	45.8	23%	0.227	23%	0.229	C	C	.	.			trans	-81.4	-56.7	-176.8	50.1	0	0	0	0	114.6	T398 R399 Y400	T396-T398 PolarHBondContact O-N 3.08Å; T396-R399 WeakPolarHBondContact O-CB 3.48Å; T396-R399 PolarHBondContact O-N 3.04Å; T396-Y400 HydrophobicContact CG2-CE2 4.42Å; T396-Y400 WeakPolarHBondContact O-CD2 3.38Å; T396-Y400 PolarHBondContact O-N 3.32Å
397	R	72.3	Confident	77.9	Confident	51 Å²	51	45.3 Å²	45.3	19%	0.192	23%	0.227	C	C	.	.	H	α-helix	trans	-53.3	-43	-163	-70.5	-177.1	178.5	160.3	-5.2	115.1	Y400 L401 L452 S456 T462	R397-Y400 WeakPolarHBondContact O-CB 3.45Å; R397-Y400 PolarHBondContact O-N 2.87Å; R397-L401 PolarHBondContact O-N 2.97Å; R397-L401 VanDerWaalsContact O-N 3.08Å; R397-L452 PolarHBondContact NH2-O 3.45Å; R397-S456 PolarHBondContact NE-OG 3.27Å; R397-S456 PolarHBondContact NH2-O 3.47Å; R397-S456 PolarHBondContact NH2-OG 2.96Å; R397-T462 PolarHBondContact NH1-OG1 3.13Å
398	T	74.5	Confident	77.9	Confident	75 Å²	75	48.8 Å²	48.8	46%	0.46	24%	0.241	S	C	.	.	H	α-helix	trans	-69.1	-35.8	178.5	-41.6	0	0	0	0	112.4	T396 L401 I402	T396-T398 PolarHBondContact O-N 3.08Å; T398-L401 PolarHBondContact O-N 3.35Å; T398-I402 HydrophobicContact CG2-CD1 4.04Å; T398-I402 WeakPolarHBondContact O-CG1 3.48Å; T398-I402 PolarHBondContact O-N 3.38Å
399	R	79.6	Confident	78.2	Confident	40 Å²	40	51.2 Å²	51.2	15%	0.151	25%	0.254	C	S	.	.	H	α-helix	trans	-69.4	-37.8	175.8	-69.2	176.3	60.1	-126.4	-6.3	111.8	F388 N390 T396 Y403	F388-R399 HydrophobicContact CE2-CB 4.22Å; F388-R399 HydrophobicContact CZ-CB 3.99Å; N390-R399 PolarHBondContact OD1-NH1 3.41Å; T396-R399 WeakPolarHBondContact O-CB 3.48Å; T396-R399 PolarHBondContact O-N 3.04Å; R399-Y403 VanDerWaalsContact O-CB 3.32Å; R399-Y403 WeakPolarHBondContact O-CB 3.47Å; R399-Y403 PolarHBondContact O-N 3.5Å
400	Y	82	Confident	78.7	Confident	12 Å²	12	51.7 Å²	51.7	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-55.2	-53.6	168.4	-91.1	-83.2	0	0	0	111	F388 T396 R397 I402 Y403 Y404 L448	F388-Y400 HydrophobicContact CB-CD1 4.37Å; F388-Y400 HydrophobicContact CB-CE1 4.21Å; F388-Y400 AromaticContact CD1-CD1 3.61Å; F388-Y400 HydrophobicContact CD1-CD1 3.61Å; F388-Y400 HydrophobicContact CD1-CD2 4.03Å; F388-Y400 AromaticContact CD1-CE1 3.25Å; F388-Y400 HydrophobicContact CD1-CE1 3.25Å; F388-Y400 AromaticContact CD1-CE2 3.73Å; F388-Y400 HydrophobicContact CD1-CE2 3.73Å; F388-Y400 AromaticContact CD1-CG 3.96Å; F388-Y400 HydrophobicContact CD1-CG 3.96Å; F388-Y400 AromaticContact CD1-CZ 3.29Å; F388-Y400 HydrophobicContact CE1-CD1 4.09Å; F388-Y400 AromaticContact CE1-CD2 3.65Å; F388-Y400 HydrophobicContact CE1-CD2 3.65Å; F388-Y400 AromaticContact CE1-CE1 3.88Å; F388-Y400 HydrophobicContact CE1-CE1 3.88Å; F388-Y400 AromaticContact CE1-CE2 3.42Å; F388-Y400 HydrophobicContact CE1-CE2 3.42Å; F388-Y400 VanDerWaalsContact CE1-CE2 3.42Å; F388-Y400 AromaticContact CE1-CG 3.96Å; F388-Y400 HydrophobicContact CE1-CG 3.96Å; F388-Y400 AromaticContact CE1-CZ 3.51Å; F388-Y400 HydrophobicContact CG-CD1 4.08Å; F388-Y400 HydrophobicContact CG-CE1 4.01Å; F388-Y400 HydrophobicContact CZ-CD2 4.33Å; F388-Y400 HydrophobicContact CZ-CE2 4.45Å; T396-Y400 HydrophobicContact CG2-CE2 4.42Å; T396-Y400 WeakPolarHBondContact O-CD2 3.38Å; T396-Y400 PolarHBondContact O-N 3.32Å; R397-Y400 WeakPolarHBondContact O-CB 3.45Å; R397-Y400 PolarHBondContact O-N 2.87Å; Y400-I402 PolarHBondContact O-N 3.49Å; Y400-Y403 PolarHBondContact O-N 2.87Å; Y400-Y404 HydrophobicContact CD1-CD2 4.2Å; Y400-Y404 AromaticContact CD1-CE2 3.78Å; Y400-Y404 HydrophobicContact CD1-CE2 3.78Å; Y400-Y404 HydrophobicContact CE1-CE2 4.24Å; Y400-Y404 WeakPolarHBondContact O-CD2 3.27Å; Y400-Y404 PolarHBondContact O-N 3.02Å; Y400-L448 HydrophobicContact CD1-CD2 4.32Å
401	L	84.1	Confident	79.6	Confident	58 Å²	58	51.5 Å²	51.5	30%	0.304	26%	0.255	S	S	.	.	H	α-helix	trans	-59.6	-49.4	-178.2	-171	158.5	0	0	0	112	R397 T398 Y404 F405	R397-L401 PolarHBondContact O-N 2.97Å; R397-L401 VanDerWaalsContact O-N 3.08Å; T398-L401 PolarHBondContact O-N 3.35Å; L401-Y404 PolarHBondContact O-N 3.24Å; L401-F405 WeakPolarHBondContact O-CB 3.42Å; L401-F405 PolarHBondContact O-N 3.41Å
402	I	85.3	Confident	81	Confident	86 Å²	86	52.2 Å²	52.2	44%	0.441	26%	0.259	S	S	.	.	H	α-helix	trans	-63	-44.6	-179.2	-67.6	168.5	0	0	0	111.4	T398 Y400 F405 F406	T398-I402 HydrophobicContact CG2-CD1 4.04Å; T398-I402 WeakPolarHBondContact O-CG1 3.48Å; T398-I402 PolarHBondContact O-N 3.38Å; Y400-I402 PolarHBondContact O-N 3.49Å; I402-F405 PolarHBondContact O-N 2.85Å; I402-F406 HydrophobicContact CG2-CD2 3.92Å; I402-F406 HydrophobicContact CG2-CE2 3.74Å; I402-F406 VanDerWaalsContact O-CD2 3.26Å; I402-F406 WeakPolarHBondContact O-CD2 3.31Å; I402-F406 PolarHBondContact O-N 3.35Å
403	Y	90.3	Very high	82.6	Confident	19 Å²	19	53.8 Å²	53.8	8%	0.075	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-51.2	177.3	172.5	-84.8	0	0	0	111.6	H339 V343 N384 E387 F388 R399 Y400 F405 F406 Y407	H339-Y403 AromaticContact CE1-CE2 3.65Å; H339-Y403 AromaticContact NE2-CE2 3.7Å; V343-Y403 HydrophobicContact CG2-CD2 4.31Å; V343-Y403 HydrophobicContact CG2-CE2 4.12Å; N384-Y403 HydrophobicContact CB-CE2 4.2Å; N384-Y403 WeakPolarHBondContact O-CE2 3.32Å; N384-Y403 PolarHBondContact O-OH 3.08Å; E387-Y403 WeakPolarHBondContact CA-OH 3.04Å; F388-Y403 HydrophobicContact CB-CD1 3.59Å; F388-Y403 HydrophobicContact CB-CE1 3.65Å; F388-Y403 HydrophobicContact CB-CG 4.12Å; F388-Y403 AromaticContact CD2-CD1 3.87Å; F388-Y403 HydrophobicContact CD2-CD1 3.87Å; F388-Y403 AromaticContact CD2-CD2 3.85Å; F388-Y403 HydrophobicContact CD2-CD2 3.85Å; F388-Y403 HydrophobicContact CD2-CE2 4.47Å; F388-Y403 AromaticContact CD2-CG 3.49Å; F388-Y403 HydrophobicContact CD2-CG 3.49Å; F388-Y403 VanDerWaalsContact CD2-CG 3.49Å; F388-Y403 HydrophobicContact CE2-CG 4.39Å; F388-Y403 HydrophobicContact CG-CD1 4.19Å; F388-Y403 HydrophobicContact CG-CG 4.26Å; F388-Y403 PolarHBondContact N-OH 3.47Å; R399-Y403 VanDerWaalsContact O-CB 3.32Å; R399-Y403 WeakPolarHBondContact O-CB 3.47Å; R399-Y403 PolarHBondContact O-N 3.5Å; Y400-Y403 PolarHBondContact O-N 2.87Å; Y403-F405 PolarHBondContact O-N 3.31Å; Y403-F406 PolarHBondContact O-N 2.91Å; Y403-Y407 AromaticContact CE1-CD2 3.54Å; Y403-Y407 HydrophobicContact CE1-CD2 3.54Å; Y403-Y407 HydrophobicContact CE1-CE2 4.08Å; Y403-Y407 HydrophobicContact CE1-CG 4.05Å; Y403-Y407 AromaticContact CZ-CD2 3.62Å; Y403-Y407 VanDerWaalsContact O-CB 3.28Å; Y403-Y407 WeakPolarHBondContact O-CB 3.41Å; Y403-Y407 PolarHBondContact O-N 2.91Å; Y403-Y407 WeakPolarHBondContact OH-CD2 3.44Å; Y403-Y407 WeakPolarHBondContact OH-CE2 3.34Å
404	Y	90.9	Very high	84.4	Confident	5 Å²	5	53 Å²	53	2%	0.02	25%	0.249	C	C	.	.	H	α-helix	trans	-69.1	-24	-175.8	-82.4	-74.6	0	0	0	112.9	H313 E387 F388 Y400 L401 Y407 Y408 L448	H313-Y404 AromaticContact CE1-CD1 3.95Å; H313-Y404 AromaticContact CE1-CE1 3.5Å; H313-Y404 VanDerWaalsContact CE1-CE1 3.5Å; H313-Y404 WeakPolarHBondContact CE1-CE1 3.29Å; H313-Y404 AromaticContact CG-CE1 3.97Å; H313-Y404 AromaticContact ND1-CE1 3.15Å; H313-Y404 WeakPolarHBondContact ND1-CE1 3.34Å; H313-Y404 AromaticContact ND1-CZ 3.65Å; E387-Y404 HydrophobicContact CG-CE1 4.41Å; E387-Y404 WeakPolarHBondContact CG-OH 3.43Å; E387-Y404 PolarHBondContact OE1-OH 3.26Å; F388-Y404 HydrophobicContact CB-CD2 4.35Å; F388-Y404 HydrophobicContact CB-CE2 3.59Å; F388-Y404 HydrophobicContact CG-CE2 4.5Å; Y400-Y404 HydrophobicContact CD1-CD2 4.2Å; Y400-Y404 AromaticContact CD1-CE2 3.78Å; Y400-Y404 HydrophobicContact CD1-CE2 3.78Å; Y400-Y404 HydrophobicContact CE1-CE2 4.24Å; Y400-Y404 WeakPolarHBondContact O-CD2 3.27Å; Y400-Y404 PolarHBondContact O-N 3.02Å; L401-Y404 PolarHBondContact O-N 3.24Å; Y404-Y407 HydrophobicContact CD1-CD1 4.35Å; Y404-Y408 WeakPolarHBondContact O-CB 3.28Å; Y404-Y408 PolarHBondContact O-N 3.01Å; Y404-L448 HydrophobicContact CD2-CD2 3.51Å; Y404-L448 HydrophobicContact CE1-CD2 4.4Å; Y404-L448 HydrophobicContact CE2-CD2 3.31Å; Y404-L448 HydrophobicContact CG-CD2 4.15Å
405	F	89.1	Confident	86.3	Confident	119 Å²	119	47.9 Å²	47.9	52%	0.522	23%	0.227	S	C	.	.	H	α-helix	trans	-64.2	-51.4	168.8	177.5	-101.2	0	0	0	111.9	L401 I402 Y403 Y408 I409	L401-F405 WeakPolarHBondContact O-CB 3.42Å; L401-F405 PolarHBondContact O-N 3.41Å; I402-F405 PolarHBondContact O-N 2.85Å; Y403-F405 PolarHBondContact O-N 3.31Å; F405-Y408 PolarHBondContact O-N 3.06Å; F405-I409 HydrophobicContact CD1-CD1 3.96Å; F405-I409 HydrophobicContact CD2-CD1 4.4Å; F405-I409 HydrophobicContact CE1-CD1 3.49Å; F405-I409 VanDerWaalsContact CE1-CD1 3.49Å; F405-I409 HydrophobicContact CE2-CD1 3.99Å; F405-I409 HydrophobicContact CG-CD1 4.4Å; F405-I409 HydrophobicContact CZ-CD1 3.52Å; F405-I409 WeakPolarHBondContact O-CG1 3.19Å; F405-I409 PolarHBondContact O-N 3.31Å; F405-I409 VanDerWaalsContact O-N 3.09Å
406	F	90.9	Very high	88.1	Confident	108 Å²	108	43.8 Å²	43.8	47%	0.474	22%	0.22	S	C	.	.	H	α-helix	trans	-65.4	-42	176.7	-74.5	-62.3	0	0	0	112.5	I402 Y403 Y408 I409 E410	I402-F406 HydrophobicContact CG2-CD2 3.92Å; I402-F406 HydrophobicContact CG2-CE2 3.74Å; I402-F406 VanDerWaalsContact O-CD2 3.26Å; I402-F406 WeakPolarHBondContact O-CD2 3.31Å; I402-F406 PolarHBondContact O-N 3.35Å; Y403-F406 PolarHBondContact O-N 2.91Å; F406-Y408 VanDerWaalsContact C-N 3.34Å; F406-Y408 PolarHBondContact O-N 2.8Å; F406-I409 PolarHBondContact O-N 2.74Å; F406-E410 WeakPolarHBondContact O-CB 3.38Å; F406-E410 PolarHBondContact O-N 3.15Å
407	Y	92.8	Very high	89.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.5	-41.3	175.9	-175.2	-81.7	0	0	0	112.4	H313 R317 Y386 Y403 Y404 N411	H313-Y407 PolarHBondContact O-OH 2.93Å; R317-Y407 HydrophobicContact CB-CE1 4.46Å; R317-Y407 VanDerWaalsContact CB-OH 3.29Å; R317-Y407 WeakPolarHBondContact CB-OH 3.49Å; R317-Y407 HydrophobicContact CG-CE2 4.21Å; Y386-Y407 VanDerWaalsContact O-CE2 3.26Å; Y386-Y407 WeakPolarHBondContact O-CE2 3.38Å; Y386-Y407 PolarHBondContact O-OH 3Å; Y403-Y407 AromaticContact CE1-CD2 3.54Å; Y403-Y407 HydrophobicContact CE1-CD2 3.54Å; Y403-Y407 HydrophobicContact CE1-CE2 4.08Å; Y403-Y407 HydrophobicContact CE1-CG 4.05Å; Y403-Y407 AromaticContact CZ-CD2 3.62Å; Y403-Y407 VanDerWaalsContact O-CB 3.28Å; Y403-Y407 WeakPolarHBondContact O-CB 3.41Å; Y403-Y407 PolarHBondContact O-N 2.91Å; Y403-Y407 WeakPolarHBondContact OH-CD2 3.44Å; Y403-Y407 WeakPolarHBondContact OH-CE2 3.34Å; Y404-Y407 HydrophobicContact CD1-CD1 4.35Å; Y407-N411 WeakPolarHBondContact CE1-ND2 3.46Å; Y407-N411 WeakPolarHBondContact O-CB 3.39Å; Y407-N411 PolarHBondContact O-N 3.04Å
408	Y	92.8	Very high	90.5	Very high	73 Å²	73	42.7 Å²	42.7	29%	0.286	22%	0.216	S	C	.	.	H	α-helix	trans	-63.8	-44.8	174.2	177.4	-86.7	0	0	0	111.4	Y404 F405 F406 S412 Q441 L442	Y404-Y408 WeakPolarHBondContact O-CB 3.28Å; Y404-Y408 PolarHBondContact O-N 3.01Å; F405-Y408 PolarHBondContact O-N 3.06Å; F406-Y408 VanDerWaalsContact C-N 3.34Å; F406-Y408 PolarHBondContact O-N 2.8Å; Y408-S412 WeakPolarHBondContact CE1-OG 3.39Å; Y408-S412 VanDerWaalsContact O-CB 3.25Å; Y408-S412 WeakPolarHBondContact O-CB 3.33Å; Y408-S412 PolarHBondContact O-N 2.65Å; Y408-S412 PolarHBondContact O-OG 2.89Å; Y408-Q441 HydrophobicContact CD2-CB 4.42Å; Y408-Q441 HydrophobicContact CD2-CG 3.69Å; Y408-Q441 HydrophobicContact CE2-CG 4.24Å; Y408-L442 HydrophobicContact CE2-CB 4.42Å
409	I	92.9	Very high	91.5	Very high	64 Å²	64	42.4 Å²	42.4	33%	0.328	21%	0.207	S	C	.	.	H	α-helix	trans	-63.3	-45.3	177.6	-71.6	169.9	0	0	0	110.9	F405 F406 S412 I413	F405-I409 HydrophobicContact CD1-CD1 3.96Å; F405-I409 HydrophobicContact CD2-CD1 4.4Å; F405-I409 HydrophobicContact CE1-CD1 3.49Å; F405-I409 VanDerWaalsContact CE1-CD1 3.49Å; F405-I409 HydrophobicContact CE2-CD1 3.99Å; F405-I409 HydrophobicContact CG-CD1 4.4Å; F405-I409 HydrophobicContact CZ-CD1 3.52Å; F405-I409 WeakPolarHBondContact O-CG1 3.19Å; F405-I409 PolarHBondContact O-N 3.31Å; F405-I409 VanDerWaalsContact O-N 3.09Å; F406-I409 PolarHBondContact O-N 2.74Å; I409-S412 PolarHBondContact O-N 2.9Å; I409-I413 HydrophobicContact CG2-CD1 3.63Å; I409-I413 HydrophobicContact CG2-CG1 4.36Å; I409-I413 WeakPolarHBondContact O-CB 3.39Å; I409-I413 VanDerWaalsContact O-CG1 3.28Å; I409-I413 WeakPolarHBondContact O-CG1 3.18Å; I409-I413 PolarHBondContact O-N 3.32Å
410	E	94.4	Very high	92.2	Very high	22 Å²	22	46 Å²	46	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-47.6	178.3	-166.7	-165.8	171.7	0	0	111.8	R317 I335 H339 F406 S412 I413 M414	R317-E410 IonicContact CZ-OE1 3.18Å; R317-E410 IonicContact CZ-OE2 3.59Å; R317-E410 VanDerWaalsContact CZ-OE2 3.22Å; R317-E410 IonicContact NH1-OE1 2.7Å; R317-E410 IonicContact NH1-OE2 3.54Å; R317-E410 PolarHBondContact NH1-OE2 2.75Å; R317-E410 IonicContact NH2-OE1 2.89Å; R317-E410 PolarHBondContact NH2-OE1 3.31Å; R317-E410 IonicContact NH2-OE2 2.85Å; R317-E410 PolarHBondContact NH2-OE2 2.93Å; I335-E410 HydrophobicContact CG2-CG 3.73Å; I335-E410 VanDerWaalsContact CG2-OE1 3.25Å; I335-E410 WeakPolarHBondContact CG2-OE1 3.49Å; H339-E410 IonicContact CE1-OE2 3.11Å; H339-E410 IonicContact CG-OE2 3.02Å; H339-E410 IonicContact ND1-OE2 2.95Å; H339-E410 PolarHBondContact ND1-OE2 2.99Å; F406-E410 WeakPolarHBondContact O-CB 3.38Å; F406-E410 PolarHBondContact O-N 3.15Å; E410-S412 VanDerWaalsContact C-N 3.34Å; E410-S412 PolarHBondContact O-N 2.74Å; E410-I413 PolarHBondContact O-N 2.98Å; E410-M414 HydrophobicContact CG-CE 4.22Å; E410-M414 WeakPolarHBondContact O-CB 3.32Å; E410-M414 WeakPolarHBondContact O-CG 3.41Å; E410-M414 PolarHBondContact O-N 3.44Å
411	N	94.9	Very high	92.7	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-61.4	-42.1	174.1	-74.7	2.7	0	0	0	111.5	R317 Y407 M414 I415 Q441	R317-N411 WeakPolarHBondContact CD-OD1 3.4Å; R317-N411 PolarHBondContact NH1-OD1 3.13Å; Y407-N411 WeakPolarHBondContact CE1-ND2 3.46Å; Y407-N411 WeakPolarHBondContact O-CB 3.39Å; Y407-N411 PolarHBondContact O-N 3.04Å; N411-M414 PolarHBondContact O-N 3.49Å; N411-M414 WeakPolarHBondContact OD1-CE 3.49Å; N411-I415 WeakPolarHBondContact O-CG2 3.28Å; N411-I415 PolarHBondContact O-N 2.99Å; N411-Q441 PolarHBondContact ND2-OE1 3.04Å
412	S	94.5	Very high	93	Very high	31 Å²	31	49.4 Å²	49.4	22%	0.217	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-39.3	178.8	-59.7	0	0	0	0	112.4	Y408 I409 E410 G416	Y408-S412 WeakPolarHBondContact CE1-OG 3.39Å; Y408-S412 VanDerWaalsContact O-CB 3.25Å; Y408-S412 WeakPolarHBondContact O-CB 3.33Å; Y408-S412 PolarHBondContact O-N 2.65Å; Y408-S412 PolarHBondContact O-OG 2.89Å; I409-S412 PolarHBondContact O-N 2.9Å; E410-S412 VanDerWaalsContact C-N 3.34Å; E410-S412 PolarHBondContact O-N 2.74Å; S412-G416 WeakPolarHBondContact O-CA 3.35Å; S412-G416 PolarHBondContact O-N 3.25Å
413	I	94.7	Very high	93.1	Very high	89 Å²	89	51.5 Å²	51.5	46%	0.456	25%	0.247	S	C	.	.	H	α-helix	trans	-68.8	-44.5	175.1	-70.6	168.6	0	0	0	110.2	I409 E410 G416 L417	I409-I413 HydrophobicContact CG2-CD1 3.63Å; I409-I413 HydrophobicContact CG2-CG1 4.36Å; I409-I413 WeakPolarHBondContact O-CB 3.39Å; I409-I413 VanDerWaalsContact O-CG1 3.28Å; I409-I413 WeakPolarHBondContact O-CG1 3.18Å; I409-I413 PolarHBondContact O-N 3.32Å; E410-I413 PolarHBondContact O-N 2.98Å; I413-G416 PolarHBondContact O-N 2.98Å; I413-L417 HydrophobicContact CG2-CD1 3.67Å; I413-L417 HydrophobicContact CG2-CG 4.25Å; I413-L417 VanDerWaalsContact O-CB 3.31Å; I413-L417 WeakPolarHBondContact O-CB 3.44Å; I413-L417 VanDerWaalsContact O-CG 3.29Å; I413-L417 WeakPolarHBondContact O-CG 3.39Å; I413-L417 PolarHBondContact O-N 3.02Å
414	M	95.6	Very high	92.9	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-60.5	-48.7	177.3	-76.6	-171.1	-65	0	0	112.1	I321 F324 I332 I335 E410 N411 W418	I321-M414 HydrophobicContact CG1-CE 4.11Å; I321-M414 HydrophobicContact CG1-SD 4.24Å; F324-M414 HydrophobicContact CB-CB 3.98Å; F324-M414 HydrophobicContact CB-CG 4.25Å; F324-M414 HydrophobicContact CB-SD 4.49Å; F324-M414 HydrophobicContact CD1-CG 4.17Å; F324-M414 HydrophobicContact CD1-SD 4.38Å; F324-M414 HydrophobicContact CD2-CB 4.12Å; F324-M414 HydrophobicContact CD2-CG 4.23Å; F324-M414 WeakPolarHBondContact CD2-O 3.27Å; F324-M414 HydrophobicContact CG-CB 4.03Å; F324-M414 HydrophobicContact CG-CG 3.94Å; F324-M414 HydrophobicContact CG-SD 4.48Å; I332-M414 HydrophobicContact CD1-SD 3.85Å; I335-M414 HydrophobicContact CD1-CG 4.11Å; I335-M414 HydrophobicContact CG2-SD 4.25Å; E410-M414 HydrophobicContact CG-CE 4.22Å; E410-M414 WeakPolarHBondContact O-CB 3.32Å; E410-M414 WeakPolarHBondContact O-CG 3.41Å; E410-M414 PolarHBondContact O-N 3.44Å; N411-M414 PolarHBondContact O-N 3.49Å; N411-M414 WeakPolarHBondContact OD1-CE 3.49Å; M414-W418 WeakPolarHBondContact O-CB 3.35Å; M414-W418 PolarHBondContact O-N 3.31Å
415	I	95.7	Very high	92.7	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-72.7	-33.2	179.9	-161.6	67.4	0	0	0	112.3	L323 N411 W418 Y419 L434 V437 I438	L323-I415 HydrophobicContact CD1-CD1 3.88Å; N411-I415 WeakPolarHBondContact O-CG2 3.28Å; N411-I415 PolarHBondContact O-N 2.99Å; I415-W418 HydrophobicContact CD1-CD2 4.21Å; I415-W418 HydrophobicContact CD1-CE3 3.55Å; I415-W418 HydrophobicContact CD1-CZ3 4.07Å; I415-W418 HydrophobicContact CG1-CE3 4.23Å; I415-W418 PolarHBondContact O-N 2.91Å; I415-Y419 VanDerWaalsContact O-CB 3.32Å; I415-Y419 WeakPolarHBondContact O-CB 3.45Å; I415-Y419 PolarHBondContact O-N 2.77Å; I415-L434 HydrophobicContact CG1-CD1 4.18Å; I415-L434 HydrophobicContact CG2-CD1 3.96Å; I415-V437 HydrophobicContact CB-CB 4.5Å; I415-V437 HydrophobicContact CB-CG1 4.09Å; I415-V437 HydrophobicContact CD1-CG2 4.13Å; I415-V437 HydrophobicContact CG1-CB 4.1Å; I415-V437 HydrophobicContact CG1-CG1 4.24Å; I415-V437 HydrophobicContact CG1-CG2 4.16Å; I415-V437 HydrophobicContact CG2-CB 4.4Å; I415-V437 HydrophobicContact CG2-CG1 3.89Å; I415-I438 HydrophobicContact CG2-CG1 4.45Å
416	G	95.7	Very high	92.6	Very high	29 Å²	29	62.9 Å²	62.9	30%	0.299	31%	0.305	S	S	.	.	H	α-helix	trans	-66.8	-45.1	175.9	0	0	0	0	0	112.8	S412 I413 Y419 D420	S412-G416 WeakPolarHBondContact O-CA 3.35Å; S412-G416 PolarHBondContact O-N 3.25Å; I413-G416 PolarHBondContact O-N 2.98Å; G416-Y419 PolarHBondContact O-N 3.41Å; G416-D420 WeakPolarHBondContact O-CB 3.3Å; G416-D420 PolarHBondContact O-N 3.12Å
417	L	95.3	Very high	92.4	Very high	65 Å²	65	59.2 Å²	59.2	34%	0.34	29%	0.292	S	S	.	.	H	α-helix	trans	-68.2	-35.4	173.8	-70.7	173.3	0	0	0	112.1	F324 F328 I413 Y419 Y421	F324-L417 HydrophobicContact CD2-CB 4.34Å; F324-L417 HydrophobicContact CE2-CB 3.91Å; F324-L417 HydrophobicContact CE2-CD1 4.01Å; F328-L417 HydrophobicContact CE2-CB 4.3Å; F328-L417 WeakPolarHBondContact CE2-O 3.47Å; I413-L417 HydrophobicContact CG2-CD1 3.67Å; I413-L417 HydrophobicContact CG2-CG 4.25Å; I413-L417 VanDerWaalsContact O-CB 3.31Å; I413-L417 WeakPolarHBondContact O-CB 3.44Å; I413-L417 VanDerWaalsContact O-CG 3.29Å; I413-L417 WeakPolarHBondContact O-CG 3.39Å; I413-L417 PolarHBondContact O-N 3.02Å; L417-Y419 VanDerWaalsContact C-N 3.35Å; L417-Y421 HydrophobicContact CD2-CD2 4.48Å; L417-Y421 HydrophobicContact CD2-CE2 4.13Å; L417-Y421 WeakPolarHBondContact O-CD2 3.45Å; L417-Y421 PolarHBondContact O-N 2.79Å
418	W	94.9	Very high	92.2	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-47.5	171.2	169.5	77.9	0	0	0	111	Y244 L323 M414 I415 Y422 Y429 Y430 C433	Y244-W418 HydrophobicContact CE2-CZ2 4.29Å; Y244-W418 AromaticContact CE2-NE1 3.5Å; Y244-W418 AromaticContact CZ-NE1 3.56Å; Y244-W418 PolarHBondContact OH-NE1 3.16Å; Y244-W418 VanDerWaalsContact OH-NE1 3.07Å; L323-W418 HydrophobicContact CB-CD2 4.15Å; L323-W418 HydrophobicContact CB-CG 4Å; L323-W418 HydrophobicContact CD1-CD2 4.43Å; L323-W418 HydrophobicContact CD1-CH2 4.48Å; L323-W418 HydrophobicContact CD1-CZ2 4.35Å; L323-W418 HydrophobicContact CD2-CZ2 4.27Å; L323-W418 VanDerWaalsContact O-CD1 3.23Å; M414-W418 WeakPolarHBondContact O-CB 3.35Å; M414-W418 PolarHBondContact O-N 3.31Å; I415-W418 HydrophobicContact CD1-CD2 4.21Å; I415-W418 HydrophobicContact CD1-CE3 3.55Å; I415-W418 HydrophobicContact CD1-CZ3 4.07Å; I415-W418 HydrophobicContact CG1-CE3 4.23Å; I415-W418 PolarHBondContact O-N 2.91Å; W418-Y422 HydrophobicContact CZ2-CD2 4.07Å; W418-Y422 HydrophobicContact CZ2-CE2 4.17Å; W418-Y422 HydrophobicContact CZ2-CG 4.34Å; W418-Y422 AromaticContact NE1-CD2 3.81Å; W418-Y422 WeakPolarHBondContact O-CB 3.35Å; W418-Y422 PolarHBondContact O-N 3.42Å; W418-Y422 VanDerWaalsContact O-N 3.12Å; W418-Y429 HydrophobicContact CH2-CD2 4.46Å; W418-Y429 HydrophobicContact CZ2-CE2 4.39Å; W418-Y430 HydrophobicContact CH2-CD2 4.38Å; W418-C433 HydrophobicContact CH2-CB 4.11Å; W418-C433 HydrophobicContact CZ3-CB 4.08Å
419	Y	94.3	Very high	92	Very high	68 Å²	68	68.3 Å²	68.3	27%	0.267	33%	0.327	S	S	.	.	H	α-helix	trans	-62.2	-53.3	179.8	-178.2	-91.4	0	0	0	111.8	I415 G416 L417 Y421 Y422 Y430 L434	I415-Y419 VanDerWaalsContact O-CB 3.32Å; I415-Y419 WeakPolarHBondContact O-CB 3.45Å; I415-Y419 PolarHBondContact O-N 2.77Å; G416-Y419 PolarHBondContact O-N 3.41Å; L417-Y419 VanDerWaalsContact C-N 3.35Å; Y419-Y421 VanDerWaalsContact C-N 3.27Å; Y419-Y421 PolarHBondContact O-N 2.91Å; Y419-Y422 WeakPolarHBondContact O-CB 3.28Å; Y419-Y422 PolarHBondContact O-N 2.97Å; Y419-Y430 HydrophobicContact CD1-CE2 4.37Å; Y419-Y430 AromaticContact CD2-CD2 3.72Å; Y419-Y430 HydrophobicContact CD2-CD2 3.72Å; Y419-Y430 HydrophobicContact CD2-CE1 4.15Å; Y419-Y430 AromaticContact CD2-CE2 3.26Å; Y419-Y430 HydrophobicContact CD2-CE2 3.26Å; Y419-Y430 HydrophobicContact CD2-CG 4.34Å; Y419-Y430 AromaticContact CD2-CZ 3.51Å; Y419-Y430 HydrophobicContact CE1-CE1 4.46Å; Y419-Y430 AromaticContact CE1-CZ 3.93Å; Y419-Y430 WeakPolarHBondContact CE1-OH 3.35Å; Y419-Y430 AromaticContact CE2-CD1 3.9Å; Y419-Y430 HydrophobicContact CE2-CD1 3.9Å; Y419-Y430 AromaticContact CE2-CD2 3.92Å; Y419-Y430 HydrophobicContact CE2-CD2 3.92Å; Y419-Y430 AromaticContact CE2-CE1 3.49Å; Y419-Y430 HydrophobicContact CE2-CE1 3.49Å; Y419-Y430 VanDerWaalsContact CE2-CE1 3.49Å; Y419-Y430 AromaticContact CE2-CE2 3.52Å; Y419-Y430 HydrophobicContact CE2-CE2 3.52Å; Y419-Y430 HydrophobicContact CE2-CG 4.1Å; Y419-Y430 AromaticContact CE2-CZ 3.29Å; Y419-Y430 AromaticContact CG-CE2 3.74Å; Y419-Y430 HydrophobicContact CG-CE2 3.74Å; Y419-Y430 AromaticContact CG-CZ 3.93Å; Y419-Y430 AromaticContact CZ-CE1 3.67Å; Y419-Y430 AromaticContact CZ-CZ 3.51Å; Y419-Y430 WeakPolarHBondContact O-CE2 3.33Å; Y419-Y430 PolarHBondContact O-OH 2.84Å; Y419-L434 HydrophobicContact CD1-CD2 4.08Å; Y419-L434 HydrophobicContact CD2-CB 3.93Å; Y419-L434 HydrophobicContact CD2-CD2 3.7Å; Y419-L434 HydrophobicContact CD2-CG 4.29Å; Y419-L434 HydrophobicContact CE1-CD2 4.11Å; Y419-L434 HydrophobicContact CE2-CB 4.3Å; Y419-L434 HydrophobicContact CE2-CD2 3.73Å; Y419-L434 HydrophobicContact CG-CD2 3.89Å
420	D	95	Very high	91.9	Very high	116 Å²	116	67 Å²	67	62%	0.62	32%	0.318	S	S	*	.	H	α-helix	trans	-59.1	-33.5	-177.1	-167.4	58.5	0	0	0	113.7	G416	G416-D420 WeakPolarHBondContact O-CB 3.3Å; G416-D420 PolarHBondContact O-N 3.12Å
421	Y	93.5	Very high	91.8	Very high	122 Å²	122	70 Å²	70	48%	0.478	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	15.9	-179.1	-67.7	-83.2	0	0	0	114.2	R327 F328 L417 Y419	R327-Y421 PolarHBondContact NE-O 2.75Å; R327-Y421 PolarHBondContact NH2-O 3.24Å; F328-Y421 HydrophobicContact CE2-CD2 4.45Å; F328-Y421 AromaticContact CZ-CD2 3.69Å; F328-Y421 HydrophobicContact CZ-CD2 3.69Å; F328-Y421 AromaticContact CZ-CG 3.75Å; F328-Y421 HydrophobicContact CZ-CG 3.75Å; L417-Y421 HydrophobicContact CD2-CD2 4.48Å; L417-Y421 HydrophobicContact CD2-CE2 4.13Å; L417-Y421 WeakPolarHBondContact O-CD2 3.45Å; L417-Y421 PolarHBondContact O-N 2.79Å; Y419-Y421 VanDerWaalsContact C-N 3.27Å; Y419-Y421 PolarHBondContact O-N 2.91Å
422	Y	89.3	Confident	91.7	Very high	19 Å²	19	72.9 Å²	72.9	8%	0.075	35%	0.353	C	S	.	.			trans	-76.6	135.1	177.4	-168.1	-121.5	0	0	0	111.6	Y244 T248 W418 Y419 Y424 S427 Y429 Y430	Y244-Y422 AromaticContact CE2-CE2 3.97Å; Y244-Y422 HydrophobicContact CE2-CE2 3.97Å; Y244-Y422 AromaticContact CZ-CE2 4Å; Y244-Y422 WeakPolarHBondContact OH-CD2 3.39Å; Y244-Y422 VanDerWaalsContact OH-CE2 3.3Å; Y244-Y422 WeakPolarHBondContact OH-CE2 3.19Å; T248-Y422 HydrophobicContact CG2-CE2 4.19Å; W418-Y422 HydrophobicContact CZ2-CD2 4.07Å; W418-Y422 HydrophobicContact CZ2-CE2 4.17Å; W418-Y422 HydrophobicContact CZ2-CG 4.34Å; W418-Y422 AromaticContact NE1-CD2 3.81Å; W418-Y422 WeakPolarHBondContact O-CB 3.35Å; W418-Y422 PolarHBondContact O-N 3.42Å; W418-Y422 VanDerWaalsContact O-N 3.12Å; Y419-Y422 WeakPolarHBondContact O-CB 3.28Å; Y419-Y422 PolarHBondContact O-N 2.97Å; Y422-Y424 WeakPolarHBondContact CE1-O 3.37Å; Y422-S427 PolarHBondContact OH-OG 3.44Å; Y422-Y429 PolarHBondContact OH-OH 3.34Å; Y422-Y430 AromaticContact CD1-CD2 3.44Å; Y422-Y430 HydrophobicContact CD1-CD2 3.44Å; Y422-Y430 VanDerWaalsContact CD1-CD2 3.44Å; Y422-Y430 AromaticContact CD1-CE2 3.85Å; Y422-Y430 HydrophobicContact CD1-CE2 3.85Å; Y422-Y430 HydrophobicContact CD1-CG 4.21Å; Y422-Y430 HydrophobicContact CE1-CD2 4.2Å; Y422-Y430 HydrophobicContact CG-CD2 4.14Å; Y422-Y430 HydrophobicContact CG-CE2 4.24Å
423	Q	87.1	Confident	91.6	Very high	130 Å²	130	72.5 Å²	72.5	61%	0.607	35%	0.35	S	S	*	.	S	Bend	trans	-85.9	-13.1	-171.1	-67.3	177.7	-70	0	0	114.4	P425	Q423-P425 WeakPolarHBondContact O-CD 3.32Å
424	Y	86.1	Confident	91.6	Very high	112 Å²	112	69.5 Å²	69.5	44%	0.439	34%	0.335	S	S	.	.			trans	-129.2	62.8	-170.3	-55.5	-69.7	0	0	0	112.3	Y422 E426 S427	Y422-Y424 WeakPolarHBondContact CE1-O 3.37Å; Y424-E426 PolarHBondContact O-N 2.85Å; Y424-S427 WeakPolarHBondContact CB-OG 3.47Å; Y424-S427 VanDerWaalsContact O-CB 3.26Å; Y424-S427 WeakPolarHBondContact O-CB 3.49Å; Y424-S427 PolarHBondContact O-N 3.44Å; Y424-S427 PolarHBondContact O-OG 2.96Å
425	P	87.2	Confident	91.5	Very high	76 Å²	76	73.4 Å²	73.4	49%	0.494	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-16.8	-175.1	26.2	-36.1	0	0	0	114.5	Q423 S427 Y430	Q423-P425 WeakPolarHBondContact O-CD 3.32Å; P425-S427 PolarHBondContact O-N 2.94Å; P425-Y430 HydrophobicContact CB-CD1 3.89Å; P425-Y430 HydrophobicContact CB-CE1 3.59Å; P425-Y430 VanDerWaalsContact O-CD1 3.31Å; P425-Y430 WeakPolarHBondContact O-CD1 3.48Å
426	E	86.6	Confident	91.4	Very high	195 Å²	195	77 Å²	77	91%	0.911	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.9	171.8	-59.1	179.6	174.6	0	0	113.6	Y424 W428	Y424-E426 PolarHBondContact O-N 2.85Å; E426-W428 PolarHBondContact O-N 3.02Å
427	S	86.9	Confident	91.3	Very high	30 Å²	30	75.7 Å²	75.7	21%	0.21	36%	0.363	C	S	.	.	S	Bend	trans	-64.4	124.7	179.9	-59.9	0	0	0	0	111	Y422 Y424 P425 Y429 Y430	Y422-S427 PolarHBondContact OH-OG 3.44Å; Y424-S427 WeakPolarHBondContact CB-OG 3.47Å; Y424-S427 VanDerWaalsContact O-CB 3.26Å; Y424-S427 WeakPolarHBondContact O-CB 3.49Å; Y424-S427 PolarHBondContact O-N 3.44Å; Y424-S427 PolarHBondContact O-OG 2.96Å; P425-S427 PolarHBondContact O-N 2.94Å; S427-Y429 PolarHBondContact O-N 2.85Å; S427-Y430 WeakPolarHBondContact O-CB 3.43Å; S427-Y430 PolarHBondContact O-N 2.85Å
428	W	89.3	Confident	91.3	Very high	214 Å²	214	75.1 Å²	75.1	81%	0.811	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-26.9	-174.9	69.5	-95.3	0	0	0	114.8	E426 P432	E426-W428 PolarHBondContact O-N 3.02Å; W428-P432 VanDerWaalsContact O-CD 3.25Å; W428-P432 WeakPolarHBondContact O-CD 3.46Å; W428-P432 VanDerWaalsContact O-CG 3.29Å; W428-P432 WeakPolarHBondContact O-CG 3.48Å
429	Y	88.7	Confident	91.3	Very high	50 Å²	50	80 Å²	80	20%	0.196	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-7	-179.7	57.1	-98.1	0	0	0	114.8	W418 Y422 S427 C433	W418-Y429 HydrophobicContact CH2-CD2 4.46Å; W418-Y429 HydrophobicContact CZ2-CE2 4.39Å; Y422-Y429 PolarHBondContact OH-OH 3.34Å; S427-Y429 PolarHBondContact O-N 2.85Å; Y429-C433 WeakPolarHBondContact O-CB 3.3Å; Y429-C433 PolarHBondContact O-N 3.04Å
430	Y	89.6	Confident	91.4	Very high	36 Å²	36	79 Å²	79	14%	0.141	39%	0.387	C	S	.	.	H	α-helix	trans	-56.5	-62.2	-174.9	174.9	-125	0	0	0	112.7	W418 Y419 Y422 P425 S427	W418-Y430 HydrophobicContact CH2-CD2 4.38Å; Y419-Y430 HydrophobicContact CD1-CE2 4.37Å; Y419-Y430 AromaticContact CD2-CD2 3.72Å; Y419-Y430 HydrophobicContact CD2-CD2 3.72Å; Y419-Y430 HydrophobicContact CD2-CE1 4.15Å; Y419-Y430 AromaticContact CD2-CE2 3.26Å; Y419-Y430 HydrophobicContact CD2-CE2 3.26Å; Y419-Y430 HydrophobicContact CD2-CG 4.34Å; Y419-Y430 AromaticContact CD2-CZ 3.51Å; Y419-Y430 HydrophobicContact CE1-CE1 4.46Å; Y419-Y430 AromaticContact CE1-CZ 3.93Å; Y419-Y430 WeakPolarHBondContact CE1-OH 3.35Å; Y419-Y430 AromaticContact CE2-CD1 3.9Å; Y419-Y430 HydrophobicContact CE2-CD1 3.9Å; Y419-Y430 AromaticContact CE2-CD2 3.92Å; Y419-Y430 HydrophobicContact CE2-CD2 3.92Å; Y419-Y430 AromaticContact CE2-CE1 3.49Å; Y419-Y430 HydrophobicContact CE2-CE1 3.49Å; Y419-Y430 VanDerWaalsContact CE2-CE1 3.49Å; Y419-Y430 AromaticContact CE2-CE2 3.52Å; Y419-Y430 HydrophobicContact CE2-CE2 3.52Å; Y419-Y430 HydrophobicContact CE2-CG 4.1Å; Y419-Y430 AromaticContact CE2-CZ 3.29Å; Y419-Y430 AromaticContact CG-CE2 3.74Å; Y419-Y430 HydrophobicContact CG-CE2 3.74Å; Y419-Y430 AromaticContact CG-CZ 3.93Å; Y419-Y430 AromaticContact CZ-CE1 3.67Å; Y419-Y430 AromaticContact CZ-CZ 3.51Å; Y419-Y430 WeakPolarHBondContact O-CE2 3.33Å; Y419-Y430 PolarHBondContact O-OH 2.84Å; Y422-Y430 AromaticContact CD1-CD2 3.44Å; Y422-Y430 HydrophobicContact CD1-CD2 3.44Å; Y422-Y430 VanDerWaalsContact CD1-CD2 3.44Å; Y422-Y430 AromaticContact CD1-CE2 3.85Å; Y422-Y430 HydrophobicContact CD1-CE2 3.85Å; Y422-Y430 HydrophobicContact CD1-CG 4.21Å; Y422-Y430 HydrophobicContact CE1-CD2 4.2Å; Y422-Y430 HydrophobicContact CG-CD2 4.14Å; Y422-Y430 HydrophobicContact CG-CE2 4.24Å; P425-Y430 HydrophobicContact CB-CD1 3.89Å; P425-Y430 HydrophobicContact CB-CE1 3.59Å; P425-Y430 VanDerWaalsContact O-CD1 3.31Å; P425-Y430 WeakPolarHBondContact O-CD1 3.48Å; S427-Y430 WeakPolarHBondContact O-CB 3.43Å; S427-Y430 PolarHBondContact O-N 2.85Å
431	L	92.9	Very high	91.3	Very high	87 Å²	87	73.7 Å²	73.7	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-71.2	-43.9	176.6	178.5	65.2	0	0	0	113.1	C433 L434 L435	L431-C433 VanDerWaalsContact C-N 3.29Å; L431-C433 PolarHBondContact O-N 2.62Å; L431-L434 PolarHBondContact O-N 3.07Å; L431-L435 HydrophobicContact CD1-CD1 4.02Å; L431-L435 HydrophobicContact CD1-CG 4.08Å; L431-L435 HydrophobicContact CD2-CD1 4.47Å; L431-L435 HydrophobicContact CG-CD1 3.9Å; L431-L435 HydrophobicContact CG-CG 4.38Å; L431-L435 WeakPolarHBondContact O-CG 3.25Å; L431-L435 PolarHBondContact O-N 3.21Å; L431-L435 VanDerWaalsContact O-N 3.16Å
432	P	93.4	Very high	91.2	Very high	61 Å²	61	71.5 Å²	71.5	40%	0.396	35%	0.354	S	S	.	.	H	α-helix	trans	-56.8	-37	176.8	-30.6	38.4	0	0	0	114.3	W428 L435 V436	W428-P432 VanDerWaalsContact O-CD 3.25Å; W428-P432 WeakPolarHBondContact O-CD 3.46Å; W428-P432 VanDerWaalsContact O-CG 3.29Å; W428-P432 WeakPolarHBondContact O-CG 3.48Å; P432-L435 PolarHBondContact O-N 2.94Å; P432-V436 VanDerWaalsContact O-CB 3.27Å; P432-V436 WeakPolarHBondContact O-CB 3.38Å; P432-V436 WeakPolarHBondContact O-CG2 3.42Å; P432-V436 PolarHBondContact O-N 3.1Å
433	C	91.5	Very high	91.5	Very high	22 Å²	22	74.6 Å²	74.6	15%	0.149	37%	0.372	C	S	.	.	H	α-helix	trans	-67.4	-45.2	-179.2	-165.8	0	0	0	0	112.2	L323 W418 Y429 L431 L435 V436 V437	L323-C433 WeakPolarHBondContact CD1-SG 3.45Å; W418-C433 HydrophobicContact CH2-CB 4.11Å; W418-C433 HydrophobicContact CZ3-CB 4.08Å; Y429-C433 WeakPolarHBondContact O-CB 3.3Å; Y429-C433 PolarHBondContact O-N 3.04Å; L431-C433 VanDerWaalsContact C-N 3.29Å; L431-C433 PolarHBondContact O-N 2.62Å; C433-L435 VanDerWaalsContact C-N 3.34Å; C433-L435 PolarHBondContact O-N 2.7Å; C433-V436 PolarHBondContact O-N 3.46Å; C433-V437 WeakPolarHBondContact O-CB 3.46Å; C433-V437 WeakPolarHBondContact O-CG2 3.37Å; C433-V437 PolarHBondContact O-N 3.13Å
434	L	94.1	Very high	91.8	Very high	27 Å²	27	68.4 Å²	68.4	14%	0.141	34%	0.343	C	S	.	.	H	α-helix	trans	-55.7	-49.3	174.4	179.7	67.5	0	0	0	111.3	I415 Y419 L431 I438	I415-L434 HydrophobicContact CG1-CD1 4.18Å; I415-L434 HydrophobicContact CG2-CD1 3.96Å; Y419-L434 HydrophobicContact CD1-CD2 4.08Å; Y419-L434 HydrophobicContact CD2-CB 3.93Å; Y419-L434 HydrophobicContact CD2-CD2 3.7Å; Y419-L434 HydrophobicContact CD2-CG 4.29Å; Y419-L434 HydrophobicContact CE1-CD2 4.11Å; Y419-L434 HydrophobicContact CE2-CB 4.3Å; Y419-L434 HydrophobicContact CE2-CD2 3.73Å; Y419-L434 HydrophobicContact CG-CD2 3.89Å; L431-L434 PolarHBondContact O-N 3.07Å; L434-I438 HydrophobicContact CD1-CD1 3.69Å; L434-I438 HydrophobicContact CG-CD1 4.06Å; L434-I438 WeakPolarHBondContact O-CB 3.5Å; L434-I438 WeakPolarHBondContact O-CG1 3.26Å; L434-I438 PolarHBondContact O-N 2.81Å; L434-I438 VanDerWaalsContact O-N 3.09Å
435	L	94.5	Very high	92	Very high	83 Å²	83	65.9 Å²	65.9	44%	0.435	33%	0.334	S	S	.	.	H	α-helix	trans	-66	-43.7	-179.2	-67.3	176.3	0	0	0	112.5	L431 P432 C433 L439	L431-L435 HydrophobicContact CD1-CD1 4.02Å; L431-L435 HydrophobicContact CD1-CG 4.08Å; L431-L435 HydrophobicContact CD2-CD1 4.47Å; L431-L435 HydrophobicContact CG-CD1 3.9Å; L431-L435 HydrophobicContact CG-CG 4.38Å; L431-L435 WeakPolarHBondContact O-CG 3.25Å; L431-L435 PolarHBondContact O-N 3.21Å; L431-L435 VanDerWaalsContact O-N 3.16Å; P432-L435 PolarHBondContact O-N 2.94Å; C433-L435 VanDerWaalsContact C-N 3.34Å; C433-L435 PolarHBondContact O-N 2.7Å; L435-L439 HydrophobicContact CB-CD1 4.47Å; L435-L439 VanDerWaalsContact O-CB 3.23Å; L435-L439 WeakPolarHBondContact O-CB 3.23Å; L435-L439 VanDerWaalsContact O-CG 3.26Å; L435-L439 WeakPolarHBondContact O-CG 3.25Å; L435-L439 PolarHBondContact O-N 2.74Å
436	V	94.2	Very high	92.3	Very high	74 Å²	74	66.2 Å²	66.2	45%	0.448	33%	0.331	S	S	.	.	H	α-helix	trans	-64.3	-45.8	178.4	166.3	0	0	0	0	111	L316 P432 C433 V440	L316-V436 HydrophobicContact CD2-CG1 4.21Å; P432-V436 VanDerWaalsContact O-CB 3.27Å; P432-V436 WeakPolarHBondContact O-CB 3.38Å; P432-V436 WeakPolarHBondContact O-CG2 3.42Å; P432-V436 PolarHBondContact O-N 3.1Å; C433-V436 PolarHBondContact O-N 3.46Å; V436-V440 HydrophobicContact CG1-CG2 4.14Å; V436-V440 WeakPolarHBondContact O-CB 3.44Å; V436-V440 VanDerWaalsContact O-CG2 3.28Å; V436-V440 WeakPolarHBondContact O-CG2 3.26Å; V436-V440 PolarHBondContact O-N 3.32Å
437	V	93.6	Very high	92.6	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.018	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-50.2	178.1	172	0	0	0	0	110.6	L316 I319 S320 I415 C433 Q441	L316-V437 HydrophobicContact CD2-CG2 4.43Å; I319-V437 HydrophobicContact CG2-CG2 4.14Å; S320-V437 WeakPolarHBondContact OG-CG1 3.11Å; I415-V437 HydrophobicContact CB-CB 4.5Å; I415-V437 HydrophobicContact CB-CG1 4.09Å; I415-V437 HydrophobicContact CD1-CG2 4.13Å; I415-V437 HydrophobicContact CG1-CB 4.1Å; I415-V437 HydrophobicContact CG1-CG1 4.24Å; I415-V437 HydrophobicContact CG1-CG2 4.16Å; I415-V437 HydrophobicContact CG2-CB 4.4Å; I415-V437 HydrophobicContact CG2-CG1 3.89Å; C433-V437 WeakPolarHBondContact O-CB 3.46Å; C433-V437 WeakPolarHBondContact O-CG2 3.37Å; C433-V437 PolarHBondContact O-N 3.13Å; V437-Q441 WeakPolarHBondContact O-CB 3.41Å; V437-Q441 PolarHBondContact O-N 3.46Å; V437-Q441 VanDerWaalsContact O-N 3.15Å
438	I	94.2	Very high	92.8	Very high	53 Å²	53	57.5 Å²	57.5	27%	0.272	29%	0.288	S	S	.	.	H	α-helix	trans	-66.1	-53.2	-177.5	-68.8	172.7	0	0	0	111.7	I415 L434 L442	I415-I438 HydrophobicContact CG2-CG1 4.45Å; L434-I438 HydrophobicContact CD1-CD1 3.69Å; L434-I438 HydrophobicContact CG-CD1 4.06Å; L434-I438 WeakPolarHBondContact O-CB 3.5Å; L434-I438 WeakPolarHBondContact O-CG1 3.26Å; L434-I438 PolarHBondContact O-N 2.81Å; L434-I438 VanDerWaalsContact O-N 3.09Å; I438-L442 WeakPolarHBondContact O-CB 3.48Å; I438-L442 PolarHBondContact O-N 3.43Å; I438-L442 VanDerWaalsContact O-N 3.15Å
439	L	95.1	Very high	92.7	Very high	103 Å²	103	50.5 Å²	50.5	54%	0.539	26%	0.264	S	S	.	.	H	α-helix	trans	-73.1	-39.2	-171.8	-62.7	174.4	0	0	0	112.6	L435 L442 L443	L435-L439 HydrophobicContact CB-CD1 4.47Å; L435-L439 VanDerWaalsContact O-CB 3.23Å; L435-L439 WeakPolarHBondContact O-CB 3.23Å; L435-L439 VanDerWaalsContact O-CG 3.26Å; L435-L439 WeakPolarHBondContact O-CG 3.25Å; L435-L439 PolarHBondContact O-N 2.74Å; L439-L442 PolarHBondContact O-N 3.05Å; L439-L443 PolarHBondContact O-N 3.2Å
440	V	95.6	Very high	92.8	Very high	47 Å²	47	52.1 Å²	52.1	29%	0.285	28%	0.275	S	S	.	.	H	α-helix	trans	-79.2	-27.8	-178.6	-169.6	0	0	0	0	111	I312 L316 V436 L443 G444	I312-V440 HydrophobicContact CG1-CG1 4.43Å; I312-V440 HydrophobicContact CG2-CG1 3.95Å; I312-V440 WeakPolarHBondContact CG2-O 3.49Å; L316-V440 VanDerWaalsContact CD1-C 3.43Å; L316-V440 HydrophobicContact CD1-CB 3.8Å; L316-V440 HydrophobicContact CD1-CG1 4.02Å; V436-V440 HydrophobicContact CG1-CG2 4.14Å; V436-V440 WeakPolarHBondContact O-CB 3.44Å; V436-V440 VanDerWaalsContact O-CG2 3.28Å; V436-V440 WeakPolarHBondContact O-CG2 3.26Å; V436-V440 PolarHBondContact O-N 3.32Å; V440-L443 PolarHBondContact O-N 2.88Å; V440-G444 PolarHBondContact O-N 2.83Å
441	Q	93.2	Very high	92.7	Very high	4 Å²	4	50.7 Å²	50.7	2%	0.019	27%	0.27	C	S	.	.	H	α-helix	trans	-65.3	-42.2	170.3	-177.5	75.6	63	0	0	110.9	H313 L316 Y408 N411 V437 G444 F445	H313-Q441 PolarHBondContact CD2-NE2 2.86Å; H313-Q441 PolarHBondContact NE2-NE2 3.29Å; L316-Q441 HydrophobicContact CD1-CB 3.87Å; Y408-Q441 HydrophobicContact CD2-CB 4.42Å; Y408-Q441 HydrophobicContact CD2-CG 3.69Å; Y408-Q441 HydrophobicContact CE2-CG 4.24Å; N411-Q441 PolarHBondContact ND2-OE1 3.04Å; V437-Q441 WeakPolarHBondContact O-CB 3.41Å; V437-Q441 PolarHBondContact O-N 3.46Å; V437-Q441 VanDerWaalsContact O-N 3.15Å; Q441-G444 PolarHBondContact O-N 3.05Å; Q441-F445 PolarHBondContact O-N 3.23Å
442	L	92.6	Very high	92.3	Very high	75 Å²	75	47 Å²	47	39%	0.393	25%	0.251	S	S	.	.	H	α-helix	trans	-63.2	-44	173.4	-179.4	61.5	0	0	0	111.5	Y408 I438 L439 G444 F445 I446	Y408-L442 HydrophobicContact CE2-CB 4.42Å; I438-L442 WeakPolarHBondContact O-CB 3.48Å; I438-L442 PolarHBondContact O-N 3.43Å; I438-L442 VanDerWaalsContact O-N 3.15Å; L439-L442 PolarHBondContact O-N 3.05Å; L442-G444 PolarHBondContact O-N 3.24Å; L442-F445 WeakPolarHBondContact O-CB 3.31Å; L442-F445 PolarHBondContact O-N 2.69Å; L442-F445 VanDerWaalsContact O-N 3.16Å; L442-I446 HydrophobicContact CD1-CD1 4.44Å; L442-I446 HydrophobicContact CG-CD1 4.13Å; L442-I446 WeakPolarHBondContact O-CG1 3.15Å; L442-I446 PolarHBondContact O-N 3.26Å
443	L	94.5	Very high	91.7	Very high	85 Å²	85	52.1 Å²	52.1	45%	0.445	26%	0.263	S	S	.	.	H	α-helix	trans	-58	-47.2	173.6	177.4	60.9	0	0	0	111.6	L439 V440 F445 I446 L447	L439-L443 PolarHBondContact O-N 3.2Å; V440-L443 PolarHBondContact O-N 2.88Å; L443-F445 VanDerWaalsContact C-N 3.28Å; L443-F445 PolarHBondContact O-N 3.35Å; L443-I446 PolarHBondContact O-N 3.38Å; L443-I446 VanDerWaalsContact O-N 3.16Å; L443-L447 HydrophobicContact CD1-CD1 4.33Å; L443-L447 HydrophobicContact CD1-CG 4.24Å; L443-L447 HydrophobicContact CG-CD1 4.09Å; L443-L447 HydrophobicContact CG-CG 4.44Å; L443-L447 WeakPolarHBondContact O-CB 3.21Å; L443-L447 WeakPolarHBondContact O-CG 3.33Å; L443-L447 PolarHBondContact O-N 3.43Å
444	G	93.3	Very high	91.4	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.4	-37.2	175.6	0	0	0	0	0	112.8	H313 V440 Q441 L442 L448	H313-G444 PolarHBondContact CE1-O 3.46Å; H313-G444 WeakPolarHBondContact NE2-CA 3.46Å; V440-G444 PolarHBondContact O-N 2.83Å; Q441-G444 PolarHBondContact O-N 3.05Å; L442-G444 PolarHBondContact O-N 3.24Å; G444-L448 WeakPolarHBondContact O-CB 3.45Å; G444-L448 PolarHBondContact O-N 2.84Å
445	F	91.3	Very high	90.6	Very high	59 Å²	59	57 Å²	57	26%	0.259	29%	0.29	S	S	.	.	H	α-helix	trans	-67	-42.1	174	179.7	-99.1	0	0	0	112.2	H313 Q441 L442 L443 L448 Q449	H313-F445 PolarHBondContact NE2-N 2.7Å; Q441-F445 PolarHBondContact O-N 3.23Å; L442-F445 WeakPolarHBondContact O-CB 3.31Å; L442-F445 PolarHBondContact O-N 2.69Å; L442-F445 VanDerWaalsContact O-N 3.16Å; L443-F445 VanDerWaalsContact C-N 3.28Å; L443-F445 PolarHBondContact O-N 3.35Å; F445-L448 WeakPolarHBondContact O-CB 3.44Å; F445-L448 PolarHBondContact O-N 3.06Å; F445-Q449 HydrophobicContact CD1-CG 4.47Å; F445-Q449 HydrophobicContact CE1-CG 4.14Å; F445-Q449 VanDerWaalsContact CE2-NE2 3.3Å; F445-Q449 HydrophobicContact CZ-CG 4.38Å; F445-Q449 WeakPolarHBondContact O-CG 3.49Å; F445-Q449 PolarHBondContact O-N 2.87Å
446	I	92.8	Very high	89.3	Confident	83 Å²	83	54.3 Å²	54.3	43%	0.426	28%	0.279	S	S	.	.	H	α-helix	trans	-62.2	-45.8	174.8	-67.4	164.2	0	0	0	110.6	L442 L443 L448 Q449 I450	L442-I446 HydrophobicContact CD1-CD1 4.44Å; L442-I446 HydrophobicContact CG-CD1 4.13Å; L442-I446 WeakPolarHBondContact O-CG1 3.15Å; L442-I446 PolarHBondContact O-N 3.26Å; L443-I446 PolarHBondContact O-N 3.38Å; L443-I446 VanDerWaalsContact O-N 3.16Å; I446-L448 VanDerWaalsContact C-N 3.29Å; I446-L448 PolarHBondContact O-N 2.86Å; I446-Q449 PolarHBondContact O-N 3.26Å; I446-Q449 VanDerWaalsContact O-N 3.11Å; I446-I450 HydrophobicContact CG2-CD1 4.01Å; I446-I450 WeakPolarHBondContact O-CG1 3.43Å; I446-I450 PolarHBondContact O-N 2.74Å
447	L	93.7	Very high	87.5	Confident	37 Å²	37	60.6 Å²	60.6	19%	0.194	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-38.5	174.8	-69.5	172.4	0	0	0	111.8	L305 I309 I312 L443 I450 Y451	L305-L447 HydrophobicContact CD1-CB 4.34Å; L305-L447 HydrophobicContact CD1-CD2 4.13Å; I309-L447 HydrophobicContact CD1-CB 4.29Å; I309-L447 HydrophobicContact CG1-CB 3.76Å; I312-L447 HydrophobicContact CD1-CD1 3.87Å; L443-L447 HydrophobicContact CD1-CD1 4.33Å; L443-L447 HydrophobicContact CD1-CG 4.24Å; L443-L447 HydrophobicContact CG-CD1 4.09Å; L443-L447 HydrophobicContact CG-CG 4.44Å; L443-L447 WeakPolarHBondContact O-CB 3.21Å; L443-L447 WeakPolarHBondContact O-CG 3.33Å; L443-L447 PolarHBondContact O-N 3.43Å; L447-I450 PolarHBondContact O-N 3Å; L447-Y451 PolarHBondContact O-N 3.06Å
448	L	89.6	Confident	85.4	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-40.7	173.1	179.7	62.9	0	0	0	112.5	I309 Y400 Y404 G444 F445 I446 Y451 L452	I309-L448 HydrophobicContact CD1-CB 4.38Å; I309-L448 HydrophobicContact CG2-CB 4.05Å; I309-L448 HydrophobicContact CG2-CD1 4.33Å; Y400-L448 HydrophobicContact CD1-CD2 4.32Å; Y404-L448 HydrophobicContact CD2-CD2 3.51Å; Y404-L448 HydrophobicContact CE1-CD2 4.4Å; Y404-L448 HydrophobicContact CE2-CD2 3.31Å; Y404-L448 HydrophobicContact CG-CD2 4.15Å; G444-L448 WeakPolarHBondContact O-CB 3.45Å; G444-L448 PolarHBondContact O-N 2.84Å; F445-L448 WeakPolarHBondContact O-CB 3.44Å; F445-L448 PolarHBondContact O-N 3.06Å; I446-L448 VanDerWaalsContact C-N 3.29Å; I446-L448 PolarHBondContact O-N 2.86Å; L448-Y451 HydrophobicContact CD1-CD1 4.33Å; L448-Y451 PolarHBondContact O-N 3.32Å; L448-L452 HydrophobicContact CD1-CD1 4.35Å; L448-L452 HydrophobicContact CD1-CG 4.29Å; L448-L452 HydrophobicContact CG-CD1 4.18Å; L448-L452 WeakPolarHBondContact O-CB 3.49Å; L448-L452 VanDerWaalsContact O-CG 3.29Å; L448-L452 WeakPolarHBondContact O-CG 3.45Å; L448-L452 PolarHBondContact O-N 3.24Å
449	Q	88.9	Confident	83.1	Confident	68 Å²	68	73.1 Å²	73.1	32%	0.318	35%	0.353	S	S	.	.	H	α-helix	trans	-65.4	-38.9	173.7	-58.7	-49.3	-30	0	0	111.8	F445 I446 L452 Y453	F445-Q449 HydrophobicContact CD1-CG 4.47Å; F445-Q449 HydrophobicContact CE1-CG 4.14Å; F445-Q449 VanDerWaalsContact CE2-NE2 3.3Å; F445-Q449 HydrophobicContact CZ-CG 4.38Å; F445-Q449 WeakPolarHBondContact O-CG 3.49Å; F445-Q449 PolarHBondContact O-N 2.87Å; I446-Q449 PolarHBondContact O-N 3.26Å; I446-Q449 VanDerWaalsContact O-N 3.11Å; Q449-L452 PolarHBondContact O-N 2.98Å; Q449-Y453 VanDerWaalsContact O-CB 3.29Å; Q449-Y453 WeakPolarHBondContact O-CB 3.31Å; Q449-Y453 PolarHBondContact O-N 3.09Å
450	I	90.1	Very high	80.5	Confident	84 Å²	84	74.9 Å²	74.9	43%	0.431	35%	0.353	S	S	.	.	H	α-helix	trans	-61.9	-44.3	173.8	-67.3	165.9	0	0	0	110.7	L305 I446 L447 Y453 A454	L305-I450 HydrophobicContact CD2-CG2 4.45Å; I446-I450 HydrophobicContact CG2-CD1 4.01Å; I446-I450 WeakPolarHBondContact O-CG1 3.43Å; I446-I450 PolarHBondContact O-N 2.74Å; L447-I450 PolarHBondContact O-N 3Å; I450-Y453 PolarHBondContact O-N 2.89Å; I450-A454 WeakPolarHBondContact O-CB 3.38Å; I450-A454 PolarHBondContact O-N 2.95Å
451	Y	88	Confident	77.6	Confident	6 Å²	6	82.8 Å²	82.8	2%	0.024	38%	0.383	C	S	.	.	H	α-helix	trans	-60.8	-46.6	174.7	171.8	-100.2	0	0	0	112.1	Y280 V298 G302 L305 L306 I309 L447 L448 Y453 Y455 S456	Y280-Y451 WeakPolarHBondContact CE1-OH 3.26Å; V298-Y451 HydrophobicContact CG1-CE2 4.5Å; G302-Y451 VanDerWaalsContact O-CE2 3.3Å; G302-Y451 WeakPolarHBondContact O-CE2 3.48Å; L305-Y451 HydrophobicContact CD2-CD2 4.33Å; L306-Y451 HydrophobicContact CB-CD2 4.4Å; L306-Y451 HydrophobicContact CB-CE2 4.05Å; L306-Y451 HydrophobicContact CD1-CD1 4.31Å; L306-Y451 HydrophobicContact CD1-CE1 3.95Å; I309-Y451 HydrophobicContact CD1-CG 4.27Å; L447-Y451 PolarHBondContact O-N 3.06Å; L448-Y451 HydrophobicContact CD1-CD1 4.33Å; L448-Y451 PolarHBondContact O-N 3.32Å; Y451-Y453 VanDerWaalsContact C-N 3.3Å; Y451-Y453 PolarHBondContact O-N 3.46Å; Y451-Y455 AromaticContact CD2-CD2 3.79Å; Y451-Y455 HydrophobicContact CD2-CD2 3.79Å; Y451-Y455 HydrophobicContact CD2-CG 4.22Å; Y451-Y455 HydrophobicContact CE2-CD2 4.34Å; Y451-Y455 HydrophobicContact CE2-CG 4.36Å; Y451-Y455 WeakPolarHBondContact O-CB 3.4Å; Y451-Y455 PolarHBondContact O-N 2.94Å; Y451-S456 PolarHBondContact O-N 3.43Å
452	L	83.1	Confident	75.1	Confident	10 Å²	10	84.7 Å²	84.7	5%	0.052	40%	0.395	C	S	.	.	H	α-helix	trans	-65.2	-32.5	177.6	-71.3	174	0	0	0	112.2	R397 L448 Q449 S456	R397-L452 PolarHBondContact NH2-O 3.45Å; L448-L452 HydrophobicContact CD1-CD1 4.35Å; L448-L452 HydrophobicContact CD1-CG 4.29Å; L448-L452 HydrophobicContact CG-CD1 4.18Å; L448-L452 WeakPolarHBondContact O-CB 3.49Å; L448-L452 VanDerWaalsContact O-CG 3.29Å; L448-L452 WeakPolarHBondContact O-CG 3.45Å; L448-L452 PolarHBondContact O-N 3.24Å; Q449-L452 PolarHBondContact O-N 2.98Å; L452-S456 WeakPolarHBondContact O-CB 3.48Å; L452-S456 PolarHBondContact O-OG 2.97Å
453	Y	81.5	Confident	72.6	Confident	168 Å²	168	85.7 Å²	85.7	66%	0.659	41%	0.405	S	S	*	.	H	α-helix	trans	-74.9	-53.4	176.2	-176.4	-94.7	0	0	0	112.3	Q449 I450 Y451	Q449-Y453 VanDerWaalsContact O-CB 3.29Å; Q449-Y453 WeakPolarHBondContact O-CB 3.31Å; Q449-Y453 PolarHBondContact O-N 3.09Å; I450-Y453 PolarHBondContact O-N 2.89Å; Y451-Y453 VanDerWaalsContact C-N 3.3Å; Y451-Y453 PolarHBondContact O-N 3.46Å
454	A	84.9	Confident	70	Confident	62 Å²	62	89.7 Å²	89.7	51%	0.512	43%	0.425	S	S	.	.	H	α-helix	trans	-81.2	-39.7	-171	0	0	0	0	0	114	I450	I450-A454 WeakPolarHBondContact O-CB 3.38Å; I450-A454 PolarHBondContact O-N 2.95Å
455	Y	77.7	Confident	67.6	Low	89 Å²	89	94.1 Å²	94.1	35%	0.349	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-28.9	-171.7	-66.8	-70.9	0	0	0	114.2	H299 L305 Y451 K457	H299-Y455 HydrophobicContact CB-CD1 4.31Å; H299-Y455 HydrophobicContact CB-CE1 4.13Å; L305-Y455 HydrophobicContact CD2-CD2 4.1Å; L305-Y455 HydrophobicContact CD2-CE2 3.84Å; Y451-Y455 AromaticContact CD2-CD2 3.79Å; Y451-Y455 HydrophobicContact CD2-CD2 3.79Å; Y451-Y455 HydrophobicContact CD2-CG 4.22Å; Y451-Y455 HydrophobicContact CE2-CD2 4.34Å; Y451-Y455 HydrophobicContact CE2-CG 4.36Å; Y451-Y455 WeakPolarHBondContact O-CB 3.4Å; Y451-Y455 PolarHBondContact O-N 2.94Å; Y455-K457 PolarHBondContact O-N 3.22Å
456	S	68	Low	65.2	Low	27 Å²	27	92.6 Å²	92.6	19%	0.189	46%	0.456	C	S	.	.			trans	-77.9	89.7	-179.5	88.9	0	0	0	0	111.9	R397 Y451 L452 S458	R397-S456 PolarHBondContact NE-OG 3.27Å; R397-S456 PolarHBondContact NH2-O 3.47Å; R397-S456 PolarHBondContact NH2-OG 2.96Å; Y451-S456 PolarHBondContact O-N 3.43Å; L452-S456 WeakPolarHBondContact O-CB 3.48Å; L452-S456 PolarHBondContact O-OG 2.97Å; S456-S458 PolarHBondContact O-N 2.72Å
457	K	56.7	Low	62.7	Low	206 Å²	206	94.5 Å²	94.5	90%	0.896	47%	0.467	S	S	*	.			trans	-65.8	41.2	176.5	-79.8	-173.2	173	177.6	0	114.8	Y455 R459	Y455-K457 PolarHBondContact O-N 3.22Å; K457-R459 PolarHBondContact O-N 2.98Å
458	S	49.4	Very low	60.2	Low	63 Å²	63	95.3 Å²	95.3	44%	0.441	47%	0.474	S	S	.	.			trans	-64.3	122.7	164.7	-175.3	0	0	0	0	109.1	S456 R460	S456-S458 PolarHBondContact O-N 2.72Å; S458-R460 PolarHBondContact O-N 3.47Å
459	R	44.3	Very low	57.7	Low	256 Å²	256	104.2 Å²	104.2	97%	0.966	51%	0.514	S	S	*	.	S	Bend	trans	-63.6	14.7	-177.1	-96.6	-175.6	175	-175	-1.3	115.6	K457	K457-R459 PolarHBondContact O-N 2.98Å
460	R	41.6	Very low	55.3	Low	140 Å²	140	106.7 Å²	106.7	53%	0.528	53%	0.527	S	S	.	.	S	Bend	trans	-114.2	118	-176.4	-59.1	-177.1	-174.9	-176.8	0.3	109	S458 T462	S458-R460 PolarHBondContact O-N 3.47Å; R460-T462 PolarHBondContact O-N 3.27Å
461	K	35.2	Very low	53	Low	212 Å²	212	110.2 Å²	110.2	92%	0.922	54%	0.541	S	S	*	.			trans	-56.8	106.6	173.5	-65	-177.9	179.3	-176.7	0	108.8
462	T	40.8	Very low	50.8	Low	45 Å²	45	118.3 Å²	118.3	28%	0.276	58%	0.576	S	S	.	*			trans	-91.1	130.4	169	29.6	0	0	0	0	109.6	R397 R460 C468	R397-T462 PolarHBondContact NH1-OG1 3.13Å; R460-T462 PolarHBondContact O-N 3.27Å; T462-C468 HydrophobicContact CG2-CB 4.38Å
463	T	39.4	Very low	49.1	Very low	96 Å²	96	121.3 Å²	121.3	59%	0.589	60%	0.598	S	S	*	*			trans	-69.8	159.7	161.3	55.7	0	0	0	0	109.5	C465 G466 C468	T463-C465 PolarHBondContact O-N 3.43Å; T463-G466 PolarHBondContact O-N 2.64Å; T463-C468 PolarHBondContact N-SG 3.39Å; T463-C468 VanDerWaalsContact N-SG 3.41Å; T463-C468 PolarHBondContact OG1-SG 3.4Å
464	L	40.1	Very low	47.2	Very low	169 Å²	169	120.3 Å²	120.3	89%	0.885	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-22.3	-173.5	-150.3	81.8	0	0	0	113.9	G466	L464-G466 PolarHBondContact O-N 2.92Å
465	C	43.2	Very low	45.2	Very low	92 Å²	92	124.4 Å²	124.4	62%	0.622	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	0.1	-172.5	-157.2	0	0	0	0	114.5	T463 L467	T463-C465 PolarHBondContact O-N 3.43Å; C465-L467 PolarHBondContact O-N 3.12Å
466	G	40.7	Very low	43.6	Very low	27 Å²	27	126.6 Å²	126.6	28%	0.278	63%	0.627	S	S	.	*	S	Bend	trans	70.4	-25.6	174.6	0	0	0	0	0	116.9	T463 L464 C468	T463-G466 PolarHBondContact O-N 2.64Å; L464-G466 PolarHBondContact O-N 2.92Å; G466-C468 PolarHBondContact O-N 3.48Å
467	L	40.5	Very low	42.2	Very low	124 Å²	124	129 Å²	129	65%	0.649	64%	0.643	S	S	*	*			trans	-73.9	37.7	-178.4	-69.1	166.8	0	0	0	114.2	C465 F469	C465-L467 PolarHBondContact O-N 3.12Å; L467-F469 PolarHBondContact O-N 2.94Å
468	C	39.8	Very low	42	Very low	53 Å²	53	125.1 Å²	125.1	36%	0.358	63%	0.63	S	S	.	*			trans	-73.8	97.3	173.1	-63.5	0	0	0	0	110.2	T462 T463 G466	T462-C468 HydrophobicContact CG2-CB 4.38Å; T463-C468 PolarHBondContact N-SG 3.39Å; T463-C468 VanDerWaalsContact N-SG 3.41Å; T463-C468 PolarHBondContact OG1-SG 3.4Å; G466-C468 PolarHBondContact O-N 3.48Å
469	F	38	Very low	41.9	Very low	192 Å²	192	131.8 Å²	131.8	84%	0.842	65%	0.646	S	S	*	*			trans	-46.2	156.8	170.7	-79.7	-97.5	0	0	0	112.8	L467 H471	L467-F469 PolarHBondContact O-N 2.94Å; F469-H471 PolarHBondContact O-N 3.05Å
470	M	38.6	Very low	42.1	Very low	120 Å²	120	126.3 Å²	126.3	59%	0.591	63%	0.631	S	S	*	*			trans	-57.3	107.1	174.8	-83.6	-161.5	69.5	0	0	111.2	Y395 K472	Y395-M470 HydrophobicContact CE1-CE 4.01Å; Y395-M470 HydrophobicContact CE1-SD 4.32Å; Y395-M470 WeakPolarHBondContact OH-CE 3.45Å; M470-K472 VanDerWaalsContact C-N 3.35Å; M470-K472 PolarHBondContact O-N 3.18Å
471	H	41.5	Very low	42.6	Very low	157 Å²	157	126.6 Å²	126.6	73%	0.727	64%	0.638	S	S	*	*			trans	-61.6	105.2	153.9	-168.8	-48.9	0	0	0	107	F469 S473	F469-H471 PolarHBondContact O-N 3.05Å; H471-S473 PolarHBondContact O-N 3.34Å
472	K	42.6	Very low	43.4	Very low	176 Å²	176	123 Å²	123	77%	0.765	63%	0.625	S	S	*	*			trans	-55.1	106.4	171.6	-173.3	173.4	-177.2	176.3	0	107.2	M470 I474	M470-K472 VanDerWaalsContact C-N 3.35Å; M470-K472 PolarHBondContact O-N 3.18Å; K472-I474 PolarHBondContact O-N 3.24Å
473	S	45.7	Very low	43.8	Very low	73 Å²	73	126.9 Å²	126.9	51%	0.51	64%	0.64	S	S	.	*			trans	-70.9	110.4	173.8	44.4	0	0	0	0	107.1	H471 E475	H471-S473 PolarHBondContact O-N 3.34Å; S473-E475 PolarHBondContact O-N 3.37Å
474	I	42.3	Very low	44.4	Very low	148 Å²	148	125.1 Å²	125.1	76%	0.759	63%	0.632	S	S	*	*			trans	-65.2	106.3	168.5	-61.9	173.4	0	0	0	105.9	K472 I476	K472-I474 PolarHBondContact O-N 3.24Å; I474-I476 PolarHBondContact O-N 3.3Å
475	E	44.2	Very low	45	Very low	147 Å²	147	120.8 Å²	120.8	69%	0.687	61%	0.612	S	S	*	*			trans	-68.7	99.5	174.6	-69.2	-177.5	151.6	0	0	108.3	S473 P477	S473-E475 PolarHBondContact O-N 3.37Å; E475-P477 WeakPolarHBondContact O-CD 3.49Å
476	I	42.2	Very low	45.4	Very low	135 Å²	135	120.2 Å²	120.2	69%	0.692	61%	0.605	S	S	*	*			trans	-66.4	117.8	168.1	-58.7	176.6	0	0	0	106.4	I474 I478	I474-I476 PolarHBondContact O-N 3.3Å; I476-I478 PolarHBondContact O-N 3.34Å; I476-I478 VanDerWaalsContact O-N 3.07Å
477	P	39.3	Very low	45.9	Very low	79 Å²	79	125.3 Å²	125.3	51%	0.513	62%	0.622	S	S	.	*			trans	-69.8	111	-170.4	26.3	-33.9	0	0	0	111.1	E475 R479 Q480	E475-P477 WeakPolarHBondContact O-CD 3.49Å; P477-R479 PolarHBondContact O-N 3.19Å; P477-Q480 PolarHBondContact O-N 3.11Å
478	I	52	Low	46.3	Very low	123 Å²	123	125.9 Å²	125.9	63%	0.631	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-19.7	-176.8	-65.5	172.3	0	0	0	113.3	I476 Q480 Q481 Q482	I476-I478 PolarHBondContact O-N 3.34Å; I476-I478 VanDerWaalsContact O-N 3.07Å; I478-Q480 PolarHBondContact O-N 2.76Å; I478-Q480 VanDerWaalsContact O-N 3.13Å; I478-Q481 PolarHBondContact O-N 3.25Å; I478-Q482 PolarHBondContact O-N 3.11Å
479	R	47.8	Very low	46.9	Very low	203 Å²	203	129.8 Å²	129.8	77%	0.766	63%	0.634	S	S	*	*	H	α-helix	trans	-46.8	-39.9	172.4	-72.2	-173	175.6	-176.9	-0.6	113.4	P477 Q481 Q482 Q483	P477-R479 PolarHBondContact O-N 3.19Å; R479-Q481 PolarHBondContact O-N 3.46Å; R479-Q482 PolarHBondContact O-N 3.05Å; R479-Q483 PolarHBondContact O-N 3.43Å
480	Q	49.6	Very low	47.5	Very low	141 Å²	141	126.8 Å²	126.8	66%	0.659	62%	0.623	S	S	*	*	H	α-helix	trans	-66.9	-34.3	-179.5	-74.8	-174.8	-27.9	0	0	113.3	P477 I478 S484	P477-Q480 PolarHBondContact O-N 3.11Å; I478-Q480 PolarHBondContact O-N 2.76Å; I478-Q480 VanDerWaalsContact O-N 3.13Å; Q480-S484 PolarHBondContact O-N 2.95Å
481	Q	51.5	Low	48	Very low	147 Å²	147	124.6 Å²	124.6	69%	0.687	62%	0.619	S	S	*	*	H	α-helix	trans	-76	-26.9	175.3	-83.1	-171	-26.3	0	0	113.4	I478 R479 S484	I478-Q481 PolarHBondContact O-N 3.25Å; R479-Q481 PolarHBondContact O-N 3.46Å; Q481-S484 PolarHBondContact O-OG 3.03Å; Q481-S484 VanDerWaalsContact O-OG 3.11Å
482	Q	51.2	Low	48.3	Very low	137 Å²	137	124.1 Å²	124.1	64%	0.64	62%	0.621	S	S	*	*	H	α-helix	trans	-78.4	-33.5	173.4	-78.8	-174.9	-30.8	0	0	112.6	I478 R479 V486	I478-Q482 PolarHBondContact O-N 3.11Å; R479-Q482 PolarHBondContact O-N 3.05Å; Q482-V486 WeakPolarHBondContact O-CG2 3.35Å; Q482-V486 PolarHBondContact O-N 2.87Å
483	Q	50.7	Low	48.5	Very low	126 Å²	126	121.3 Å²	121.3	59%	0.589	62%	0.619	S	S	*	*	H	α-helix	trans	-68.2	-37.9	176	-75	-179.3	-75.7	0	0	112.9	R479 V485 V486 Q487	R479-Q483 PolarHBondContact O-N 3.43Å; Q483-V485 PolarHBondContact O-N 3.17Å; Q483-V486 PolarHBondContact O-N 3.37Å; Q483-Q487 PolarHBondContact O-N 3.26Å
484	S	50.2	Low	48.4	Very low	59 Å²	59	120.6 Å²	120.6	41%	0.413	62%	0.623	S	S	.	*	H	α-helix	trans	-62.8	-42.5	178.2	60.5	0	0	0	0	112.8	Q480 Q481 V486 Q487 Q488	Q480-S484 PolarHBondContact O-N 2.95Å; Q481-S484 PolarHBondContact O-OG 3.03Å; Q481-S484 VanDerWaalsContact O-OG 3.11Å; S484-V486 PolarHBondContact O-N 3.01Å; S484-Q487 PolarHBondContact O-N 3.18Å; S484-Q488 VanDerWaalsContact O-CB 3.3Å; S484-Q488 WeakPolarHBondContact O-CB 3.39Å; S484-Q488 PolarHBondContact O-N 3.2Å
485	V	53.5	Low	48.4	Very low	78 Å²	78	121.5 Å²	121.5	47%	0.473	63%	0.628	S	S	.	*	H	α-helix	trans	-65.5	-37.8	177.9	177.7	0	0	0	0	111.9	Q483 Q488 Q489	Q483-V485 PolarHBondContact O-N 3.17Å; V485-Q488 PolarHBondContact O-N 3.39Å; V485-Q489 PolarHBondContact O-N 3.14Å; V485-Q489 VanDerWaalsContact O-N 3.1Å
486	V	52	Low	48.2	Very low	79 Å²	79	124.1 Å²	124.1	48%	0.479	64%	0.638	S	S	.	*	H	α-helix	trans	-68.2	-44.5	177.3	173.2	0	0	0	0	111.4	Q482 Q483 S484 Q488 Q489 Q490	Q482-V486 WeakPolarHBondContact O-CG2 3.35Å; Q482-V486 PolarHBondContact O-N 2.87Å; Q483-V486 PolarHBondContact O-N 3.37Å; S484-V486 PolarHBondContact O-N 3.01Å; V486-Q488 VanDerWaalsContact C-N 3.33Å; V486-Q488 PolarHBondContact O-N 3.06Å; V486-Q489 PolarHBondContact O-N 3.44Å; V486-Q490 WeakPolarHBondContact O-CG 3.3Å; V486-Q490 PolarHBondContact O-N 3Å
487	Q	50.5	Low	47.8	Very low	134 Å²	134	129.5 Å²	129.5	63%	0.626	65%	0.649	S	S	*	*	H	α-helix	trans	-64.6	-37.5	176	-73.9	-177.1	-51.7	0	0	112.2	Q483 S484 Q489 Q490 S491	Q483-Q487 PolarHBondContact O-N 3.26Å; S484-Q487 PolarHBondContact O-N 3.18Å; Q487-Q489 VanDerWaalsContact C-N 3.3Å; Q487-Q489 PolarHBondContact O-N 3.25Å; Q487-Q490 PolarHBondContact O-N 3.08Å; Q487-S491 PolarHBondContact O-N 3.07Å; Q487-S491 PolarHBondContact O-OG 3.43Å
488	Q	50.1	Low	47.7	Very low	136 Å²	136	130.3 Å²	130.3	64%	0.636	66%	0.656	S	S	*	*	H	α-helix	trans	-71.9	-21	178.4	-161.7	169.8	25.3	0	0	113.5	S484 V485 V486 S491	S484-Q488 VanDerWaalsContact O-CB 3.3Å; S484-Q488 WeakPolarHBondContact O-CB 3.39Å; S484-Q488 PolarHBondContact O-N 3.2Å; V485-Q488 PolarHBondContact O-N 3.39Å; V486-Q488 VanDerWaalsContact C-N 3.33Å; V486-Q488 PolarHBondContact O-N 3.06Å; Q488-S491 PolarHBondContact O-OG 3.19Å
489	Q	51.1	Low	47.1	Very low	135 Å²	135	133 Å²	133	63%	0.631	67%	0.666	S	S	*	*	H	α-helix	trans	-82.9	-36.9	168.7	-74.8	-173.3	-28	0	0	112.7	V485 V486 Q487 L492 T493	V485-Q489 PolarHBondContact O-N 3.14Å; V485-Q489 VanDerWaalsContact O-N 3.1Å; V486-Q489 PolarHBondContact O-N 3.44Å; Q487-Q489 VanDerWaalsContact C-N 3.3Å; Q487-Q489 PolarHBondContact O-N 3.25Å; Q489-L492 PolarHBondContact O-N 3.05Å; Q489-T493 PolarHBondContact O-OG1 3.3Å
490	Q	51.6	Low	46.8	Very low	130 Å²	130	128.8 Å²	128.8	61%	0.607	67%	0.668	S	S	*	*	H	α-helix	trans	-66.7	-39.2	177.9	-74.7	-179.9	-37	0	0	112.6	V486 Q487 L492 T493	V486-Q490 WeakPolarHBondContact O-CG 3.3Å; V486-Q490 PolarHBondContact O-N 3Å; Q487-Q490 PolarHBondContact O-N 3.08Å; Q490-L492 VanDerWaalsContact C-N 3.33Å; Q490-L492 PolarHBondContact O-N 3.39Å; Q490-T493 PolarHBondContact O-N 3.5Å; Q490-T493 PolarHBondContact O-OG1 3.3Å
491	S	48.3	Very low	46	Very low	74 Å²	74	129.9 Å²	129.9	52%	0.517	68%	0.678	S	S	.	*	H	α-helix	trans	-64.7	-34.3	175.7	57.9	0	0	0	0	113.1	Q487 Q488 T493 G494	Q487-S491 PolarHBondContact O-N 3.07Å; Q487-S491 PolarHBondContact O-OG 3.43Å; Q488-S491 PolarHBondContact O-OG 3.19Å; S491-T493 PolarHBondContact O-N 3.27Å; S491-G494 PolarHBondContact O-N 3.15Å
492	L	48.6	Very low	45.4	Very low	147 Å²	147	132.9 Å²	132.9	77%	0.77	69%	0.689	S	S	*	*	H	α-helix	trans	-71.2	-14.5	177.8	-126.7	73.7	0	0	0	114.1	Q489 Q490	Q489-L492 PolarHBondContact O-N 3.05Å; Q490-L492 VanDerWaalsContact C-N 3.33Å; Q490-L492 PolarHBondContact O-N 3.39Å
493	T	46.4	Very low	44.7	Very low	117 Å²	117	133.8 Å²	133.8	72%	0.718	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-2.6	178.4	50.7	0	0	0	0	114.8	Q489 Q490 S491	Q489-T493 PolarHBondContact O-OG1 3.3Å; Q490-T493 PolarHBondContact O-N 3.5Å; Q490-T493 PolarHBondContact O-OG1 3.3Å; S491-T493 PolarHBondContact O-N 3.27Å
494	G	42.3	Very low	44	Very low	57 Å²	57	137.8 Å²	137.8	59%	0.588	71%	0.709	S	S	*	*			trans	-81.5	-20.4	-178.2	0	0	0	0	0	115.6	S491 K496	S491-G494 PolarHBondContact O-N 3.15Å; G494-K496 VanDerWaalsContact C-N 3.34Å; G494-K496 PolarHBondContact O-N 3.48Å
495	L	42.3	Very low	43.3	Very low	167 Å²	167	141.2 Å²	141.2	87%	0.874	72%	0.723	S	S	*	*			trans	-86.1	60.2	-170.6	-83.2	162.1	0	0	0	113.8
496	K	41.1	Very low	42.5	Very low	203 Å²	203	147.8 Å²	147.8	88%	0.883	74%	0.739	S	S	*	*			trans	-156.7	69.7	163	-148.4	177	-174.2	-173	0	114.1	G494	G494-K496 VanDerWaalsContact C-N 3.34Å; G494-K496 PolarHBondContact O-N 3.48Å
497	R	33.4	Very low	41.8	Very low	248 Å²	248	150.7 Å²	150.7	94%	0.936	75%	0.752	S	S	*	*			trans	-143.1	88.8	175.8	-169.3	-179.6	-170.5	176.5	3.4	112
498	S	37.6	Very low	41.3	Very low	95 Å²	95	149 Å²	149	66%	0.664	76%	0.755	S	S	*	*			trans	-154	126	174.9	52.3	0	0	0	0	111.7
499	E	39.3	Very low	40.8	Very low	180 Å²	180	149 Å²	149	84%	0.841	76%	0.76	S	S	*	*			trans	72.4	155.2	151	-68.9	150.6	-147	0	0	122
500	S	41.1	Very low	40.4	Very low	115 Å²	115	149.4 Å²	149.4	80%	0.804	77%	0.766	S	S	*	*			trans	58	113.5	-168	62.1	0	0	0	0	114.6
501	L	34	Very low	40	Very low	163 Å²	163	147.9 Å²	147.9	85%	0.853	77%	0.765	S	S	*	*			cis	59.9	96.4	34.2	-66.4	170.8	0	0	0	114.9
502	F	38.8	Very low	39.7	Very low	211 Å²	211	150.7 Å²	150.7	93%	0.925	78%	0.775	S	S	*	*				-162.3	146.9	117.5	-117.2	-79.9	0	0	0	111.1
503	N	36.5	Very low	39.4	Very low	156 Å²	156	151 Å²	151	83%	0.834	78%	0.777	S	S	*	*			trans	-93.8	142.6	176.5	-87.5	-29.1	0	0	0	111.4
504	Y	35.2	Very low	39	Very low	209 Å²	209	148.1 Å²	148.1	82%	0.82	77%	0.771	S	S	*	*			trans	-148.7	145.5	139.8	-148.4	-98.1	0	0	0	111.4
505	N	34.9	Very low	39	Very low	131 Å²	131	151 Å²	151	70%	0.701	78%	0.782	S	S	*	*			trans	-142.2	134	-173.3	176.7	15.2	0	0	0	109.2
506	R	37.9	Very low	38.8	Very low	217 Å²	217	150.8 Å²	150.8	82%	0.819	78%	0.781	S	S	*	*			trans	-155.9	119.6	166.6	-148	170.1	-171.7	159.8	4	113.2
507	N	36.7	Very low	38.9	Very low	140 Å²	140	146 Å²	146	75%	0.749	77%	0.77	S	S	*	*			trans	-73.9	160.9	165.2	-65.5	-27.9	0	0	0	111
508	S	40.1	Very low	39.2	Very low	98 Å²	98	145.2 Å²	145.2	69%	0.685	77%	0.768	S	S	*	*				168.1	113	109.7	-166.3	0	0	0	0	114.3
509	N	40.3	Very low	39.2	Very low	137 Å²	137	145.6 Å²	145.6	73%	0.733	77%	0.766	S	S	*	*			trans	64.5	151.2	134.8	-60.8	4.1	0	0	0	124.9
510	N	42	Very low	39.2	Very low	142 Å²	142	143.4 Å²	143.4	76%	0.759	76%	0.76	S	S	*	*			trans	78.9	137	147.9	-78.2	18.5	0	0	0	121
511	T	42.1	Very low	39.1	Very low	98 Å²	98	142.5 Å²	142.5	60%	0.601	75%	0.754	S	S	*	*			cis	-169.3	155.8	-19.7	7.2	0	0	0	0	111.1
512	N	43.2	Very low	39.4	Very low	133 Å²	133	141.8 Å²	141.8	71%	0.711	75%	0.751	S	S	*	*			trans	66.1	154.1	158.4	-54	-17.6	0	0	0	117.8
513	N	42.8	Very low	39.5	Very low	154 Å²	154	139.3 Å²	139.3	82%	0.824	75%	0.745	S	S	*	*			cis	-167.4	168.6	-24.1	-94.9	-19.4	0	0	0	107.2
514	G	38.2	Very low	39.7	Very low	57 Å²	57	136.8 Å²	136.8	59%	0.588	74%	0.737	S	S	*	*			cis	167.2	155.9	-5.5	0	0	0	0	0	111.6
515	S	40.6	Very low	39.9	Very low	118 Å²	118	136.3 Å²	136.3	83%	0.825	74%	0.74	S	S	*	*			trans	61.6	141.5	176	46.1	0	0	0	0	119.1
516	L	38.4	Very low	39.8	Very low	162 Å²	162	134.6 Å²	134.6	85%	0.848	74%	0.738	S	S	*	*			cis	113.7	153.7	19.6	-104.6	76.1	0	0	0	111.7
517	P	44.6	Very low	39.9	Very low	101 Å²	101	135.1 Å²	135.1	66%	0.656	74%	0.742	S	S	*	*				-140.8	177.9	-57	38.1	-19	0	0	0	115.5
518	R	38.2	Very low	39.8	Very low	233 Å²	233	134.2 Å²	134.2	88%	0.879	74%	0.741	S	S	*	*			trans	66.4	161.4	158.6	-82.8	178.5	168	160.6	-3.5	116.9
519	T	37.9	Very low	39.7	Very low	103 Å²	103	137.8 Å²	137.8	63%	0.632	75%	0.753	S	S	*	*			cis	-148.4	165.7	4.7	-8.6	0	0	0	0	113
520	D	38.7	Very low	39.3	Very low	134 Å²	134	138.3 Å²	138.3	72%	0.717	76%	0.755	S	S	*	*			trans	60.5	104.2	145	-57.8	-27.2	0	0	0	125.5
521	S	39	Very low	39.1	Very low	96 Å²	96	139.5 Å²	139.5	67%	0.671	76%	0.761	S	S	*	*				93.3	151	114.8	80.2	0	0	0	0	123.2
522	N	41.2	Very low	38.6	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	77%	0.773	S	S	*	*			trans	88.2	146.3	157.8	-60.2	-40	0	0	0	121.5
523	I	40.9	Very low	38.3	Very low	158 Å²	158	147.6 Å²	147.6	81%	0.81	78%	0.778	S	S	*	*			trans	-156.3	162.8	-155.3	-55.8	168.2	0	0	0	106
524	P	40.9	Very low	38	Very low	103 Å²	103	149 Å²	149	67%	0.669	78%	0.78	S	S	*	*			cis	-120.9	-179	-35.5	34.7	-19	0	0	0	112.2
525	K	39.6	Very low	37.7	Very low	199 Å²	199	151 Å²	151	87%	0.865	79%	0.785	S	S	*	*				-177	161.9	117.8	-100.1	158.3	-172.2	172.9	0	114.5
526	S	32.8	Very low	37.4	Very low	96 Å²	96	152.3 Å²	152.3	67%	0.671	78%	0.783	S	S	*	*			trans	-78.6	151.2	179.7	52.4	0	0	0	0	113.7
527	Y	38.8	Very low	37.1	Very low	228 Å²	228	150.2 Å²	150.2	89%	0.894	78%	0.777	S	S	*	*			trans	-140.9	141.4	136.7	-91.1	-65.9	0	0	0	113.4
528	T	35.3	Very low	36.5	Very low	120 Å²	120	153.7 Å²	153.7	74%	0.736	79%	0.789	S	S	*	*			trans	-66.8	155.9	170.4	42	0	0	0	0	112.7
529	N	37.4	Very low	36	Very low	174 Å²	174	149.7 Å²	149.7	93%	0.93	78%	0.784	S	S	*	*			trans	-133.4	134.3	150.2	-114.4	-39.9	0	0	0	109.6
530	L	33.5	Very low	35.8	Very low	148 Å²	148	153.2 Å²	153.2	78%	0.775	79%	0.793	S	S	*	*			trans	-143.7	119.8	-174	-176.5	151.1	0	0	0	108	R532	L530-R532 HydrophobicContact CD2-CB 4.42Å
531	N	36.4	Very low	35.5	Very low	166 Å²	166	152 Å²	152	89%	0.888	80%	0.795	S	S	*	*			trans	-122.5	128.1	-177.1	-137.8	-15.7	0	0	0	109.9
532	R	31.4	Very low	35.1	Very low	224 Å²	224	158.8 Å²	158.8	85%	0.845	81%	0.807	S	S	*	*			trans	-138.4	100.6	-170.5	-179.3	-174.8	-176.7	-179.2	1.7	109.1	L530	L530-R532 HydrophobicContact CD2-CB 4.42Å
533	Q	36.9	Very low	34.8	Very low	178 Å²	178	157.3 Å²	157.3	83%	0.832	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-81.2	160.5	175.8	-87.1	-177.3	-34.1	0	0	113
534	Q	36.5	Very low	34.3	Very low	182 Å²	182	154.4 Å²	154.4	85%	0.85	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.4	161.8	-158.3	-66.5	132.7	-55.6	0	0	114.7
535	S	31.9	Very low	34.2	Very low	100 Å²	100	156.5 Å²	156.5	70%	0.699	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-80	156.7	161	50.8	0	0	0	0	111.7
536	N	35.3	Very low	34	Very low	145 Å²	145	153.2 Å²	153.2	78%	0.775	80%	0.796	S	S	*	*			trans	-161.1	151.3	132.8	-104.1	-13.4	0	0	0	114
537	T	31.5	Very low	34	Very low	118 Å²	118	155.3 Å²	155.3	72%	0.724	80%	0.799	S	S	*	*			trans	30.9	118.1	152.4	58.3	0	0	0	0	120.6
538	L	33.5	Very low	33.7	Very low	174 Å²	174	151.3 Å²	151.3	91%	0.911	79%	0.791	S	S	*	*				-167	152.6	101.2	-105	165.4	0	0	0	112.2
539	L	27.6	Very low	33.6	Very low	149 Å²	149	150.9 Å²	150.9	78%	0.78	78%	0.784	S	S	*	*			trans	-106.3	135	178.2	-158	83.6	0	0	0	107.8
540	H	32.4	Very low	33.7	Very low	178 Å²	178	149.5 Å²	149.5	82%	0.824	77%	0.767	S	S	*	*			trans	173.9	155.2	146.7	-99.4	-67.9	0	0	0	113.7
541	S	33.1	Very low	34	Very low	107 Å²	107	148.1 Å²	148.1	75%	0.748	77%	0.765	S	S	*	*			trans	54.1	109.2	161.4	58.1	0	0	0	0	120
542	Y	29.9	Very low	34.1	Very low	239 Å²	239	149.5 Å²	149.5	94%	0.937	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-89.2	132.3	154.3	-82.6	-94.1	0	0	0	110.5
543	P	34.8	Very low	34.3	Very low	118 Å²	118	143.2 Å²	143.2	77%	0.766	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-88.5	162.6	158.4	34.5	-30.7	0	0	0	111.6
544	S	31.1	Very low	34.7	Very low	97 Å²	97	139.7 Å²	139.7	68%	0.678	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-77	172.5	-172.9	75.6	0	0	0	0	114.8	D546	S544-D546 VanDerWaalsContact C-N 3.3Å; S544-D546 WeakPolarHBondContact CB-OD2 3.37Å; S544-D546 PolarHBondContact O-N 3.01Å; S544-D546 PolarHBondContact OG-OD2 3.41Å
545	I	38.7	Very low	34.6	Very low	147 Å²	147	140.5 Å²	140.5	75%	0.754	74%	0.74	S	S	*	*	S	Bend	trans	-82.6	-4.3	-166.8	-73.9	171.1	0	0	0	113.3	N547	I545-N547 VanDerWaalsContact C-N 3.35Å; I545-N547 PolarHBondContact O-N 3Å; I545-N547 VanDerWaalsContact O-N 3.13Å
546	D	34.7	Very low	34.8	Very low	129 Å²	129	144.7 Å²	144.7	69%	0.69	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	14.9	-156.4	-48.9	-69	0	0	0	116.2	S544	S544-D546 VanDerWaalsContact C-N 3.3Å; S544-D546 WeakPolarHBondContact CB-OD2 3.37Å; S544-D546 PolarHBondContact O-N 3.01Å; S544-D546 PolarHBondContact OG-OD2 3.41Å
547	N	33.6	Very low	35	Very low	140 Å²	140	143.5 Å²	143.5	75%	0.749	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.8	40.7	-172.9	-123.6	-46.9	0	0	0	116.4	I545 N549	I545-N547 VanDerWaalsContact C-N 3.35Å; I545-N547 PolarHBondContact O-N 3Å; I545-N547 VanDerWaalsContact O-N 3.13Å; N547-N549 PolarHBondContact O-N 3.26Å
548	M	32.2	Very low	35.5	Very low	145 Å²	145	145.2 Å²	145.2	71%	0.714	74%	0.74	S	S	*	*			trans	-73.8	69.3	170.6	-84	-159.8	-82.2	0	0	113.3	Y550	M548-Y550 HydrophobicContact CB-CD2 4.4Å; M548-Y550 HydrophobicContact CB-CE2 4.46Å; M548-Y550 PolarHBondContact O-N 2.97Å; M548-Y550 HydrophobicContact SD-CE2 4.3Å
549	N	33.6	Very low	36	Very low	111 Å²	111	142.8 Å²	142.8	59%	0.594	73%	0.728	S	S	*	*			trans	-77.8	84.2	176.5	-149.2	-25	0	0	0	110.8	N547 T551 K552	N547-N549 PolarHBondContact O-N 3.26Å; N549-T551 PolarHBondContact O-N 3.15Å; N549-K552 PolarHBondContact O-N 3.46Å
550	Y	39.5	Very low	36.7	Very low	145 Å²	145	136.6 Å²	136.6	57%	0.569	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	-15	-163.3	-109.7	-98	0	0	0	117.2	M548	M548-Y550 HydrophobicContact CB-CD2 4.4Å; M548-Y550 HydrophobicContact CB-CE2 4.46Å; M548-Y550 PolarHBondContact O-N 2.97Å; M548-Y550 HydrophobicContact SD-CE2 4.3Å
551	T	39.9	Very low	37.3	Very low	119 Å²	119	130.4 Å²	130.4	73%	0.73	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-16.7	-175.7	49	0	0	0	0	114.3	N549	N549-T551 PolarHBondContact O-N 3.15Å
552	K	38.5	Very low	37.9	Very low	194 Å²	194	127.9 Å²	127.9	84%	0.843	65%	0.647	S	S	*	*	S	Bend	trans	-102.1	1.6	-165.7	-141.7	174.1	-174.8	178.6	0	115.8	N549	N549-K552 PolarHBondContact O-N 3.46Å
553	S	36.1	Very low	38.8	Very low	93 Å²	93	116.8 Å²	116.8	65%	0.65	60%	0.604	S	S	*	*			trans	-109.4	4.7	-170.3	59.6	0	0	0	0	116	K555	S553-K555 VanDerWaalsContact C-N 3.25Å; S553-K555 PolarHBondContact O-N 3.29Å
554	I	44.2	Very low	39.1	Very low	104 Å²	104	114 Å²	114	53%	0.533	59%	0.586	S	S	.	*			trans	-76.1	74.9	177	-48.5	179.3	0	0	0	110.2	Y556	I554-Y556 PolarHBondContact O-N 3.36Å
555	K	34	Very low	39.8	Very low	199 Å²	199	111.5 Å²	111.5	87%	0.865	56%	0.564	S	S	*	*			trans	-70.8	118.3	166.6	-78.4	-168.7	172.9	-174	0	109.5	S553	S553-K555 VanDerWaalsContact C-N 3.25Å; S553-K555 PolarHBondContact O-N 3.29Å
556	Y	36.2	Very low	40.5	Very low	187 Å²	187	105.9 Å²	105.9	73%	0.733	54%	0.535	S	S	*	.			trans	-62.2	138.9	163.3	-91.5	-109	0	0	0	109.8	I554	I554-Y556 PolarHBondContact O-N 3.36Å
557	N	40.9	Very low	40.9	Very low	121 Å²	121	99.8 Å²	99.8	65%	0.647	50%	0.502	S	S	*	.			trans	-155.7	138.8	172.1	-146.1	1.1	0	0	0	107.1	N559 G560	N557-N559 PolarHBondContact O-N 3.49Å; N557-G560 PolarHBondContact O-N 3.07Å
558	D	42	Very low	41.8	Very low	154 Å²	154	97.1 Å²	97.1	82%	0.824	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.2	-160.7	-64.4	-48	0	0	0	115.3	G560	D558-G560 PolarHBondContact O-N 3.35Å
559	N	43.5	Very low	42.2	Very low	122 Å²	122	91.6 Å²	91.6	65%	0.652	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-0.3	174.4	-62.8	-34.7	0	0	0	113.9	N557 Q569	N557-N559 PolarHBondContact O-N 3.49Å; N559-Q569 PolarHBondContact O-NE2 3.11Å
560	G	42.6	Very low	43.1	Very low	19 Å²	19	87 Å²	87	20%	0.196	43%	0.432	C	S	.	.			trans	99	164	173.2	0	0	0	0	0	114.2	N557 D558 Y562	N557-G560 PolarHBondContact O-N 3.07Å; D558-G560 PolarHBondContact O-N 3.35Å; G560-Y562 VanDerWaalsContact O-CD2 3.23Å; G560-Y562 WeakPolarHBondContact O-CD2 3.38Å
561	I	44.7	Very low	43.2	Very low	49 Å²	49	82.3 Å²	82.3	25%	0.251	42%	0.417	S	S	.	.			trans	-77.2	144.2	176.3	-46.9	179.3	0	0	0	108.8	I570 I571	I561-I570 HydrophobicContact CB-CB 4.12Å; I561-I570 HydrophobicContact CB-CG2 4.36Å; I561-I570 HydrophobicContact CG2-CB 4.37Å; I561-I570 HydrophobicContact CG2-CD1 3.9Å; I561-I570 WeakPolarHBondContact O-CA 3.4Å; I561-I570 WeakPolarHBondContact O-CB 3.41Å; I561-I570 PolarHBondContact O-N 3.46Å; I561-I571 HydrophobicContact CB-CG1 4.33Å; I561-I571 HydrophobicContact CD1-CD1 3.62Å; I561-I571 HydrophobicContact CD1-CG1 4.25Å; I561-I571 HydrophobicContact CG1-CD1 3.91Å; I561-I571 HydrophobicContact CG1-CG1 4.19Å; I561-I571 PolarHBondContact O-N 2.91Å
562	Y	45.7	Very low	43.2	Very low	53 Å²	53	82.1 Å²	82.1	21%	0.208	41%	0.408	C	S	.	.	B	Isolated β-bridge	trans	-132.2	147	178.6	-74.7	-109	0	0	0	111.8	Q101 G560 Q569	Q101-Y562 WeakPolarHBondContact O-CE1 3.28Å; G560-Y562 VanDerWaalsContact O-CD2 3.23Å; G560-Y562 WeakPolarHBondContact O-CD2 3.38Å; Y562-Q569 HydrophobicContact CD1-CB 3.84Å; Y562-Q569 HydrophobicContact CD1-CG 4.26Å; Y562-Q569 HydrophobicContact CD2-CG 4.3Å; Y562-Q569 HydrophobicContact CE1-CB 3.62Å; Y562-Q569 HydrophobicContact CE1-CG 3.9Å; Y562-Q569 HydrophobicContact CE2-CG 3.91Å; Y562-Q569 HydrophobicContact CG-CB 4.39Å; Y562-Q569 HydrophobicContact CG-CG 4.46Å; Y562-Q569 PolarHBondContact OH-NE2 3.03Å
563	D	47.9	Very low	42.9	Very low	6 Å²	6	77.3 Å²	77.3	3%	0.032	40%	0.396	C	S	.	.			trans	-66.8	121.5	174.5	-175.2	-31	0	0	0	111.3	Q106 R140 I565 F566 G567 E568 I570	Q106-D563 WeakPolarHBondContact CG-O 3.42Å; Q106-D563 PolarHBondContact NE2-O 3.31Å; R140-D563 IonicContact CZ-OD2 3.04Å; R140-D563 IonicContact NH1-OD2 2.94Å; R140-D563 PolarHBondContact NH1-OD2 2.89Å; R140-D563 IonicContact NH2-OD2 2.81Å; R140-D563 PolarHBondContact NH2-OD2 3.18Å; R140-D563 VanDerWaalsContact NH2-OD2 3.13Å; D563-I565 VanDerWaalsContact C-N 3.29Å; D563-I565 PolarHBondContact O-N 3.01Å; D563-I565 PolarHBondContact OD1-N 3.48Å; D563-F566 PolarHBondContact OD1-N 3.13Å; D563-F566 WeakPolarHBondContact OD2-CD2 3.22Å; D563-G567 WeakPolarHBondContact O-CA 3.44Å; D563-G567 PolarHBondContact O-N 3.17Å; D563-E568 HydrophobicContact CB-CB 4.29Å; D563-E568 WeakPolarHBondContact CB-O 3.35Å; D563-E568 PolarHBondContact N-O 2.95Å; D563-I570 HydrophobicContact CB-CD1 4.39Å
564	P	42.6	Very low	43	Very low	59 Å²	59	77.6 Å²	77.6	38%	0.383	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.5	-178.8	27.7	-34.2	0	0	0	114	N109	N109-P564 VanDerWaalsContact CB-O 3.22Å; N109-P564 WeakPolarHBondContact CB-O 3.35Å; N109-P564 PolarHBondContact ND2-O 2.89Å
565	I	45.1	Very low	42.6	Very low	45 Å²	45	78.1 Å²	78.1	23%	0.231	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-54.9	-176.7	-61.3	173.6	0	0	0	110	V136 D563	V136-I565 HydrophobicContact CG1-CD1 4.01Å; D563-I565 VanDerWaalsContact C-N 3.29Å; D563-I565 PolarHBondContact O-N 3.01Å; D563-I565 PolarHBondContact OD1-N 3.48Å
566	F	52.1	Low	42.5	Very low	30 Å²	30	72.6 Å²	72.6	13%	0.132	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-8.5	-173.9	-60	-72.6	0	0	0	113.8	R102 W113 E133 V136 D563 E568	R102-F566 PolarHBondContact NH1-O 3.01Å; R102-F566 PolarHBondContact NH2-O 3.32Å; W113-F566 HydrophobicContact CD2-CE1 4.35Å; W113-F566 AromaticContact NE1-CE1 3.9Å; E133-F566 HydrophobicContact CG-CE1 4.46Å; E133-F566 HydrophobicContact CG-CZ 4.34Å; V136-F566 HydrophobicContact CG1-CE2 4.06Å; V136-F566 HydrophobicContact CG1-CZ 4.42Å; D563-F566 PolarHBondContact OD1-N 3.13Å; D563-F566 WeakPolarHBondContact OD2-CD2 3.22Å; F566-E568 HydrophobicContact CB-CG 4.41Å; F566-E568 PolarHBondContact O-N 3.3Å
567	G	45	Very low	42.8	Very low	0 Å²	0	69.9 Å²	69.9	0%	0	39%	0.388	C	S	.	.			trans	61.9	20.5	-179.3	0	0	0	0	0	114.6	D563	D563-G567 WeakPolarHBondContact O-CA 3.44Å; D563-G567 PolarHBondContact O-N 3.17Å
568	E	50.6	Low	42.8	Very low	84 Å²	84	71.7 Å²	71.7	39%	0.393	39%	0.393	S	S	.	.			trans	-75.7	125.5	171.7	-65.6	-157.1	152.4	0	0	110.8	D563 F566 I570	D563-E568 HydrophobicContact CB-CB 4.29Å; D563-E568 WeakPolarHBondContact CB-O 3.35Å; D563-E568 PolarHBondContact N-O 2.95Å; F566-E568 HydrophobicContact CB-CG 4.41Å; F566-E568 PolarHBondContact O-N 3.3Å; E568-I570 PolarHBondContact O-N 3.49Å; E568-I570 VanDerWaalsContact O-N 3.17Å
569	Q	42.6	Very low	42.7	Very low	30 Å²	30	69.5 Å²	69.5	14%	0.14	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-62.2	114.1	169.9	-167.9	-179	31.2	0	0	110.2	N559 Y562 I571 Q572	N559-Q569 PolarHBondContact O-NE2 3.11Å; Y562-Q569 HydrophobicContact CD1-CB 3.84Å; Y562-Q569 HydrophobicContact CD1-CG 4.26Å; Y562-Q569 HydrophobicContact CD2-CG 4.3Å; Y562-Q569 HydrophobicContact CE1-CB 3.62Å; Y562-Q569 HydrophobicContact CE1-CG 3.9Å; Y562-Q569 HydrophobicContact CE2-CG 3.91Å; Y562-Q569 HydrophobicContact CG-CB 4.39Å; Y562-Q569 HydrophobicContact CG-CG 4.46Å; Y562-Q569 PolarHBondContact OH-NE2 3.03Å; Q569-I571 VanDerWaalsContact CG-O 3.25Å; Q569-I571 WeakPolarHBondContact CG-O 3.37Å; Q569-I571 PolarHBondContact NE2-O 3.24Å; Q569-Q572 HydrophobicContact CG-CG 4.49Å
570	I	51.4	Low	42.5	Very low	13 Å²	13	72.5 Å²	72.5	7%	0.067	38%	0.383	C	S	.	.	S	Bend	trans	-77.3	-38.8	-178.2	-68	160.7	0	0	0	110.7	Y205 R208 I561 D563 E568	Y205-I570 HydrophobicContact CD1-CG2 3.71Å; Y205-I570 HydrophobicContact CD2-CG2 3.63Å; Y205-I570 HydrophobicContact CE1-CD1 4.47Å; Y205-I570 HydrophobicContact CE1-CG2 3.59Å; Y205-I570 HydrophobicContact CE2-CB 4.26Å; Y205-I570 HydrophobicContact CE2-CD1 4.29Å; Y205-I570 HydrophobicContact CE2-CG1 3.84Å; Y205-I570 HydrophobicContact CE2-CG2 3.53Å; Y205-I570 HydrophobicContact CG-CG2 3.74Å; Y205-I570 VanDerWaalsContact OH-CD1 3.28Å; Y205-I570 WeakPolarHBondContact OH-CD1 3.47Å; R208-I570 PolarHBondContact NH1-O 3.46Å; I561-I570 HydrophobicContact CB-CB 4.12Å; I561-I570 HydrophobicContact CB-CG2 4.36Å; I561-I570 HydrophobicContact CG2-CB 4.37Å; I561-I570 HydrophobicContact CG2-CD1 3.9Å; I561-I570 WeakPolarHBondContact O-CA 3.4Å; I561-I570 WeakPolarHBondContact O-CB 3.41Å; I561-I570 PolarHBondContact O-N 3.46Å; D563-I570 HydrophobicContact CB-CD1 4.39Å; E568-I570 PolarHBondContact O-N 3.49Å; E568-I570 VanDerWaalsContact O-N 3.17Å
571	I	41	Very low	42.4	Very low	47 Å²	47	76.2 Å²	76.2	24%	0.241	40%	0.398	C	S	.	.			trans	-123.8	125.4	176.7	-56.7	-170.7	0	0	0	110.1	T201 I561 Q569	T201-I571 HydrophobicContact CG2-CD1 3.93Å; I561-I571 HydrophobicContact CB-CG1 4.33Å; I561-I571 HydrophobicContact CD1-CD1 3.62Å; I561-I571 HydrophobicContact CD1-CG1 4.25Å; I561-I571 HydrophobicContact CG1-CD1 3.91Å; I561-I571 HydrophobicContact CG1-CG1 4.19Å; I561-I571 PolarHBondContact O-N 2.91Å; Q569-I571 VanDerWaalsContact CG-O 3.25Å; Q569-I571 WeakPolarHBondContact CG-O 3.37Å; Q569-I571 PolarHBondContact NE2-O 3.24Å
572	Q	40	Very low	42.5	Very low	115 Å²	115	79.5 Å²	79.5	54%	0.537	41%	0.412	S	S	.	.			trans	-97.2	141.4	155.3	-76.2	-175.2	-25.2	0	0	108.2	Q569 A574	Q569-Q572 HydrophobicContact CG-CG 4.49Å; Q572-A574 PolarHBondContact O-N 3.05Å
573	P	33.5	Very low	42.3	Very low	93 Å²	93	86.6 Å²	86.6	60%	0.604	44%	0.439	S	S	*	.			trans	-58.2	137.7	170.2	25.4	-33.4	0	0	0	109.7	I575	P573-I575 PolarHBondContact O-N 3.43Å
574	A	36.9	Very low	42.3	Very low	99 Å²	99	90.7 Å²	90.7	82%	0.818	46%	0.46	S	S	*	.			trans	-70.3	105.7	-174.1	0	0	0	0	0	111	Q572	Q572-A574 PolarHBondContact O-N 3.05Å
575	I	35.5	Very low	42.4	Very low	116 Å²	116	94.6 Å²	94.6	60%	0.595	47%	0.471	S	S	*	.			trans	-54.6	124.1	170.8	-60.8	175.9	0	0	0	108.4	P573 L579	P573-I575 PolarHBondContact O-N 3.43Å; I575-L579 HydrophobicContact CG2-CB 3.53Å; I575-L579 HydrophobicContact CG2-CD1 4.21Å; I575-L579 HydrophobicContact CG2-CG 4.37Å
576	P	33.6	Very low	42.5	Very low	82 Å²	82	100.2 Å²	100.2	53%	0.532	49%	0.491	S	S	.	.			trans	-62	146.6	-174.4	23.4	-33.3	0	0	0	111.7	Q578 L579	P576-Q578 PolarHBondContact O-N 3.49Å; P576-L579 HydrophobicContact CG-CD1 4.11Å; P576-L579 PolarHBondContact O-N 3.33Å
577	I	41.1	Very low	42.2	Very low	131 Å²	131	105.9 Å²	105.9	67%	0.672	52%	0.515	S	S	*	.	H	α-helix	trans	-55.1	-32.1	-168.3	-64.6	170.9	0	0	0	112.6	L579 R580 N581	I577-L579 PolarHBondContact O-N 3.16Å; I577-R580 WeakPolarHBondContact O-CB 3.41Å; I577-R580 PolarHBondContact O-N 3.35Å; I577-R580 VanDerWaalsContact O-N 3.15Å; I577-N581 PolarHBondContact O-N 3.12Å
578	Q	41.5	Very low	42.8	Very low	158 Å²	158	110.9 Å²	110.9	74%	0.738	54%	0.541	S	S	*	.	H	α-helix	trans	-58.5	-41.6	176.6	-64.7	-177	-6.2	0	0	113.2	P576 R580 N581 H582	P576-Q578 PolarHBondContact O-N 3.49Å; Q578-R580 VanDerWaalsContact C-N 3.33Å; Q578-R580 PolarHBondContact O-N 3.37Å; Q578-N581 PolarHBondContact O-N 3.46Å; Q578-H582 PolarHBondContact O-N 2.96Å
579	L	40.5	Very low	43	Very low	108 Å²	108	111.3 Å²	111.3	57%	0.565	55%	0.546	S	S	*	.	H	α-helix	trans	-67.4	-33.9	176.7	-101.9	144.3	0	0	0	112	I575 P576 I577 H582 R583	I575-L579 HydrophobicContact CG2-CB 3.53Å; I575-L579 HydrophobicContact CG2-CD1 4.21Å; I575-L579 HydrophobicContact CG2-CG 4.37Å; P576-L579 HydrophobicContact CG-CD1 4.11Å; P576-L579 PolarHBondContact O-N 3.33Å; I577-L579 PolarHBondContact O-N 3.16Å; L579-H582 PolarHBondContact O-N 3.11Å; L579-R583 PolarHBondContact O-N 3.18Å; L579-R583 VanDerWaalsContact O-N 3.07Å
580	R	38.6	Very low	43.4	Very low	185 Å²	185	114.6 Å²	114.6	70%	0.698	57%	0.565	S	S	*	*	H	α-helix	trans	-66.7	-39.7	173.9	-158.3	176.7	-166.8	170.8	3.7	111.4	I577 Q578 R583 N584	I577-R580 WeakPolarHBondContact O-CB 3.41Å; I577-R580 PolarHBondContact O-N 3.35Å; I577-R580 VanDerWaalsContact O-N 3.15Å; Q578-R580 VanDerWaalsContact C-N 3.33Å; Q578-R580 PolarHBondContact O-N 3.37Å; R580-R583 PolarHBondContact O-N 2.92Å; R580-N584 PolarHBondContact O-N 3.14Å; R580-N584 VanDerWaalsContact O-N 3.15Å
581	N	40.7	Very low	43.3	Very low	97 Å²	97	118.9 Å²	118.9	52%	0.519	59%	0.588	S	S	.	*	H	α-helix	trans	-67	-42.7	175.5	-70.2	-7.1	0	0	0	111.9	I577 Q578 R583 N584 K585	I577-N581 PolarHBondContact O-N 3.12Å; Q578-N581 PolarHBondContact O-N 3.46Å; N581-R583 PolarHBondContact O-N 3.43Å; N581-N584 PolarHBondContact O-N 3.4Å; N581-K585 WeakPolarHBondContact O-CB 3.3Å; N581-K585 PolarHBondContact O-N 3.35Å
582	H	46.2	Very low	43.9	Very low	118 Å²	118	121.9 Å²	121.9	55%	0.546	60%	0.601	S	S	.	*	H	α-helix	trans	-58.3	-46	173.3	-96	-98.7	0	0	0	112.5	Q578 L579 N584 K585 Y586	Q578-H582 PolarHBondContact O-N 2.96Å; L579-H582 PolarHBondContact O-N 3.11Å; H582-N584 VanDerWaalsContact C-N 3.29Å; H582-N584 PolarHBondContact O-N 3.18Å; H582-K585 PolarHBondContact O-N 3.31Å; H582-K585 VanDerWaalsContact O-N 3.16Å; H582-Y586 PolarHBondContact O-N 3.03Å
583	R	41.9	Very low	44.5	Very low	203 Å²	203	122.4 Å²	122.4	77%	0.766	60%	0.603	S	S	*	*	H	α-helix	trans	-63.8	-34.1	179.8	-160.8	174.5	-168.2	173.6	5.3	112.8	L579 R580 N581 K587	L579-R583 PolarHBondContact O-N 3.18Å; L579-R583 VanDerWaalsContact O-N 3.07Å; R580-R583 PolarHBondContact O-N 2.92Å; N581-R583 PolarHBondContact O-N 3.43Å; R583-K587 PolarHBondContact O-N 3.07Å
584	N	47.4	Very low	45.4	Very low	92 Å²	92	124.3 Å²	124.3	49%	0.492	60%	0.602	S	S	.	*	H	α-helix	trans	-71.4	-41.2	172.5	-73.9	-7.1	0	0	0	112	R580 N581 H582 Y586 K587 I588	R580-N584 PolarHBondContact O-N 3.14Å; R580-N584 VanDerWaalsContact O-N 3.15Å; N581-N584 PolarHBondContact O-N 3.4Å; H582-N584 VanDerWaalsContact C-N 3.29Å; H582-N584 PolarHBondContact O-N 3.18Å; N584-Y586 PolarHBondContact O-N 2.95Å; N584-K587 PolarHBondContact O-N 3.44Å; N584-K587 VanDerWaalsContact O-N 3.12Å; N584-I588 WeakPolarHBondContact O-CG1 3.49Å; N584-I588 PolarHBondContact O-N 3.48Å
585	K	46.2	Very low	46.2	Very low	140 Å²	140	126.3 Å²	126.3	61%	0.609	59%	0.589	S	S	*	*	H	α-helix	trans	-61.4	-44.7	179.7	-157.2	175.7	-173.7	-176.5	0	111.9	N581 H582 K587 I588 N589	N581-K585 WeakPolarHBondContact O-CB 3.3Å; N581-K585 PolarHBondContact O-N 3.35Å; H582-K585 PolarHBondContact O-N 3.31Å; H582-K585 VanDerWaalsContact O-N 3.16Å; K585-K587 VanDerWaalsContact C-N 3.34Å; K585-K587 PolarHBondContact O-N 3.03Å; K585-I588 PolarHBondContact O-N 3.38Å; K585-N589 PolarHBondContact O-N 3.42Å; K585-N589 PolarHBondContact O-OD1 3.43Å
586	Y	45.8	Very low	47.3	Very low	163 Å²	163	124.7 Å²	124.7	64%	0.639	58%	0.582	S	S	*	*	H	α-helix	trans	-59.3	-41.5	171.5	-92.1	-81	0	0	0	112.9	H582 N584 I588 N589 N590	H582-Y586 PolarHBondContact O-N 3.03Å; N584-Y586 PolarHBondContact O-N 2.95Å; Y586-I588 VanDerWaalsContact C-N 3.33Å; Y586-I588 PolarHBondContact O-N 3.1Å; Y586-N589 PolarHBondContact O-N 3.33Å; Y586-N590 PolarHBondContact O-N 2.9Å; Y586-N590 PolarHBondContact O-OD1 3.22Å
587	K	47	Very low	48.4	Very low	149 Å²	149	125.2 Å²	125.2	65%	0.648	58%	0.58	S	S	*	*	H	α-helix	trans	-70.7	-28.7	-178.8	-153.8	178.9	-175.2	-171.3	0	113.1	R583 N584 K585 N591	R583-K587 PolarHBondContact O-N 3.07Å; N584-K587 PolarHBondContact O-N 3.44Å; N584-K587 VanDerWaalsContact O-N 3.12Å; K585-K587 VanDerWaalsContact C-N 3.34Å; K585-K587 PolarHBondContact O-N 3.03Å; K587-N591 PolarHBondContact O-N 3.29Å; K587-N591 PolarHBondContact O-OD1 3.27Å
588	I	56.6	Low	49	Very low	106 Å²	106	124.4 Å²	124.4	54%	0.544	57%	0.574	S	S	.	*	H	α-helix	trans	-69.9	-49.4	171.2	-68.4	164.8	0	0	0	109.9	N584 K585 Y586 N590 N591 Q592	N584-I588 WeakPolarHBondContact O-CG1 3.49Å; N584-I588 PolarHBondContact O-N 3.48Å; K585-I588 PolarHBondContact O-N 3.38Å; Y586-I588 VanDerWaalsContact C-N 3.33Å; Y586-I588 PolarHBondContact O-N 3.1Å; I588-N590 PolarHBondContact O-N 3.46Å; I588-N591 PolarHBondContact O-N 3.49Å; I588-N591 VanDerWaalsContact O-N 3.14Å; I588-Q592 PolarHBondContact O-N 3.02Å
589	N	54.3	Low	49.5	Very low	93 Å²	93	124.1 Å²	124.1	50%	0.497	57%	0.57	S	S	.	*	H	α-helix	trans	-57.2	-45.6	179.8	-75	23.5	0	0	0	112.8	K585 Y586 N591 Q592 Q593	K585-N589 PolarHBondContact O-N 3.42Å; K585-N589 PolarHBondContact O-OD1 3.43Å; Y586-N589 PolarHBondContact O-N 3.33Å; N589-N591 VanDerWaalsContact C-N 3.32Å; N589-N591 PolarHBondContact O-N 3.48Å; N589-Q592 WeakPolarHBondContact O-CB 3.49Å; N589-Q592 PolarHBondContact O-N 3.28Å; N589-Q593 WeakPolarHBondContact O-CB 3.43Å; N589-Q593 PolarHBondContact O-N 3.22Å
590	N	51.9	Low	50	Low	99 Å²	99	122.3 Å²	122.3	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-64.2	-35.2	178.5	-74.4	37.6	0	0	0	112.7	Y586 I588 F594	Y586-N590 PolarHBondContact O-N 2.9Å; Y586-N590 PolarHBondContact O-OD1 3.22Å; I588-N590 PolarHBondContact O-N 3.46Å; N590-F594 PolarHBondContact O-N 3.01Å
591	N	49.8	Very low	50.6	Low	103 Å²	103	119.9 Å²	119.9	55%	0.551	57%	0.566	S	S	*	*	H	α-helix	trans	-70.5	-38.4	174.9	-78.7	15.2	0	0	0	111.6	K587 I588 N589 F594 Y595	K587-N591 PolarHBondContact O-N 3.29Å; K587-N591 PolarHBondContact O-OD1 3.27Å; I588-N591 PolarHBondContact O-N 3.49Å; I588-N591 VanDerWaalsContact O-N 3.14Å; N589-N591 VanDerWaalsContact C-N 3.32Å; N589-N591 PolarHBondContact O-N 3.48Å; N591-F594 PolarHBondContact O-N 3.25Å; N591-Y595 PolarHBondContact O-N 2.92Å; N591-Y595 VanDerWaalsContact O-N 3.11Å
592	Q	54	Low	51	Low	110 Å²	110	119.7 Å²	119.7	51%	0.514	57%	0.572	S	S	.	*	H	α-helix	trans	-60.4	-51.4	175.6	-160.2	71.5	37.7	0	0	110.4	I588 N589 F594 Y595 D596	I588-Q592 PolarHBondContact O-N 3.02Å; N589-Q592 WeakPolarHBondContact O-CB 3.49Å; N589-Q592 PolarHBondContact O-N 3.28Å; Q592-F594 PolarHBondContact O-N 3.44Å; Q592-Y595 WeakPolarHBondContact O-CA 3.42Å; Q592-Y595 WeakPolarHBondContact O-CB 3.41Å; Q592-Y595 PolarHBondContact O-N 2.97Å; Q592-D596 PolarHBondContact O-N 2.94Å
593	Q	52.1	Low	50.8	Low	125 Å²	125	117 Å²	117	58%	0.584	58%	0.576	S	S	*	*	H	α-helix	trans	-61.6	-29.1	179	-164.5	173.8	17.7	0	0	113.1	N589 N597	N589-Q593 WeakPolarHBondContact O-CB 3.43Å; N589-Q593 PolarHBondContact O-N 3.22Å; Q593-N597 WeakPolarHBondContact O-CB 3.37Å; Q593-N597 PolarHBondContact O-N 3.43Å; Q593-N597 VanDerWaalsContact O-N 3.11Å
594	F	52.5	Low	50.7	Low	133 Å²	133	114.6 Å²	114.6	58%	0.583	58%	0.578	S	S	*	*	H	α-helix	trans	-73.7	-37.6	173.4	-156.9	-87.5	0	0	0	112.4	N590 N591 Q592 Q598	N590-F594 PolarHBondContact O-N 3.01Å; N591-F594 PolarHBondContact O-N 3.25Å; Q592-F594 PolarHBondContact O-N 3.44Å; F594-Q598 HydrophobicContact CD1-CG 4.5Å; F594-Q598 HydrophobicContact CE1-CG 4.41Å; F594-Q598 PolarHBondContact O-N 3.11Å
595	Y	52.5	Low	50.4	Low	141 Å²	141	117.6 Å²	117.6	55%	0.553	59%	0.594	S	S	*	*	H	α-helix	trans	-66.6	-43.3	172.7	-99.5	-80.6	0	0	0	112.1	N591 Q592 N597 Q598 K599	N591-Y595 PolarHBondContact O-N 2.92Å; N591-Y595 VanDerWaalsContact O-N 3.11Å; Q592-Y595 WeakPolarHBondContact O-CA 3.42Å; Q592-Y595 WeakPolarHBondContact O-CB 3.41Å; Q592-Y595 PolarHBondContact O-N 2.97Å; Y595-N597 VanDerWaalsContact C-N 3.33Å; Y595-N597 PolarHBondContact O-N 3.04Å; Y595-Q598 PolarHBondContact O-N 3.27Å; Y595-K599 WeakPolarHBondContact O-CB 3.46Å; Y595-K599 PolarHBondContact O-N 3.07Å
596	D	59	Low	49.9	Very low	82 Å²	82	117.5 Å²	117.5	44%	0.439	61%	0.605	S	S	.	*	H	α-helix	trans	-66.7	-36	179.4	-63.6	-38	0	0	0	111.4	Q592 K599 S600	Q592-D596 PolarHBondContact O-N 2.94Å; D596-K599 PolarHBondContact O-N 2.8Å; D596-S600 PolarHBondContact O-N 3.24Å; D596-S600 PolarHBondContact O-OG 3.32Å
597	N	56.5	Low	49.5	Very low	94 Å²	94	117.2 Å²	117.2	50%	0.503	62%	0.615	S	S	.	*	H	α-helix	trans	-69.4	-34.8	171.6	-81.4	-7	0	0	0	113.9	Q593 Y595 K599 S600 I601	Q593-N597 WeakPolarHBondContact O-CB 3.37Å; Q593-N597 PolarHBondContact O-N 3.43Å; Q593-N597 VanDerWaalsContact O-N 3.11Å; Y595-N597 VanDerWaalsContact C-N 3.33Å; Y595-N597 PolarHBondContact O-N 3.04Å; N597-K599 VanDerWaalsContact C-N 3.3Å; N597-S600 PolarHBondContact O-OG 3.3Å; N597-S600 VanDerWaalsContact O-OG 3.07Å; N597-I601 WeakPolarHBondContact O-CD1 3.29Å; N597-I601 VanDerWaalsContact O-CG1 3.29Å; N597-I601 WeakPolarHBondContact O-CG1 3.44Å; N597-I601 PolarHBondContact O-N 3.25Å
598	Q	54.3	Low	49.2	Very low	114 Å²	114	117.2 Å²	117.2	53%	0.533	62%	0.622	S	S	.	*	H	α-helix	trans	-66	-37.6	169.6	-78.7	-167.2	-20.2	0	0	111.2	F594 Y595 I601 S602	F594-Q598 HydrophobicContact CD1-CG 4.5Å; F594-Q598 HydrophobicContact CE1-CG 4.41Å; F594-Q598 PolarHBondContact O-N 3.11Å; Y595-Q598 PolarHBondContact O-N 3.27Å; Q598-I601 PolarHBondContact O-N 3.45Å; Q598-S602 PolarHBondContact O-N 3.05Å; Q598-S602 PolarHBondContact O-OG 2.94Å
599	K	51.4	Low	48.3	Very low	152 Å²	152	117.9 Å²	117.9	66%	0.661	63%	0.631	S	S	*	*	H	α-helix	trans	-68.2	-39.4	-178.7	-157.6	176	-175.8	-174.4	0	112.5	Y595 D596 N597 S602 G603	Y595-K599 WeakPolarHBondContact O-CB 3.46Å; Y595-K599 PolarHBondContact O-N 3.07Å; D596-K599 PolarHBondContact O-N 2.8Å; N597-K599 VanDerWaalsContact C-N 3.3Å; K599-S602 WeakPolarHBondContact CA-OG 3.39Å; K599-S602 PolarHBondContact O-N 3.42Å; K599-S602 PolarHBondContact O-OG 3.11Å; K599-G603 PolarHBondContact O-N 3.29Å
600	S	50.5	Low	47.6	Very low	70 Å²	70	120.3 Å²	120.3	49%	0.49	64%	0.644	S	S	.	*	H	α-helix	trans	-67.2	-40.7	174.4	61	0	0	0	0	112.6	D596 N597 S602 G603	D596-S600 PolarHBondContact O-N 3.24Å; D596-S600 PolarHBondContact O-OG 3.32Å; N597-S600 PolarHBondContact O-OG 3.3Å; N597-S600 VanDerWaalsContact O-OG 3.07Å; S600-S602 VanDerWaalsContact C-N 3.32Å; S600-S602 PolarHBondContact O-N 3.32Å; S600-G603 PolarHBondContact O-N 3.41Å; S600-G603 VanDerWaalsContact O-N 3.11Å
601	I	52.9	Low	46.9	Very low	134 Å²	134	120.8 Å²	120.8	69%	0.687	65%	0.65	S	S	*	*	H	α-helix	trans	-65.1	-36.1	175.1	-66.7	168.9	0	0	0	111.3	N597 Q598 G603	N597-I601 WeakPolarHBondContact O-CD1 3.29Å; N597-I601 VanDerWaalsContact O-CG1 3.29Å; N597-I601 WeakPolarHBondContact O-CG1 3.44Å; N597-I601 PolarHBondContact O-N 3.25Å; Q598-I601 PolarHBondContact O-N 3.45Å; I601-G603 PolarHBondContact O-N 2.96Å
602	S	47.7	Very low	46.4	Very low	92 Å²	92	123.2 Å²	123.2	64%	0.643	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-8.1	174.1	66.6	0	0	0	0	114.9	Q598 K599 S600	Q598-S602 PolarHBondContact O-N 3.05Å; Q598-S602 PolarHBondContact O-OG 2.94Å; K599-S602 WeakPolarHBondContact CA-OG 3.39Å; K599-S602 PolarHBondContact O-N 3.42Å; K599-S602 PolarHBondContact O-OG 3.11Å; S600-S602 VanDerWaalsContact C-N 3.32Å; S600-S602 PolarHBondContact O-N 3.32Å
603	G	41.7	Very low	45.8	Very low	61 Å²	61	124.6 Å²	124.6	63%	0.629	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-3.5	-174.7	0	0	0	0	0	115.8	K599 S600 I601	K599-G603 PolarHBondContact O-N 3.29Å; S600-G603 PolarHBondContact O-N 3.41Å; S600-G603 VanDerWaalsContact O-N 3.11Å; I601-G603 PolarHBondContact O-N 2.96Å
604	L	41.3	Very low	45.1	Very low	153 Å²	153	125 Å²	125	80%	0.801	68%	0.684	S	S	*	*	S	Bend	trans	-97.3	9.4	-169.8	-85.9	164	0	0	0	115.2
605	N	39.8	Very low	44.5	Very low	155 Å²	155	124.2 Å²	124.2	83%	0.829	69%	0.686	S	S	*	*	S	Bend	trans	-141	60	-169.3	-118.4	-5	0	0	0	114.7
606	T	37.3	Very low	43.7	Very low	138 Å²	138	124.2 Å²	124.2	85%	0.847	70%	0.696	S	S	*	*			trans	-161	108.6	153	42.4	0	0	0	0	110.3
607	N	36.5	Very low	42.8	Very low	158 Å²	158	128.8 Å²	128.8	85%	0.845	72%	0.719	S	S	*	*			trans	-104.3	151.8	162.7	-88.2	-13.4	0	0	0	110.2
608	N	39.7	Very low	41.8	Very low	149 Å²	149	132.8 Å²	132.8	80%	0.797	74%	0.735	S	S	*	*			trans	93.4	131.2	168.7	-60.7	-9.2	0	0	0	119.6
609	T	39.1	Very low	41	Very low	120 Å²	120	133.1 Å²	133.1	74%	0.736	75%	0.747	S	S	*	*			trans	62.2	94.8	153.7	46.9	0	0	0	0	119.7
610	N	39.2	Very low	40.4	Very low	143 Å²	143	135.3 Å²	135.3	77%	0.765	76%	0.756	S	S	*	*				37	136.3	92.9	-54.1	1.5	0	0	0	117
611	T	37.2	Very low	39.8	Very low	109 Å²	109	140.2 Å²	140.2	67%	0.669	77%	0.774	S	S	*	*			cis	-172.7	146.3	3.7	12.2	0	0	0	0	109.3
612	I	40	Very low	39	Very low	154 Å²	154	143.4 Å²	143.4	79%	0.79	78%	0.783	S	S	*	*			trans	67.1	144	151.8	-59.9	163.1	0	0	0	114
613	T	41.3	Very low	38.5	Very low	139 Å²	139	148.6 Å²	148.6	85%	0.853	79%	0.794	S	S	*	*			cis	-130.8	-167.5	19.1	-22.1	0	0	0	0	112.1
614	N	37.1	Very low	38.4	Very low	135 Å²	135	154.7 Å²	154.7	72%	0.722	81%	0.805	S	S	*	*			trans	-123.7	172.6	-168.9	-161.9	6.8	0	0	0	112.9
615	N	39.7	Very low	38.2	Very low	116 Å²	116	154.5 Å²	154.5	62%	0.62	80%	0.804	S	S	*	*			trans	92	116.4	160.1	-53.8	-32.4	0	0	0	120.9
616	N	36.5	Very low	37.9	Very low	141 Å²	141	153.9 Å²	153.9	75%	0.754	80%	0.801	S	S	*	*				49.9	123.4	128.4	-49.9	-27	0	0	0	122.1
617	L	39	Very low	38	Very low	177 Å²	177	156.6 Å²	156.6	93%	0.927	80%	0.804	S	S	*	*				-165.6	-174.6	99.7	-127.3	88.9	0	0	0	114.1
618	Q	36.8	Very low	38.2	Very low	178 Å²	178	154.3 Å²	154.3	83%	0.832	80%	0.801	S	S	*	*			trans	-90.2	163	-169.5	-80.2	-172.5	-2.6	0	0	116.2
619	P	36.1	Very low	38.1	Very low	121 Å²	121	154.3 Å²	154.3	79%	0.786	80%	0.8	S	S	*	*			trans	-88.4	149.2	-179.9	35.3	-36.2	0	0	0	115.1
620	K	38.3	Very low	38.2	Very low	198 Å²	198	155.9 Å²	155.9	86%	0.861	80%	0.799	S	S	*	*			trans	-143.5	130.3	169.8	-87.5	-174.8	176.9	175.9	0	115.4
621	M	38.2	Very low	38.3	Very low	174 Å²	174	155.2 Å²	155.2	86%	0.857	80%	0.795	S	S	*	*			trans	33.7	126.4	142.1	-55.6	-178.3	89.1	0	0	123.8
622	K	36.5	Very low	38.5	Very low	201 Å²	201	157.8 Å²	157.8	87%	0.874	80%	0.799	S	S	*	*			trans	-9.3	133.7	143.8	-52.3	171	178.6	179.4	0	118.6
623	K	37.2	Very low	38.5	Very low	201 Å²	201	160.6 Å²	160.6	87%	0.874	80%	0.8	S	S	*	*				-171.4	179.9	117.7	-126.8	-177.2	177.8	-175.7	0	112.3
624	Q	38.9	Very low	38.4	Very low	188 Å²	188	159.9 Å²	159.9	88%	0.879	79%	0.791	S	S	*	*			trans	69.7	150.8	172.8	-71.5	164.3	-39.7	0	0	117.3
625	L	37.1	Very low	38.6	Very low	149 Å²	149	160.5 Å²	160.5	78%	0.78	79%	0.793	S	S	*	*				166.2	132	-59.2	176.5	71.1	0	0	0	108.1
626	N	35.1	Very low	38.4	Very low	142 Å²	142	166.2 Å²	166.2	76%	0.759	81%	0.805	S	S	*	*			trans	1.8	124.8	167.1	-54	3.3	0	0	0	121.5
627	E	38.7	Very low	39	Very low	196 Å²	196	164.3 Å²	164.3	92%	0.916	80%	0.801	S	S	*	*			trans	-159.8	145.7	134	-102.7	159.1	-153.3	0	0	105.7
628	S	41.2	Very low	38.9	Very low	109 Å²	109	162.3 Å²	162.3	76%	0.762	80%	0.796	S	S	*	*			cis	-145.4	157	3.4	-172.1	0	0	0	0	111.3
629	L	37.6	Very low	39.1	Very low	150 Å²	150	158.4 Å²	158.4	79%	0.785	79%	0.788	S	S	*	*			trans	-81.1	-179.9	155.5	-111.8	68.7	0	0	0	108.3
630	E	39.7	Very low	39.2	Very low	153 Å²	153	162.8 Å²	162.8	72%	0.715	79%	0.791	S	S	*	*			cis	-166	-169.2	30.5	-154.3	151.2	-161.9	0	0	110
631	N	41.5	Very low	39.2	Very low	129 Å²	129	164.6 Å²	164.6	69%	0.69	79%	0.792	S	S	*	*			trans	72.5	140.3	164.5	-55.5	-25.7	0	0	0	118.1
632	H	41.8	Very low	39.2	Very low	162 Å²	162	163 Å²	163	75%	0.75	79%	0.788	S	S	*	*			cis	-153.2	146.8	-18	-131.8	-71.9	0	0	0	112.5
633	R	39.6	Very low	39.9	Very low	214 Å²	214	158 Å²	158	81%	0.808	78%	0.776	S	S	*	*			trans	-49.6	155.3	173	-63	167.8	160.5	164.4	-6.2	114.7
634	N	39.8	Very low	40	Very low	123 Å²	123	153.5 Å²	153.5	66%	0.658	77%	0.769	S	S	*	*				172.6	153.4	83	-102.6	-27.1	0	0	0	115
635	I	41.7	Very low	40.2	Very low	148 Å²	148	150.4 Å²	150.4	76%	0.759	76%	0.763	S	S	*	*			trans	56	144	137	-61	168.7	0	0	0	119.6
636	R	36.4	Very low	40.4	Very low	236 Å²	236	149.5 Å²	149.5	89%	0.891	76%	0.759	S	S	*	*			cis	-170.7	-179.9	-29.1	-116.9	-157.1	167.1	178.8	-3.3	106.8
637	P	47	Very low	41	Very low	101 Å²	101	149.1 Å²	149.1	66%	0.656	76%	0.757	S	S	*	*			trans	-122.3	-164.3	-154.3	44.8	-34.8	0	0	0	118.1
638	T	38.3	Very low	41.1	Very low	135 Å²	135	146.8 Å²	146.8	83%	0.828	76%	0.756	S	S	*	*			trans	85.3	158.8	178.3	77.8	0	0	0	0	115
639	S	39.9	Very low	41.5	Very low	96 Å²	96	147.1 Å²	147.1	67%	0.671	76%	0.755	S	S	*	*			cis	-160	143.5	10.6	-153.5	0	0	0	0	114.8
640	Y	39.4	Very low	41.6	Very low	214 Å²	214	144.7 Å²	144.7	84%	0.839	75%	0.751	S	S	*	*			trans	45.1	147.1	146.2	-88.9	-97.6	0	0	0	127.2
641	R	37.7	Very low	41.7	Very low	236 Å²	236	142.4 Å²	142.4	89%	0.891	75%	0.752	S	S	*	*			trans	84.7	157.8	144.4	-113.1	169.7	-176.6	-179.6	1.9	120.5
642	N	37.8	Very low	41.7	Very low	141 Å²	141	140.5 Å²	140.5	75%	0.754	75%	0.749	S	S	*	*				-158.9	-156.4	-57.1	-153.5	18.4	0	0	0	108.6
643	P	51.1	Low	41.8	Very low	96 Å²	96	139 Å²	139	62%	0.623	75%	0.746	S	S	*	*				-127.2	-155.6	-124.9	45	-24.7	0	0	0	116.4
644	S	40	Very low	42	Very low	106 Å²	106	134.8 Å²	134.8	74%	0.741	74%	0.74	S	S	*	*			trans	82.3	154.6	169.8	84	0	0	0	0	116.2
645	T	42.2	Very low	42.1	Very low	122 Å²	122	136 Å²	136	75%	0.748	75%	0.745	S	S	*	*			cis	-168.6	179.7	-15.6	22.6	0	0	0	0	107.8
646	N	42.8	Very low	42	Very low	130 Å²	130	134.5 Å²	134.5	70%	0.695	74%	0.742	S	S	*	*			cis	-161.1	-177	6.6	-142.4	-11	0	0	0	113.5
647	N	46.2	Very low	42.1	Very low	135 Å²	135	131.3 Å²	131.3	72%	0.722	74%	0.738	S	S	*	*			trans	80.8	132.4	148.8	-65.3	-10.3	0	0	0	122.7
648	V	41.5	Very low	41.5	Very low	146 Å²	146	131.7 Å²	131.7	89%	0.885	74%	0.743	S	S	*	*			trans	-151.8	124.5	179.1	176.8	0	0	0	0	113.3
649	P	49	Very low	41.5	Very low	116 Å²	116	131.2 Å²	131.2	75%	0.753	74%	0.74	S	S	*	*			trans	-132.7	173	158.2	37.4	-23.2	0	0	0	112.9
650	S	40.2	Very low	41.4	Very low	99 Å²	99	134.7 Å²	134.7	69%	0.692	75%	0.747	S	S	*	*			cis	-171.8	168.5	-28.7	59.8	0	0	0	0	109.7
651	S	42.3	Very low	41.4	Very low	105 Å²	105	131.2 Å²	131.2	73%	0.734	74%	0.742	S	S	*	*			trans	61.6	149.9	154.5	42.9	0	0	0	0	120.5
652	S	42.1	Very low	41.5	Very low	89 Å²	89	126 Å²	126	62%	0.622	73%	0.731	S	S	*	*			cis	-169.3	178	-14.8	47.3	0	0	0	0	110.6
653	D	43.7	Very low	41.7	Very low	131 Å²	131	125 Å²	125	70%	0.701	73%	0.726	S	S	*	*			trans	73.2	148	153.6	-59.1	-46.9	0	0	0	120.2
654	N	42.4	Very low	41.4	Very low	126 Å²	126	126.5 Å²	126.5	67%	0.674	73%	0.729	S	S	*	*			cis	-168.7	164.8	-28.7	-128.5	-41.3	0	0	0	110.9
655	I	42	Very low	41.5	Very low	149 Å²	149	126.3 Å²	126.3	76%	0.764	73%	0.727	S	S	*	*			trans	63.7	156.1	153.6	-69.6	163	0	0	0	118.2
656	V	40	Very low	41.7	Very low	116 Å²	116	132.5 Å²	132.5	70%	0.703	74%	0.737	S	S	*	*			cis	-177.8	167.7	-46.9	130.2	0	0	0	0	107.7
657	Q	37.8	Very low	41.8	Very low	169 Å²	169	135 Å²	135	79%	0.79	74%	0.742	S	S	*	*			trans	77.5	98.2	165.1	-87.7	166.8	-9.6	0	0	122.1
658	S	35.8	Very low	42.1	Very low	109 Å²	109	134.7 Å²	134.7	76%	0.762	75%	0.75	S	S	*	*				54.8	150	110.6	-53	0	0	0	0	125.6
659	T	37.5	Very low	42.3	Very low	125 Å²	125	133.2 Å²	133.2	77%	0.767	73%	0.734	S	S	*	*			trans	97.9	95.1	143.4	-2.7	0	0	0	0	121.8
660	M	37.7	Very low	42.6	Very low	169 Å²	169	137.6 Å²	137.6	83%	0.833	74%	0.741	S	S	*	*				63.6	150.5	129	-75.6	-162.7	174.9	0	0	125.9
661	I	39.4	Very low	42.7	Very low	141 Å²	141	138.1 Å²	138.1	72%	0.723	74%	0.736	S	S	*	*			trans	80	92.6	148	-71.6	158.1	0	0	0	119.6
662	N	40.6	Very low	43.3	Very low	126 Å²	126	140.8 Å²	140.8	67%	0.674	74%	0.74	S	S	*	*				44.2	125.1	116.2	-175.7	44.9	0	0	0	121.2
663	N	41.8	Very low	43.3	Very low	119 Å²	119	142.8 Å²	142.8	64%	0.636	74%	0.744	S	S	*	*				178	156.6	116.1	-99.9	-54.3	0	0	0	118.3
664	N	44.8	Very low	43.5	Very low	129 Å²	129	145.1 Å²	145.1	69%	0.69	75%	0.75	S	S	*	*			trans	69.7	90.3	143.6	-71.8	-30.2	0	0	0	124.8
665	S	42	Very low	43.3	Very low	101 Å²	101	146.9 Å²	146.9	71%	0.706	75%	0.754	S	S	*	*				55	142.8	101	76.2	0	0	0	0	123.7
666	R	47	Very low	43.3	Very low	253 Å²	253	146.8 Å²	146.8	96%	0.955	75%	0.75	S	S	*	*			trans	-147.5	154.2	142.1	-115.8	177.1	-177.1	-178.1	1	111.4
667	K	44.9	Very low	43.4	Very low	181 Å²	181	148.9 Å²	148.9	79%	0.787	75%	0.752	S	S	*	*			trans	-106.9	163.8	-167.5	-62.9	-178.5	174.4	-173.2	0	114
668	S	50.6	Low	43.6	Very low	129 Å²	129	151.6 Å²	151.6	90%	0.902	76%	0.755	S	S	*	*			trans	-145.7	157.5	133.7	-165.3	0	0	0	0	110.1
669	Q	45.7	Very low	43.9	Very low	116 Å²	116	153.7 Å²	153.7	54%	0.542	75%	0.752	S	S	.	*			trans	-157	142.9	-160.4	172.7	-177.2	-20	0	0	111	D671	Q669-D671 PolarHBondContact NE2-OD1 3.46Å; Q669-D671 VanDerWaalsContact NE2-OD1 3.16Å; Q669-D671 PolarHBondContact NE2-OD2 3.03Å
670	K	55.3	Low	44.2	Very low	208 Å²	208	154.5 Å²	154.5	90%	0.904	75%	0.747	S	S	*	*			trans	-162.3	120	149.9	-120.3	174.9	-176.5	-177.8	0	115.2
671	D	44.1	Very low	44.5	Very low	109 Å²	109	152.8 Å²	152.8	58%	0.583	74%	0.737	S	S	*	*			trans	-84.5	169.8	-171.3	-38.6	-83.7	0	0	0	113.9	Q669	Q669-D671 PolarHBondContact NE2-OD1 3.46Å; Q669-D671 VanDerWaalsContact NE2-OD1 3.16Å; Q669-D671 PolarHBondContact NE2-OD2 3.03Å
672	I	54.4	Low	44.8	Very low	162 Å²	162	152.6 Å²	152.6	83%	0.831	73%	0.733	S	S	*	*				163.4	152.9	125.6	-82.5	162.8	0	0	0	113.6
673	N	41.1	Very low	44.9	Very low	130 Å²	130	153.2 Å²	153.2	70%	0.695	74%	0.736	S	S	*	*			trans	-95.5	165.4	-166.6	-41.8	-60.2	0	0	0	115.3
674	H	48.5	Very low	45.3	Very low	180 Å²	180	151.2 Å²	151.2	83%	0.833	74%	0.743	S	S	*	*				175.3	-161.7	107.4	-98.7	-56.6	0	0	0	115.8
675	H	38	Very low	45.1	Very low	163 Å²	163	151 Å²	151	76%	0.755	75%	0.747	S	S	*	*			trans	-140.8	169.4	-148.3	-134.3	36.7	0	0	0	114.9
676	H	43.3	Very low	45.1	Very low	148 Å²	148	156.9 Å²	156.9	69%	0.685	75%	0.754	S	S	*	*			trans	83	133.1	158.3	-81.2	-37.5	0	0	0	125.7
677	H	40.3	Very low	44.8	Very low	160 Å²	160	150.7 Å²	150.7	74%	0.741	74%	0.744	S	S	*	*			trans	28.7	136.5	144.8	-64.2	-58.4	0	0	0	123.2
678	R	42.9	Very low	44.7	Very low	225 Å²	225	146.9 Å²	146.9	85%	0.849	74%	0.74	S	S	*	*				-168.9	153	74.7	-121.9	-180	174.9	171.9	-2.9	115.4
679	H	42.8	Very low	44.3	Very low	153 Å²	153	148.1 Å²	148.1	71%	0.708	73%	0.732	S	S	*	*			trans	14.3	158.7	140.1	-71	-36.2	0	0	0	123.9
680	Q	43.8	Very low	44.1	Very low	142 Å²	142	151.2 Å²	151.2	66%	0.664	74%	0.74	S	S	*	*			cis	-168	163.4	12.8	-126.2	167.1	-21.5	0	0	115.2
681	H	42.5	Very low	43.4	Very low	133 Å²	133	146.9 Å²	146.9	62%	0.616	73%	0.727	S	S	*	*			trans	60.1	154	152.7	-71.8	-60.5	0	0	0	121.6
682	H	46.4	Very low	43.1	Very low	138 Å²	138	146.1 Å²	146.1	64%	0.639	73%	0.73	S	S	*	*			cis	-155.4	145.7	-2.3	-129.8	-27.7	0	0	0	114.9
683	N	43.4	Very low	42.5	Very low	139 Å²	139	148.5 Å²	148.5	74%	0.743	73%	0.73	S	S	*	*			trans	51.5	137	143.3	-71.5	8.5	0	0	0	125.8
684	G	48.6	Very low	42.5	Very low	76 Å²	76	147.3 Å²	147.3	78%	0.784	73%	0.727	S	S	*	*			trans	174.2	126.6	158.7	0	0	0	0	0	110.6
685	T	40.8	Very low	42.1	Very low	124 Å²	124	145.2 Å²	145.2	76%	0.761	72%	0.721	S	S	*	*			trans	-138.9	141.7	-154.3	-38.7	0	0	0	0	116
686	R	43.4	Very low	42.4	Very low	226 Å²	226	146.1 Å²	146.1	85%	0.853	73%	0.725	S	S	*	*			trans	144.7	124.9	149.9	-82	-179.1	163.9	172	-4.1	110.1
687	T	40.3	Very low	42.4	Very low	122 Å²	122	143.5 Å²	143.5	75%	0.748	72%	0.724	S	S	*	*				63.7	131.9	56.8	71.6	0	0	0	0	112.5
688	S	42.2	Very low	42.8	Very low	102 Å²	102	148 Å²	148	71%	0.713	73%	0.734	S	S	*	*			cis	-170.1	-176.9	9.7	64.9	0	0	0	0	108.8
689	Q	42	Very low	42.9	Very low	155 Å²	155	143.6 Å²	143.6	72%	0.724	73%	0.732	S	S	*	*			cis	-168.9	178.2	-3.1	-136.6	169.3	1.9	0	0	111.5
690	Y	41.4	Very low	43.6	Very low	181 Å²	181	145.7 Å²	145.7	71%	0.71	74%	0.739	S	S	*	*			trans	73.4	121.6	145.5	-90.7	-64.4	0	0	0	125.7
691	N	42.2	Very low	44	Very low	117 Å²	117	147.2 Å²	147.2	63%	0.626	75%	0.746	S	S	*	*			trans	62.8	109.8	141.6	-83	1.3	0	0	0	126.1
692	S	37.3	Very low	44.6	Very low	93 Å²	93	156 Å²	156	65%	0.65	77%	0.774	S	S	*	*				57.9	157.4	94.6	-52	0	0	0	0	123.8
693	Y	41.7	Very low	44.5	Very low	212 Å²	212	156.9 Å²	156.9	83%	0.831	78%	0.781	S	S	*	*			trans	82.1	148	173.2	-66.4	-94.7	0	0	0	117.7
694	T	41.4	Very low	44.6	Very low	105 Å²	105	157.8 Å²	157.8	64%	0.644	78%	0.783	S	S	*	*			cis	-168.3	147.6	-31.8	-103.5	0	0	0	0	110.9
695	I	39.6	Very low	44.3	Very low	136 Å²	136	162.4 Å²	162.4	70%	0.697	78%	0.783	S	S	*	*			trans	19	121.3	156.4	-57.7	166.7	0	0	0	119
696	H	44.5	Very low	44.5	Very low	182 Å²	182	164.6 Å²	164.6	84%	0.843	78%	0.784	S	S	*	*				-158.3	143.3	112.5	-119	-58.3	0	0	0	116.1
697	S	42	Very low	44.6	Very low	93 Å²	93	160.8 Å²	160.8	65%	0.65	78%	0.78	S	S	*	*			trans	-87.4	156.1	175.5	51	0	0	0	0	113.6
698	R	49.2	Very low	44.9	Very low	254 Å²	254	163.4 Å²	163.4	96%	0.958	78%	0.782	S	S	*	*			trans	-160.8	136.3	132.8	-115.7	171.9	-172.5	175.9	3.4	113.6
699	T	46.5	Very low	45.1	Very low	133 Å²	133	167.8 Å²	167.8	82%	0.816	79%	0.787	S	S	*	*			trans	-98.6	153.6	169.3	40.4	0	0	0	0	110.8
700	K	55.9	Low	45.3	Very low	197 Å²	197	168.8 Å²	168.8	86%	0.857	79%	0.792	S	S	*	*				-170.3	154.5	123.2	-110.9	-172.8	174.8	-169.5	0	112.6
701	E	51.9	Low	45.6	Very low	173 Å²	173	167.8 Å²	167.8	81%	0.808	80%	0.798	S	S	*	*			trans	-82.8	162.9	-178.1	-50.6	108.3	123.7	0	0	114.1
702	R	55.6	Low	46	Very low	318 Å²	318	172.4 Å²	172.4	100%	1.2	81%	0.814	S	S	*	*			trans	-147.5	0	132.2	-138	-175.7	-164.3	-166.1	4.6	110.6

Retrieved 702 of 702 residues in 868.7 ms (Link to these results)

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