A0A077Z1V9_TRITR Loading...

Conserved oligomeric Golgi complex subunit 3

AlphaFold DB , UniProt , Accession A0A077Z1V9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 604 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	68.2	Low	81.2	Confident	198 Å²	198	120 Å²	120	98%	0.975	61%	0.605	S	S	*	*				0	-56.3	0	-83	-130	-73.9	0	0	112.4	E3 L4 E5	M1-E3 VanDerWaalsContact C-N 3.35Å; M1-E3 PolarHBondContact O-N 3.05Å; M1-L4 WeakPolarHBondContact O-CB 3.43Å; M1-L4 PolarHBondContact O-N 2.98Å; M1-E5 PolarHBondContact O-N 2.93Å
2	Q	74.4	Confident	81.7	Confident	151 Å²	151	123.3 Å²	123.3	71%	0.706	61%	0.605	S	S	*	*	H	α-helix	trans	-58.6	-42.6	179.4	-79.8	-175.2	-12.8	0	0	114	L4 E5 K6	Q2-L4 PolarHBondContact O-N 3.47Å; Q2-E5 PolarHBondContact O-N 2.95Å; Q2-K6 WeakPolarHBondContact O-CB 3.18Å; Q2-K6 PolarHBondContact O-N 3.03Å
3	E	74.2	Confident	82.5	Confident	159 Å²	159	120.7 Å²	120.7	74%	0.743	60%	0.595	S	S	*	*	H	α-helix	trans	-53	-41.5	172.5	-74.9	-71.1	140.3	0	0	112	M1 A7	M1-E3 VanDerWaalsContact C-N 3.35Å; M1-E3 PolarHBondContact O-N 3.05Å; E3-A7 WeakPolarHBondContact O-CB 3.48Å; E3-A7 PolarHBondContact O-N 2.78Å
4	L	74.3	Confident	83.1	Confident	138 Å²	138	118.2 Å²	118.2	72%	0.723	59%	0.585	S	S	*	*	H	α-helix	trans	-70.7	-39.6	179.8	-161.1	83.3	0	0	0	111.8	M1 Q2 S8	M1-L4 WeakPolarHBondContact O-CB 3.43Å; M1-L4 PolarHBondContact O-N 2.98Å; Q2-L4 PolarHBondContact O-N 3.47Å; L4-S8 WeakPolarHBondContact O-CB 3.17Å; L4-S8 PolarHBondContact O-N 2.8Å
5	E	79.9	Confident	83.6	Confident	126 Å²	126	121.1 Å²	121.1	59%	0.589	59%	0.592	S	S	*	*	H	α-helix	trans	-69.9	-45.8	177.8	-74.8	-179.4	146.8	0	0	112	M1 Q2 S8 S9	M1-E5 PolarHBondContact O-N 2.93Å; Q2-E5 PolarHBondContact O-N 2.95Å; E5-S8 PolarHBondContact O-N 2.97Å; E5-S9 WeakPolarHBondContact O-CB 3.37Å; E5-S9 PolarHBondContact O-N 3.33Å
6	K	84.5	Confident	84	Confident	141 Å²	141	117.6 Å²	117.6	61%	0.613	58%	0.584	S	S	*	*	H	α-helix	trans	-59	-48.9	173.3	-90.9	-176.1	176.2	176	0	110.6	Q2 S8 S9 L10	Q2-K6 WeakPolarHBondContact O-CB 3.18Å; Q2-K6 PolarHBondContact O-N 3.03Å; K6-S8 PolarHBondContact O-N 3.03Å; K6-S9 PolarHBondContact O-N 3.05Å; K6-S9 PolarHBondContact O-OG 3.14Å; K6-L10 PolarHBondContact O-N 3.21Å
7	A	85.8	Confident	84.5	Confident	36 Å²	36	118.8 Å²	118.8	30%	0.298	59%	0.585	S	S	.	*	H	α-helix	trans	-57.7	-48	174.9	0	0	0	0	0	111.4	E3 S9 L10 F11	E3-A7 WeakPolarHBondContact O-CB 3.48Å; E3-A7 PolarHBondContact O-N 2.78Å; A7-S9 VanDerWaalsContact C-N 3.28Å; A7-S9 PolarHBondContact O-N 3.19Å; A7-L10 PolarHBondContact O-N 2.69Å; A7-F11 HydrophobicContact CB-CD2 4.29Å; A7-F11 HydrophobicContact CB-CE2 4.16Å; A7-F11 WeakPolarHBondContact O-CB 3.4Å; A7-F11 WeakPolarHBondContact O-CD2 3.09Å; A7-F11 PolarHBondContact O-N 2.96Å
8	S	87.6	Confident	84.9	Confident	49 Å²	49	119.1 Å²	119.1	34%	0.343	58%	0.583	S	S	.	*	H	α-helix	trans	-57.8	-38.3	176.8	-178.7	0	0	0	0	112.7	L4 E5 K6 R12	L4-S8 WeakPolarHBondContact O-CB 3.17Å; L4-S8 PolarHBondContact O-N 2.8Å; E5-S8 PolarHBondContact O-N 2.97Å; K6-S8 PolarHBondContact O-N 3.03Å; S8-R12 WeakPolarHBondContact O-CB 3.42Å; S8-R12 PolarHBondContact O-N 2.93Å; S8-R12 PolarHBondContact OG-NH2 3.39Å
9	S	82	Confident	85.2	Confident	58 Å²	58	116 Å²	116	41%	0.406	57%	0.574	S	S	.	*	H	α-helix	trans	-68.9	-43.3	177.1	77.5	0	0	0	0	112.4	E5 K6 A7 R12 N13	E5-S9 WeakPolarHBondContact O-CB 3.37Å; E5-S9 PolarHBondContact O-N 3.33Å; K6-S9 PolarHBondContact O-N 3.05Å; K6-S9 PolarHBondContact O-OG 3.14Å; A7-S9 VanDerWaalsContact C-N 3.28Å; A7-S9 PolarHBondContact O-N 3.19Å; S9-R12 PolarHBondContact O-N 3Å; S9-N13 PolarHBondContact O-N 3.36Å
10	L	92.2	Very high	85.5	Confident	124 Å²	124	114.7 Å²	114.7	65%	0.649	57%	0.569	S	S	*	*	H	α-helix	trans	-62.3	-44.4	173.2	-90	159.3	0	0	0	110.7	K6 A7 R12 N13 L14	K6-L10 PolarHBondContact O-N 3.21Å; A7-L10 PolarHBondContact O-N 2.69Å; L10-R12 PolarHBondContact O-N 2.72Å; L10-N13 PolarHBondContact O-N 3.24Å; L10-L14 VanDerWaalsContact O-CB 3.24Å; L10-L14 WeakPolarHBondContact O-CB 3.2Å; L10-L14 PolarHBondContact O-N 3.25Å
11	F	90.5	Very high	85.9	Confident	140 Å²	140	114.1 Å²	114.1	61%	0.614	57%	0.568	S	S	*	*	H	α-helix	trans	-62.7	-39.1	176.6	-78.1	-61.5	0	0	0	112.7	A7 L14 K15	A7-F11 HydrophobicContact CB-CD2 4.29Å; A7-F11 HydrophobicContact CB-CE2 4.16Å; A7-F11 WeakPolarHBondContact O-CB 3.4Å; A7-F11 WeakPolarHBondContact O-CD2 3.09Å; A7-F11 PolarHBondContact O-N 2.96Å; F11-L14 PolarHBondContact O-N 2.93Å; F11-K15 VanDerWaalsContact O-CB 3.3Å; F11-K15 WeakPolarHBondContact O-CB 3.35Å; F11-K15 PolarHBondContact O-N 2.87Å
12	R	87.3	Confident	87.1	Confident	160 Å²	160	110.2 Å²	110.2	60%	0.604	55%	0.551	S	S	*	*	H	α-helix	trans	-64.7	-44.6	173.4	-94	179	-84.3	135.7	-6	112.3	S8 S9 L10 L14 K15 S16	S8-R12 WeakPolarHBondContact O-CB 3.42Å; S8-R12 PolarHBondContact O-N 2.93Å; S8-R12 PolarHBondContact OG-NH2 3.39Å; S9-R12 PolarHBondContact O-N 3Å; L10-R12 PolarHBondContact O-N 2.72Å; R12-L14 VanDerWaalsContact C-N 3.35Å; R12-K15 PolarHBondContact O-N 3Å; R12-S16 PolarHBondContact O-N 2.87Å
13	N	91.1	Very high	87.9	Confident	89 Å²	89	108 Å²	108	48%	0.476	54%	0.542	S	S	.	.	H	α-helix	trans	-62.4	-44.2	175.7	-166.4	-52.9	0	0	0	110.9	S9 L10 K15 S16 K17	S9-N13 PolarHBondContact O-N 3.36Å; L10-N13 PolarHBondContact O-N 3.24Å; N13-K15 PolarHBondContact O-N 2.9Å; N13-S16 PolarHBondContact O-N 3.13Å; N13-K17 WeakPolarHBondContact O-CG 3.4Å; N13-K17 PolarHBondContact O-N 3.23Å; N13-K17 VanDerWaalsContact OD1-CE 3.25Å; N13-K17 WeakPolarHBondContact OD1-CE 3.48Å
14	L	90.9	Very high	88.8	Confident	86 Å²	86	109.5 Å²	109.5	45%	0.45	54%	0.541	S	S	.	.	H	α-helix	trans	-59.5	-45.9	175.2	-168.6	68.8	0	0	0	111	L10 F11 R12 S16 K17 F18	L10-L14 VanDerWaalsContact O-CB 3.24Å; L10-L14 WeakPolarHBondContact O-CB 3.2Å; L10-L14 PolarHBondContact O-N 3.25Å; F11-L14 PolarHBondContact O-N 2.93Å; R12-L14 VanDerWaalsContact C-N 3.35Å; L14-S16 PolarHBondContact O-N 3.16Å; L14-K17 PolarHBondContact O-N 3.39Å; L14-F18 HydrophobicContact CD1-CD2 4.27Å; L14-F18 HydrophobicContact CD1-CE2 4.1Å; L14-F18 HydrophobicContact CD2-CE2 4.48Å; L14-F18 HydrophobicContact CG-CD2 3.96Å; L14-F18 HydrophobicContact CG-CE2 4.02Å; L14-F18 WeakPolarHBondContact O-CB 3.28Å; L14-F18 WeakPolarHBondContact O-CD2 3.31Å; L14-F18 PolarHBondContact O-N 3.43Å
15	K	90.8	Very high	89.6	Confident	161 Å²	161	106.7 Å²	106.7	70%	0.7	53%	0.53	S	S	*	.	H	α-helix	trans	-61.4	-43	176.2	-173.7	178.9	-179.5	-179.6	0	112.4	F11 R12 N13 F18 S19	F11-K15 VanDerWaalsContact O-CB 3.3Å; F11-K15 WeakPolarHBondContact O-CB 3.35Å; F11-K15 PolarHBondContact O-N 2.87Å; R12-K15 PolarHBondContact O-N 3Å; N13-K15 PolarHBondContact O-N 2.9Å; K15-F18 PolarHBondContact O-N 2.9Å; K15-S19 PolarHBondContact O-N 3.41Å
16	S	90.3	Very high	90.2	Very high	66 Å²	66	103.6 Å²	103.6	46%	0.462	52%	0.522	S	S	.	.	H	α-helix	trans	-61.2	-49.2	175.5	-169	0	0	0	0	111.2	R12 N13 L14 F18 S19 D20	R12-S16 PolarHBondContact O-N 2.87Å; N13-S16 PolarHBondContact O-N 3.13Å; L14-S16 PolarHBondContact O-N 3.16Å; S16-F18 VanDerWaalsContact C-N 3.3Å; S16-F18 PolarHBondContact O-N 3.36Å; S16-S19 WeakPolarHBondContact O-CB 3.48Å; S16-S19 PolarHBondContact O-N 3.26Å; S16-S19 VanDerWaalsContact O-N 3.11Å; S16-D20 PolarHBondContact O-N 3.11Å
17	K	92.7	Very high	90.6	Very high	137 Å²	137	99.9 Å²	99.9	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-60.3	-39	176.2	-74	-176.8	176	-178.4	0	112.2	N13 L14 L21	N13-K17 WeakPolarHBondContact O-CG 3.4Å; N13-K17 PolarHBondContact O-N 3.23Å; N13-K17 VanDerWaalsContact OD1-CE 3.25Å; N13-K17 WeakPolarHBondContact OD1-CE 3.48Å; L14-K17 PolarHBondContact O-N 3.39Å; K17-L21 WeakPolarHBondContact O-CB 3.38Å; K17-L21 PolarHBondContact O-N 2.95Å
18	F	92	Very high	91	Very high	125 Å²	125	103.8 Å²	103.8	55%	0.548	53%	0.529	S	S	.	.	H	α-helix	trans	-63.8	-41.1	173.8	-98.8	-77.1	0	0	0	112.2	L14 K15 S16 L21 L22	L14-F18 HydrophobicContact CD1-CD2 4.27Å; L14-F18 HydrophobicContact CD1-CE2 4.1Å; L14-F18 HydrophobicContact CD2-CE2 4.48Å; L14-F18 HydrophobicContact CG-CD2 3.96Å; L14-F18 HydrophobicContact CG-CE2 4.02Å; L14-F18 WeakPolarHBondContact O-CB 3.28Å; L14-F18 WeakPolarHBondContact O-CD2 3.31Å; L14-F18 PolarHBondContact O-N 3.43Å; K15-F18 PolarHBondContact O-N 2.9Å; S16-F18 VanDerWaalsContact C-N 3.3Å; S16-F18 PolarHBondContact O-N 3.36Å; F18-L21 PolarHBondContact O-N 3.1Å; F18-L22 WeakPolarHBondContact O-CB 3.23Å; F18-L22 WeakPolarHBondContact O-CD1 3.35Å; F18-L22 VanDerWaalsContact O-CG 3.24Å; F18-L22 WeakPolarHBondContact O-CG 3.44Å; F18-L22 PolarHBondContact O-N 2.94Å
19	S	89.7	Confident	91.2	Very high	60 Å²	60	108.6 Å²	108.6	42%	0.42	54%	0.541	S	S	.	.	H	α-helix	trans	-66.1	-44.6	177.5	-166.2	0	0	0	0	112.5	K15 S16 L21 L22 I23	K15-S19 PolarHBondContact O-N 3.41Å; S16-S19 WeakPolarHBondContact O-CB 3.48Å; S16-S19 PolarHBondContact O-N 3.26Å; S16-S19 VanDerWaalsContact O-N 3.11Å; S19-L21 VanDerWaalsContact C-N 3.33Å; S19-L22 WeakPolarHBondContact O-CB 3.29Å; S19-L22 PolarHBondContact O-N 3.43Å; S19-I23 WeakPolarHBondContact O-CG1 3.34Å; S19-I23 PolarHBondContact O-N 3.38Å
20	D	92.1	Very high	91.6	Very high	89 Å²	89	110 Å²	110	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-64.4	-40.8	176.8	-69.1	-23.6	0	0	0	111.3	S16 L22 I23 R24	S16-D20 PolarHBondContact O-N 3.11Å; D20-L22 VanDerWaalsContact C-N 3.34Å; D20-I23 PolarHBondContact O-N 3.04Å; D20-R24 WeakPolarHBondContact O-CB 3.37Å; D20-R24 WeakPolarHBondContact O-CG 3.34Å; D20-R24 PolarHBondContact O-N 3.24Å
21	L	93.4	Very high	91.6	Very high	104 Å²	104	106.3 Å²	106.3	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-62	-42.8	174.3	-171.1	73.6	0	0	0	110.7	K17 F18 S19 R24 T25	K17-L21 WeakPolarHBondContact O-CB 3.38Å; K17-L21 PolarHBondContact O-N 2.95Å; F18-L21 PolarHBondContact O-N 3.1Å; S19-L21 VanDerWaalsContact C-N 3.33Å; L21-R24 PolarHBondContact O-N 3.08Å; L21-T25 WeakPolarHBondContact O-CB 3.25Å; L21-T25 PolarHBondContact O-N 3.46Å; L21-T25 PolarHBondContact O-OG1 3.19Å
22	L	92.9	Very high	91.6	Very high	116 Å²	116	102.3 Å²	102.3	61%	0.607	52%	0.52	S	S	*	.	H	α-helix	trans	-61.1	-45.8	177.5	-79.7	164.2	0	0	0	112.4	F18 S19 D20 T25 S26	F18-L22 WeakPolarHBondContact O-CB 3.23Å; F18-L22 WeakPolarHBondContact O-CD1 3.35Å; F18-L22 VanDerWaalsContact O-CG 3.24Å; F18-L22 WeakPolarHBondContact O-CG 3.44Å; F18-L22 PolarHBondContact O-N 2.94Å; S19-L22 WeakPolarHBondContact O-CB 3.29Å; S19-L22 PolarHBondContact O-N 3.43Å; D20-L22 VanDerWaalsContact C-N 3.34Å; L22-T25 PolarHBondContact O-N 3.46Å; L22-S26 PolarHBondContact O-N 3.49Å
23	I	91.5	Very high	91.9	Very high	103 Å²	103	98.1 Å²	98.1	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-65.5	-44.1	178.9	-65.9	166.7	0	0	0	111.4	S19 D20 T25 S26 S27	S19-I23 WeakPolarHBondContact O-CG1 3.34Å; S19-I23 PolarHBondContact O-N 3.38Å; D20-I23 PolarHBondContact O-N 3.04Å; I23-T25 VanDerWaalsContact C-N 3.3Å; I23-T25 PolarHBondContact O-N 3.21Å; I23-S26 PolarHBondContact O-N 2.97Å; I23-S26 PolarHBondContact O-OG 3.25Å; I23-S27 PolarHBondContact O-N 2.86Å; I23-S27 PolarHBondContact O-OG 3.25Å
24	R	92.6	Very high	91.9	Very high	191 Å²	191	100.6 Å²	100.6	72%	0.721	52%	0.518	S	S	*	.	H	α-helix	trans	-64.4	-37.9	175.5	-71.7	-176.5	-176.6	-167.7	1.7	111.8	D20 L21 S27 L28	D20-R24 WeakPolarHBondContact O-CB 3.37Å; D20-R24 WeakPolarHBondContact O-CG 3.34Å; D20-R24 PolarHBondContact O-N 3.24Å; L21-R24 PolarHBondContact O-N 3.08Å; R24-S27 WeakPolarHBondContact CA-OG 3.28Å; R24-S27 PolarHBondContact O-OG 3.06Å; R24-S27 VanDerWaalsContact O-OG 3.1Å; R24-L28 VanDerWaalsContact O-CB 3.24Å; R24-L28 WeakPolarHBondContact O-CB 3.45Å; R24-L28 PolarHBondContact O-N 3.48Å
25	T	92.9	Very high	91.9	Very high	80 Å²	80	102.2 Å²	102.2	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-68.6	-39.2	177.5	-54.1	0	0	0	0	111.1	L21 L22 I23 Y29	L21-T25 WeakPolarHBondContact O-CB 3.25Å; L21-T25 PolarHBondContact O-N 3.46Å; L21-T25 PolarHBondContact O-OG1 3.19Å; L22-T25 PolarHBondContact O-N 3.46Å; I23-T25 VanDerWaalsContact C-N 3.3Å; I23-T25 PolarHBondContact O-N 3.21Å; T25-Y29 VanDerWaalsContact O-CB 3.25Å; T25-Y29 WeakPolarHBondContact O-CB 3.49Å; T25-Y29 PolarHBondContact O-N 3.45Å
26	S	91.4	Very high	91.9	Very high	60 Å²	60	98.1 Å²	98.1	42%	0.42	52%	0.515	S	S	.	.	H	α-helix	trans	-69.5	-45.9	178.1	85.4	0	0	0	0	112.1	L22 I23 L28 Y29 D30	L22-S26 PolarHBondContact O-N 3.49Å; I23-S26 PolarHBondContact O-N 2.97Å; I23-S26 PolarHBondContact O-OG 3.25Å; S26-L28 VanDerWaalsContact C-N 3.33Å; S26-L28 PolarHBondContact O-N 2.92Å; S26-Y29 CarbonylContact O-C 3.57Å; S26-Y29 WeakPolarHBondContact O-CA 3.47Å; S26-Y29 WeakPolarHBondContact O-CB 3.35Å; S26-Y29 PolarHBondContact O-N 3.49Å; S26-Y29 VanDerWaalsContact O-N 3.08Å; S26-D30 VanDerWaalsContact O-CG 3.28Å; S26-D30 PolarHBondContact O-N 2.91Å
27	S	93.3	Very high	91.8	Very high	63 Å²	63	97.5 Å²	97.5	44%	0.441	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-38.9	177.4	52.2	0	0	0	0	112.6	I23 R24 Y29 D30 A31	I23-S27 PolarHBondContact O-N 2.86Å; I23-S27 PolarHBondContact O-OG 3.25Å; R24-S27 WeakPolarHBondContact CA-OG 3.28Å; R24-S27 PolarHBondContact O-OG 3.06Å; R24-S27 VanDerWaalsContact O-OG 3.1Å; S27-Y29 VanDerWaalsContact C-N 3.34Å; S27-D30 PolarHBondContact O-N 3.32Å; S27-A31 WeakPolarHBondContact O-CB 3.27Å; S27-A31 PolarHBondContact O-N 3.23Å
28	L	93.1	Very high	91.6	Very high	118 Å²	118	95.3 Å²	95.3	62%	0.618	51%	0.509	S	S	*	.	H	α-helix	trans	-66.1	-38	172.7	-170.8	126.9	0	0	0	111.5	R24 S26 C32	R24-L28 VanDerWaalsContact O-CB 3.24Å; R24-L28 WeakPolarHBondContact O-CB 3.45Å; R24-L28 PolarHBondContact O-N 3.48Å; S26-L28 VanDerWaalsContact C-N 3.33Å; S26-L28 PolarHBondContact O-N 2.92Å; L28-C32 VanDerWaalsContact O-CB 3.31Å; L28-C32 WeakPolarHBondContact O-CB 3.42Å; L28-C32 PolarHBondContact O-N 3.29Å; L28-C32 PolarHBondContact O-SG 2.96Å
29	Y	91.8	Very high	91.4	Very high	150 Å²	150	95.1 Å²	95.1	59%	0.588	51%	0.51	S	S	*	.	H	α-helix	trans	-63.4	-43.8	174.3	-174	-100.4	0	0	0	112.2	T25 S26 S27 C32 N33	T25-Y29 VanDerWaalsContact O-CB 3.25Å; T25-Y29 WeakPolarHBondContact O-CB 3.49Å; T25-Y29 PolarHBondContact O-N 3.45Å; S26-Y29 CarbonylContact O-C 3.57Å; S26-Y29 WeakPolarHBondContact O-CA 3.47Å; S26-Y29 WeakPolarHBondContact O-CB 3.35Å; S26-Y29 PolarHBondContact O-N 3.49Å; S26-Y29 VanDerWaalsContact O-N 3.08Å; S27-Y29 VanDerWaalsContact C-N 3.34Å; Y29-C32 PolarHBondContact O-N 3.06Å; Y29-N33 VanDerWaalsContact CD1-ND2 3.27Å; Y29-N33 WeakPolarHBondContact CD1-ND2 3.38Å; Y29-N33 WeakPolarHBondContact CE1-ND2 3.3Å; Y29-N33 VanDerWaalsContact O-CG 3.23Å; Y29-N33 PolarHBondContact O-N 2.9Å; Y29-N33 PolarHBondContact O-ND2 3.47Å
30	D	91.7	Very high	91.3	Very high	89 Å²	89	96.3 Å²	96.3	48%	0.476	52%	0.515	S	S	.	.	H	α-helix	trans	-64.2	-46.3	177.5	-65	-28.8	0	0	0	111.6	S26 S27 C32 N33 E34	S26-D30 VanDerWaalsContact O-CG 3.28Å; S26-D30 PolarHBondContact O-N 2.91Å; S27-D30 PolarHBondContact O-N 3.32Å; D30-C32 VanDerWaalsContact C-N 3.33Å; D30-C32 PolarHBondContact O-N 3.18Å; D30-N33 WeakPolarHBondContact O-CB 3.5Å; D30-N33 PolarHBondContact O-N 2.9Å; D30-N33 VanDerWaalsContact O-N 3.11Å; D30-E34 PolarHBondContact O-N 2.91Å
31	A	92.1	Very high	90.9	Very high	45 Å²	45	96.2 Å²	96.2	37%	0.372	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-41.1	175	0	0	0	0	0	112	S27 N33 E34 L35	S27-A31 WeakPolarHBondContact O-CB 3.27Å; S27-A31 PolarHBondContact O-N 3.23Å; A31-N33 VanDerWaalsContact C-N 3.32Å; A31-N33 PolarHBondContact O-N 3.43Å; A31-E34 PolarHBondContact O-N 3.5Å; A31-L35 WeakPolarHBondContact O-CB 3.32Å; A31-L35 WeakPolarHBondContact O-CD1 3.32Å; A31-L35 PolarHBondContact O-N 3.35Å
32	C	91.2	Very high	90.3	Very high	57 Å²	57	97.4 Å²	97.4	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-62	-39	173.4	-77.3	0	0	0	0	111.8	L28 Y29 D30 T36	L28-C32 VanDerWaalsContact O-CB 3.31Å; L28-C32 WeakPolarHBondContact O-CB 3.42Å; L28-C32 PolarHBondContact O-N 3.29Å; L28-C32 PolarHBondContact O-SG 2.96Å; Y29-C32 PolarHBondContact O-N 3.06Å; D30-C32 VanDerWaalsContact C-N 3.33Å; D30-C32 PolarHBondContact O-N 3.18Å; C32-T36 WeakPolarHBondContact O-CB 3.3Å; C32-T36 PolarHBondContact O-N 3.46Å; C32-T36 PolarHBondContact O-OG1 3.36Å
33	N	91.7	Very high	89.8	Confident	71 Å²	71	96 Å²	96	38%	0.38	51%	0.508	S	S	.	.	H	α-helix	trans	-67.5	-41.4	177.2	-70.7	-27.4	0	0	0	112.2	Y29 D30 A31 T36 A37	Y29-N33 VanDerWaalsContact CD1-ND2 3.27Å; Y29-N33 WeakPolarHBondContact CD1-ND2 3.38Å; Y29-N33 WeakPolarHBondContact CE1-ND2 3.3Å; Y29-N33 VanDerWaalsContact O-CG 3.23Å; Y29-N33 PolarHBondContact O-N 2.9Å; Y29-N33 PolarHBondContact O-ND2 3.47Å; D30-N33 WeakPolarHBondContact O-CB 3.5Å; D30-N33 PolarHBondContact O-N 2.9Å; D30-N33 VanDerWaalsContact O-N 3.11Å; A31-N33 VanDerWaalsContact C-N 3.32Å; A31-N33 PolarHBondContact O-N 3.43Å; N33-T36 PolarHBondContact O-N 2.85Å; N33-A37 WeakPolarHBondContact O-CB 3.47Å; N33-A37 PolarHBondContact O-N 3.22Å
34	E	91.5	Very high	89.2	Confident	142 Å²	142	95 Å²	95	66%	0.664	51%	0.509	S	S	*	.	H	α-helix	trans	-62.4	-47.3	173.8	-74.3	-175.5	171.6	0	0	111.4	D30 A31 T36 A37 D38	D30-E34 PolarHBondContact O-N 2.91Å; A31-E34 PolarHBondContact O-N 3.5Å; E34-T36 VanDerWaalsContact C-N 3.3Å; E34-T36 PolarHBondContact O-N 2.61Å; E34-A37 WeakPolarHBondContact O-CB 3.44Å; E34-A37 PolarHBondContact O-N 2.74Å; E34-A37 VanDerWaalsContact O-N 3.16Å; E34-D38 PolarHBondContact O-N 3.1Å
35	L	92.2	Very high	88.4	Confident	120 Å²	120	87.3 Å²	87.3	63%	0.628	48%	0.481	S	S	*	.	H	α-helix	trans	-59.2	-40.4	175	-88	151.4	0	0	0	112.1	A31 D38 E39	A31-L35 WeakPolarHBondContact O-CB 3.32Å; A31-L35 WeakPolarHBondContact O-CD1 3.32Å; A31-L35 PolarHBondContact O-N 3.35Å; L35-D38 PolarHBondContact O-N 3.33Å; L35-E39 VanDerWaalsContact O-CB 3.29Å; L35-E39 WeakPolarHBondContact O-CB 3.43Å; L35-E39 PolarHBondContact O-N 2.96Å
36	T	90.1	Very high	87.6	Confident	75 Å²	75	86.8 Å²	86.8	46%	0.46	48%	0.477	S	S	.	.	H	α-helix	trans	-67.8	-39.1	177	-51.5	0	0	0	0	110.9	C32 N33 E34 E39 V40	C32-T36 WeakPolarHBondContact O-CB 3.3Å; C32-T36 PolarHBondContact O-N 3.46Å; C32-T36 PolarHBondContact O-OG1 3.36Å; N33-T36 PolarHBondContact O-N 2.85Å; E34-T36 VanDerWaalsContact C-N 3.3Å; E34-T36 PolarHBondContact O-N 2.61Å; T36-E39 PolarHBondContact O-N 3.38Å; T36-V40 VanDerWaalsContact O-CG2 3.3Å; T36-V40 WeakPolarHBondContact O-CG2 3.45Å; T36-V40 PolarHBondContact O-N 3.49Å
37	A	88	Confident	86.7	Confident	53 Å²	53	93.4 Å²	93.4	44%	0.438	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-44.8	175.5	0	0	0	0	0	111.5	N33 E34 V40 V41	N33-A37 WeakPolarHBondContact O-CB 3.47Å; N33-A37 PolarHBondContact O-N 3.22Å; E34-A37 WeakPolarHBondContact O-CB 3.44Å; E34-A37 PolarHBondContact O-N 2.74Å; E34-A37 VanDerWaalsContact O-N 3.16Å; A37-V40 PolarHBondContact O-N 3.28Å; A37-V41 WeakPolarHBondContact O-CG2 3.26Å; A37-V41 PolarHBondContact O-N 3.2Å
38	D	87.8	Confident	85.5	Confident	91 Å²	91	93.4 Å²	93.4	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-62.6	-44.1	174.8	-84.1	-5	0	0	0	111.4	E34 L35 V40 V41 Y42	E34-D38 PolarHBondContact O-N 3.1Å; L35-D38 PolarHBondContact O-N 3.33Å; D38-V40 VanDerWaalsContact C-N 3.29Å; D38-V40 PolarHBondContact O-N 2.65Å; D38-V41 PolarHBondContact O-N 3.46Å; D38-V41 VanDerWaalsContact O-N 3.13Å; D38-Y42 HydrophobicContact CB-CD2 4.32Å; D38-Y42 HydrophobicContact CB-CE2 4.25Å; D38-Y42 WeakPolarHBondContact O-CD2 3.45Å; D38-Y42 PolarHBondContact O-N 3Å
39	E	88.5	Confident	84.4	Confident	120 Å²	120	90.4 Å²	90.4	56%	0.561	47%	0.468	S	S	*	.	H	α-helix	trans	-58.2	-41.1	175.8	-179.6	175.3	-176.9	0	0	111.4	L35 T36 N43	L35-E39 VanDerWaalsContact O-CB 3.29Å; L35-E39 WeakPolarHBondContact O-CB 3.43Å; L35-E39 PolarHBondContact O-N 2.96Å; T36-E39 PolarHBondContact O-N 3.38Å; E39-N43 WeakPolarHBondContact CG-ND2 3.39Å; E39-N43 VanDerWaalsContact O-CB 3.25Å; E39-N43 WeakPolarHBondContact O-CB 3.23Å; E39-N43 PolarHBondContact O-N 3.25Å; E39-N43 PolarHBondContact O-ND2 3.49Å
40	V	86.9	Confident	83.3	Confident	86 Å²	86	89 Å²	89	52%	0.521	47%	0.47	S	S	.	.	H	α-helix	trans	-63.4	-44.1	175.1	170	0	0	0	0	111.1	T36 A37 D38 N43 C44	T36-V40 VanDerWaalsContact O-CG2 3.3Å; T36-V40 WeakPolarHBondContact O-CG2 3.45Å; T36-V40 PolarHBondContact O-N 3.49Å; A37-V40 PolarHBondContact O-N 3.28Å; D38-V40 VanDerWaalsContact C-N 3.29Å; D38-V40 PolarHBondContact O-N 2.65Å; V40-N43 PolarHBondContact O-N 3.43Å; V40-C44 VanDerWaalsContact O-CB 3.31Å; V40-C44 WeakPolarHBondContact O-CB 3.48Å; V40-C44 PolarHBondContact O-N 2.97Å; V40-C44 PolarHBondContact O-SG 2.89Å
41	V	83.9	Confident	82.1	Confident	86 Å²	86	90.5 Å²	90.5	52%	0.521	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-45	178.4	173.9	0	0	0	0	111.3	A37 D38 C44 F45	A37-V41 WeakPolarHBondContact O-CG2 3.26Å; A37-V41 PolarHBondContact O-N 3.2Å; D38-V41 PolarHBondContact O-N 3.46Å; D38-V41 VanDerWaalsContact O-N 3.13Å; V41-C44 PolarHBondContact O-N 3.32Å; V41-F45 WeakPolarHBondContact O-CB 3.49Å; V41-F45 PolarHBondContact O-N 3.36Å
42	Y	82.3	Confident	80.7	Confident	130 Å²	130	88.8 Å²	88.8	51%	0.51	46%	0.458	S	S	.	.	H	α-helix	trans	-66.7	-40.1	177.2	-76	-64	0	0	0	112.3	D38 F45 V46	D38-Y42 HydrophobicContact CB-CD2 4.32Å; D38-Y42 HydrophobicContact CB-CE2 4.25Å; D38-Y42 WeakPolarHBondContact O-CD2 3.45Å; D38-Y42 PolarHBondContact O-N 3Å; Y42-F45 CarbonylContact O-C 3.58Å; Y42-F45 WeakPolarHBondContact O-CB 3.27Å; Y42-F45 PolarHBondContact O-N 2.67Å; Y42-V46 WeakPolarHBondContact O-CB 3.37Å; Y42-V46 WeakPolarHBondContact O-CG2 3.03Å; Y42-V46 PolarHBondContact O-N 2.99Å
43	N	81	Confident	79.4	Confident	87 Å²	87	87 Å²	87	47%	0.465	44%	0.444	S	S	.	.	H	α-helix	trans	-64.9	-41.3	174.8	-86.3	-66	0	0	0	111.8	E39 V40 F45 V46 R47	E39-N43 WeakPolarHBondContact CG-ND2 3.39Å; E39-N43 VanDerWaalsContact O-CB 3.25Å; E39-N43 WeakPolarHBondContact O-CB 3.23Å; E39-N43 PolarHBondContact O-N 3.25Å; E39-N43 PolarHBondContact O-ND2 3.49Å; V40-N43 PolarHBondContact O-N 3.43Å; N43-F45 VanDerWaalsContact C-N 3.3Å; N43-F45 PolarHBondContact O-N 3.39Å; N43-V46 PolarHBondContact O-N 3.39Å; N43-R47 WeakPolarHBondContact O-CB 3.17Å; N43-R47 PolarHBondContact O-N 2.97Å
44	C	78.8	Confident	78	Confident	81 Å²	81	85.6 Å²	85.6	55%	0.547	44%	0.439	S	S	.	.	H	α-helix	trans	-59.2	-42.4	171.3	-76.7	0	0	0	0	111.2	V40 V41 W48	V40-C44 VanDerWaalsContact O-CB 3.31Å; V40-C44 WeakPolarHBondContact O-CB 3.48Å; V40-C44 PolarHBondContact O-N 2.97Å; V40-C44 PolarHBondContact O-SG 2.89Å; V41-C44 PolarHBondContact O-N 3.32Å; C44-W48 VanDerWaalsContact O-CB 3.26Å; C44-W48 WeakPolarHBondContact O-CB 3.29Å; C44-W48 PolarHBondContact O-N 2.86Å
45	F	76.6	Confident	76.4	Confident	29 Å²	29	81.6 Å²	81.6	13%	0.127	43%	0.43	C	S	.	.	H	α-helix	trans	-66.6	-44.6	177.1	178.5	-118.7	0	0	0	113.2	V41 Y42 N43 W48 L49 F91 Y96	V41-F45 WeakPolarHBondContact O-CB 3.49Å; V41-F45 PolarHBondContact O-N 3.36Å; Y42-F45 CarbonylContact O-C 3.58Å; Y42-F45 WeakPolarHBondContact O-CB 3.27Å; Y42-F45 PolarHBondContact O-N 2.67Å; N43-F45 VanDerWaalsContact C-N 3.3Å; N43-F45 PolarHBondContact O-N 3.39Å; F45-W48 HydrophobicContact CD2-CE3 4.03Å; F45-W48 HydrophobicContact CD2-CZ3 4.47Å; F45-W48 AromaticContact CE2-CE3 3.86Å; F45-W48 HydrophobicContact CE2-CE3 3.86Å; F45-W48 AromaticContact CE2-CZ3 3.87Å; F45-W48 HydrophobicContact CE2-CZ3 3.87Å; F45-W48 CarbonylContact O-C 3.6Å; F45-W48 WeakPolarHBondContact O-CB 3.5Å; F45-W48 PolarHBondContact O-N 3.12Å; F45-L49 HydrophobicContact CD1-CD1 3.99Å; F45-L49 HydrophobicContact CD2-CG 4.41Å; F45-L49 HydrophobicContact CE1-CD1 3.41Å; F45-L49 VanDerWaalsContact CE1-CD1 3.41Å; F45-L49 HydrophobicContact CE1-CG 4.19Å; F45-L49 HydrophobicContact CE2-CD1 4.01Å; F45-L49 HydrophobicContact CE2-CD2 4.3Å; F45-L49 HydrophobicContact CE2-CG 3.86Å; F45-L49 HydrophobicContact CZ-CD1 3.43Å; F45-L49 VanDerWaalsContact CZ-CD1 3.43Å; F45-L49 HydrophobicContact CZ-CD2 4.19Å; F45-L49 HydrophobicContact CZ-CG 3.79Å; F45-L49 WeakPolarHBondContact O-CB 3.49Å; F45-L49 PolarHBondContact O-N 3.25Å; F45-F91 HydrophobicContact CD2-CB 4.09Å; F45-F91 AromaticContact CD2-CD1 3.71Å; F45-F91 HydrophobicContact CD2-CD1 3.71Å; F45-F91 HydrophobicContact CD2-CE1 4.34Å; F45-F91 AromaticContact CD2-CG 3.91Å; F45-F91 HydrophobicContact CD2-CG 3.91Å; F45-F91 HydrophobicContact CE2-CB 3.53Å; F45-F91 AromaticContact CE2-CD1 3.87Å; F45-F91 HydrophobicContact CE2-CD1 3.87Å; F45-F91 AromaticContact CE2-CG 3.87Å; F45-F91 HydrophobicContact CE2-CG 3.87Å; F45-F91 HydrophobicContact CZ-CB 4.42Å; F45-Y96 HydrophobicContact CE1-CE2 4.47Å; F45-Y96 HydrophobicContact CZ-CE2 4.31Å
46	V	75.3	Confident	74.9	Confident	69 Å²	69	83 Å²	83	42%	0.418	43%	0.433	S	S	.	.	H	α-helix	trans	-65	-44	176.4	169.8	0	0	0	0	110.5	Y42 N43 W48 L49 L50	Y42-V46 WeakPolarHBondContact O-CB 3.37Å; Y42-V46 WeakPolarHBondContact O-CG2 3.03Å; Y42-V46 PolarHBondContact O-N 2.99Å; N43-V46 PolarHBondContact O-N 3.39Å; V46-W48 VanDerWaalsContact C-N 3.26Å; V46-W48 PolarHBondContact O-N 3.38Å; V46-L49 PolarHBondContact O-N 3.48Å; V46-L50 HydrophobicContact CG1-CD1 3.84Å; V46-L50 HydrophobicContact CG1-CG 4.28Å; V46-L50 WeakPolarHBondContact O-CB 3.4Å; V46-L50 WeakPolarHBondContact O-CG 3.45Å; V46-L50 PolarHBondContact O-N 3.32Å
47	R	72.6	Confident	73.7	Confident	199 Å²	199	80.8 Å²	80.8	75%	0.751	42%	0.42	S	S	*	.	H	α-helix	trans	-61.3	-39.5	175.6	-169	173.2	-174.5	171.6	1.4	110.8	N43 F51	N43-R47 WeakPolarHBondContact O-CB 3.17Å; N43-R47 PolarHBondContact O-N 2.97Å; R47-F51 WeakPolarHBondContact O-CB 3.38Å; R47-F51 PolarHBondContact O-N 2.81Å
48	W	68.5	Low	72.6	Confident	63 Å²	63	79.2 Å²	79.2	24%	0.239	40%	0.404	C	S	.	.	H	α-helix	trans	-66.6	-42	174	175.8	88.1	0	0	0	112.9	C44 F45 V46 F51 S52 F53 S87 F91	C44-W48 VanDerWaalsContact O-CB 3.26Å; C44-W48 WeakPolarHBondContact O-CB 3.29Å; C44-W48 PolarHBondContact O-N 2.86Å; F45-W48 HydrophobicContact CD2-CE3 4.03Å; F45-W48 HydrophobicContact CD2-CZ3 4.47Å; F45-W48 AromaticContact CE2-CE3 3.86Å; F45-W48 HydrophobicContact CE2-CE3 3.86Å; F45-W48 AromaticContact CE2-CZ3 3.87Å; F45-W48 HydrophobicContact CE2-CZ3 3.87Å; F45-W48 CarbonylContact O-C 3.6Å; F45-W48 WeakPolarHBondContact O-CB 3.5Å; F45-W48 PolarHBondContact O-N 3.12Å; V46-W48 VanDerWaalsContact C-N 3.26Å; V46-W48 PolarHBondContact O-N 3.38Å; W48-F51 PolarHBondContact O-N 2.84Å; W48-S52 PolarHBondContact NE1-OG 2.83Å; W48-S52 VanDerWaalsContact O-CB 3.27Å; W48-S52 WeakPolarHBondContact O-CB 3.42Å; W48-S52 PolarHBondContact O-N 2.92Å; W48-S52 PolarHBondContact O-OG 3.48Å; W48-F53 HydrophobicContact CH2-CD2 4.34Å; W48-F53 AromaticContact CH2-CE2 3.76Å; W48-F53 HydrophobicContact CH2-CE2 3.76Å; W48-F53 HydrophobicContact CZ2-CE2 4.35Å; W48-F53 HydrophobicContact CZ3-CD2 4.33Å; W48-F53 HydrophobicContact CZ3-CE2 4.18Å; W48-S87 WeakPolarHBondContact CZ2-O 3.32Å; W48-F91 HydrophobicContact CH2-CB 4.34Å; W48-F91 HydrophobicContact CZ3-CB 4.16Å
49	L	69.6	Low	71.7	Confident	56 Å²	56	78.7 Å²	78.7	29%	0.293	41%	0.405	S	S	.	.	H	α-helix	trans	-63.1	-47.4	174.7	-83.8	174.2	0	0	0	111.4	F45 V46 F51 F53	F45-L49 HydrophobicContact CD1-CD1 3.99Å; F45-L49 HydrophobicContact CD2-CG 4.41Å; F45-L49 HydrophobicContact CE1-CD1 3.41Å; F45-L49 VanDerWaalsContact CE1-CD1 3.41Å; F45-L49 HydrophobicContact CE1-CG 4.19Å; F45-L49 HydrophobicContact CE2-CD1 4.01Å; F45-L49 HydrophobicContact CE2-CD2 4.3Å; F45-L49 HydrophobicContact CE2-CG 3.86Å; F45-L49 HydrophobicContact CZ-CD1 3.43Å; F45-L49 VanDerWaalsContact CZ-CD1 3.43Å; F45-L49 HydrophobicContact CZ-CD2 4.19Å; F45-L49 HydrophobicContact CZ-CG 3.79Å; F45-L49 WeakPolarHBondContact O-CB 3.49Å; F45-L49 PolarHBondContact O-N 3.25Å; V46-L49 PolarHBondContact O-N 3.48Å; L49-F51 VanDerWaalsContact C-N 3.31Å; L49-F51 PolarHBondContact O-N 2.99Å; L49-F53 HydrophobicContact CD2-CD2 4.12Å; L49-F53 CarbonylContact O-C 3.46Å; L49-F53 VanDerWaalsContact O-CA 3.26Å; L49-F53 WeakPolarHBondContact O-CA 3.41Å; L49-F53 VanDerWaalsContact O-CB 3.31Å; L49-F53 WeakPolarHBondContact O-CB 3.44Å; L49-F53 PolarHBondContact O-N 2.84Å
50	L	69.3	Low	70.9	Confident	120 Å²	120	77 Å²	77	63%	0.628	40%	0.399	S	S	*	.	H	α-helix	trans	-63.4	-40.3	177.2	-73.7	171.8	0	0	0	111.4	V46 S54	V46-L50 HydrophobicContact CG1-CD1 3.84Å; V46-L50 HydrophobicContact CG1-CG 4.28Å; V46-L50 WeakPolarHBondContact O-CB 3.4Å; V46-L50 WeakPolarHBondContact O-CG 3.45Å; V46-L50 PolarHBondContact O-N 3.32Å; L50-S54 WeakPolarHBondContact O-CB 2.95Å; L50-S54 PolarHBondContact O-N 2.97Å
51	F	66.3	Low	70	Confident	121 Å²	121	74.9 Å²	74.9	53%	0.531	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-64.5	174.5	-172	-103.8	0	0	0	109.3	R47 W48 L49 R83	R47-F51 WeakPolarHBondContact O-CB 3.38Å; R47-F51 PolarHBondContact O-N 2.81Å; W48-F51 PolarHBondContact O-N 2.84Å; L49-F51 VanDerWaalsContact C-N 3.31Å; L49-F51 PolarHBondContact O-N 2.99Å; F51-R83 VanDerWaalsContact C-NH2 3.26Å; F51-R83 VanDerWaalsContact CD2-NH2 3.3Å; F51-R83 VanDerWaalsContact CE2-NH2 3.34Å; F51-R83 VanDerWaalsContact CZ-NH2 3.29Å; F51-R83 PolarHBondContact O-NH1 3.43Å; F51-R83 PolarHBondContact O-NH2 3.36Å
52	S	63.7	Low	69.4	Low	8 Å²	8	73 Å²	73	6%	0.056	37%	0.369	C	S	.	.	H	α-helix	trans	-69.9	-37.4	-171.4	-53.4	0	0	0	0	114.4	W48	W48-S52 PolarHBondContact NE1-OG 2.83Å; W48-S52 VanDerWaalsContact O-CB 3.27Å; W48-S52 WeakPolarHBondContact O-CB 3.42Å; W48-S52 PolarHBondContact O-N 2.92Å; W48-S52 PolarHBondContact O-OG 3.48Å
53	F	63.2	Low	69.1	Low	21 Å²	21	73.8 Å²	73.8	9%	0.092	38%	0.378	C	S	.	.	H	α-helix	trans	-123.9	25.4	-166.3	-71.1	-78.9	0	0	0	114.4	W48 L49 A55 F92 Y106	W48-F53 HydrophobicContact CH2-CD2 4.34Å; W48-F53 AromaticContact CH2-CE2 3.76Å; W48-F53 HydrophobicContact CH2-CE2 3.76Å; W48-F53 HydrophobicContact CZ2-CE2 4.35Å; W48-F53 HydrophobicContact CZ3-CD2 4.33Å; W48-F53 HydrophobicContact CZ3-CE2 4.18Å; L49-F53 HydrophobicContact CD2-CD2 4.12Å; L49-F53 CarbonylContact O-C 3.46Å; L49-F53 VanDerWaalsContact O-CA 3.26Å; L49-F53 WeakPolarHBondContact O-CA 3.41Å; L49-F53 VanDerWaalsContact O-CB 3.31Å; L49-F53 WeakPolarHBondContact O-CB 3.44Å; L49-F53 PolarHBondContact O-N 2.84Å; F53-A55 PolarHBondContact O-N 3.31Å; F53-F92 HydrophobicContact CD2-CZ 4.32Å; F53-F92 HydrophobicContact CE1-CE2 4.39Å; F53-F92 AromaticContact CE1-CZ 3.87Å; F53-F92 HydrophobicContact CE1-CZ 3.87Å; F53-F92 AromaticContact CE2-CE2 3.79Å; F53-F92 HydrophobicContact CE2-CE2 3.79Å; F53-F92 AromaticContact CE2-CZ 3.64Å; F53-F92 HydrophobicContact CE2-CZ 3.64Å; F53-F92 AromaticContact CZ-CE2 3.54Å; F53-F92 HydrophobicContact CZ-CE2 3.54Å; F53-F92 AromaticContact CZ-CZ 3.4Å; F53-F92 HydrophobicContact CZ-CZ 3.4Å; F53-Y106 AromaticContact CE1-CD2 3.81Å; F53-Y106 HydrophobicContact CE1-CD2 3.81Å; F53-Y106 HydrophobicContact CE1-CG 4.18Å; F53-Y106 AromaticContact CZ-CD2 3.72Å; F53-Y106 HydrophobicContact CZ-CD2 3.72Å; F53-Y106 HydrophobicContact CZ-CE2 4.3Å; F53-Y106 HydrophobicContact CZ-CG 4.17Å
54	S	62.1	Low	68.7	Low	40 Å²	40	75 Å²	75	28%	0.28	38%	0.379	S	S	.	.			trans	-44.2	116.6	166.6	158.3	0	0	0	0	108.8	L50 H56 V57	L50-S54 WeakPolarHBondContact O-CB 2.95Å; L50-S54 PolarHBondContact O-N 2.97Å; S54-H56 PolarHBondContact O-N 3.44Å; S54-V57 WeakPolarHBondContact O-CB 3.36Å; S54-V57 PolarHBondContact O-N 3.11Å; S54-V57 WeakPolarHBondContact OG-CG2 3.18Å
55	A	56.8	Low	68.3	Low	58 Å²	58	71.3 Å²	71.3	48%	0.479	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-19.1	-170.2	0	0	0	0	0	112.7	F53 P59	F53-A55 PolarHBondContact O-N 3.31Å; A55-P59 VanDerWaalsContact O-CD 3.28Å; A55-P59 WeakPolarHBondContact O-CD 3.33Å
56	H	61.5	Low	68.2	Low	149 Å²	149	73.4 Å²	73.4	69%	0.69	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-26	178.1	-66.3	53.5	0	0	0	112.7	S54 I60	S54-H56 PolarHBondContact O-N 3.44Å; H56-I60 WeakPolarHBondContact O-CD1 3.19Å; H56-I60 WeakPolarHBondContact O-CG1 3.38Å
57	V	65.9	Low	68.2	Low	30 Å²	30	72.2 Å²	72.2	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-75.9	-41.9	-173.8	176.9	0	0	0	0	111.3	S54 I60 F61 F80	S54-V57 WeakPolarHBondContact O-CB 3.36Å; S54-V57 PolarHBondContact O-N 3.11Å; S54-V57 WeakPolarHBondContact OG-CG2 3.18Å; V57-I60 PolarHBondContact O-N 3.4Å; V57-F61 HydrophobicContact CG1-CD2 3.43Å; V57-F61 VanDerWaalsContact CG1-CD2 3.43Å; V57-F61 HydrophobicContact CG1-CE2 3.65Å; V57-F61 WeakPolarHBondContact O-CB 3.5Å; V57-F61 WeakPolarHBondContact O-CD2 3.29Å; V57-F61 PolarHBondContact O-N 2.84Å; V57-F80 HydrophobicContact CG1-CE2 3.88Å
58	M	65	Low	68.1	Low	20 Å²	20	69 Å²	69	10%	0.099	37%	0.372	C	S	.	.	H	α-helix	trans	-61.6	-47.5	-175.7	-70.3	-61.5	112.5	0	0	114	F61 L62 F80 L84	M58-F61 PolarHBondContact O-N 3.36Å; M58-L62 WeakPolarHBondContact O-CB 3.28Å; M58-L62 PolarHBondContact O-N 3.45Å; M58-F80 HydrophobicContact CE-CE2 3.61Å; M58-F80 HydrophobicContact CE-CZ 3.48Å; M58-F80 VanDerWaalsContact CE-CZ 3.48Å; M58-F80 HydrophobicContact SD-CZ 4.2Å; M58-L84 HydrophobicContact CE-CD2 4.4Å; M58-L84 HydrophobicContact SD-CD2 4.36Å
59	P	68.8	Low	68.2	Low	80 Å²	80	73.9 Å²	73.9	52%	0.519	40%	0.402	S	S	.	.	H	α-helix	trans	-64	-41.9	177.9	-21.3	33.6	0	0	0	112.9	A55 F61 L62 Q63	A55-P59 VanDerWaalsContact O-CD 3.28Å; A55-P59 WeakPolarHBondContact O-CD 3.33Å; P59-F61 VanDerWaalsContact C-N 3.29Å; P59-F61 PolarHBondContact O-N 3.23Å; P59-L62 PolarHBondContact O-N 3.21Å; P59-Q63 PolarHBondContact O-N 2.83Å
60	I	71.8	Confident	68.3	Low	83 Å²	83	73.1 Å²	73.1	43%	0.426	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-43.4	177.5	-65.9	171.8	0	0	0	110.1	H56 V57 Q63 K64	H56-I60 WeakPolarHBondContact O-CD1 3.19Å; H56-I60 WeakPolarHBondContact O-CG1 3.38Å; V57-I60 PolarHBondContact O-N 3.4Å; I60-Q63 WeakPolarHBondContact O-CB 3.33Å; I60-Q63 PolarHBondContact O-N 3.13Å; I60-K64 WeakPolarHBondContact O-CG 3.49Å; I60-K64 PolarHBondContact O-N 3.23Å
61	F	66.9	Low	68.5	Low	42 Å²	42	70.2 Å²	70.2	18%	0.184	39%	0.388	C	S	.	.	H	α-helix	trans	-72.2	-36.8	177.1	-90.4	-83.6	0	0	0	112.9	V57 M58 P59 Q63 K64 L65 F80	V57-F61 HydrophobicContact CG1-CD2 3.43Å; V57-F61 VanDerWaalsContact CG1-CD2 3.43Å; V57-F61 HydrophobicContact CG1-CE2 3.65Å; V57-F61 WeakPolarHBondContact O-CB 3.5Å; V57-F61 WeakPolarHBondContact O-CD2 3.29Å; V57-F61 PolarHBondContact O-N 2.84Å; M58-F61 PolarHBondContact O-N 3.36Å; P59-F61 VanDerWaalsContact C-N 3.29Å; P59-F61 PolarHBondContact O-N 3.23Å; F61-Q63 PolarHBondContact O-N 3.03Å; F61-K64 HydrophobicContact CD1-CD 4.34Å; F61-K64 HydrophobicContact CE1-CD 4.38Å; F61-K64 CarbonylContact O-C 3.55Å; F61-K64 PolarHBondContact O-N 3.14Å; F61-K64 VanDerWaalsContact O-N 3.12Å; F61-L65 WeakPolarHBondContact O-CB 3.25Å; F61-L65 VanDerWaalsContact O-CG 3.26Å; F61-L65 WeakPolarHBondContact O-CG 3.45Å; F61-L65 PolarHBondContact O-N 3.3Å; F61-F80 HydrophobicContact CB-CD1 4.24Å; F61-F80 HydrophobicContact CB-CE1 3.53Å; F61-F80 HydrophobicContact CB-CE2 3.92Å; F61-F80 HydrophobicContact CB-CZ 3.34Å; F61-F80 HydrophobicContact CD1-CB 3.96Å; F61-F80 AromaticContact CD1-CD1 3.26Å; F61-F80 HydrophobicContact CD1-CD1 3.26Å; F61-F80 AromaticContact CD1-CD2 3.6Å; F61-F80 HydrophobicContact CD1-CD2 3.6Å; F61-F80 AromaticContact CD1-CE1 3.49Å; F61-F80 HydrophobicContact CD1-CE1 3.49Å; F61-F80 VanDerWaalsContact CD1-CE1 3.49Å; F61-F80 AromaticContact CD1-CE2 3.82Å; F61-F80 HydrophobicContact CD1-CE2 3.82Å; F61-F80 AromaticContact CD1-CG 3.3Å; F61-F80 HydrophobicContact CD1-CG 3.3Å; F61-F80 AromaticContact CD1-CZ 3.77Å; F61-F80 HydrophobicContact CD1-CZ 3.77Å; F61-F80 AromaticContact CD2-CD2 3.61Å; F61-F80 HydrophobicContact CD2-CD2 3.61Å; F61-F80 HydrophobicContact CD2-CE1 4.35Å; F61-F80 AromaticContact CD2-CE2 3.35Å; F61-F80 HydrophobicContact CD2-CE2 3.35Å; F61-F80 HydrophobicContact CD2-CG 4.22Å; F61-F80 AromaticContact CD2-CZ 3.76Å; F61-F80 HydrophobicContact CD2-CZ 3.76Å; F61-F80 HydrophobicContact CE1-CB 3.33Å; F61-F80 AromaticContact CE1-CD1 3.63Å; F61-F80 HydrophobicContact CE1-CD1 3.63Å; F61-F80 AromaticContact CE1-CD2 3.46Å; F61-F80 HydrophobicContact CE1-CD2 3.46Å; F61-F80 VanDerWaalsContact CE1-CD2 3.46Å; F61-F80 HydrophobicContact CE1-CE1 4.25Å; F61-F80 HydrophobicContact CE1-CE2 4.13Å; F61-F80 AromaticContact CE1-CG 3.16Å; F61-F80 HydrophobicContact CE1-CG 3.16Å; F61-F80 HydrophobicContact CE1-CZ 4.48Å; F61-F80 AromaticContact CE2-CD2 3.45Å; F61-F80 HydrophobicContact CE2-CD2 3.45Å; F61-F80 VanDerWaalsContact CE2-CD2 3.45Å; F61-F80 AromaticContact CE2-CE2 3.68Å; F61-F80 HydrophobicContact CE2-CE2 3.68Å; F61-F80 HydrophobicContact CE2-CG 4.09Å; F61-F80 HydrophobicContact CE2-CZ 4.46Å; F61-F80 AromaticContact CG-CD1 3.79Å; F61-F80 HydrophobicContact CG-CD1 3.79Å; F61-F80 AromaticContact CG-CD2 3.65Å; F61-F80 HydrophobicContact CG-CD2 3.65Å; F61-F80 AromaticContact CG-CE1 3.53Å; F61-F80 HydrophobicContact CG-CE1 3.53Å; F61-F80 AromaticContact CG-CE2 3.4Å; F61-F80 HydrophobicContact CG-CE2 3.4Å; F61-F80 AromaticContact CG-CG 3.83Å; F61-F80 HydrophobicContact CG-CG 3.83Å; F61-F80 AromaticContact CG-CZ 3.33Å; F61-F80 HydrophobicContact CG-CZ 3.33Å; F61-F80 HydrophobicContact CZ-CB 3.72Å; F61-F80 HydrophobicContact CZ-CD1 4.4Å; F61-F80 AromaticContact CZ-CD2 3.36Å; F61-F80 HydrophobicContact CZ-CD2 3.36Å; F61-F80 HydrophobicContact CZ-CE2 4.04Å; F61-F80 AromaticContact CZ-CG 3.57Å; F61-F80 HydrophobicContact CZ-CG 3.57Å
62	L	71.2	Confident	68.8	Low	46 Å²	46	64.9 Å²	64.9	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-34.9	173.8	-160.7	116.7	0	0	0	111.2	M58 P59 S66 Q108 C109	M58-L62 WeakPolarHBondContact O-CB 3.28Å; M58-L62 PolarHBondContact O-N 3.45Å; P59-L62 PolarHBondContact O-N 3.21Å; L62-S66 PolarHBondContact O-N 3.3Å; L62-S66 VanDerWaalsContact O-N 3.12Å; L62-S66 PolarHBondContact O-OG 3.38Å; L62-Q108 HydrophobicContact CD1-CG 4.4Å; L62-C109 VanDerWaalsContact CD1-SG 3.55Å
63	Q	75.6	Confident	69.2	Low	148 Å²	148	68.5 Å²	68.5	69%	0.692	39%	0.387	S	S	*	.	H	α-helix	trans	-66.5	-46.4	171.1	-171.4	-178	11.1	0	0	111.7	P59 I60 F61 L65 S66 S67	P59-Q63 PolarHBondContact O-N 2.83Å; I60-Q63 WeakPolarHBondContact O-CB 3.33Å; I60-Q63 PolarHBondContact O-N 3.13Å; F61-Q63 PolarHBondContact O-N 3.03Å; Q63-L65 PolarHBondContact O-N 2.89Å; Q63-S66 PolarHBondContact O-N 3.1Å; Q63-S66 VanDerWaalsContact O-N 3.1Å; Q63-S67 PolarHBondContact O-N 3Å
64	K	73.1	Confident	69.8	Low	111 Å²	111	68.9 Å²	68.9	48%	0.483	39%	0.392	S	S	.	.	H	α-helix	trans	-61.7	-40.2	175	-72.1	180	178.4	-173.4	0	112.8	I60 F61 S66 S67	I60-K64 WeakPolarHBondContact O-CG 3.49Å; I60-K64 PolarHBondContact O-N 3.23Å; F61-K64 HydrophobicContact CD1-CD 4.34Å; F61-K64 HydrophobicContact CE1-CD 4.38Å; F61-K64 CarbonylContact O-C 3.55Å; F61-K64 PolarHBondContact O-N 3.14Å; F61-K64 VanDerWaalsContact O-N 3.12Å; K64-S66 PolarHBondContact O-N 3.44Å; K64-S67 VanDerWaalsContact O-CB 3.28Å; K64-S67 WeakPolarHBondContact O-CB 3.49Å; K64-S67 PolarHBondContact O-N 3.22Å; K64-S67 PolarHBondContact O-OG 3.12Å
65	L	70.3	Confident	70.3	Confident	5 Å²	5	75.1 Å²	75.1	3%	0.026	42%	0.417	C	S	.	.	H	α-helix	trans	-66.5	-22.2	175.2	-72.6	173.7	0	0	0	112.3	F61 Q63 S67 L70 F77 A113 H116	F61-L65 WeakPolarHBondContact O-CB 3.25Å; F61-L65 VanDerWaalsContact O-CG 3.26Å; F61-L65 WeakPolarHBondContact O-CG 3.45Å; F61-L65 PolarHBondContact O-N 3.3Å; Q63-L65 PolarHBondContact O-N 2.89Å; L65-S67 VanDerWaalsContact C-N 3.28Å; L65-L70 HydrophobicContact CD2-CD2 3.97Å; L65-F77 HydrophobicContact CD2-CD2 4.17Å; L65-F77 HydrophobicContact CD2-CE2 3.68Å; L65-A113 HydrophobicContact CD2-CB 4.33Å; L65-H116 PolarHBondContact O-NE2 3.3Å
66	S	73.8	Confident	71	Confident	73 Å²	73	76.2 Å²	76.2	51%	0.51	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-1.6	174.7	-52.7	0	0	0	0	112.3	L62 Q63 K64	L62-S66 PolarHBondContact O-N 3.3Å; L62-S66 VanDerWaalsContact O-N 3.12Å; L62-S66 PolarHBondContact O-OG 3.38Å; Q63-S66 PolarHBondContact O-N 3.1Å; Q63-S66 VanDerWaalsContact O-N 3.1Å; K64-S66 PolarHBondContact O-N 3.44Å
67	S	76.7	Confident	71.6	Confident	44 Å²	44	69.4 Å²	69.4	31%	0.308	39%	0.389	S	S	.	.			trans	-79.1	134.3	179.3	74.5	0	0	0	0	111.5	Q63 K64 L65 L69 L70	Q63-S67 PolarHBondContact O-N 3Å; K64-S67 VanDerWaalsContact O-CB 3.28Å; K64-S67 WeakPolarHBondContact O-CB 3.49Å; K64-S67 PolarHBondContact O-N 3.22Å; K64-S67 PolarHBondContact O-OG 3.12Å; L65-S67 VanDerWaalsContact C-N 3.28Å; S67-L69 VanDerWaalsContact C-N 3.28Å; S67-L69 PolarHBondContact O-N 2.81Å; S67-L70 WeakPolarHBondContact O-CB 3.29Å
68	P	69.3	Low	71.8	Confident	132 Å²	132	69.9 Å²	69.9	86%	0.857	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-17.1	-178.2	28.3	-34.4	0	0	0	113.7	L70	P68-L70 VanDerWaalsContact C-N 3.31Å
69	L	71.1	Confident	72.1	Confident	165 Å²	165	74.8 Å²	74.8	86%	0.864	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	9.4	-179.3	-64.5	171.9	0	0	0	113.1	S67 S71	S67-L69 VanDerWaalsContact C-N 3.28Å; S67-L69 PolarHBondContact O-N 2.81Å; L69-S71 PolarHBondContact O-N 2.79Å
70	L	70.9	Confident	72.2	Confident	40 Å²	40	71.2 Å²	71.2	21%	0.209	39%	0.389	C	S	.	.			trans	-66.3	116.7	-178.5	-174	73.7	0	0	0	110.5	L65 S67 P68 F77	L65-L70 HydrophobicContact CD2-CD2 3.97Å; S67-L70 WeakPolarHBondContact O-CB 3.29Å; P68-L70 VanDerWaalsContact C-N 3.31Å; L70-F77 HydrophobicContact CD1-CD2 4.14Å; L70-F77 HydrophobicContact CD2-CD2 3.77Å; L70-F77 HydrophobicContact CD2-CE2 3.84Å; L70-F77 HydrophobicContact CG-CD2 4.16Å
71	S	74.7	Confident	72.1	Confident	59 Å²	59	67.3 Å²	67.3	41%	0.413	37%	0.369	S	S	.	.			trans	-91.3	118.2	168.5	55.2	0	0	0	0	110.2	L69 T73 S74	L69-S71 PolarHBondContact O-N 2.79Å; S71-T73 PolarHBondContact O-N 3.03Å; S71-S74 WeakPolarHBondContact O-CB 3.15Å; S71-S74 PolarHBondContact O-N 2.94Å; S71-S74 PolarHBondContact O-OG 3.48Å; S71-S74 WeakPolarHBondContact OG-CB 3.28Å
72	V	72.2	Confident	72	Confident	8 Å²	8	67.6 Å²	67.6	5%	0.048	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-28.3	174.2	174.3	0	0	0	0	111.4	S74 F77 H116 V117 Y120 V164	V72-S74 VanDerWaalsContact C-N 3.29Å; V72-S74 PolarHBondContact O-N 3.43Å; V72-F77 HydrophobicContact CB-CD1 4.31Å; V72-F77 HydrophobicContact CB-CE1 4.22Å; V72-F77 HydrophobicContact CG1-CD1 4.05Å; V72-F77 HydrophobicContact CG1-CE1 3.71Å; V72-F77 HydrophobicContact CG2-CE1 4.28Å; V72-F77 HydrophobicContact CG2-CZ 4.42Å; V72-F77 VanDerWaalsContact O-CD1 3.3Å; V72-F77 WeakPolarHBondContact O-CD1 3.42Å; V72-H116 HydrophobicContact CG2-CB 4.03Å; V72-V117 HydrophobicContact CG1-CG2 3.98Å; V72-Y120 HydrophobicContact CB-CD2 4.44Å; V72-Y120 HydrophobicContact CB-CG 4.24Å; V72-Y120 HydrophobicContact CG1-CG 4.4Å; V72-V164 HydrophobicContact CG1-CG1 3.89Å; V72-V164 HydrophobicContact CG1-CG2 4.49Å
73	T	71.9	Confident	71.8	Confident	85 Å²	85	67.3 Å²	67.3	52%	0.521	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-7.5	176.7	54.7	0	0	0	0	114.1	S71 Y120	S71-T73 PolarHBondContact O-N 3.03Å; T73-Y120 HydrophobicContact CG2-CE2 3.91Å
74	S	75.9	Confident	71.4	Confident	28 Å²	28	60.5 Å²	60.5	20%	0.196	34%	0.336	C	S	.	.	S	Bend	trans	-68.5	138.4	177.2	66.3	0	0	0	0	111.4	S71 V72 S76 F77 M78	S71-S74 WeakPolarHBondContact O-CB 3.15Å; S71-S74 PolarHBondContact O-N 2.94Å; S71-S74 PolarHBondContact O-OG 3.48Å; S71-S74 WeakPolarHBondContact OG-CB 3.28Å; V72-S74 VanDerWaalsContact C-N 3.29Å; V72-S74 PolarHBondContact O-N 3.43Å; S74-S76 PolarHBondContact O-N 2.92Å; S74-S76 VanDerWaalsContact O-N 3.16Å; S74-S76 PolarHBondContact OG-OG 3.06Å; S74-F77 PolarHBondContact O-N 3.33Å; S74-F77 WeakPolarHBondContact OG-CB 3.13Å; S74-F77 PolarHBondContact OG-N 3.48Å; S74-M78 PolarHBondContact O-N 3.28Å
75	E	72.8	Confident	71	Confident	172 Å²	172	56.3 Å²	56.3	80%	0.804	32%	0.32	S	S	*	.	H	α-helix	trans	-54.8	-35.4	175.8	-170.4	179.3	-178.2	0	0	111.8	M78 H79	E75-M78 PolarHBondContact O-N 3.36Å; E75-H79 VanDerWaalsContact O-CB 3.24Å; E75-H79 WeakPolarHBondContact O-CB 3.39Å; E75-H79 PolarHBondContact O-N 3.11Å
76	S	70.7	Confident	70.7	Confident	80 Å²	80	60.8 Å²	60.8	56%	0.559	35%	0.347	S	S	*	.	H	α-helix	trans	-65.7	-38	178.1	75.6	0	0	0	0	113.7	S74 F80	S74-S76 PolarHBondContact O-N 2.92Å; S74-S76 VanDerWaalsContact O-N 3.16Å; S74-S76 PolarHBondContact OG-OG 3.06Å; S76-F80 PolarHBondContact O-N 3.44Å
77	F	75.3	Confident	70.1	Confident	7 Å²	7	57.6 Å²	57.6	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-72.4	-50.7	175	177.6	-92.6	0	0	0	109.9	L65 L70 V72 S74 H79 F80 A81 A113 H116 V117 F168	L65-F77 HydrophobicContact CD2-CD2 4.17Å; L65-F77 HydrophobicContact CD2-CE2 3.68Å; L70-F77 HydrophobicContact CD1-CD2 4.14Å; L70-F77 HydrophobicContact CD2-CD2 3.77Å; L70-F77 HydrophobicContact CD2-CE2 3.84Å; L70-F77 HydrophobicContact CG-CD2 4.16Å; V72-F77 HydrophobicContact CB-CD1 4.31Å; V72-F77 HydrophobicContact CB-CE1 4.22Å; V72-F77 HydrophobicContact CG1-CD1 4.05Å; V72-F77 HydrophobicContact CG1-CE1 3.71Å; V72-F77 HydrophobicContact CG2-CE1 4.28Å; V72-F77 HydrophobicContact CG2-CZ 4.42Å; V72-F77 VanDerWaalsContact O-CD1 3.3Å; V72-F77 WeakPolarHBondContact O-CD1 3.42Å; S74-F77 PolarHBondContact O-N 3.33Å; S74-F77 WeakPolarHBondContact OG-CB 3.13Å; S74-F77 PolarHBondContact OG-N 3.48Å; F77-H79 VanDerWaalsContact C-N 3.33Å; F77-H79 PolarHBondContact O-N 3.5Å; F77-F80 PolarHBondContact O-N 3.26Å; F77-A81 HydrophobicContact CD1-CB 4.2Å; F77-A81 HydrophobicContact CE1-CB 3.92Å; F77-A81 HydrophobicContact CZ-CB 4.12Å; F77-A81 WeakPolarHBondContact O-CB 3.44Å; F77-A81 PolarHBondContact O-N 3.06Å; F77-A113 HydrophobicContact CE2-CB 4.41Å; F77-A113 HydrophobicContact CZ-CB 4.28Å; F77-H116 HydrophobicContact CZ-CB 4.42Å; F77-V117 HydrophobicContact CE1-CG2 3.87Å; F77-V117 HydrophobicContact CZ-CG2 4.02Å; F77-F168 HydrophobicContact CE1-CE2 4.32Å; F77-F168 AromaticContact CE1-CZ 3.67Å; F77-F168 HydrophobicContact CE1-CZ 3.67Å; F77-F168 HydrophobicContact CZ-CZ 4.26Å
78	M	69.3	Low	69.2	Low	39 Å²	39	64.5 Å²	64.5	19%	0.192	34%	0.344	C	S	.	.	H	α-helix	trans	-54.8	-47.9	-179.9	-72	-72.3	-82.6	0	0	111.5	S74 E75 F80 A81 L82 E167 F168	S74-M78 PolarHBondContact O-N 3.28Å; E75-M78 PolarHBondContact O-N 3.36Å; M78-F80 PolarHBondContact O-N 3.14Å; M78-A81 PolarHBondContact O-N 3.19Å; M78-L82 WeakPolarHBondContact O-CB 3.42Å; M78-L82 WeakPolarHBondContact O-CG 3.42Å; M78-L82 PolarHBondContact O-N 3.41Å; M78-E167 HydrophobicContact CE-CB 4.15Å; M78-E167 HydrophobicContact CE-CG 3.48Å; M78-E167 VanDerWaalsContact CE-CG 3.48Å; M78-F168 HydrophobicContact SD-CE2 4.26Å
79	H	72.7	Confident	68.6	Low	124 Å²	124	66.3 Å²	66.3	57%	0.574	34%	0.339	S	S	*	.	H	α-helix	trans	-61.4	-44.6	178.4	-179.3	-95.3	0	0	0	112.8	E75 F77 R83	E75-H79 VanDerWaalsContact O-CB 3.24Å; E75-H79 WeakPolarHBondContact O-CB 3.39Å; E75-H79 PolarHBondContact O-N 3.11Å; F77-H79 VanDerWaalsContact C-N 3.33Å; F77-H79 PolarHBondContact O-N 3.5Å; H79-R83 VanDerWaalsContact O-CB 3.27Å; H79-R83 WeakPolarHBondContact O-CB 3.35Å; H79-R83 PolarHBondContact O-N 3.12Å; H79-R83 VanDerWaalsContact O-N 3.1Å
80	F	70.1	Confident	67.5	Low	5 Å²	5	63.2 Å²	63.2	2%	0.022	33%	0.328	C	S	.	.	H	α-helix	trans	-72.8	-39.8	179.5	-178	-102.5	0	0	0	112.8	V57 M58 F61 S76 F77 M78 R83 L84	V57-F80 HydrophobicContact CG1-CE2 3.88Å; M58-F80 HydrophobicContact CE-CE2 3.61Å; M58-F80 HydrophobicContact CE-CZ 3.48Å; M58-F80 VanDerWaalsContact CE-CZ 3.48Å; M58-F80 HydrophobicContact SD-CZ 4.2Å; F61-F80 HydrophobicContact CB-CD1 4.24Å; F61-F80 HydrophobicContact CB-CE1 3.53Å; F61-F80 HydrophobicContact CB-CE2 3.92Å; F61-F80 HydrophobicContact CB-CZ 3.34Å; F61-F80 HydrophobicContact CD1-CB 3.96Å; F61-F80 AromaticContact CD1-CD1 3.26Å; F61-F80 HydrophobicContact CD1-CD1 3.26Å; F61-F80 AromaticContact CD1-CD2 3.6Å; F61-F80 HydrophobicContact CD1-CD2 3.6Å; F61-F80 AromaticContact CD1-CE1 3.49Å; F61-F80 HydrophobicContact CD1-CE1 3.49Å; F61-F80 VanDerWaalsContact CD1-CE1 3.49Å; F61-F80 AromaticContact CD1-CE2 3.82Å; F61-F80 HydrophobicContact CD1-CE2 3.82Å; F61-F80 AromaticContact CD1-CG 3.3Å; F61-F80 HydrophobicContact CD1-CG 3.3Å; F61-F80 AromaticContact CD1-CZ 3.77Å; F61-F80 HydrophobicContact CD1-CZ 3.77Å; F61-F80 AromaticContact CD2-CD2 3.61Å; F61-F80 HydrophobicContact CD2-CD2 3.61Å; F61-F80 HydrophobicContact CD2-CE1 4.35Å; F61-F80 AromaticContact CD2-CE2 3.35Å; F61-F80 HydrophobicContact CD2-CE2 3.35Å; F61-F80 HydrophobicContact CD2-CG 4.22Å; F61-F80 AromaticContact CD2-CZ 3.76Å; F61-F80 HydrophobicContact CD2-CZ 3.76Å; F61-F80 HydrophobicContact CE1-CB 3.33Å; F61-F80 AromaticContact CE1-CD1 3.63Å; F61-F80 HydrophobicContact CE1-CD1 3.63Å; F61-F80 AromaticContact CE1-CD2 3.46Å; F61-F80 HydrophobicContact CE1-CD2 3.46Å; F61-F80 VanDerWaalsContact CE1-CD2 3.46Å; F61-F80 HydrophobicContact CE1-CE1 4.25Å; F61-F80 HydrophobicContact CE1-CE2 4.13Å; F61-F80 AromaticContact CE1-CG 3.16Å; F61-F80 HydrophobicContact CE1-CG 3.16Å; F61-F80 HydrophobicContact CE1-CZ 4.48Å; F61-F80 AromaticContact CE2-CD2 3.45Å; F61-F80 HydrophobicContact CE2-CD2 3.45Å; F61-F80 VanDerWaalsContact CE2-CD2 3.45Å; F61-F80 AromaticContact CE2-CE2 3.68Å; F61-F80 HydrophobicContact CE2-CE2 3.68Å; F61-F80 HydrophobicContact CE2-CG 4.09Å; F61-F80 HydrophobicContact CE2-CZ 4.46Å; F61-F80 AromaticContact CG-CD1 3.79Å; F61-F80 HydrophobicContact CG-CD1 3.79Å; F61-F80 AromaticContact CG-CD2 3.65Å; F61-F80 HydrophobicContact CG-CD2 3.65Å; F61-F80 AromaticContact CG-CE1 3.53Å; F61-F80 HydrophobicContact CG-CE1 3.53Å; F61-F80 AromaticContact CG-CE2 3.4Å; F61-F80 HydrophobicContact CG-CE2 3.4Å; F61-F80 AromaticContact CG-CG 3.83Å; F61-F80 HydrophobicContact CG-CG 3.83Å; F61-F80 AromaticContact CG-CZ 3.33Å; F61-F80 HydrophobicContact CG-CZ 3.33Å; F61-F80 HydrophobicContact CZ-CB 3.72Å; F61-F80 HydrophobicContact CZ-CD1 4.4Å; F61-F80 AromaticContact CZ-CD2 3.36Å; F61-F80 HydrophobicContact CZ-CD2 3.36Å; F61-F80 HydrophobicContact CZ-CE2 4.04Å; F61-F80 AromaticContact CZ-CG 3.57Å; F61-F80 HydrophobicContact CZ-CG 3.57Å; S76-F80 PolarHBondContact O-N 3.44Å; F77-F80 PolarHBondContact O-N 3.26Å; M78-F80 PolarHBondContact O-N 3.14Å; F80-R83 CarbonylContact O-C 3.59Å; F80-R83 WeakPolarHBondContact O-CA 3.39Å; F80-R83 WeakPolarHBondContact O-CB 3.49Å; F80-R83 PolarHBondContact O-N 3.09Å; F80-L84 HydrophobicContact CD1-CD1 4.02Å; F80-L84 HydrophobicContact CD1-CG 4.22Å; F80-L84 HydrophobicContact CE1-CD1 3.59Å; F80-L84 HydrophobicContact CE1-CD2 4.12Å; F80-L84 HydrophobicContact CE1-CG 3.84Å; F80-L84 HydrophobicContact CZ-CD1 4.35Å; F80-L84 HydrophobicContact CZ-CD2 4.05Å; F80-L84 HydrophobicContact CZ-CG 4.2Å; F80-L84 PolarHBondContact O-N 3.13Å
81	A	68.9	Low	66.7	Low	1 Å²	1	65.7 Å²	65.7	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-69.1	-41.9	-178.5	0	0	0	0	0	110.7	F77 M78 R83 L84 V85 F168	F77-A81 HydrophobicContact CD1-CB 4.2Å; F77-A81 HydrophobicContact CE1-CB 3.92Å; F77-A81 HydrophobicContact CZ-CB 4.12Å; F77-A81 WeakPolarHBondContact O-CB 3.44Å; F77-A81 PolarHBondContact O-N 3.06Å; M78-A81 PolarHBondContact O-N 3.19Å; A81-R83 VanDerWaalsContact C-N 3.26Å; A81-R83 PolarHBondContact O-N 3.31Å; A81-L84 WeakPolarHBondContact O-CA 3.42Å; A81-L84 WeakPolarHBondContact O-CB 3.23Å; A81-L84 PolarHBondContact O-N 3.45Å; A81-L84 VanDerWaalsContact O-N 3.08Å; A81-V85 VanDerWaalsContact O-CG2 3.22Å; A81-V85 WeakPolarHBondContact O-CG2 3.47Å; A81-V85 PolarHBondContact O-N 3.27Å; A81-F168 HydrophobicContact CB-CE1 3.49Å; A81-F168 VanDerWaalsContact CB-CE1 3.49Å; A81-F168 HydrophobicContact CB-CE2 4.46Å; A81-F168 HydrophobicContact CB-CZ 3.26Å
82	L	65.7	Low	65.7	Low	48 Å²	48	66 Å²	66	25%	0.251	33%	0.332	S	S	.	.	H	α-helix	trans	-57.3	-40.1	167.8	-83.8	167.5	0	0	0	112.8	M78 L84 V85 T86 E167	M78-L82 WeakPolarHBondContact O-CB 3.42Å; M78-L82 WeakPolarHBondContact O-CG 3.42Å; M78-L82 PolarHBondContact O-N 3.41Å; L82-L84 VanDerWaalsContact C-N 3.32Å; L82-L84 PolarHBondContact O-N 3.23Å; L82-V85 PolarHBondContact O-N 3.37Å; L82-T86 WeakPolarHBondContact O-CB 3.5Å; L82-T86 VanDerWaalsContact O-CG2 3.31Å; L82-T86 WeakPolarHBondContact O-CG2 3.44Å; L82-T86 PolarHBondContact O-N 3.06Å; L82-T86 PolarHBondContact O-OG1 3.34Å; L82-E167 HydrophobicContact CD1-CB 4.34Å; L82-E167 HydrophobicContact CD1-CG 4.16Å; L82-E167 WeakPolarHBondContact CD1-OE2 3.39Å; L82-E167 HydrophobicContact CD2-CB 3.71Å; L82-E167 HydrophobicContact CD2-CG 4.25Å; L82-E167 WeakPolarHBondContact CD2-O 3.48Å; L82-E167 WeakPolarHBondContact CD2-OE2 3.36Å; L82-E167 HydrophobicContact CG-CB 4Å; L82-E167 HydrophobicContact CG-CG 4.38Å
83	R	67.4	Low	65	Low	40 Å²	40	71.3 Å²	71.3	15%	0.151	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-33.9	175.1	175.8	165.9	145.6	162.6	135	112.9	F51 H79 F80 A81 T86 S87	F51-R83 VanDerWaalsContact C-NH2 3.26Å; F51-R83 VanDerWaalsContact CD2-NH2 3.3Å; F51-R83 VanDerWaalsContact CE2-NH2 3.34Å; F51-R83 VanDerWaalsContact CZ-NH2 3.29Å; F51-R83 PolarHBondContact O-NH1 3.43Å; F51-R83 PolarHBondContact O-NH2 3.36Å; H79-R83 VanDerWaalsContact O-CB 3.27Å; H79-R83 WeakPolarHBondContact O-CB 3.35Å; H79-R83 PolarHBondContact O-N 3.12Å; H79-R83 VanDerWaalsContact O-N 3.1Å; F80-R83 CarbonylContact O-C 3.59Å; F80-R83 WeakPolarHBondContact O-CA 3.39Å; F80-R83 WeakPolarHBondContact O-CB 3.49Å; F80-R83 PolarHBondContact O-N 3.09Å; A81-R83 VanDerWaalsContact C-N 3.26Å; A81-R83 PolarHBondContact O-N 3.31Å; R83-T86 PolarHBondContact O-OG1 2.86Å; R83-S87 WeakPolarHBondContact O-CB 3.45Å; R83-S87 PolarHBondContact O-OG 3.42Å
84	L	67.5	Low	64.4	Low	4 Å²	4	72 Å²	72	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-62.2	-62	166.5	-65.4	173.3	0	0	0	108.6	M58 F80 A81 L82 T86 S87 Y106 C109 L110 A113	M58-L84 HydrophobicContact CE-CD2 4.4Å; M58-L84 HydrophobicContact SD-CD2 4.36Å; F80-L84 HydrophobicContact CD1-CD1 4.02Å; F80-L84 HydrophobicContact CD1-CG 4.22Å; F80-L84 HydrophobicContact CE1-CD1 3.59Å; F80-L84 HydrophobicContact CE1-CD2 4.12Å; F80-L84 HydrophobicContact CE1-CG 3.84Å; F80-L84 HydrophobicContact CZ-CD1 4.35Å; F80-L84 HydrophobicContact CZ-CD2 4.05Å; F80-L84 HydrophobicContact CZ-CG 4.2Å; F80-L84 PolarHBondContact O-N 3.13Å; A81-L84 WeakPolarHBondContact O-CA 3.42Å; A81-L84 WeakPolarHBondContact O-CB 3.23Å; A81-L84 PolarHBondContact O-N 3.45Å; A81-L84 VanDerWaalsContact O-N 3.08Å; L82-L84 VanDerWaalsContact C-N 3.32Å; L82-L84 PolarHBondContact O-N 3.23Å; L84-T86 PolarHBondContact O-N 3.19Å; L84-S87 PolarHBondContact O-N 3.18Å; L84-S87 PolarHBondContact O-OG 3.35Å; L84-Y106 HydrophobicContact CB-CE2 4.25Å; L84-Y106 HydrophobicContact CD2-CD2 3.89Å; L84-Y106 HydrophobicContact CD2-CE2 3.67Å; L84-Y106 PolarHBondContact O-OH 2.97Å; L84-C109 HydrophobicContact CD1-CB 4.26Å; L84-C109 HydrophobicContact CD2-CB 4.4Å; L84-L110 HydrophobicContact CB-CD1 4.28Å; L84-A113 HydrophobicContact CD1-CB 4.25Å
85	V	64.7	Low	64	Low	24 Å²	24	79.1 Å²	79.1	15%	0.145	40%	0.398	C	S	.	.	H	α-helix	trans	-52	-47.6	-173.9	-175.1	0	0	0	0	113.6	A81 L82 S87 F168 Y170	A81-V85 VanDerWaalsContact O-CG2 3.22Å; A81-V85 WeakPolarHBondContact O-CG2 3.47Å; A81-V85 PolarHBondContact O-N 3.27Å; L82-V85 PolarHBondContact O-N 3.37Å; V85-S87 VanDerWaalsContact C-N 3.26Å; V85-S87 PolarHBondContact O-N 2.86Å; V85-F168 HydrophobicContact CG2-CD1 3.86Å; V85-F168 HydrophobicContact CG2-CE1 4.25Å; V85-Y170 HydrophobicContact CB-CE2 4.17Å; V85-Y170 HydrophobicContact CG1-CE2 3.79Å; V85-Y170 HydrophobicContact CG2-CE2 3.62Å
86	T	63.2	Low	64	Low	98 Å²	98	75.4 Å²	75.4	60%	0.601	38%	0.377	S	S	*	.	H	α-helix	trans	-65.3	-24.5	-177.8	50.4	0	0	0	0	113.8	L82 R83 L84 R88	L82-T86 WeakPolarHBondContact O-CB 3.5Å; L82-T86 VanDerWaalsContact O-CG2 3.31Å; L82-T86 WeakPolarHBondContact O-CG2 3.44Å; L82-T86 PolarHBondContact O-N 3.06Å; L82-T86 PolarHBondContact O-OG1 3.34Å; R83-T86 PolarHBondContact O-OG1 2.86Å; L84-T86 PolarHBondContact O-N 3.19Å; T86-R88 VanDerWaalsContact C-N 3.26Å; T86-R88 PolarHBondContact O-N 2.76Å
87	S	60.4	Low	64.2	Low	6 Å²	6	80.4 Å²	80.4	4%	0.042	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	1.8	-175.2	71.2	0	0	0	0	115	W48 R83 L84 V85 Y106	W48-S87 WeakPolarHBondContact CZ2-O 3.32Å; R83-S87 WeakPolarHBondContact O-CB 3.45Å; R83-S87 PolarHBondContact O-OG 3.42Å; L84-S87 PolarHBondContact O-N 3.18Å; L84-S87 PolarHBondContact O-OG 3.35Å; V85-S87 VanDerWaalsContact C-N 3.26Å; V85-S87 PolarHBondContact O-N 2.86Å; S87-Y106 WeakPolarHBondContact OG-CE2 3.05Å; S87-Y106 PolarHBondContact OG-OH 3.47Å
88	R	59.3	Low	64.1	Low	190 Å²	190	84.2 Å²	84.2	72%	0.717	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-34.5	-176.8	-172.4	178.5	177.1	-130	-1.8	114.8	T86	T86-R88 VanDerWaalsContact C-N 3.26Å; T86-R88 PolarHBondContact O-N 2.76Å
89	K	56.2	Low	64.3	Low	170 Å²	170	83 Å²	83	74%	0.739	41%	0.405	S	S	*	.	S	Bend	trans	-96.4	115.8	-172.8	-59.2	175.1	-178.5	173.1	0	108.9
90	P	47.5	Very low	64.4	Low	100 Å²	100	81.5 Å²	81.5	65%	0.649	41%	0.409	S	S	*	.	S	Bend	cis	-135.1	103.5	-31.2	33.6	-12.2	0	0	0	111.4
91	F	53.6	Low	64.8	Low	92 Å²	92	85.3 Å²	85.3	40%	0.404	43%	0.429	S	S	.	.			trans	-144.9	0.1	-177.8	-79.1	-78.9	0	0	0	119.3	F45 W48 K93	F45-F91 HydrophobicContact CD2-CB 4.09Å; F45-F91 AromaticContact CD2-CD1 3.71Å; F45-F91 HydrophobicContact CD2-CD1 3.71Å; F45-F91 HydrophobicContact CD2-CE1 4.34Å; F45-F91 AromaticContact CD2-CG 3.91Å; F45-F91 HydrophobicContact CD2-CG 3.91Å; F45-F91 HydrophobicContact CE2-CB 3.53Å; F45-F91 AromaticContact CE2-CD1 3.87Å; F45-F91 HydrophobicContact CE2-CD1 3.87Å; F45-F91 AromaticContact CE2-CG 3.87Å; F45-F91 HydrophobicContact CE2-CG 3.87Å; F45-F91 HydrophobicContact CZ-CB 4.42Å; W48-F91 HydrophobicContact CH2-CB 4.34Å; W48-F91 HydrophobicContact CZ3-CB 4.16Å; F91-K93 PolarHBondContact O-N 3.41Å
92	F	54.6	Low	65	Low	65 Å²	65	89.6 Å²	89.6	29%	0.285	45%	0.445	S	S	.	.			trans	-78.1	78.2	166.1	-73.7	-80.1	0	0	0	109.6	F53 A94 L103	F53-F92 HydrophobicContact CD2-CZ 4.32Å; F53-F92 HydrophobicContact CE1-CE2 4.39Å; F53-F92 AromaticContact CE1-CZ 3.87Å; F53-F92 HydrophobicContact CE1-CZ 3.87Å; F53-F92 AromaticContact CE2-CE2 3.79Å; F53-F92 HydrophobicContact CE2-CE2 3.79Å; F53-F92 AromaticContact CE2-CZ 3.64Å; F53-F92 HydrophobicContact CE2-CZ 3.64Å; F53-F92 AromaticContact CZ-CE2 3.54Å; F53-F92 HydrophobicContact CZ-CE2 3.54Å; F53-F92 AromaticContact CZ-CZ 3.4Å; F53-F92 HydrophobicContact CZ-CZ 3.4Å; F92-A94 PolarHBondContact O-N 3.35Å; F92-L103 HydrophobicContact CB-CD1 4.16Å; F92-L103 HydrophobicContact CG-CD1 4.32Å
93	K	56.8	Low	65.4	Low	120 Å²	120	90.3 Å²	90.3	52%	0.522	45%	0.449	S	S	.	.			trans	-59	123.5	160.5	-64.8	-177.9	178.4	176.9	0	106.1	F91 Q95 Y96	F91-K93 PolarHBondContact O-N 3.41Å; K93-Q95 PolarHBondContact O-N 3.42Å; K93-Y96 HydrophobicContact CB-CD2 3.83Å; K93-Y96 HydrophobicContact CB-CE2 3.61Å; K93-Y96 HydrophobicContact CD-CE2 4.07Å; K93-Y96 HydrophobicContact CG-CE2 3.97Å; K93-Y96 WeakPolarHBondContact O-CD2 3.22Å; K93-Y96 PolarHBondContact O-N 3.12Å; K93-Y96 VanDerWaalsContact O-N 3.14Å
94	A	59.4	Low	65.9	Low	98 Å²	98	91.7 Å²	91.7	81%	0.81	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-5.8	179.8	0	0	0	0	0	114.1	F92	F92-A94 PolarHBondContact O-N 3.35Å
95	Q	68.6	Low	66.3	Low	179 Å²	179	96.2 Å²	96.2	84%	0.836	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-13.9	-179.2	-62	173.5	-4	0	0	113.8	K93	K93-Q95 PolarHBondContact O-N 3.42Å
96	Y	73.1	Confident	66.7	Low	93 Å²	93	95.9 Å²	95.9	37%	0.365	48%	0.481	S	S	.	.	S	Bend	trans	-77.7	140.2	-179	-66.3	-61.9	0	0	0	112.3	F45 K93 D98 S99	F45-Y96 HydrophobicContact CE1-CE2 4.47Å; F45-Y96 HydrophobicContact CZ-CE2 4.31Å; K93-Y96 HydrophobicContact CB-CD2 3.83Å; K93-Y96 HydrophobicContact CB-CE2 3.61Å; K93-Y96 HydrophobicContact CD-CE2 4.07Å; K93-Y96 HydrophobicContact CG-CE2 3.97Å; K93-Y96 WeakPolarHBondContact O-CD2 3.22Å; K93-Y96 PolarHBondContact O-N 3.12Å; K93-Y96 VanDerWaalsContact O-N 3.14Å; Y96-D98 PolarHBondContact O-N 2.72Å; Y96-S99 WeakPolarHBondContact O-CB 3.28Å; Y96-S99 PolarHBondContact O-N 3.14Å; Y96-S99 PolarHBondContact O-OG 3.38Å
97	K	74.5	Confident	67.4	Low	186 Å²	186	96.1 Å²	96.1	81%	0.809	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	134.9	175.3	-173	179.2	176	-178.6	0	110.5	S99	K97-S99 PolarHBondContact O-N 3.03Å
98	D	73	Confident	68.5	Low	86 Å²	86	100.5 Å²	100.5	46%	0.46	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	6.6	-178.5	-52.1	-38.5	0	0	0	116.1	Y96 S100 L101 Y102	Y96-D98 PolarHBondContact O-N 2.72Å; D98-S100 VanDerWaalsContact C-N 3.27Å; D98-S100 PolarHBondContact O-N 2.95Å; D98-L101 PolarHBondContact O-N 3.04Å; D98-L101 VanDerWaalsContact O-N 3.09Å; D98-Y102 HydrophobicContact CB-CD2 4.13Å; D98-Y102 HydrophobicContact CB-CE2 3.99Å; D98-Y102 VanDerWaalsContact O-CD2 3.3Å; D98-Y102 WeakPolarHBondContact O-CD2 3.47Å; D98-Y102 PolarHBondContact O-N 3.08Å
99	S	72.8	Confident	69.3	Low	14 Å²	14	91.5 Å²	91.5	10%	0.098	46%	0.461	C	S	.	.	H	α-helix	trans	-55.6	-40.7	-179.2	56.9	0	0	0	0	112.9	Y96 K97 L101 Y102 L103	Y96-S99 WeakPolarHBondContact O-CB 3.28Å; Y96-S99 PolarHBondContact O-N 3.14Å; Y96-S99 PolarHBondContact O-OG 3.38Å; K97-S99 PolarHBondContact O-N 3.03Å; S99-L101 PolarHBondContact O-N 3.37Å; S99-Y102 PolarHBondContact O-N 3.37Å; S99-L103 WeakPolarHBondContact O-CB 3.29Å; S99-L103 PolarHBondContact O-N 3.21Å
100	S	76.2	Confident	70.4	Confident	92 Å²	92	84.2 Å²	84.2	64%	0.643	43%	0.43	S	S	*	.	H	α-helix	trans	-61	-40	177.6	56.4	0	0	0	0	112.9	D98 S104	D98-S100 VanDerWaalsContact C-N 3.27Å; D98-S100 PolarHBondContact O-N 2.95Å; S100-S104 WeakPolarHBondContact O-CB 3.4Å; S100-S104 PolarHBondContact O-N 2.91Å
101	L	77.2	Confident	72.1	Confident	86 Å²	86	83 Å²	83	45%	0.45	42%	0.424	S	S	.	.	H	α-helix	trans	-67.7	-47	178.8	-179.1	70.2	0	0	0	111.3	D98 S99 L103 S104 K105	D98-L101 PolarHBondContact O-N 3.04Å; D98-L101 VanDerWaalsContact O-N 3.09Å; S99-L101 PolarHBondContact O-N 3.37Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-S104 PolarHBondContact O-N 2.81Å; L101-K105 WeakPolarHBondContact O-CG 3.34Å; L101-K105 PolarHBondContact O-N 3.27Å
102	Y	73.2	Confident	73.5	Confident	90 Å²	90	81.4 Å²	81.4	35%	0.353	42%	0.417	S	S	.	.	H	α-helix	trans	-66.6	-37.5	178.2	-75	-74.5	0	0	0	111.9	D98 S99 K105 Y106	D98-Y102 HydrophobicContact CB-CD2 4.13Å; D98-Y102 HydrophobicContact CB-CE2 3.99Å; D98-Y102 VanDerWaalsContact O-CD2 3.3Å; D98-Y102 WeakPolarHBondContact O-CD2 3.47Å; D98-Y102 PolarHBondContact O-N 3.08Å; S99-Y102 PolarHBondContact O-N 3.37Å; Y102-K105 PolarHBondContact O-N 3.43Å; Y102-Y106 WeakPolarHBondContact O-CB 3.33Å; Y102-Y106 PolarHBondContact O-N 3.45Å
103	L	74	Confident	74.8	Confident	63 Å²	63	78.3 Å²	78.3	33%	0.33	40%	0.403	S	S	.	.	H	α-helix	trans	-63.4	-43.1	176	-170.7	152.4	0	0	0	111.3	F92 S99 L101 Y106 Q107	F92-L103 HydrophobicContact CB-CD1 4.16Å; F92-L103 HydrophobicContact CG-CD1 4.32Å; S99-L103 WeakPolarHBondContact O-CB 3.29Å; S99-L103 PolarHBondContact O-N 3.21Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L103-Y106 PolarHBondContact O-N 3.42Å; L103-Q107 VanDerWaalsContact CD2-CD 3.43Å; L103-Q107 HydrophobicContact CD2-CG 4.13Å; L103-Q107 VanDerWaalsContact CD2-NE2 3.34Å; L103-Q107 WeakPolarHBondContact O-CB 3.35Å; L103-Q107 VanDerWaalsContact O-CG 3.27Å; L103-Q107 WeakPolarHBondContact O-CG 3.41Å; L103-Q107 PolarHBondContact O-N 2.79Å
104	S	77.8	Confident	76.1	Confident	69 Å²	69	73.7 Å²	73.7	48%	0.483	38%	0.384	S	S	.	.	H	α-helix	trans	-61.7	-48.3	174.9	174.7	0	0	0	0	112.3	S100 L101 Y106 Q107 Q108	S100-S104 WeakPolarHBondContact O-CB 3.4Å; S100-S104 PolarHBondContact O-N 2.91Å; L101-S104 PolarHBondContact O-N 2.81Å; S104-Y106 VanDerWaalsContact C-N 3.33Å; S104-Y106 PolarHBondContact O-N 2.8Å; S104-Q107 PolarHBondContact O-N 2.56Å; S104-Q108 PolarHBondContact O-N 2.91Å
105	K	75.9	Confident	77.4	Confident	99 Å²	99	75.4 Å²	75.4	43%	0.43	38%	0.376	S	S	.	.	H	α-helix	trans	-62.8	-40.6	177.1	-70.1	-179.1	-178.7	178.5	0	112.2	L101 Y102 Q108 C109	L101-K105 WeakPolarHBondContact O-CG 3.34Å; L101-K105 PolarHBondContact O-N 3.27Å; Y102-K105 PolarHBondContact O-N 3.43Å; K105-Q108 WeakPolarHBondContact O-CB 3.35Å; K105-Q108 PolarHBondContact O-N 3.04Å; K105-C109 PolarHBondContact O-N 3.27Å; K105-C109 PolarHBondContact O-SG 3.41Å
106	Y	74.5	Confident	78.2	Confident	17 Å²	17	69.6 Å²	69.6	7%	0.067	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-47.4	175.7	172.1	-95	0	0	0	111.7	F53 L84 S87 Y102 L103 S104 Q108 C109 L110	F53-Y106 AromaticContact CE1-CD2 3.81Å; F53-Y106 HydrophobicContact CE1-CD2 3.81Å; F53-Y106 HydrophobicContact CE1-CG 4.18Å; F53-Y106 AromaticContact CZ-CD2 3.72Å; F53-Y106 HydrophobicContact CZ-CD2 3.72Å; F53-Y106 HydrophobicContact CZ-CE2 4.3Å; F53-Y106 HydrophobicContact CZ-CG 4.17Å; L84-Y106 HydrophobicContact CB-CE2 4.25Å; L84-Y106 HydrophobicContact CD2-CD2 3.89Å; L84-Y106 HydrophobicContact CD2-CE2 3.67Å; L84-Y106 PolarHBondContact O-OH 2.97Å; S87-Y106 WeakPolarHBondContact OG-CE2 3.05Å; S87-Y106 PolarHBondContact OG-OH 3.47Å; Y102-Y106 WeakPolarHBondContact O-CB 3.33Å; Y102-Y106 PolarHBondContact O-N 3.45Å; L103-Y106 PolarHBondContact O-N 3.42Å; S104-Y106 VanDerWaalsContact C-N 3.33Å; S104-Y106 PolarHBondContact O-N 2.8Å; Y106-Q108 VanDerWaalsContact C-N 3.27Å; Y106-Q108 PolarHBondContact O-N 3.28Å; Y106-C109 PolarHBondContact O-N 3.06Å; Y106-L110 HydrophobicContact CE1-CD2 4.11Å; Y106-L110 VanDerWaalsContact O-CB 3.31Å; Y106-L110 WeakPolarHBondContact O-CB 3.22Å; Y106-L110 PolarHBondContact O-N 2.84Å
107	Q	77.8	Confident	78.8	Confident	104 Å²	104	65.2 Å²	65.2	49%	0.486	33%	0.331	S	S	.	.	H	α-helix	trans	-57.1	-42.8	174.1	-77.5	175.2	-23.1	0	0	111	L103 S104 L110 S111	L103-Q107 VanDerWaalsContact CD2-CD 3.43Å; L103-Q107 HydrophobicContact CD2-CG 4.13Å; L103-Q107 VanDerWaalsContact CD2-NE2 3.34Å; L103-Q107 WeakPolarHBondContact O-CB 3.35Å; L103-Q107 VanDerWaalsContact O-CG 3.27Å; L103-Q107 WeakPolarHBondContact O-CG 3.41Å; L103-Q107 PolarHBondContact O-N 2.79Å; S104-Q107 PolarHBondContact O-N 2.56Å; Q107-L110 PolarHBondContact O-N 3.44Å; Q107-S111 WeakPolarHBondContact O-CB 3.4Å; Q107-S111 PolarHBondContact O-N 2.98Å; Q107-S111 PolarHBondContact O-OG 3.15Å; Q107-S111 VanDerWaalsContact O-OG 3.09Å
108	Q	81.5	Confident	79.4	Confident	97 Å²	97	59.8 Å²	59.8	45%	0.453	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-46.2	177	-169.8	-176.6	23.9	0	0	112.8	L62 S104 K105 Y106 L110 K112	L62-Q108 HydrophobicContact CD1-CG 4.4Å; S104-Q108 PolarHBondContact O-N 2.91Å; K105-Q108 WeakPolarHBondContact O-CB 3.35Å; K105-Q108 PolarHBondContact O-N 3.04Å; Y106-Q108 VanDerWaalsContact C-N 3.27Å; Y106-Q108 PolarHBondContact O-N 3.28Å; Q108-L110 VanDerWaalsContact C-N 3.3Å; Q108-L110 PolarHBondContact O-N 3.27Å; Q108-K112 WeakPolarHBondContact O-CG 3.24Å; Q108-K112 PolarHBondContact O-N 2.98Å
109	C	77.9	Confident	80.2	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-44.6	175.5	-73.1	0	0	0	0	111.3	L62 L84 K105 Y106 A113	L62-C109 VanDerWaalsContact CD1-SG 3.55Å; L84-C109 HydrophobicContact CD1-CB 4.26Å; L84-C109 HydrophobicContact CD2-CB 4.4Å; K105-C109 PolarHBondContact O-N 3.27Å; K105-C109 PolarHBondContact O-SG 3.41Å; Y106-C109 PolarHBondContact O-N 3.06Å; C109-A113 WeakPolarHBondContact O-CB 3.47Å; C109-A113 PolarHBondContact O-N 3.41Å
110	L	78.2	Confident	80.9	Confident	17 Å²	17	60 Å²	60	9%	0.089	31%	0.311	C	S	.	.	H	α-helix	trans	-66.2	-47.8	-179.7	175.8	63.6	0	0	0	112	L84 Y106 Q107 Q108 K112 A113 L114 Y170	L84-L110 HydrophobicContact CB-CD1 4.28Å; Y106-L110 HydrophobicContact CE1-CD2 4.11Å; Y106-L110 VanDerWaalsContact O-CB 3.31Å; Y106-L110 WeakPolarHBondContact O-CB 3.22Å; Y106-L110 PolarHBondContact O-N 2.84Å; Q107-L110 PolarHBondContact O-N 3.44Å; Q108-L110 VanDerWaalsContact C-N 3.3Å; Q108-L110 PolarHBondContact O-N 3.27Å; L110-K112 VanDerWaalsContact C-N 3.31Å; L110-K112 PolarHBondContact O-N 2.99Å; L110-A113 PolarHBondContact O-N 3.45Å; L110-A113 VanDerWaalsContact O-N 3.15Å; L110-L114 HydrophobicContact CD1-CD1 4.16Å; L110-L114 HydrophobicContact CD1-CG 4.18Å; L110-L114 HydrophobicContact CG-CD1 4.08Å; L110-L114 HydrophobicContact CG-CG 4.5Å; L110-L114 VanDerWaalsContact O-CG 3.32Å; L110-L114 WeakPolarHBondContact O-CG 3.15Å; L110-L114 PolarHBondContact O-N 3.02Å; L110-Y170 HydrophobicContact CD1-CE1 4.28Å; L110-Y170 HydrophobicContact CD1-CE2 3.8Å; L110-Y170 VanDerWaalsContact CD1-CZ 3.49Å; L110-Y170 WeakPolarHBondContact CD1-OH 3.4Å; L110-Y170 HydrophobicContact CD2-CE1 3.65Å; L110-Y170 WeakPolarHBondContact CD2-OH 3.39Å; L110-Y170 HydrophobicContact CG-CE1 4.26Å
111	S	82.8	Confident	81.6	Confident	75 Å²	75	55.6 Å²	55.6	52%	0.524	28%	0.281	S	S	.	.	H	α-helix	trans	-57	-44.7	176.4	-68.6	0	0	0	0	111.5	Q107 L114 E115	Q107-S111 WeakPolarHBondContact O-CB 3.4Å; Q107-S111 PolarHBondContact O-N 2.98Å; Q107-S111 PolarHBondContact O-OG 3.15Å; Q107-S111 VanDerWaalsContact O-OG 3.09Å; S111-L114 PolarHBondContact O-N 3.41Å; S111-E115 WeakPolarHBondContact O-CB 3.21Å; S111-E115 PolarHBondContact O-N 2.84Å
112	K	84	Confident	82.2	Confident	59 Å²	59	53.3 Å²	53.3	26%	0.257	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-41.8	175.3	-74.6	-174.6	172.6	-168.9	0	112.7	Q108 L110 L114 E115 H116	Q108-K112 WeakPolarHBondContact O-CG 3.24Å; Q108-K112 PolarHBondContact O-N 2.98Å; L110-K112 VanDerWaalsContact C-N 3.31Å; L110-K112 PolarHBondContact O-N 2.99Å; K112-L114 VanDerWaalsContact C-N 3.34Å; K112-E115 PolarHBondContact O-N 3.47Å; K112-H116 PolarHBondContact O-CD2 3.41Å; K112-H116 PolarHBondContact O-N 2.98Å; K112-H116 VanDerWaalsContact O-N 3.13Å
113	A	81.9	Confident	83.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-42	177	0	0	0	0	0	111.5	L65 F77 L84 C109 L110 H116 V117	L65-A113 HydrophobicContact CD2-CB 4.33Å; F77-A113 HydrophobicContact CE2-CB 4.41Å; F77-A113 HydrophobicContact CZ-CB 4.28Å; L84-A113 HydrophobicContact CD1-CB 4.25Å; C109-A113 WeakPolarHBondContact O-CB 3.47Å; C109-A113 PolarHBondContact O-N 3.41Å; L110-A113 PolarHBondContact O-N 3.45Å; L110-A113 VanDerWaalsContact O-N 3.15Å; A113-H116 PolarHBondContact O-N 2.89Å; A113-V117 WeakPolarHBondContact O-CG2 3.38Å; A113-V117 PolarHBondContact O-N 2.94Å; A113-V117 VanDerWaalsContact O-N 3.09Å
114	L	84	Confident	83.8	Confident	22 Å²	22	53.7 Å²	53.7	12%	0.115	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-35.9	175.9	-67	173.3	0	0	0	112.5	L110 S111 K112 V117 K118 F168 Y170 M173	L110-L114 HydrophobicContact CD1-CD1 4.16Å; L110-L114 HydrophobicContact CD1-CG 4.18Å; L110-L114 HydrophobicContact CG-CD1 4.08Å; L110-L114 HydrophobicContact CG-CG 4.5Å; L110-L114 VanDerWaalsContact O-CG 3.32Å; L110-L114 WeakPolarHBondContact O-CG 3.15Å; L110-L114 PolarHBondContact O-N 3.02Å; S111-L114 PolarHBondContact O-N 3.41Å; K112-L114 VanDerWaalsContact C-N 3.34Å; L114-V117 PolarHBondContact O-N 3.48Å; L114-K118 WeakPolarHBondContact O-CB 3.25Å; L114-K118 PolarHBondContact O-N 3.49Å; L114-F168 HydrophobicContact CD2-CB 4.37Å; L114-F168 HydrophobicContact CD2-CD1 3.76Å; L114-F168 HydrophobicContact CD2-CG 4.45Å; L114-Y170 HydrophobicContact CD1-CD1 3.72Å; L114-Y170 HydrophobicContact CD1-CD2 3.84Å; L114-Y170 HydrophobicContact CD1-CE1 4.1Å; L114-Y170 HydrophobicContact CD1-CE2 4.17Å; L114-Y170 HydrophobicContact CD1-CG 3.59Å; L114-Y170 HydrophobicContact CD2-CD2 3.38Å; L114-Y170 HydrophobicContact CD2-CE2 3.92Å; L114-Y170 HydrophobicContact CD2-CG 3.86Å; L114-Y170 HydrophobicContact CG-CD2 4.2Å; L114-Y170 HydrophobicContact CG-CE2 4.5Å; L114-Y170 HydrophobicContact CG-CG 4.39Å; L114-M173 HydrophobicContact CD2-CE 3.87Å
115	E	86.2	Confident	84.6	Confident	135 Å²	135	50.6 Å²	50.6	63%	0.631	25%	0.251	S	S	*	.	H	α-helix	trans	-62.2	-42.2	174.4	-172.3	177.4	-171.9	0	0	111.7	S111 K112 K118 A119	S111-E115 WeakPolarHBondContact O-CB 3.21Å; S111-E115 PolarHBondContact O-N 2.84Å; K112-E115 PolarHBondContact O-N 3.47Å; E115-K118 PolarHBondContact O-N 3.3Å; E115-A119 WeakPolarHBondContact O-CB 3.44Å; E115-A119 PolarHBondContact O-N 2.78Å
116	H	84.9	Confident	85.4	Confident	57 Å²	57	47.6 Å²	47.6	26%	0.264	24%	0.242	S	C	.	.	H	α-helix	trans	-63.8	-43.4	174	-78.6	-66.1	0	0	0	112.7	L65 V72 F77 K112 A113 A119 Y120	L65-H116 PolarHBondContact O-NE2 3.3Å; V72-H116 HydrophobicContact CG2-CB 4.03Å; F77-H116 HydrophobicContact CZ-CB 4.42Å; K112-H116 PolarHBondContact O-CD2 3.41Å; K112-H116 PolarHBondContact O-N 2.98Å; K112-H116 VanDerWaalsContact O-N 3.13Å; A113-H116 PolarHBondContact O-N 2.89Å; H116-A119 PolarHBondContact O-N 3.19Å; H116-Y120 PolarHBondContact O-N 3.37Å
117	V	85.7	Confident	86.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-47.4	175.3	171.3	0	0	0	0	110.6	V72 F77 A113 L114 A119 Y120 V121 V164 F168 M173	V72-V117 HydrophobicContact CG1-CG2 3.98Å; F77-V117 HydrophobicContact CE1-CG2 3.87Å; F77-V117 HydrophobicContact CZ-CG2 4.02Å; A113-V117 WeakPolarHBondContact O-CG2 3.38Å; A113-V117 PolarHBondContact O-N 2.94Å; A113-V117 VanDerWaalsContact O-N 3.09Å; L114-V117 PolarHBondContact O-N 3.48Å; V117-A119 PolarHBondContact O-N 3.06Å; V117-Y120 WeakPolarHBondContact O-CB 3.46Å; V117-Y120 PolarHBondContact O-N 3.24Å; V117-V121 WeakPolarHBondContact O-CG2 3.4Å; V117-V121 PolarHBondContact O-N 2.81Å; V117-V164 HydrophobicContact CG1-CG1 3.72Å; V117-V164 HydrophobicContact CG2-CG1 4.4Å; V117-F168 HydrophobicContact CG1-CD2 4.2Å; V117-F168 HydrophobicContact CG1-CG 4.42Å; V117-F168 HydrophobicContact CG2-CD1 4.12Å; V117-F168 HydrophobicContact CG2-CD2 3.87Å; V117-F168 HydrophobicContact CG2-CE1 3.76Å; V117-F168 HydrophobicContact CG2-CE2 3.53Å; V117-F168 HydrophobicContact CG2-CG 4.15Å; V117-F168 HydrophobicContact CG2-CZ 3.44Å; V117-F168 VanDerWaalsContact CG2-CZ 3.44Å; V117-M173 HydrophobicContact CG1-CE 3.84Å; V117-M173 HydrophobicContact CG1-SD 4.43Å
118	K	87.9	Confident	86.8	Confident	73 Å²	73	44.6 Å²	44.6	32%	0.317	24%	0.235	S	C	.	.	H	α-helix	trans	-58.6	-47.5	175.9	-179.5	-172.3	171.6	-171.9	0	111.1	L114 E115 Y120 V121 V122 M173 E176	L114-K118 WeakPolarHBondContact O-CB 3.25Å; L114-K118 PolarHBondContact O-N 3.49Å; E115-K118 PolarHBondContact O-N 3.3Å; K118-Y120 VanDerWaalsContact C-N 3.27Å; K118-Y120 PolarHBondContact O-N 2.93Å; K118-V121 PolarHBondContact O-N 3.28Å; K118-V122 HydrophobicContact CG-CG2 4.21Å; K118-V122 WeakPolarHBondContact O-CB 3.28Å; K118-V122 VanDerWaalsContact O-CG2 3.28Å; K118-V122 WeakPolarHBondContact O-CG2 3.36Å; K118-V122 PolarHBondContact O-N 3.29Å; K118-M173 HydrophobicContact CB-CG 4.41Å; K118-E176 WeakPolarHBondContact CD-OE2 3.31Å; K118-E176 WeakPolarHBondContact CE-OE2 3.28Å; K118-E176 IonicContact NZ-OE2 2.61Å; K118-E176 PolarHBondContact NZ-OE2 3.23Å
119	A	89	Confident	87.3	Confident	54 Å²	54	40 Å²	40	45%	0.446	21%	0.214	S	C	.	.	H	α-helix	trans	-59.9	-38.6	178.5	0	0	0	0	0	111.9	E115 H116 V117 K123	E115-A119 WeakPolarHBondContact O-CB 3.44Å; E115-A119 PolarHBondContact O-N 2.78Å; H116-A119 PolarHBondContact O-N 3.19Å; V117-A119 PolarHBondContact O-N 3.06Å; A119-K123 WeakPolarHBondContact O-CB 3.43Å; A119-K123 PolarHBondContact O-N 3.37Å
120	Y	88.7	Confident	87.9	Confident	49 Å²	49	44.8 Å²	44.8	19%	0.192	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-47.7	173.7	175.5	-96.1	0	0	0	112.2	V72 T73 H116 V117 K118 K123 S124 V164	V72-Y120 HydrophobicContact CB-CD2 4.44Å; V72-Y120 HydrophobicContact CB-CG 4.24Å; V72-Y120 HydrophobicContact CG1-CG 4.4Å; T73-Y120 HydrophobicContact CG2-CE2 3.91Å; H116-Y120 PolarHBondContact O-N 3.37Å; V117-Y120 WeakPolarHBondContact O-CB 3.46Å; V117-Y120 PolarHBondContact O-N 3.24Å; K118-Y120 VanDerWaalsContact C-N 3.27Å; K118-Y120 PolarHBondContact O-N 2.93Å; Y120-K123 PolarHBondContact O-N 3.04Å; Y120-S124 WeakPolarHBondContact O-CB 3.42Å; Y120-S124 PolarHBondContact O-N 3.21Å; Y120-V164 HydrophobicContact CD1-CG2 4.21Å; Y120-V164 HydrophobicContact CE1-CG2 3.82Å
121	V	89.6	Confident	88.4	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-47.8	178.1	173.8	0	0	0	0	110.7	V117 K118 K123 S124 L125 V161 L165 C177	V117-V121 WeakPolarHBondContact O-CG2 3.4Å; V117-V121 PolarHBondContact O-N 2.81Å; K118-V121 PolarHBondContact O-N 3.28Å; V121-K123 VanDerWaalsContact C-N 3.34Å; V121-K123 PolarHBondContact O-N 3.07Å; V121-S124 PolarHBondContact O-N 3.34Å; V121-L125 HydrophobicContact CG1-CD1 3.78Å; V121-L125 HydrophobicContact CG1-CG 4.3Å; V121-L125 WeakPolarHBondContact O-CB 3.21Å; V121-L125 VanDerWaalsContact O-CG 3.29Å; V121-L125 WeakPolarHBondContact O-CG 3.49Å; V121-L125 PolarHBondContact O-N 3.44Å; V121-V161 HydrophobicContact CG1-CG1 4.17Å; V121-V161 HydrophobicContact CG2-CG1 4.3Å; V121-L165 HydrophobicContact CG2-CD2 3.99Å; V121-L165 HydrophobicContact CG2-CG 4.31Å; V121-C177 HydrophobicContact CG1-CB 4.41Å
122	V	91.6	Very high	88.6	Confident	37 Å²	37	44 Å²	44	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-57.1	-46.9	176.1	164.7	0	0	0	0	111.1	K118 L125 S126 Y180	K118-V122 HydrophobicContact CG-CG2 4.21Å; K118-V122 WeakPolarHBondContact O-CB 3.28Å; K118-V122 VanDerWaalsContact O-CG2 3.28Å; K118-V122 WeakPolarHBondContact O-CG2 3.36Å; K118-V122 PolarHBondContact O-N 3.29Å; V122-L125 PolarHBondContact O-N 3.27Å; V122-S126 VanDerWaalsContact O-CB 3.3Å; V122-S126 WeakPolarHBondContact O-CB 3.07Å; V122-S126 PolarHBondContact O-N 3Å; V122-S126 PolarHBondContact O-OG 3.15Å; V122-Y180 HydrophobicContact CB-CD1 4.37Å; V122-Y180 HydrophobicContact CB-CE1 4.18Å; V122-Y180 HydrophobicContact CG1-CD1 4.45Å; V122-Y180 HydrophobicContact CG1-CE1 3.89Å; V122-Y180 HydrophobicContact CG1-CE2 3.97Å; V122-Y180 HydrophobicContact CG2-CD1 3.98Å; V122-Y180 HydrophobicContact CG2-CD2 4.24Å; V122-Y180 HydrophobicContact CG2-CE1 4.25Å; V122-Y180 HydrophobicContact CG2-CE2 4.49Å; V122-Y180 HydrophobicContact CG2-CG 3.98Å
123	K	90.9	Very high	88.7	Confident	150 Å²	150	43.3 Å²	43.3	65%	0.652	23%	0.225	S	C	*	.	H	α-helix	trans	-62.9	-45.7	177.9	-175.3	177.5	178.5	-179.8	0	111.5	A119 Y120 V121 S126 S127	A119-K123 WeakPolarHBondContact O-CB 3.43Å; A119-K123 PolarHBondContact O-N 3.37Å; Y120-K123 PolarHBondContact O-N 3.04Å; V121-K123 VanDerWaalsContact C-N 3.34Å; V121-K123 PolarHBondContact O-N 3.07Å; K123-S126 WeakPolarHBondContact CA-OG 3.39Å; K123-S126 PolarHBondContact O-N 3.07Å; K123-S126 PolarHBondContact O-OG 3.34Å; K123-S127 WeakPolarHBondContact O-CB 3.45Å; K123-S127 PolarHBondContact O-N 3.41Å
124	S	90.2	Very high	88.9	Confident	12 Å²	12	46.7 Å²	46.7	8%	0.084	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-45.8	178.9	-175.9	0	0	0	0	112.1	Y120 V121 S127 A128	Y120-S124 WeakPolarHBondContact O-CB 3.42Å; Y120-S124 PolarHBondContact O-N 3.21Å; V121-S124 PolarHBondContact O-N 3.34Å; S124-S127 PolarHBondContact O-N 2.87Å; S124-A128 PolarHBondContact O-N 3.17Å
125	L	92.8	Very high	88.9	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-65.1	-44.8	176.3	-68.3	173.4	0	0	0	111.5	V121 V122 S127 A128 T129 F154 Y180 Y181 F233	V121-L125 HydrophobicContact CG1-CD1 3.78Å; V121-L125 HydrophobicContact CG1-CG 4.3Å; V121-L125 WeakPolarHBondContact O-CB 3.21Å; V121-L125 VanDerWaalsContact O-CG 3.29Å; V121-L125 WeakPolarHBondContact O-CG 3.49Å; V121-L125 PolarHBondContact O-N 3.44Å; V122-L125 PolarHBondContact O-N 3.27Å; L125-S127 VanDerWaalsContact C-N 3.33Å; L125-S127 PolarHBondContact O-N 2.87Å; L125-A128 WeakPolarHBondContact O-CB 3.47Å; L125-A128 PolarHBondContact O-N 2.75Å; L125-T129 PolarHBondContact O-N 2.89Å; L125-T129 PolarHBondContact O-OG1 3.35Å; L125-F154 HydrophobicContact CD2-CE1 4.22Å; L125-F154 HydrophobicContact CD2-CZ 3.91Å; L125-Y180 HydrophobicContact CB-CD1 4.2Å; L125-Y180 HydrophobicContact CB-CE1 4Å; L125-Y180 HydrophobicContact CD1-CD1 3.9Å; L125-Y181 HydrophobicContact CD1-CD2 4.48Å; L125-Y181 HydrophobicContact CD2-CD2 3.91Å; L125-F233 HydrophobicContact CD2-CD1 4.22Å; L125-F233 HydrophobicContact CD2-CE1 3.77Å; L125-F233 HydrophobicContact CD2-CZ 4.43Å
126	S	93.2	Very high	88.6	Confident	37 Å²	37	47 Å²	47	26%	0.259	25%	0.249	S	C	.	.	H	α-helix	trans	-62.4	-39.4	177.1	69.7	0	0	0	0	112.5	V122 K123 T129 Q130	V122-S126 VanDerWaalsContact O-CB 3.3Å; V122-S126 WeakPolarHBondContact O-CB 3.07Å; V122-S126 PolarHBondContact O-N 3Å; V122-S126 PolarHBondContact O-OG 3.15Å; K123-S126 WeakPolarHBondContact CA-OG 3.39Å; K123-S126 PolarHBondContact O-N 3.07Å; K123-S126 PolarHBondContact O-OG 3.34Å; S126-T129 PolarHBondContact O-N 3.29Å; S126-Q130 VanDerWaalsContact O-CG 3.31Å; S126-Q130 WeakPolarHBondContact O-CG 3.04Å; S126-Q130 PolarHBondContact O-N 3.01Å
127	S	91.2	Very high	88.2	Confident	56 Å²	56	51.1 Å²	51.1	39%	0.392	27%	0.269	S	S	.	.	H	α-helix	trans	-63.1	-46.1	175.1	-168.6	0	0	0	0	110.5	K123 S124 L125 T129 Q130 D131	K123-S127 WeakPolarHBondContact O-CB 3.45Å; K123-S127 PolarHBondContact O-N 3.41Å; S124-S127 PolarHBondContact O-N 2.87Å; L125-S127 VanDerWaalsContact C-N 3.33Å; L125-S127 PolarHBondContact O-N 2.87Å; S127-T129 VanDerWaalsContact C-N 3.32Å; S127-T129 PolarHBondContact O-N 2.91Å; S127-Q130 PolarHBondContact O-N 2.74Å; S127-D131 WeakPolarHBondContact O-CB 3.42Å; S127-D131 PolarHBondContact O-N 2.87Å
128	A	90.6	Very high	87.6	Confident	2 Å²	2	57.7 Å²	57.7	2%	0.017	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-42.8	176.5	0	0	0	0	0	111.7	S124 L125 D131 V132 F154	S124-A128 PolarHBondContact O-N 3.17Å; L125-A128 WeakPolarHBondContact O-CB 3.47Å; L125-A128 PolarHBondContact O-N 2.75Å; A128-D131 PolarHBondContact O-N 3.31Å; A128-V132 VanDerWaalsContact O-CG2 3.26Å; A128-V132 WeakPolarHBondContact O-CG2 3.43Å; A128-V132 PolarHBondContact O-N 3.37Å; A128-F154 HydrophobicContact CB-CD2 3.84Å; A128-F154 HydrophobicContact CB-CE2 3.94Å; A128-F154 HydrophobicContact CB-CG 4.5Å
129	T	91.6	Very high	86.7	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-47.9	174.9	-54.4	0	0	0	0	111.6	L125 S126 S127 D131 V132 L133 Q184 L188	L125-T129 PolarHBondContact O-N 2.89Å; L125-T129 PolarHBondContact O-OG1 3.35Å; S126-T129 PolarHBondContact O-N 3.29Å; S127-T129 VanDerWaalsContact C-N 3.32Å; S127-T129 PolarHBondContact O-N 2.91Å; T129-D131 VanDerWaalsContact C-N 3.33Å; T129-D131 PolarHBondContact O-N 3.15Å; T129-V132 PolarHBondContact O-N 3.42Å; T129-L133 HydrophobicContact CG2-CD1 4.01Å; T129-L133 HydrophobicContact CG2-CG 4.37Å; T129-L133 WeakPolarHBondContact O-CG 3.49Å; T129-L133 PolarHBondContact O-N 3.48Å; T129-Q184 PolarHBondContact OG1-OE1 3.34Å; T129-L188 HydrophobicContact CG2-CD1 4.31Å; T129-L188 HydrophobicContact CG2-CD2 3.77Å; T129-L188 HydrophobicContact CG2-CG 3.99Å
130	Q	90.4	Very high	85.3	Confident	101 Å²	101	61.7 Å²	61.7	47%	0.472	32%	0.318	S	S	.	.	H	α-helix	trans	-64.9	-36.5	179.3	-68	-57.1	-44.1	0	0	112.4	S126 S127 V132 L133 T134	S126-Q130 VanDerWaalsContact O-CG 3.31Å; S126-Q130 WeakPolarHBondContact O-CG 3.04Å; S126-Q130 PolarHBondContact O-N 3.01Å; S127-Q130 PolarHBondContact O-N 2.74Å; Q130-V132 VanDerWaalsContact C-N 3.35Å; Q130-L133 PolarHBondContact O-N 3.35Å; Q130-T134 VanDerWaalsContact O-CB 3.32Å; Q130-T134 WeakPolarHBondContact O-CB 3.49Å; Q130-T134 PolarHBondContact O-N 2.84Å; Q130-T134 PolarHBondContact O-OG1 2.84Å
131	D	88.5	Confident	83.4	Confident	75 Å²	75	64 Å²	64	40%	0.401	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-41.2	175.2	-69.1	-28.6	0	0	0	111.4	S127 A128 T129 K135	S127-D131 WeakPolarHBondContact O-CB 3.42Å; S127-D131 PolarHBondContact O-N 2.87Å; A128-D131 PolarHBondContact O-N 3.31Å; T129-D131 VanDerWaalsContact C-N 3.33Å; T129-D131 PolarHBondContact O-N 3.15Å; D131-K135 WeakPolarHBondContact O-CG 3.27Å; D131-K135 PolarHBondContact O-N 3.04Å
132	V	87.7	Confident	81.7	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-66.5	-50.6	174.8	176.8	0	0	0	0	110.6	A128 T129 Q130 T134 K135 V136 Q149 L150 L153 F154 L188	A128-V132 VanDerWaalsContact O-CG2 3.26Å; A128-V132 WeakPolarHBondContact O-CG2 3.43Å; A128-V132 PolarHBondContact O-N 3.37Å; T129-V132 PolarHBondContact O-N 3.42Å; Q130-V132 VanDerWaalsContact C-N 3.35Å; V132-T134 VanDerWaalsContact C-N 3.31Å; V132-T134 PolarHBondContact O-N 3.39Å; V132-K135 PolarHBondContact O-N 3.35Å; V132-V136 HydrophobicContact CG1-CG2 4.04Å; V132-V136 WeakPolarHBondContact O-CB 3.49Å; V132-V136 VanDerWaalsContact O-CG2 3.25Å; V132-V136 WeakPolarHBondContact O-CG2 3.26Å; V132-V136 PolarHBondContact O-N 3.46Å; V132-Q149 WeakPolarHBondContact CG2-O 3.23Å; V132-L150 HydrophobicContact CG1-CD2 4.13Å; V132-L153 HydrophobicContact CB-CD2 4.48Å; V132-L153 HydrophobicContact CG2-CB 4.25Å; V132-L153 HydrophobicContact CG2-CD2 3.89Å; V132-L153 HydrophobicContact CG2-CG 4.07Å; V132-F154 HydrophobicContact CG2-CB 4.21Å; V132-F154 HydrophobicContact CG2-CD2 4.41Å; V132-L188 HydrophobicContact CB-CD1 4.37Å; V132-L188 HydrophobicContact CB-CD2 4Å; V132-L188 HydrophobicContact CG1-CD1 4.34Å; V132-L188 HydrophobicContact CG1-CD2 3.78Å; V132-L188 HydrophobicContact CG2-CD1 4.48Å
133	L	87.3	Confident	80	Confident	45 Å²	45	70.1 Å²	70.1	24%	0.236	40%	0.396	C	S	.	.	H	α-helix	trans	-58.2	-43	-179.8	-71.8	174.9	0	0	0	112.1	T129 Q130 V136 Q137 L188	T129-L133 HydrophobicContact CG2-CD1 4.01Å; T129-L133 HydrophobicContact CG2-CG 4.37Å; T129-L133 WeakPolarHBondContact O-CG 3.49Å; T129-L133 PolarHBondContact O-N 3.48Å; Q130-L133 PolarHBondContact O-N 3.35Å; L133-V136 PolarHBondContact O-N 3.25Å; L133-Q137 VanDerWaalsContact O-CG 3.29Å; L133-Q137 WeakPolarHBondContact O-CG 3.36Å; L133-Q137 PolarHBondContact O-N 2.96Å; L133-L188 HydrophobicContact CD2-CD2 3.81Å; L133-L188 HydrophobicContact CG-CD2 3.83Å
134	T	86.1	Confident	78.1	Confident	70 Å²	70	68.8 Å²	68.8	43%	0.429	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-43.8	178.1	-56.3	0	0	0	0	111.3	Q130 V132 Q137 I138	Q130-T134 VanDerWaalsContact O-CB 3.32Å; Q130-T134 WeakPolarHBondContact O-CB 3.49Å; Q130-T134 PolarHBondContact O-N 2.84Å; Q130-T134 PolarHBondContact O-OG1 2.84Å; V132-T134 VanDerWaalsContact C-N 3.31Å; V132-T134 PolarHBondContact O-N 3.39Å; T134-Q137 PolarHBondContact O-N 3.5Å; T134-I138 HydrophobicContact CG2-CD1 4.14Å; T134-I138 WeakPolarHBondContact O-CD1 3.37Å; T134-I138 VanDerWaalsContact O-CG1 3.3Å; T134-I138 WeakPolarHBondContact O-CG1 3.35Å; T134-I138 PolarHBondContact O-N 3.47Å
135	K	82.4	Confident	76.8	Confident	100 Å²	100	71.4 Å²	71.4	44%	0.435	41%	0.413	S	S	.	.	H	α-helix	trans	-71.6	-37.6	179.3	-71.3	-166.2	-162.7	171.7	0	113.2	D131 V132 Q137 I138 A139 L153	D131-K135 WeakPolarHBondContact O-CG 3.27Å; D131-K135 PolarHBondContact O-N 3.04Å; V132-K135 PolarHBondContact O-N 3.35Å; K135-Q137 VanDerWaalsContact C-N 3.3Å; K135-Q137 PolarHBondContact O-N 3.44Å; K135-I138 PolarHBondContact O-N 3.05Å; K135-A139 WeakPolarHBondContact O-CB 3.31Å; K135-A139 PolarHBondContact O-N 3Å; K135-L153 HydrophobicContact CB-CD2 4.45Å; K135-L153 HydrophobicContact CD-CD2 3.62Å; K135-L153 HydrophobicContact CG-CD2 4.33Å; K135-L153 VanDerWaalsContact NZ-CD1 3.34Å
136	V	80.1	Confident	75.7	Confident	64 Å²	64	73.2 Å²	73.2	39%	0.388	43%	0.428	S	S	.	.	H	α-helix	trans	-62.7	-38.4	175.4	170.8	0	0	0	0	110.9	V132 L133 I138 Q149	V132-V136 HydrophobicContact CG1-CG2 4.04Å; V132-V136 WeakPolarHBondContact O-CB 3.49Å; V132-V136 VanDerWaalsContact O-CG2 3.25Å; V132-V136 WeakPolarHBondContact O-CG2 3.26Å; V132-V136 PolarHBondContact O-N 3.46Å; L133-V136 PolarHBondContact O-N 3.25Å; V136-I138 VanDerWaalsContact C-N 3.33Å; V136-I138 PolarHBondContact O-N 3.23Å; V136-Q149 HydrophobicContact CG2-CB 4.43Å
137	Q	76.8	Confident	74.5	Confident	144 Å²	144	75.1 Å²	75.1	67%	0.673	43%	0.432	S	S	*	.	H	α-helix	trans	-63.6	-36.8	174.8	-75.3	174.9	2.8	0	0	112.9	L133 T134 K135	L133-Q137 VanDerWaalsContact O-CG 3.29Å; L133-Q137 WeakPolarHBondContact O-CG 3.36Å; L133-Q137 PolarHBondContact O-N 2.96Å; T134-Q137 PolarHBondContact O-N 3.5Å; K135-Q137 VanDerWaalsContact C-N 3.3Å; K135-Q137 PolarHBondContact O-N 3.44Å
138	I	73.2	Confident	73.7	Confident	137 Å²	137	75.9 Å²	75.9	70%	0.703	43%	0.434	S	S	*	.	H	α-helix	trans	-76.5	-39.5	179.7	-63.7	164.6	0	0	0	111	T134 K135 V136 Q140	T134-I138 HydrophobicContact CG2-CD1 4.14Å; T134-I138 WeakPolarHBondContact O-CD1 3.37Å; T134-I138 VanDerWaalsContact O-CG1 3.3Å; T134-I138 WeakPolarHBondContact O-CG1 3.35Å; T134-I138 PolarHBondContact O-N 3.47Å; K135-I138 PolarHBondContact O-N 3.05Å; V136-I138 VanDerWaalsContact C-N 3.33Å; V136-I138 PolarHBondContact O-N 3.23Å; I138-Q140 VanDerWaalsContact C-N 3.34Å; I138-Q140 PolarHBondContact O-N 3.36Å; I138-Q140 VanDerWaalsContact O-N 3.07Å
139	A	68.2	Low	72.9	Confident	29 Å²	29	76.7 Å²	76.7	24%	0.24	44%	0.438	C	S	.	.			trans	-84.7	65.6	-177.3	0	0	0	0	0	112.1	K135 S141 Q149	K135-A139 WeakPolarHBondContact O-CB 3.31Å; K135-A139 PolarHBondContact O-N 3Å; A139-S141 PolarHBondContact O-N 3.3Å; A139-Q149 VanDerWaalsContact CB-NE2 3.28Å
140	Q	60.5	Low	72.3	Confident	183 Å²	183	77.6 Å²	77.6	86%	0.855	44%	0.442	S	S	*	.			trans	-71.2	20	171.9	-66.8	-172.7	-0.6	0	0	113.9	I138	I138-Q140 VanDerWaalsContact C-N 3.34Å; I138-Q140 PolarHBondContact O-N 3.36Å; I138-Q140 VanDerWaalsContact O-N 3.07Å
141	S	49.8	Very low	72.2	Confident	96 Å²	96	73.9 Å²	73.9	67%	0.671	42%	0.424	S	S	*	.	S	Bend	trans	-142.3	104.1	-171.4	61.6	0	0	0	0	113.8	A139	A139-S141 PolarHBondContact O-N 3.3Å
142	G	52	Low	72	Confident	62 Å²	62	73.8 Å²	73.8	64%	0.639	43%	0.429	S	S	*	.			trans	110.2	133.4	160.3	0	0	0	0	0	116.4
143	S	55.8	Low	71.8	Confident	106 Å²	106	75.6 Å²	75.6	74%	0.741	44%	0.438	S	S	*	.	H	α-helix	trans	-72	-28.4	-176.8	58.2	0	0	0	0	114.9	D145 A146	S143-D145 VanDerWaalsContact C-N 3.29Å; S143-D145 PolarHBondContact O-N 3.03Å; S143-A146 PolarHBondContact O-N 2.59Å
144	V	52.3	Low	71.9	Confident	121 Å²	121	73.5 Å²	73.5	73%	0.733	43%	0.427	S	S	*	.	H	α-helix	trans	-69.2	-30.9	-177.7	-178	0	0	0	0	111.1
145	D	62.8	Low	72.1	Confident	67 Å²	67	71 Å²	71	36%	0.358	41%	0.413	S	S	.	.	H	α-helix	trans	-74.4	-31.7	-178.3	-157.8	7.8	0	0	0	111.9	S143 F147 T148 Q149	S143-D145 VanDerWaalsContact C-N 3.29Å; S143-D145 PolarHBondContact O-N 3.03Å; D145-F147 PolarHBondContact O-N 3.42Å; D145-T148 PolarHBondContact O-N 3.01Å; D145-Q149 WeakPolarHBondContact O-CB 3.5Å; D145-Q149 WeakPolarHBondContact O-CG 3.45Å; D145-Q149 PolarHBondContact O-N 3.45Å; D145-Q149 WeakPolarHBondContact OD1-CG 3.25Å; D145-Q149 PolarHBondContact OD1-NE2 2.81Å; D145-Q149 VanDerWaalsContact OD1-NE2 3.1Å; D145-Q149 PolarHBondContact OD2-NE2 3.39Å
146	A	69.4	Low	72.3	Confident	41 Å²	41	69.6 Å²	69.6	34%	0.339	42%	0.42	S	S	.	.	H	α-helix	trans	-59.8	-42.5	-177.4	0	0	0	0	0	113.4	S143 L150	S143-A146 PolarHBondContact O-N 2.59Å; A146-L150 VanDerWaalsContact O-CB 3.26Å; A146-L150 WeakPolarHBondContact O-CB 3.32Å; A146-L150 WeakPolarHBondContact O-CD1 3.22Å; A146-L150 WeakPolarHBondContact O-CG 3.26Å; A146-L150 PolarHBondContact O-N 3.32Å
147	F	68	Low	72.5	Confident	78 Å²	78	68.2 Å²	68.2	34%	0.342	41%	0.411	S	S	.	.	H	α-helix	trans	-67.1	-46.7	177.6	178.4	-95.8	0	0	0	111.6	D145 Q149 L150 Y151 D225	D145-F147 PolarHBondContact O-N 3.42Å; F147-Q149 VanDerWaalsContact C-N 3.29Å; F147-Q149 PolarHBondContact O-N 3.13Å; F147-L150 PolarHBondContact O-N 2.86Å; F147-Y151 AromaticContact CD2-CD2 3.53Å; F147-Y151 HydrophobicContact CD2-CD2 3.53Å; F147-Y151 AromaticContact CD2-CE2 3.9Å; F147-Y151 HydrophobicContact CD2-CE2 3.9Å; F147-Y151 HydrophobicContact CD2-CG 4.42Å; F147-Y151 AromaticContact CE2-CD2 3.53Å; F147-Y151 HydrophobicContact CE2-CD2 3.53Å; F147-Y151 AromaticContact CE2-CE2 3.91Å; F147-Y151 HydrophobicContact CE2-CE2 3.91Å; F147-Y151 HydrophobicContact CE2-CG 4.06Å; F147-Y151 HydrophobicContact CG-CD2 4.26Å; F147-Y151 HydrophobicContact CZ-CD2 4.26Å; F147-Y151 HydrophobicContact CZ-CG 4.4Å; F147-Y151 PolarHBondContact O-N 3.41Å; F147-D225 HydrophobicContact CE2-CB 4.47Å; F147-D225 WeakPolarHBondContact CE2-OD2 3.34Å
148	T	75.1	Confident	72.9	Confident	71 Å²	71	61.6 Å²	61.6	44%	0.436	38%	0.381	S	S	.	.	I	π-helix	trans	-61.1	-39.8	178.2	-57.9	0	0	0	0	111.3	D145 C152 L153	D145-T148 PolarHBondContact O-N 3.01Å; T148-C152 HydrophobicContact CG2-CB 4.18Å; T148-C152 WeakPolarHBondContact O-CA 3.49Å; T148-C152 VanDerWaalsContact O-CB 3.24Å; T148-C152 WeakPolarHBondContact O-CB 3.49Å; T148-C152 PolarHBondContact O-N 3.28Å; T148-L153 PolarHBondContact O-N 3.47Å; T148-L153 VanDerWaalsContact O-N 3.15Å
149	Q	73.3	Confident	73.5	Confident	20 Å²	20	57.2 Å²	57.2	9%	0.093	37%	0.37	C	S	.	.	I	π-helix	trans	-70.3	-42.7	176.1	-70	177.3	4.3	0	0	112.6	V132 V136 A139 D145 F147 L153	V132-Q149 WeakPolarHBondContact CG2-O 3.23Å; V136-Q149 HydrophobicContact CG2-CB 4.43Å; A139-Q149 VanDerWaalsContact CB-NE2 3.28Å; D145-Q149 WeakPolarHBondContact O-CB 3.5Å; D145-Q149 WeakPolarHBondContact O-CG 3.45Å; D145-Q149 PolarHBondContact O-N 3.45Å; D145-Q149 WeakPolarHBondContact OD1-CG 3.25Å; D145-Q149 PolarHBondContact OD1-NE2 2.81Å; D145-Q149 VanDerWaalsContact OD1-NE2 3.1Å; D145-Q149 PolarHBondContact OD2-NE2 3.39Å; F147-Q149 VanDerWaalsContact C-N 3.29Å; F147-Q149 PolarHBondContact O-N 3.13Å; Q149-L153 WeakPolarHBondContact O-CB 3.41Å
150	L	79.5	Confident	74.2	Confident	19 Å²	19	61.1 Å²	61.1	10%	0.099	38%	0.383	C	S	.	.	I	π-helix	trans	-73.6	-33.1	-176.3	-73.2	169.2	0	0	0	113.4	V132 A146 F147 R185 L188	V132-L150 HydrophobicContact CG1-CD2 4.13Å; A146-L150 VanDerWaalsContact O-CB 3.26Å; A146-L150 WeakPolarHBondContact O-CB 3.32Å; A146-L150 WeakPolarHBondContact O-CD1 3.22Å; A146-L150 WeakPolarHBondContact O-CG 3.26Å; A146-L150 PolarHBondContact O-N 3.32Å; F147-L150 PolarHBondContact O-N 2.86Å; L150-R185 PolarHBondContact O-NH1 3.27Å; L150-R185 PolarHBondContact O-NH2 3.15Å; L150-L188 HydrophobicContact CD2-CB 4.08Å
151	Y	86.6	Confident	75.4	Confident	23 Å²	23	52.4 Å²	52.4	9%	0.09	34%	0.342	C	S	.	.	I	π-helix	trans	-107.5	-58.6	-174.8	-69.7	-86.2	0	0	0	112.5	F147 L153 F154 A155 D225 E226 L229	F147-Y151 AromaticContact CD2-CD2 3.53Å; F147-Y151 HydrophobicContact CD2-CD2 3.53Å; F147-Y151 AromaticContact CD2-CE2 3.9Å; F147-Y151 HydrophobicContact CD2-CE2 3.9Å; F147-Y151 HydrophobicContact CD2-CG 4.42Å; F147-Y151 AromaticContact CE2-CD2 3.53Å; F147-Y151 HydrophobicContact CE2-CD2 3.53Å; F147-Y151 AromaticContact CE2-CE2 3.91Å; F147-Y151 HydrophobicContact CE2-CE2 3.91Å; F147-Y151 HydrophobicContact CE2-CG 4.06Å; F147-Y151 HydrophobicContact CG-CD2 4.26Å; F147-Y151 HydrophobicContact CZ-CD2 4.26Å; F147-Y151 HydrophobicContact CZ-CG 4.4Å; F147-Y151 PolarHBondContact O-N 3.41Å; Y151-L153 PolarHBondContact O-N 2.87Å; Y151-F154 PolarHBondContact O-N 3.32Å; Y151-A155 VanDerWaalsContact O-CB 3.26Å; Y151-A155 WeakPolarHBondContact O-CB 3.5Å; Y151-A155 PolarHBondContact O-N 3.4Å; Y151-D225 HydrophobicContact CD1-CB 4.43Å; Y151-D225 HydrophobicContact CE1-CB 3.77Å; Y151-D225 HydrophobicContact CE2-CB 4.42Å; Y151-E226 HydrophobicContact CE1-CG 4.42Å; Y151-E226 WeakPolarHBondContact CE1-OE1 3.08Å; Y151-E226 PolarHBondContact OH-OE1 2.99Å; Y151-L229 HydrophobicContact CD1-CB 4.07Å; Y151-L229 HydrophobicContact CD1-CD2 3.8Å; Y151-L229 HydrophobicContact CD1-CG 4.39Å; Y151-L229 HydrophobicContact CE1-CB 4.45Å; Y151-L229 HydrophobicContact CE1-CD2 4.18Å
152	C	84.7	Confident	77.1	Confident	73 Å²	73	50.3 Å²	50.3	49%	0.493	32%	0.322	S	S	.	.	I	π-helix	trans	-68.2	-38.8	-173.2	-54.8	0	0	0	0	112.8	T148 A155 A156	T148-C152 HydrophobicContact CG2-CB 4.18Å; T148-C152 WeakPolarHBondContact O-CA 3.49Å; T148-C152 VanDerWaalsContact O-CB 3.24Å; T148-C152 WeakPolarHBondContact O-CB 3.49Å; T148-C152 PolarHBondContact O-N 3.28Å; C152-A155 PolarHBondContact O-N 2.99Å; C152-A156 PolarHBondContact O-N 2.89Å
153	L	85	Confident	78.5	Confident	39 Å²	39	50 Å²	50	20%	0.204	31%	0.313	C	S	.	.	I	π-helix	trans	-69.4	-41.3	177.7	-177.7	63.8	0	0	0	111.8	V132 K135 T148 Q149 Y151 A155 A156	V132-L153 HydrophobicContact CB-CD2 4.48Å; V132-L153 HydrophobicContact CG2-CB 4.25Å; V132-L153 HydrophobicContact CG2-CD2 3.89Å; V132-L153 HydrophobicContact CG2-CG 4.07Å; K135-L153 HydrophobicContact CB-CD2 4.45Å; K135-L153 HydrophobicContact CD-CD2 3.62Å; K135-L153 HydrophobicContact CG-CD2 4.33Å; K135-L153 VanDerWaalsContact NZ-CD1 3.34Å; T148-L153 PolarHBondContact O-N 3.47Å; T148-L153 VanDerWaalsContact O-N 3.15Å; Q149-L153 WeakPolarHBondContact O-CB 3.41Å; Y151-L153 PolarHBondContact O-N 2.87Å; L153-A155 VanDerWaalsContact C-N 3.3Å; L153-A155 PolarHBondContact O-N 3.43Å; L153-A156 VanDerWaalsContact O-CB 3.23Å; L153-A156 WeakPolarHBondContact O-CB 3.41Å; L153-A156 PolarHBondContact O-N 2.94Å
154	F	89	Confident	79.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.5	-39.7	176	-167.4	-93.3	0	0	0	111.2	L125 A128 V132 Y151 A156 Y181 R185 L188 L229 F233	L125-F154 HydrophobicContact CD2-CE1 4.22Å; L125-F154 HydrophobicContact CD2-CZ 3.91Å; A128-F154 HydrophobicContact CB-CD2 3.84Å; A128-F154 HydrophobicContact CB-CE2 3.94Å; A128-F154 HydrophobicContact CB-CG 4.5Å; V132-F154 HydrophobicContact CG2-CB 4.21Å; V132-F154 HydrophobicContact CG2-CD2 4.41Å; Y151-F154 PolarHBondContact O-N 3.32Å; F154-A156 PolarHBondContact O-N 3.49Å; F154-Y181 HydrophobicContact CE1-CD2 4.24Å; F154-Y181 AromaticContact CE1-CE2 3.71Å; F154-Y181 HydrophobicContact CE1-CE2 3.71Å; F154-Y181 HydrophobicContact CZ-CE2 4.45Å; F154-R185 VanDerWaalsContact CG-NH1 3.29Å; F154-L188 HydrophobicContact CD2-CD1 3.59Å; F154-L188 HydrophobicContact CE2-CD1 3.84Å; F154-L188 HydrophobicContact CG-CD1 4.45Å; F154-L229 HydrophobicContact CD1-CD2 4.02Å; F154-F233 AromaticContact CD1-CE2 3.84Å; F154-F233 HydrophobicContact CD1-CE2 3.84Å; F154-F233 AromaticContact CD1-CZ 3.77Å; F154-F233 HydrophobicContact CD1-CZ 3.77Å; F154-F233 HydrophobicContact CE1-CE1 4.48Å; F154-F233 AromaticContact CE1-CE2 3.92Å; F154-F233 HydrophobicContact CE1-CE2 3.92Å; F154-F233 AromaticContact CE1-CZ 3.71Å; F154-F233 HydrophobicContact CE1-CZ 3.71Å; F154-F233 WeakPolarHBondContact O-CZ 3.29Å
155	A	89	Confident	81.1	Confident	17 Å²	17	39.5 Å²	39.5	14%	0.14	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-17.3	175.9	0	0	0	0	0	114.7	Y151 C152 L153 N157 A158 L229 E232	Y151-A155 VanDerWaalsContact O-CB 3.26Å; Y151-A155 WeakPolarHBondContact O-CB 3.5Å; Y151-A155 PolarHBondContact O-N 3.4Å; C152-A155 PolarHBondContact O-N 2.99Å; L153-A155 VanDerWaalsContact C-N 3.3Å; L153-A155 PolarHBondContact O-N 3.43Å; A155-N157 PolarHBondContact O-N 2.91Å; A155-N157 VanDerWaalsContact O-N 3.09Å; A155-A158 WeakPolarHBondContact O-CB 2.87Å; A155-A158 PolarHBondContact O-N 3.19Å; A155-L229 HydrophobicContact CB-CD1 3.78Å; A155-E232 WeakPolarHBondContact CB-OE2 3.47Å
156	A	86.8	Confident	81.7	Confident	71 Å²	71	41.5 Å²	41.5	59%	0.587	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-32.5	-176.5	0	0	0	0	0	113.3	C152 L153 F154	C152-A156 PolarHBondContact O-N 2.89Å; L153-A156 VanDerWaalsContact O-CB 3.23Å; L153-A156 WeakPolarHBondContact O-CB 3.41Å; L153-A156 PolarHBondContact O-N 2.94Å; F154-A156 PolarHBondContact O-N 3.49Å
157	N	83.9	Confident	81.7	Confident	35 Å²	35	42.3 Å²	42.3	19%	0.187	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-2	179.3	-67.6	-16.3	0	0	0	113.6	A155 G159 Q160 V161	A155-N157 PolarHBondContact O-N 2.91Å; A155-N157 VanDerWaalsContact O-N 3.09Å; N157-G159 PolarHBondContact O-N 3.45Å; N157-Q160 PolarHBondContact O-N 3.17Å; N157-V161 PolarHBondContact O-N 2.77Å
158	A	86.5	Confident	81.8	Confident	5 Å²	5	38.6 Å²	38.6	4%	0.041	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-46.9	-173.8	0	0	0	0	0	112.4	A155 Q160 V161 Q162 E232 F233	A155-A158 WeakPolarHBondContact O-CB 2.87Å; A155-A158 PolarHBondContact O-N 3.19Å; A158-Q160 VanDerWaalsContact C-N 3.29Å; A158-Q160 PolarHBondContact O-N 3.1Å; A158-V161 PolarHBondContact O-N 3.45Å; A158-Q162 VanDerWaalsContact O-CB 3.24Å; A158-Q162 WeakPolarHBondContact O-CB 3.49Å; A158-Q162 PolarHBondContact O-N 3.35Å; A158-E232 HydrophobicContact CB-CB 4.12Å; A158-F233 HydrophobicContact CB-CD1 4.12Å; A158-F233 HydrophobicContact CB-CD2 3.88Å; A158-F233 HydrophobicContact CB-CE1 4.01Å; A158-F233 HydrophobicContact CB-CE2 3.77Å; A158-F233 HydrophobicContact CB-CG 4.06Å; A158-F233 HydrophobicContact CB-CZ 3.84Å
159	G	85	Confident	81.4	Confident	46 Å²	46	40.4 Å²	40.4	47%	0.474	23%	0.234	S	C	.	.	H	α-helix	trans	-60.8	-35.2	-178.3	0	0	0	0	0	113.8	N157 A163	N157-G159 PolarHBondContact O-N 3.45Å; G159-A163 WeakPolarHBondContact O-CB 3.23Å; G159-A163 PolarHBondContact O-N 3.41Å; G159-A163 VanDerWaalsContact O-N 3.1Å
160	Q	83.7	Confident	81.4	Confident	111 Å²	111	41 Å²	41	52%	0.519	24%	0.236	S	C	.	.	H	α-helix	trans	-72.7	-41.6	177.4	-64.3	-177.2	3.3	0	0	111.8	N157 A158 V164	N157-Q160 PolarHBondContact O-N 3.17Å; A158-Q160 VanDerWaalsContact C-N 3.29Å; A158-Q160 PolarHBondContact O-N 3.1Å; Q160-V164 PolarHBondContact O-N 3.36Å
161	V	86	Confident	81.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.3	-43.7	177.5	173.1	0	0	0	0	110.4	V121 N157 A158 A163 V164 L165 F233	V121-V161 HydrophobicContact CG1-CG1 4.17Å; V121-V161 HydrophobicContact CG2-CG1 4.3Å; N157-V161 PolarHBondContact O-N 2.77Å; A158-V161 PolarHBondContact O-N 3.45Å; V161-A163 PolarHBondContact O-N 2.93Å; V161-V164 PolarHBondContact O-N 2.92Å; V161-L165 HydrophobicContact CG1-CD1 3.66Å; V161-L165 HydrophobicContact CG1-CG 4.1Å; V161-L165 WeakPolarHBondContact O-CB 3.48Å; V161-L165 WeakPolarHBondContact O-CG 3.29Å; V161-L165 PolarHBondContact O-N 3.46Å; V161-F233 HydrophobicContact CB-CD1 4.11Å; V161-F233 HydrophobicContact CB-CE1 4.48Å; V161-F233 HydrophobicContact CG1-CD1 4.1Å; V161-F233 HydrophobicContact CG2-CD1 4.46Å; V161-F233 HydrophobicContact CG2-CE1 4.39Å
162	Q	84.7	Confident	81	Confident	51 Å²	51	45 Å²	45	24%	0.238	28%	0.276	C	S	.	.	H	α-helix	trans	-60.4	-43.8	177.9	-174.6	-178.4	32.6	0	0	112	A158 V164 L165 K166 T236	A158-Q162 VanDerWaalsContact O-CB 3.24Å; A158-Q162 WeakPolarHBondContact O-CB 3.49Å; A158-Q162 PolarHBondContact O-N 3.35Å; Q162-V164 VanDerWaalsContact C-N 3.29Å; Q162-V164 PolarHBondContact O-N 3.39Å; Q162-L165 PolarHBondContact O-N 3.42Å; Q162-K166 WeakPolarHBondContact O-CB 3.49Å; Q162-K166 PolarHBondContact O-N 2.84Å; Q162-T236 WeakPolarHBondContact CG-OG1 3.46Å; Q162-T236 PolarHBondContact NE2-OG1 2.81Å
163	A	81.1	Confident	80.9	Confident	55 Å²	55	42 Å²	42	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-60.9	-37.7	177.7	0	0	0	0	0	112.4	G159 V161	G159-A163 WeakPolarHBondContact O-CB 3.23Å; G159-A163 PolarHBondContact O-N 3.41Å; G159-A163 VanDerWaalsContact O-N 3.1Å; V161-A163 PolarHBondContact O-N 2.93Å
164	V	80.5	Confident	80.9	Confident	6 Å²	6	40.3 Å²	40.3	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-74.2	-50.9	176	177.9	0	0	0	0	110.4	V72 V117 Y120 Q160 V161 Q162 K166 E167 F168	V72-V164 HydrophobicContact CG1-CG1 3.89Å; V72-V164 HydrophobicContact CG1-CG2 4.49Å; V117-V164 HydrophobicContact CG1-CG1 3.72Å; V117-V164 HydrophobicContact CG2-CG1 4.4Å; Y120-V164 HydrophobicContact CD1-CG2 4.21Å; Y120-V164 HydrophobicContact CE1-CG2 3.82Å; Q160-V164 PolarHBondContact O-N 3.36Å; V161-V164 PolarHBondContact O-N 2.92Å; Q162-V164 VanDerWaalsContact C-N 3.29Å; Q162-V164 PolarHBondContact O-N 3.39Å; V164-K166 VanDerWaalsContact C-N 3.29Å; V164-K166 PolarHBondContact O-N 3.43Å; V164-E167 PolarHBondContact O-N 2.98Å; V164-F168 HydrophobicContact CG1-CD2 4.31Å; V164-F168 HydrophobicContact CG1-CE2 4.32Å; V164-F168 VanDerWaalsContact O-CD2 3.31Å; V164-F168 WeakPolarHBondContact O-CD2 3.36Å
165	L	82.1	Confident	80.9	Confident	2 Å²	2	43 Å²	43	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-30.8	-174.8	-72.3	-179	0	0	0	114	V121 V161 Q162 E167 F168 M173 L174 F234	V121-L165 HydrophobicContact CG2-CD2 3.99Å; V121-L165 HydrophobicContact CG2-CG 4.31Å; V161-L165 HydrophobicContact CG1-CD1 3.66Å; V161-L165 HydrophobicContact CG1-CG 4.1Å; V161-L165 WeakPolarHBondContact O-CB 3.48Å; V161-L165 WeakPolarHBondContact O-CG 3.29Å; V161-L165 PolarHBondContact O-N 3.46Å; Q162-L165 PolarHBondContact O-N 3.42Å; L165-E167 PolarHBondContact O-N 2.86Å; L165-F168 PolarHBondContact O-N 2.87Å; L165-M173 HydrophobicContact CD2-CE 4.33Å; L165-M173 HydrophobicContact CD2-SD 4.22Å; L165-L174 HydrophobicContact CD2-CD2 3.96Å; L165-F234 HydrophobicContact CD1-CD1 3.88Å; L165-F234 HydrophobicContact CD1-CE1 3.61Å
166	K	76.3	Confident	80.9	Confident	109 Å²	109	46.3 Å²	46.3	47%	0.474	27%	0.273	S	S	.	.	H	α-helix	trans	-54.9	-38.2	175.6	-178.7	-174.3	-174.9	-169.5	0	112.5	Q162 V164 F168 T236	Q162-K166 WeakPolarHBondContact O-CB 3.49Å; Q162-K166 PolarHBondContact O-N 2.84Å; V164-K166 VanDerWaalsContact C-N 3.29Å; V164-K166 PolarHBondContact O-N 3.43Å; K166-F168 VanDerWaalsContact C-N 3.34Å; K166-T236 HydrophobicContact CB-CG2 4.28Å; K166-T236 HydrophobicContact CD-CG2 3.59Å; K166-T236 HydrophobicContact CG-CG2 3.74Å
167	E	69.5	Low	81.1	Confident	57 Å²	57	43 Å²	43	27%	0.266	25%	0.245	S	C	.	.	H	α-helix	trans	-82.8	-12.9	-173.9	-60.2	-48.7	143.7	0	0	112.6	M78 L82 V164 L165	M78-E167 HydrophobicContact CE-CB 4.15Å; M78-E167 HydrophobicContact CE-CG 3.48Å; M78-E167 VanDerWaalsContact CE-CG 3.48Å; L82-E167 HydrophobicContact CD1-CB 4.34Å; L82-E167 HydrophobicContact CD1-CG 4.16Å; L82-E167 WeakPolarHBondContact CD1-OE2 3.39Å; L82-E167 HydrophobicContact CD2-CB 3.71Å; L82-E167 HydrophobicContact CD2-CG 4.25Å; L82-E167 WeakPolarHBondContact CD2-O 3.48Å; L82-E167 WeakPolarHBondContact CD2-OE2 3.36Å; L82-E167 HydrophobicContact CG-CB 4Å; L82-E167 HydrophobicContact CG-CG 4.38Å; V164-E167 PolarHBondContact O-N 2.98Å; L165-E167 PolarHBondContact O-N 2.86Å
168	F	70.5	Confident	81.4	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	24%	0.237	C	C	.	.			trans	-121.1	83.1	-175.5	-66.8	-89.6	0	0	0	112.4	F77 M78 A81 V85 L114 V117 V164 L165 K166 Y170 M173	F77-F168 HydrophobicContact CE1-CE2 4.32Å; F77-F168 AromaticContact CE1-CZ 3.67Å; F77-F168 HydrophobicContact CE1-CZ 3.67Å; F77-F168 HydrophobicContact CZ-CZ 4.26Å; M78-F168 HydrophobicContact SD-CE2 4.26Å; A81-F168 HydrophobicContact CB-CE1 3.49Å; A81-F168 VanDerWaalsContact CB-CE1 3.49Å; A81-F168 HydrophobicContact CB-CE2 4.46Å; A81-F168 HydrophobicContact CB-CZ 3.26Å; V85-F168 HydrophobicContact CG2-CD1 3.86Å; V85-F168 HydrophobicContact CG2-CE1 4.25Å; L114-F168 HydrophobicContact CD2-CB 4.37Å; L114-F168 HydrophobicContact CD2-CD1 3.76Å; L114-F168 HydrophobicContact CD2-CG 4.45Å; V117-F168 HydrophobicContact CG1-CD2 4.2Å; V117-F168 HydrophobicContact CG1-CG 4.42Å; V117-F168 HydrophobicContact CG2-CD1 4.12Å; V117-F168 HydrophobicContact CG2-CD2 3.87Å; V117-F168 HydrophobicContact CG2-CE1 3.76Å; V117-F168 HydrophobicContact CG2-CE2 3.53Å; V117-F168 HydrophobicContact CG2-CG 4.15Å; V117-F168 HydrophobicContact CG2-CZ 3.44Å; V117-F168 VanDerWaalsContact CG2-CZ 3.44Å; V164-F168 HydrophobicContact CG1-CD2 4.31Å; V164-F168 HydrophobicContact CG1-CE2 4.32Å; V164-F168 VanDerWaalsContact O-CD2 3.31Å; V164-F168 WeakPolarHBondContact O-CD2 3.36Å; L165-F168 PolarHBondContact O-N 2.87Å; K166-F168 VanDerWaalsContact C-N 3.34Å; F168-Y170 VanDerWaalsContact C-N 3.31Å; F168-Y170 PolarHBondContact O-N 2.81Å; F168-M173 HydrophobicContact CB-CE 3.62Å; F168-M173 HydrophobicContact CG-CE 4.47Å
169	E	65.2	Low	81.7	Confident	108 Å²	108	45 Å²	45	51%	0.505	26%	0.255	S	S	.	.			trans	-81.4	62.6	-179.7	-60.6	-174.3	155.5	0	0	113.5
170	Y	73.9	Confident	82.1	Confident	34 Å²	34	46 Å²	46	13%	0.133	25%	0.245	C	C	.	.			trans	-110	108.6	176.5	-75.4	-90.1	0	0	0	112.3	V85 L110 L114 F168 A172 M173 L174	V85-Y170 HydrophobicContact CB-CE2 4.17Å; V85-Y170 HydrophobicContact CG1-CE2 3.79Å; V85-Y170 HydrophobicContact CG2-CE2 3.62Å; L110-Y170 HydrophobicContact CD1-CE1 4.28Å; L110-Y170 HydrophobicContact CD1-CE2 3.8Å; L110-Y170 VanDerWaalsContact CD1-CZ 3.49Å; L110-Y170 WeakPolarHBondContact CD1-OH 3.4Å; L110-Y170 HydrophobicContact CD2-CE1 3.65Å; L110-Y170 WeakPolarHBondContact CD2-OH 3.39Å; L110-Y170 HydrophobicContact CG-CE1 4.26Å; L114-Y170 HydrophobicContact CD1-CD1 3.72Å; L114-Y170 HydrophobicContact CD1-CD2 3.84Å; L114-Y170 HydrophobicContact CD1-CE1 4.1Å; L114-Y170 HydrophobicContact CD1-CE2 4.17Å; L114-Y170 HydrophobicContact CD1-CG 3.59Å; L114-Y170 HydrophobicContact CD2-CD2 3.38Å; L114-Y170 HydrophobicContact CD2-CE2 3.92Å; L114-Y170 HydrophobicContact CD2-CG 3.86Å; L114-Y170 HydrophobicContact CG-CD2 4.2Å; L114-Y170 HydrophobicContact CG-CE2 4.5Å; L114-Y170 HydrophobicContact CG-CG 4.39Å; F168-Y170 VanDerWaalsContact C-N 3.31Å; F168-Y170 PolarHBondContact O-N 2.81Å; Y170-A172 PolarHBondContact O-N 2.85Å; Y170-M173 PolarHBondContact O-N 2.81Å; Y170-M173 VanDerWaalsContact O-N 3.15Å; Y170-L174 WeakPolarHBondContact O-CB 3.18Å; Y170-L174 VanDerWaalsContact O-CG 3.32Å; Y170-L174 WeakPolarHBondContact O-CG 3.48Å; Y170-L174 PolarHBondContact O-N 3.26Å
171	A	77	Confident	82.7	Confident	58 Å²	58	40.7 Å²	40.7	48%	0.479	22%	0.221	S	C	.	.	H	α-helix	trans	-49.3	-51.6	-178	0	0	0	0	0	113.3	M173 L174 D175	A171-M173 PolarHBondContact O-N 2.67Å; A171-L174 PolarHBondContact O-N 2.82Å; A171-D175 PolarHBondContact O-N 3.3Å
172	A	81.1	Confident	83.1	Confident	66 Å²	66	41.3 Å²	41.3	55%	0.545	22%	0.223	S	C	.	.	H	α-helix	trans	-62.8	-41.3	-178.7	0	0	0	0	0	113.6	Y170 D175 E176	Y170-A172 PolarHBondContact O-N 2.85Å; A172-D175 PolarHBondContact O-N 2.99Å; A172-E176 WeakPolarHBondContact O-CG 3.34Å; A172-E176 PolarHBondContact O-N 3.03Å; A172-E176 VanDerWaalsContact O-N 3.16Å
173	M	83	Confident	83.6	Confident	11 Å²	11	42.2 Å²	42.2	5%	0.054	24%	0.235	C	C	.	.	H	α-helix	trans	-68.7	-37.8	177	-179.8	-86.7	-79.2	0	0	111.2	L114 V117 K118 L165 F168 Y170 A171 E176 C177	L114-M173 HydrophobicContact CD2-CE 3.87Å; V117-M173 HydrophobicContact CG1-CE 3.84Å; V117-M173 HydrophobicContact CG1-SD 4.43Å; K118-M173 HydrophobicContact CB-CG 4.41Å; L165-M173 HydrophobicContact CD2-CE 4.33Å; L165-M173 HydrophobicContact CD2-SD 4.22Å; F168-M173 HydrophobicContact CB-CE 3.62Å; F168-M173 HydrophobicContact CG-CE 4.47Å; Y170-M173 PolarHBondContact O-N 2.81Å; Y170-M173 VanDerWaalsContact O-N 3.15Å; A171-M173 PolarHBondContact O-N 2.67Å; M173-E176 PolarHBondContact O-N 3.42Å; M173-C177 PolarHBondContact O-N 2.85Å; M173-C177 PolarHBondContact O-SG 2.88Å
174	L	84.9	Confident	84.3	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-41.8	175.1	-70.6	173.8	0	0	0	111.5	L165 Y170 A171 E176 C177 Y178 I237 T242	L165-L174 HydrophobicContact CD2-CD2 3.96Å; Y170-L174 WeakPolarHBondContact O-CB 3.18Å; Y170-L174 VanDerWaalsContact O-CG 3.32Å; Y170-L174 WeakPolarHBondContact O-CG 3.48Å; Y170-L174 PolarHBondContact O-N 3.26Å; A171-L174 PolarHBondContact O-N 2.82Å; L174-E176 VanDerWaalsContact C-N 3.31Å; L174-E176 PolarHBondContact O-N 3.44Å; L174-C177 CarbonylContact O-C 3.57Å; L174-C177 WeakPolarHBondContact O-CB 3.38Å; L174-C177 PolarHBondContact O-N 3.19Å; L174-C177 VanDerWaalsContact O-N 3.12Å; L174-Y178 HydrophobicContact CB-CE2 4.44Å; L174-Y178 WeakPolarHBondContact O-CD2 3.35Å; L174-Y178 PolarHBondContact O-N 3.06Å; L174-I237 HydrophobicContact CD1-CD1 4.32Å; L174-I237 HydrophobicContact CD1-CG2 4.08Å; L174-I237 HydrophobicContact CD2-CD1 3.84Å; L174-T242 HydrophobicContact CD1-CG2 4.1Å
175	D	88.2	Confident	84.9	Confident	56 Å²	56	40.2 Å²	40.2	30%	0.299	22%	0.215	S	C	.	.	H	α-helix	trans	-60.5	-41.2	176	-67.1	-16.1	0	0	0	111.4	A171 A172 Y178 N179 F249	A171-D175 PolarHBondContact O-N 3.3Å; A172-D175 PolarHBondContact O-N 2.99Å; D175-Y178 PolarHBondContact O-N 3.04Å; D175-N179 WeakPolarHBondContact O-CB 3.16Å; D175-N179 PolarHBondContact O-N 2.99Å; D175-N179 PolarHBondContact O-ND2 3.11Å; D175-F249 HydrophobicContact CB-CE2 3.95Å; D175-F249 HydrophobicContact CB-CZ 3.83Å; D175-F249 WeakPolarHBondContact OD1-CE2 3.36Å
176	E	88.9	Confident	85.5	Confident	87 Å²	87	41.4 Å²	41.4	41%	0.407	22%	0.221	S	C	.	.	H	α-helix	trans	-65.7	-38.8	173.5	-68.8	176.3	-146.5	0	0	112.3	K118 A172 M173 L174 Y180	K118-E176 WeakPolarHBondContact CD-OE2 3.31Å; K118-E176 WeakPolarHBondContact CE-OE2 3.28Å; K118-E176 IonicContact NZ-OE2 2.61Å; K118-E176 PolarHBondContact NZ-OE2 3.23Å; A172-E176 WeakPolarHBondContact O-CG 3.34Å; A172-E176 PolarHBondContact O-N 3.03Å; A172-E176 VanDerWaalsContact O-N 3.16Å; M173-E176 PolarHBondContact O-N 3.42Å; L174-E176 VanDerWaalsContact C-N 3.31Å; L174-E176 PolarHBondContact O-N 3.44Å; E176-Y180 PolarHBondContact O-N 3.2Å
177	C	90.4	Very high	86.3	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.007	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-42.9	174.2	-68.8	0	0	0	0	112.1	V121 M173 L174 Y180 Y181	V121-C177 HydrophobicContact CG1-CB 4.41Å; M173-C177 PolarHBondContact O-N 2.85Å; M173-C177 PolarHBondContact O-SG 2.88Å; L174-C177 CarbonylContact O-C 3.57Å; L174-C177 WeakPolarHBondContact O-CB 3.38Å; L174-C177 PolarHBondContact O-N 3.19Å; L174-C177 VanDerWaalsContact O-N 3.12Å; C177-Y180 PolarHBondContact O-N 3.45Å; C177-Y181 VanDerWaalsContact O-CB 3.26Å; C177-Y181 WeakPolarHBondContact O-CB 3.38Å; C177-Y181 PolarHBondContact O-N 3.32Å
178	Y	91.5	Very high	87.3	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-48.2	175.2	-80.8	-62.5	0	0	0	111.2	L174 D175 Y180 Y181 F182 F234 A245 R246 F249	L174-Y178 HydrophobicContact CB-CE2 4.44Å; L174-Y178 WeakPolarHBondContact O-CD2 3.35Å; L174-Y178 PolarHBondContact O-N 3.06Å; D175-Y178 PolarHBondContact O-N 3.04Å; Y178-Y180 VanDerWaalsContact C-N 3.35Å; Y178-Y180 PolarHBondContact O-N 3.43Å; Y178-Y181 PolarHBondContact O-N 3.36Å; Y178-F182 HydrophobicContact CD1-CE2 4.24Å; Y178-F182 VanDerWaalsContact O-CD2 3.22Å; Y178-F182 WeakPolarHBondContact O-CD2 3.28Å; Y178-F182 PolarHBondContact O-N 3.37Å; Y178-F234 HydrophobicContact CD1-CD1 4.26Å; Y178-F234 HydrophobicContact CD1-CD2 4.07Å; Y178-F234 HydrophobicContact CD1-CE1 4.05Å; Y178-F234 AromaticContact CD1-CE2 3.87Å; Y178-F234 HydrophobicContact CD1-CE2 3.87Å; Y178-F234 HydrophobicContact CD1-CG 4.28Å; Y178-F234 AromaticContact CD1-CZ 3.85Å; Y178-F234 HydrophobicContact CD1-CZ 3.85Å; Y178-F234 HydrophobicContact CE1-CB 4Å; Y178-F234 AromaticContact CE1-CD1 3.62Å; Y178-F234 HydrophobicContact CE1-CD1 3.62Å; Y178-F234 AromaticContact CE1-CD2 3.54Å; Y178-F234 HydrophobicContact CE1-CD2 3.54Å; Y178-F234 AromaticContact CE1-CE1 3.89Å; Y178-F234 HydrophobicContact CE1-CE1 3.89Å; Y178-F234 AromaticContact CE1-CE2 3.83Å; Y178-F234 HydrophobicContact CE1-CE2 3.83Å; Y178-F234 AromaticContact CE1-CG 3.44Å; Y178-F234 HydrophobicContact CE1-CG 3.44Å; Y178-F234 VanDerWaalsContact CE1-CG 3.44Å; Y178-F234 AromaticContact CE1-CZ 3.99Å; Y178-F234 HydrophobicContact CE1-CZ 3.99Å; Y178-F234 AromaticContact CZ-CD1 3.77Å; Y178-F234 AromaticContact CZ-CG 3.87Å; Y178-A245 HydrophobicContact CE2-CB 4.49Å; Y178-R246 HydrophobicContact CE1-CB 4.44Å; Y178-R246 HydrophobicContact CE1-CG 4.31Å; Y178-F249 VanDerWaalsContact CB-CD2 3.45Å; Y178-F249 AromaticContact CD2-CD2 3.82Å; Y178-F249 HydrophobicContact CD2-CD2 3.82Å; Y178-F249 HydrophobicContact CD2-CE2 4.11Å; Y178-F249 AromaticContact CG-CD2 3.73Å; Y178-F249 HydrophobicContact CG-CD2 3.73Å; Y178-F249 HydrophobicContact CG-CE2 4.32Å; Y178-F249 HydrophobicContact CG-CG 4.29Å
179	N	92.6	Very high	88.3	Confident	80 Å²	80	38.4 Å²	38.4	43%	0.428	21%	0.209	S	C	.	.	H	α-helix	trans	-56.6	-48.9	177	-80.4	-54.3	0	0	0	111.6	D175 F182 C183 F249	D175-N179 WeakPolarHBondContact O-CB 3.16Å; D175-N179 PolarHBondContact O-N 2.99Å; D175-N179 PolarHBondContact O-ND2 3.11Å; N179-F182 PolarHBondContact O-N 2.91Å; N179-C183 PolarHBondContact O-N 3.05Å; N179-C183 PolarHBondContact O-SG 3.37Å; N179-F249 VanDerWaalsContact CG-CE1 3.45Å; N179-F249 VanDerWaalsContact ND2-CE1 3.34Å; N179-F249 WeakPolarHBondContact ND2-CE1 3.46Å; N179-F249 WeakPolarHBondContact OD1-CE1 3.35Å
180	Y	94	Very high	89.6	Confident	68 Å²	68	38 Å²	38	27%	0.267	20%	0.203	S	C	.	.	H	α-helix	trans	-64.7	-43.4	179.6	-169.2	-94	0	0	0	112	V122 L125 E176 C177 Y178 F182 C183 Q184	V122-Y180 HydrophobicContact CB-CD1 4.37Å; V122-Y180 HydrophobicContact CB-CE1 4.18Å; V122-Y180 HydrophobicContact CG1-CD1 4.45Å; V122-Y180 HydrophobicContact CG1-CE1 3.89Å; V122-Y180 HydrophobicContact CG1-CE2 3.97Å; V122-Y180 HydrophobicContact CG2-CD1 3.98Å; V122-Y180 HydrophobicContact CG2-CD2 4.24Å; V122-Y180 HydrophobicContact CG2-CE1 4.25Å; V122-Y180 HydrophobicContact CG2-CE2 4.49Å; V122-Y180 HydrophobicContact CG2-CG 3.98Å; L125-Y180 HydrophobicContact CB-CD1 4.2Å; L125-Y180 HydrophobicContact CB-CE1 4Å; L125-Y180 HydrophobicContact CD1-CD1 3.9Å; E176-Y180 PolarHBondContact O-N 3.2Å; C177-Y180 PolarHBondContact O-N 3.45Å; Y178-Y180 VanDerWaalsContact C-N 3.35Å; Y178-Y180 PolarHBondContact O-N 3.43Å; Y180-F182 PolarHBondContact O-N 2.98Å; Y180-C183 PolarHBondContact O-N 2.84Å; Y180-Q184 HydrophobicContact CD1-CG 3.9Å; Y180-Q184 HydrophobicContact CE1-CG 3.49Å; Y180-Q184 VanDerWaalsContact CE1-CG 3.49Å; Y180-Q184 WeakPolarHBondContact O-CG 3.2Å; Y180-Q184 PolarHBondContact O-N 3.42Å
181	Y	95.1	Very high	90.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-53.6	-52.9	174.7	171.7	-87.7	0	0	0	111.4	L125 F154 C177 Y178 C183 Q184 R185 L229 M230 F233 F234	L125-Y181 HydrophobicContact CD1-CD2 4.48Å; L125-Y181 HydrophobicContact CD2-CD2 3.91Å; F154-Y181 HydrophobicContact CE1-CD2 4.24Å; F154-Y181 AromaticContact CE1-CE2 3.71Å; F154-Y181 HydrophobicContact CE1-CE2 3.71Å; F154-Y181 HydrophobicContact CZ-CE2 4.45Å; C177-Y181 VanDerWaalsContact O-CB 3.26Å; C177-Y181 WeakPolarHBondContact O-CB 3.38Å; C177-Y181 PolarHBondContact O-N 3.32Å; Y178-Y181 PolarHBondContact O-N 3.36Å; Y181-C183 VanDerWaalsContact C-N 3.34Å; Y181-C183 PolarHBondContact O-N 2.94Å; Y181-Q184 PolarHBondContact O-N 2.87Å; Y181-R185 HydrophobicContact CD1-CG 4.05Å; Y181-R185 HydrophobicContact CE1-CG 3.59Å; Y181-R185 HydrophobicContact CE2-CG 4.27Å; Y181-R185 WeakPolarHBondContact O-CG 3.48Å; Y181-R185 PolarHBondContact O-N 3.35Å; Y181-L229 WeakPolarHBondContact OH-CG 3.33Å; Y181-M230 HydrophobicContact CE1-CB 4.3Å; Y181-M230 PolarHBondContact OH-N 2.78Å; Y181-F233 HydrophobicContact CD2-CG 4.45Å; Y181-F233 HydrophobicContact CE2-CB 4.39Å; Y181-F233 HydrophobicContact CE2-CD1 4.38Å; Y181-F233 AromaticContact CE2-CD2 3.73Å; Y181-F233 HydrophobicContact CE2-CD2 3.73Å; Y181-F233 HydrophobicContact CE2-CE2 4.05Å; Y181-F233 AromaticContact CE2-CG 3.91Å; Y181-F233 HydrophobicContact CE2-CG 3.91Å; Y181-F233 HydrophobicContact CE2-CZ 4.5Å; Y181-F234 HydrophobicContact CD1-CE2 4.12Å; Y181-F234 AromaticContact CD2-CE2 3.86Å; Y181-F234 HydrophobicContact CD2-CE2 3.86Å; Y181-F234 HydrophobicContact CD2-CZ 4.31Å; Y181-F234 HydrophobicContact CE2-CE2 4.23Å; Y181-F234 AromaticContact CG-CE2 3.81Å; Y181-F234 HydrophobicContact CG-CE2 3.81Å; Y181-F234 HydrophobicContact CG-CZ 4.18Å
182	F	95.7	Very high	91	Very high	12 Å²	12	39.9 Å²	39.9	5%	0.053	22%	0.215	C	C	.	.	H	α-helix	trans	-69.3	-29.8	-178.6	-75	-64.7	0	0	0	113.1	Y178 N179 Y180 R185 E186 M230 F249 L250 F253	Y178-F182 HydrophobicContact CD1-CE2 4.24Å; Y178-F182 VanDerWaalsContact O-CD2 3.22Å; Y178-F182 WeakPolarHBondContact O-CD2 3.28Å; Y178-F182 PolarHBondContact O-N 3.37Å; N179-F182 PolarHBondContact O-N 2.91Å; Y180-F182 PolarHBondContact O-N 2.98Å; F182-R185 PolarHBondContact O-N 3.24Å; F182-E186 WeakPolarHBondContact O-CB 3.49Å; F182-E186 PolarHBondContact O-N 3.49Å; F182-M230 HydrophobicContact CE2-SD 4.33Å; F182-M230 HydrophobicContact CZ-CG 4.12Å; F182-M230 HydrophobicContact CZ-SD 3.69Å; F182-F249 HydrophobicContact CD2-CB 3.8Å; F182-F249 HydrophobicContact CE2-CB 3.55Å; F182-L250 HydrophobicContact CE1-CD1 4.14Å; F182-L250 HydrophobicContact CZ-CB 4.17Å; F182-L250 HydrophobicContact CZ-CD1 4.12Å; F182-F253 HydrophobicContact CB-CB 4.31Å; F182-F253 HydrophobicContact CB-CD2 4Å; F182-F253 HydrophobicContact CB-CG 4.27Å; F182-F253 HydrophobicContact CD1-CB 3.56Å; F182-F253 AromaticContact CD1-CD1 3.47Å; F182-F253 HydrophobicContact CD1-CD1 3.47Å; F182-F253 VanDerWaalsContact CD1-CD1 3.47Å; F182-F253 AromaticContact CD1-CD2 3.75Å; F182-F253 HydrophobicContact CD1-CD2 3.75Å; F182-F253 AromaticContact CD1-CE1 3.98Å; F182-F253 HydrophobicContact CD1-CE1 3.98Å; F182-F253 HydrophobicContact CD1-CE2 4.24Å; F182-F253 AromaticContact CD1-CG 3.31Å; F182-F253 HydrophobicContact CD1-CG 3.31Å; F182-F253 HydrophobicContact CD1-CZ 4.33Å; F182-F253 HydrophobicContact CE1-CB 3.96Å; F182-F253 AromaticContact CE1-CD1 3.63Å; F182-F253 HydrophobicContact CE1-CD1 3.63Å; F182-F253 HydrophobicContact CE1-CE1 4.22Å; F182-F253 AromaticContact CE1-CG 3.86Å; F182-F253 HydrophobicContact CE1-CG 3.86Å; F182-F253 HydrophobicContact CG-CB 3.94Å; F182-F253 HydrophobicContact CG-CD2 4.25Å; F182-F253 HydrophobicContact CG-CG 4.03Å
183	C	95.2	Very high	91.5	Very high	71 Å²	71	37.1 Å²	37.1	48%	0.48	19%	0.191	S	C	.	.	H	α-helix	trans	-62	-44	170.6	-69	0	0	0	0	111.7	N179 Y180 Y181 E186 E187	N179-C183 PolarHBondContact O-N 3.05Å; N179-C183 PolarHBondContact O-SG 3.37Å; Y180-C183 PolarHBondContact O-N 2.84Å; Y181-C183 VanDerWaalsContact C-N 3.34Å; Y181-C183 PolarHBondContact O-N 2.94Å; C183-E186 PolarHBondContact O-N 3.3Å; C183-E187 PolarHBondContact O-N 3.07Å
184	Q	94.6	Very high	91.9	Very high	19 Å²	19	39.7 Å²	39.7	9%	0.089	20%	0.203	C	C	.	.	H	α-helix	trans	-66.6	-41	176.6	-66.6	-63.2	-71.7	0	0	111.7	T129 Y180 Y181 E186 E187 L188	T129-Q184 PolarHBondContact OG1-OE1 3.34Å; Y180-Q184 HydrophobicContact CD1-CG 3.9Å; Y180-Q184 HydrophobicContact CE1-CG 3.49Å; Y180-Q184 VanDerWaalsContact CE1-CG 3.49Å; Y180-Q184 WeakPolarHBondContact O-CG 3.2Å; Y180-Q184 PolarHBondContact O-N 3.42Å; Y181-Q184 PolarHBondContact O-N 2.87Å; Q184-E186 VanDerWaalsContact C-N 3.35Å; Q184-E186 PolarHBondContact O-N 2.9Å; Q184-E187 PolarHBondContact O-N 3.37Å; Q184-L188 WeakPolarHBondContact O-CG 3.27Å; Q184-L188 PolarHBondContact O-N 3.03Å
185	R	94.4	Very high	92.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-40.6	175.1	-67.9	-54.4	-56.9	168.8	-1.4	112.3	L150 F154 Y181 F182 E187 L188 V189 E226 F253	L150-R185 PolarHBondContact O-NH1 3.27Å; L150-R185 PolarHBondContact O-NH2 3.15Å; F154-R185 VanDerWaalsContact CG-NH1 3.29Å; Y181-R185 HydrophobicContact CD1-CG 4.05Å; Y181-R185 HydrophobicContact CE1-CG 3.59Å; Y181-R185 HydrophobicContact CE2-CG 4.27Å; Y181-R185 WeakPolarHBondContact O-CG 3.48Å; Y181-R185 PolarHBondContact O-N 3.35Å; F182-R185 PolarHBondContact O-N 3.24Å; R185-E187 VanDerWaalsContact C-N 3.33Å; R185-E187 PolarHBondContact O-N 3.25Å; R185-L188 PolarHBondContact O-N 3.39Å; R185-V189 WeakPolarHBondContact O-CB 3.42Å; R185-V189 VanDerWaalsContact O-CG2 3.32Å; R185-V189 WeakPolarHBondContact O-CG2 3.42Å; R185-V189 PolarHBondContact O-N 2.83Å; R185-E226 IonicContact CZ-OE1 3.72Å; R185-E226 IonicContact NE-OE1 3.66Å; R185-E226 IonicContact NE-OE2 3.36Å; R185-E226 PolarHBondContact NE-OE2 3Å; R185-E226 IonicContact NH2-OE1 2.89Å; R185-E226 PolarHBondContact NH2-OE1 3.39Å; R185-E226 IonicContact NH2-OE2 3.91Å; R185-F253 HydrophobicContact CB-CE2 4.18Å; R185-F253 HydrophobicContact CB-CZ 3.83Å
186	E	93.8	Very high	92.4	Very high	26 Å²	26	42 Å²	42	12%	0.121	23%	0.225	C	C	.	.	H	α-helix	trans	-59.7	-43.6	176.3	-170	-179.1	170	0	0	111.8	F182 C183 Q184 L188 V189 R190 F253 K256	F182-E186 WeakPolarHBondContact O-CB 3.49Å; F182-E186 PolarHBondContact O-N 3.49Å; C183-E186 PolarHBondContact O-N 3.3Å; Q184-E186 VanDerWaalsContact C-N 3.35Å; Q184-E186 PolarHBondContact O-N 2.9Å; E186-L188 VanDerWaalsContact C-N 3.26Å; E186-L188 PolarHBondContact O-N 3.44Å; E186-V189 PolarHBondContact O-N 3.08Å; E186-R190 HydrophobicContact CG-CB 4.43Å; E186-R190 WeakPolarHBondContact O-CB 3.39Å; E186-R190 PolarHBondContact O-N 2.89Å; E186-F253 HydrophobicContact CB-CE2 3.95Å; E186-K256 WeakPolarHBondContact OE1-CD 3.21Å; E186-K256 WeakPolarHBondContact OE1-CE 3.38Å; E186-K256 IonicContact OE1-NZ 3.91Å; E186-K256 PolarHBondContact OE1-NZ 3.15Å; E186-K256 WeakPolarHBondContact OE2-CD 3.32Å; E186-K256 WeakPolarHBondContact OE2-CE 3.35Å; E186-K256 IonicContact OE2-NZ 3.5Å; E186-K256 PolarHBondContact OE2-NZ 2.69Å
187	E	92.3	Very high	92.6	Very high	92 Å²	92	38.4 Å²	38.4	43%	0.43	21%	0.208	S	C	.	.	H	α-helix	trans	-58.1	-38.1	177.8	-171.5	177.7	169.2	0	0	112.3	C183 Q184 R185 P191	C183-E187 PolarHBondContact O-N 3.07Å; Q184-E187 PolarHBondContact O-N 3.37Å; R185-E187 VanDerWaalsContact C-N 3.33Å; R185-E187 PolarHBondContact O-N 3.25Å; E187-P191 WeakPolarHBondContact O-CD 3.34Å
188	L	91.3	Very high	92.7	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-80	-42.5	-179.4	-64.2	176.4	0	0	0	113.4	T129 V132 L133 L150 F154 Q184 R185 E186	T129-L188 HydrophobicContact CG2-CD1 4.31Å; T129-L188 HydrophobicContact CG2-CD2 3.77Å; T129-L188 HydrophobicContact CG2-CG 3.99Å; V132-L188 HydrophobicContact CB-CD1 4.37Å; V132-L188 HydrophobicContact CB-CD2 4Å; V132-L188 HydrophobicContact CG1-CD1 4.34Å; V132-L188 HydrophobicContact CG1-CD2 3.78Å; V132-L188 HydrophobicContact CG2-CD1 4.48Å; L133-L188 HydrophobicContact CD2-CD2 3.81Å; L133-L188 HydrophobicContact CG-CD2 3.83Å; L150-L188 HydrophobicContact CD2-CB 4.08Å; F154-L188 HydrophobicContact CD2-CD1 3.59Å; F154-L188 HydrophobicContact CE2-CD1 3.84Å; F154-L188 HydrophobicContact CG-CD1 4.45Å; Q184-L188 WeakPolarHBondContact O-CG 3.27Å; Q184-L188 PolarHBondContact O-N 3.03Å; R185-L188 PolarHBondContact O-N 3.39Å; E186-L188 VanDerWaalsContact C-N 3.26Å; E186-L188 PolarHBondContact O-N 3.44Å
189	V	92.1	Very high	92.8	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.018	26%	0.26	C	S	.	.	H	α-helix	trans	-85.7	-35.7	-170.6	174.7	0	0	0	0	111.8	R185 E186 S192 F193 L222 E226 L257	R185-V189 WeakPolarHBondContact O-CB 3.42Å; R185-V189 VanDerWaalsContact O-CG2 3.32Å; R185-V189 WeakPolarHBondContact O-CG2 3.42Å; R185-V189 PolarHBondContact O-N 2.83Å; E186-V189 PolarHBondContact O-N 3.08Å; V189-S192 PolarHBondContact O-N 3.44Å; V189-S192 PolarHBondContact O-OG 3.2Å; V189-F193 HydrophobicContact CG1-CB 4.34Å; V189-F193 VanDerWaalsContact O-CB 3.29Å; V189-F193 WeakPolarHBondContact O-CB 3.26Å; V189-F193 PolarHBondContact O-N 2.9Å; V189-L222 HydrophobicContact CG1-CD1 3.81Å; V189-E226 WeakPolarHBondContact CG2-OE1 3.33Å; V189-L257 HydrophobicContact CG1-CD1 4.19Å
190	R	91.6	Very high	92.8	Very high	100 Å²	100	45.1 Å²	45.1	38%	0.377	25%	0.246	S	C	.	.	H	α-helix	trans	-54.6	-49.4	-173	175.3	-175	177.9	173.7	3	113.6	E186 S192 F193 E194 Y260	E186-R190 HydrophobicContact CG-CB 4.43Å; E186-R190 WeakPolarHBondContact O-CB 3.39Å; E186-R190 PolarHBondContact O-N 2.89Å; R190-S192 PolarHBondContact O-N 3.41Å; R190-F193 PolarHBondContact O-N 3.01Å; R190-E194 HydrophobicContact CG-CG 4.22Å; R190-E194 IonicContact CZ-OE1 3.14Å; R190-E194 IonicContact NE-OE1 2.66Å; R190-E194 PolarHBondContact NE-OE1 2.82Å; R190-E194 IonicContact NE-OE2 2.83Å; R190-E194 IonicContact NH2-OE1 2.84Å; R190-E194 PolarHBondContact NH2-OE1 3.41Å; R190-E194 VanDerWaalsContact NH2-OE1 3.14Å; R190-E194 WeakPolarHBondContact O-CB 3.26Å; R190-E194 WeakPolarHBondContact O-CG 3.43Å; R190-E194 PolarHBondContact O-N 2.98Å; R190-Y260 WeakPolarHBondContact CD-OH 3.44Å; R190-Y260 HydrophobicContact CG-CE2 4.29Å; R190-Y260 PolarHBondContact NE-OH 3.23Å; R190-Y260 VanDerWaalsContact NE-OH 3.15Å; R190-Y260 PolarHBondContact NH1-OH 2.93Å
191	P	90.5	Very high	92.7	Very high	79 Å²	79	44 Å²	44	51%	0.513	25%	0.245	S	C	.	.	H	α-helix	trans	-64.6	-40.8	-175	-22.1	34.5	0	0	0	113	E187 A195	E187-P191 WeakPolarHBondContact O-CD 3.34Å; P191-A195 WeakPolarHBondContact O-CB 3.24Å; P191-A195 PolarHBondContact O-N 3.32Å; P191-A195 VanDerWaalsContact O-N 3.11Å
192	S	88.9	Confident	92.5	Very high	51 Å²	51	48.2 Å²	48.2	36%	0.357	27%	0.274	S	S	.	.	H	α-helix	trans	-70.5	-35.2	178.4	64.7	0	0	0	0	111.5	V189 R190 T196	V189-S192 PolarHBondContact O-N 3.44Å; V189-S192 PolarHBondContact O-OG 3.2Å; R190-S192 PolarHBondContact O-N 3.41Å; S192-T196 WeakPolarHBondContact O-CB 3.36Å; S192-T196 PolarHBondContact O-N 3.42Å; S192-T196 PolarHBondContact O-OG1 3.29Å
193	F	91.9	Very high	92.3	Very high	9 Å²	9	51.9 Å²	51.9	4%	0.039	30%	0.297	C	S	.	.	H	α-helix	trans	-70.1	-46.6	177.4	-174.8	-112.9	0	0	0	112.7	V189 R190 A195 T196 I197 V218 L219 L222 L257 Y260	V189-F193 HydrophobicContact CG1-CB 4.34Å; V189-F193 VanDerWaalsContact O-CB 3.29Å; V189-F193 WeakPolarHBondContact O-CB 3.26Å; V189-F193 PolarHBondContact O-N 2.9Å; R190-F193 PolarHBondContact O-N 3.01Å; F193-A195 VanDerWaalsContact C-N 3.3Å; F193-A195 PolarHBondContact O-N 2.86Å; F193-T196 WeakPolarHBondContact O-CB 3.33Å; F193-T196 PolarHBondContact O-N 2.98Å; F193-T196 VanDerWaalsContact O-N 3.15Å; F193-I197 HydrophobicContact CD1-CD1 3.74Å; F193-I197 HydrophobicContact CE1-CD1 3.21Å; F193-I197 HydrophobicContact CE1-CG1 4.18Å; F193-I197 HydrophobicContact CE2-CD1 4.21Å; F193-I197 HydrophobicContact CE2-CG1 4.36Å; F193-I197 HydrophobicContact CG-CD1 4.43Å; F193-I197 HydrophobicContact CZ-CD1 3.47Å; F193-I197 VanDerWaalsContact CZ-CD1 3.47Å; F193-I197 HydrophobicContact CZ-CG1 4.06Å; F193-I197 WeakPolarHBondContact O-CG1 3.18Å; F193-I197 PolarHBondContact O-N 3.49Å; F193-V218 HydrophobicContact CD2-CG1 4.41Å; F193-V218 HydrophobicContact CE2-CG1 4Å; F193-L219 HydrophobicContact CE2-CD2 4.16Å; F193-L219 HydrophobicContact CZ-CD2 3.58Å; F193-L219 HydrophobicContact CZ-CG 4.38Å; F193-L222 HydrophobicContact CD2-CD2 3.8Å; F193-L222 HydrophobicContact CE2-CD2 3.68Å; F193-L222 HydrophobicContact CG-CD2 4.35Å; F193-L222 HydrophobicContact CZ-CD2 4.13Å; F193-L257 HydrophobicContact CE1-CB 4.48Å; F193-L257 VanDerWaalsContact CE1-O 3.27Å; F193-L257 WeakPolarHBondContact CE1-O 3.26Å; F193-Y260 HydrophobicContact CD1-CD2 4.49Å
194	E	92	Very high	92	Very high	65 Å²	65	50.9 Å²	50.9	30%	0.304	29%	0.285	S	S	.	.	H	α-helix	trans	-60.9	-39.4	174.6	-75.1	177.9	169.8	0	0	111.5	R190 I197 S198 Y260	R190-E194 HydrophobicContact CG-CG 4.22Å; R190-E194 IonicContact CZ-OE1 3.14Å; R190-E194 IonicContact NE-OE1 2.66Å; R190-E194 PolarHBondContact NE-OE1 2.82Å; R190-E194 IonicContact NE-OE2 2.83Å; R190-E194 IonicContact NH2-OE1 2.84Å; R190-E194 PolarHBondContact NH2-OE1 3.41Å; R190-E194 VanDerWaalsContact NH2-OE1 3.14Å; R190-E194 WeakPolarHBondContact O-CB 3.26Å; R190-E194 WeakPolarHBondContact O-CG 3.43Å; R190-E194 PolarHBondContact O-N 2.98Å; E194-I197 PolarHBondContact O-N 3.23Å; E194-S198 WeakPolarHBondContact O-CB 3.29Å; E194-S198 PolarHBondContact O-N 2.89Å; E194-S198 PolarHBondContact O-OG 3.34Å; E194-Y260 HydrophobicContact CG-CD1 4.27Å; E194-Y260 HydrophobicContact CG-CG 4.4Å; E194-Y260 WeakPolarHBondContact OE1-CD1 3.2Å; E194-Y260 WeakPolarHBondContact OE1-CE1 3.38Å
195	A	91.2	Very high	91.2	Very high	57 Å²	57	52.8 Å²	52.8	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-42.9	173.6	0	0	0	0	0	111.9	P191 F193 S198 Q199	P191-A195 WeakPolarHBondContact O-CB 3.24Å; P191-A195 PolarHBondContact O-N 3.32Å; P191-A195 VanDerWaalsContact O-N 3.11Å; F193-A195 VanDerWaalsContact C-N 3.3Å; F193-A195 PolarHBondContact O-N 2.86Å; A195-S198 PolarHBondContact O-N 3.35Å; A195-Q199 WeakPolarHBondContact O-CB 3.48Å; A195-Q199 PolarHBondContact O-N 3.49Å
196	T	92.5	Very high	90.6	Very high	50 Å²	50	62.9 Å²	62.9	31%	0.307	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-44.5	176.4	-58.4	0	0	0	0	111.4	S192 F193 S198 Q199 L200 V218	S192-T196 WeakPolarHBondContact O-CB 3.36Å; S192-T196 PolarHBondContact O-N 3.42Å; S192-T196 PolarHBondContact O-OG1 3.29Å; F193-T196 WeakPolarHBondContact O-CB 3.33Å; F193-T196 PolarHBondContact O-N 2.98Å; F193-T196 VanDerWaalsContact O-N 3.15Å; T196-S198 VanDerWaalsContact C-N 3.35Å; T196-S198 PolarHBondContact O-N 2.84Å; T196-Q199 PolarHBondContact O-N 2.92Å; T196-L200 HydrophobicContact CG2-CD1 4.41Å; T196-L200 WeakPolarHBondContact O-CG 3.2Å; T196-L200 PolarHBondContact O-N 3.41Å; T196-V218 HydrophobicContact CG2-CG1 4.21Å; T196-V218 HydrophobicContact CG2-CG2 4.43Å
197	I	93.3	Very high	90.2	Very high	11 Å²	11	63.4 Å²	63.4	6%	0.056	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-46.6	175.1	-71.3	170.9	0	0	0	110.4	F193 E194 Q199 L200 L201 F261 A264	F193-I197 HydrophobicContact CD1-CD1 3.74Å; F193-I197 HydrophobicContact CE1-CD1 3.21Å; F193-I197 HydrophobicContact CE1-CG1 4.18Å; F193-I197 HydrophobicContact CE2-CD1 4.21Å; F193-I197 HydrophobicContact CE2-CG1 4.36Å; F193-I197 HydrophobicContact CG-CD1 4.43Å; F193-I197 HydrophobicContact CZ-CD1 3.47Å; F193-I197 VanDerWaalsContact CZ-CD1 3.47Å; F193-I197 HydrophobicContact CZ-CG1 4.06Å; F193-I197 WeakPolarHBondContact O-CG1 3.18Å; F193-I197 PolarHBondContact O-N 3.49Å; E194-I197 PolarHBondContact O-N 3.23Å; I197-Q199 VanDerWaalsContact C-N 3.28Å; I197-Q199 PolarHBondContact O-N 2.96Å; I197-L200 WeakPolarHBondContact O-CB 3.5Å; I197-L200 PolarHBondContact O-N 2.94Å; I197-L200 VanDerWaalsContact O-N 3.12Å; I197-L201 HydrophobicContact CG2-CD1 4.17Å; I197-L201 HydrophobicContact CG2-CG 4.32Å; I197-L201 WeakPolarHBondContact O-CG 3.13Å; I197-L201 PolarHBondContact O-N 2.96Å; I197-F261 HydrophobicContact CD1-CB 4.04Å; I197-A264 HydrophobicContact CG2-CB 3.49Å; I197-A264 VanDerWaalsContact CG2-CB 3.49Å
198	S	92.9	Very high	90.1	Very high	73 Å²	73	59.8 Å²	59.8	51%	0.51	34%	0.34	S	S	.	.	H	α-helix	trans	-59.9	-40.4	178.6	-60	0	0	0	0	111.6	E194 A195 T196 L201 S202	E194-S198 WeakPolarHBondContact O-CB 3.29Å; E194-S198 PolarHBondContact O-N 2.89Å; E194-S198 PolarHBondContact O-OG 3.34Å; A195-S198 PolarHBondContact O-N 3.35Å; T196-S198 VanDerWaalsContact C-N 3.35Å; T196-S198 PolarHBondContact O-N 2.84Å; S198-L201 PolarHBondContact O-N 2.96Å; S198-S202 PolarHBondContact O-N 3.46Å; S198-S202 VanDerWaalsContact O-N 3.15Å
199	Q	92.5	Very high	90	Very high	127 Å²	127	59.4 Å²	59.4	59%	0.593	34%	0.338	S	S	*	.	H	α-helix	trans	-64.1	-44.1	173.9	-174.8	179.8	-2.1	0	0	111.8	A195 T196 I197 L201 S202 T203	A195-Q199 WeakPolarHBondContact O-CB 3.48Å; A195-Q199 PolarHBondContact O-N 3.49Å; T196-Q199 PolarHBondContact O-N 2.92Å; I197-Q199 VanDerWaalsContact C-N 3.28Å; I197-Q199 PolarHBondContact O-N 2.96Å; Q199-L201 PolarHBondContact O-N 3.44Å; Q199-S202 PolarHBondContact O-N 3.49Å; Q199-S202 PolarHBondContact O-OG 2.87Å; Q199-T203 WeakPolarHBondContact O-CB 3.33Å; Q199-T203 PolarHBondContact O-N 3.43Å; Q199-T203 PolarHBondContact O-OG1 3.02Å
200	L	93.2	Very high	90	Very high	25 Å²	25	61.2 Å²	61.2	13%	0.131	35%	0.351	C	S	.	.	H	α-helix	trans	-62.8	-40.9	177.4	-72.4	176.2	0	0	0	112.3	T196 I197 S202 T203 H204 L211 V218	T196-L200 HydrophobicContact CG2-CD1 4.41Å; T196-L200 WeakPolarHBondContact O-CG 3.2Å; T196-L200 PolarHBondContact O-N 3.41Å; I197-L200 WeakPolarHBondContact O-CB 3.5Å; I197-L200 PolarHBondContact O-N 2.94Å; I197-L200 VanDerWaalsContact O-N 3.12Å; L200-S202 VanDerWaalsContact C-N 3.3Å; L200-S202 PolarHBondContact O-N 2.99Å; L200-T203 PolarHBondContact O-N 3.47Å; L200-H204 PolarHBondContact O-N 2.78Å; L200-L211 HydrophobicContact CB-CD1 3.93Å; L200-V218 HydrophobicContact CD1-CG2 4.12Å
201	L	91.3	Very high	90.1	Very high	45 Å²	45	56.8 Å²	56.8	24%	0.236	33%	0.334	C	S	.	.	H	α-helix	trans	-60	-40.8	175.2	-71.9	172.7	0	0	0	111.7	I197 S198 Q199 A205 L211 A264	I197-L201 HydrophobicContact CG2-CD1 4.17Å; I197-L201 HydrophobicContact CG2-CG 4.32Å; I197-L201 WeakPolarHBondContact O-CG 3.13Å; I197-L201 PolarHBondContact O-N 2.96Å; S198-L201 PolarHBondContact O-N 2.96Å; Q199-L201 PolarHBondContact O-N 3.44Å; L201-A205 PolarHBondContact O-N 2.99Å; L201-L211 HydrophobicContact CD2-CD1 4.28Å; L201-L211 HydrophobicContact CD2-CD2 3.76Å; L201-A264 HydrophobicContact CD1-CB 3.91Å; L201-A264 HydrophobicContact CD2-CB 4.32Å; L201-A264 HydrophobicContact CG-CB 4.44Å
202	S	90.8	Very high	90.2	Very high	87 Å²	87	53 Å²	53	61%	0.608	31%	0.31	S	S	*	.	H	α-helix	trans	-72.6	-39.8	178	72.5	0	0	0	0	112.3	S198 Q199 L200	S198-S202 PolarHBondContact O-N 3.46Å; S198-S202 VanDerWaalsContact O-N 3.15Å; Q199-S202 PolarHBondContact O-N 3.49Å; Q199-S202 PolarHBondContact O-OG 2.87Å; L200-S202 VanDerWaalsContact C-N 3.3Å; L200-S202 PolarHBondContact O-N 2.99Å
203	T	91.8	Very high	90.4	Very high	90 Å²	90	55.2 Å²	55.2	55%	0.552	31%	0.311	S	S	*	.	H	α-helix	trans	-69.1	-41.5	-177.9	-56.5	0	0	0	0	112	Q199 L200	Q199-T203 WeakPolarHBondContact O-CB 3.33Å; Q199-T203 PolarHBondContact O-N 3.43Å; Q199-T203 PolarHBondContact O-OG1 3.02Å; L200-T203 PolarHBondContact O-N 3.47Å
204	H	88.3	Confident	90.5	Very high	49 Å²	49	56.5 Å²	56.5	23%	0.227	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	30	-176.4	-63.6	-59.4	0	0	0	113.3	L200 K206 S207 L211 S214	L200-H204 PolarHBondContact O-N 2.78Å; H204-K206 PolarHBondContact O-N 3.27Å; H204-S207 PolarHBondContact O-N 2.83Å; H204-S207 VanDerWaalsContact O-N 3.1Å; H204-L211 HydrophobicContact CB-CB 3.79Å; H204-L211 HydrophobicContact CB-CD1 4.36Å; H204-S214 PolarHBondContact NE2-OG 3.17Å
205	A	79.4	Confident	90.6	Very high	60 Å²	60	53.5 Å²	53.5	50%	0.496	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-26.8	-177.2	0	0	0	0	0	114.6	L201	L201-A205 PolarHBondContact O-N 2.99Å
206	K	80.1	Confident	90.8	Very high	211 Å²	211	51 Å²	51	92%	0.917	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-25.6	-178	-63.2	-177	179.9	-179.8	0	114.6	H204	H204-K206 PolarHBondContact O-N 3.27Å
207	S	86.6	Confident	90.9	Very high	38 Å²	38	52 Å²	52	27%	0.266	30%	0.295	S	S	.	.			trans	-133.1	108.4	-169.9	174.8	0	0	0	0	111.3	H204 C209 S210 L211	H204-S207 PolarHBondContact O-N 2.83Å; H204-S207 VanDerWaalsContact O-N 3.1Å; S207-C209 VanDerWaalsContact C-N 3.3Å; S207-C209 PolarHBondContact O-N 3.2Å; S207-S210 PolarHBondContact O-N 3.25Å; S207-S210 WeakPolarHBondContact OG-CB 3.28Å; S207-S210 PolarHBondContact OG-N 2.88Å; S207-S210 VanDerWaalsContact OG-N 3.14Å; S207-S210 PolarHBondContact OG-OG 3.48Å; S207-L211 PolarHBondContact O-N 2.91Å
208	C	88.9	Confident	90.9	Very high	16 Å²	16	53.8 Å²	53.8	11%	0.108	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-35.3	175.2	-171.8	0	0	0	0	111.7	L211 T212	C208-L211 PolarHBondContact O-N 3.4Å; C208-T212 WeakPolarHBondContact O-CB 3.41Å; C208-T212 PolarHBondContact O-N 2.92Å; C208-T212 PolarHBondContact O-OG1 3.06Å
209	C	90.5	Very high	91.1	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.014	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-45.3	176	-63	0	0	0	0	111.7	S207 T212 R213 E280	S207-C209 VanDerWaalsContact C-N 3.3Å; S207-C209 PolarHBondContact O-N 3.2Å; C209-T212 PolarHBondContact O-N 3.43Å; C209-R213 WeakPolarHBondContact O-CG 3.29Å; C209-R213 PolarHBondContact O-N 3.33Å; C209-E280 PolarHBondContact SG-OE2 2.75Å
210	S	91.3	Very high	91.2	Very high	41 Å²	41	44.9 Å²	44.9	29%	0.287	26%	0.257	S	S	.	.	H	α-helix	trans	-66	-42.5	177.2	-58.4	0	0	0	0	111.6	S207 T212 R213 S214	S207-S210 PolarHBondContact O-N 3.25Å; S207-S210 WeakPolarHBondContact OG-CB 3.28Å; S207-S210 PolarHBondContact OG-N 2.88Å; S207-S210 VanDerWaalsContact OG-N 3.14Å; S207-S210 PolarHBondContact OG-OG 3.48Å; S210-T212 VanDerWaalsContact C-N 3.29Å; S210-T212 PolarHBondContact O-N 2.98Å; S210-R213 PolarHBondContact O-N 3.48Å; S210-S214 WeakPolarHBondContact O-CB 3.34Å; S210-S214 PolarHBondContact O-N 2.97Å; S210-S214 PolarHBondContact O-OG 2.89Å
211	L	93.3	Very high	91.2	Very high	6 Å²	6	50.9 Å²	50.9	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-56.4	-44.9	173.3	176	62.4	0	0	0	111.5	L200 L201 H204 S207 C208 G215 I265	L200-L211 HydrophobicContact CB-CD1 3.93Å; L201-L211 HydrophobicContact CD2-CD1 4.28Å; L201-L211 HydrophobicContact CD2-CD2 3.76Å; H204-L211 HydrophobicContact CB-CB 3.79Å; H204-L211 HydrophobicContact CB-CD1 4.36Å; S207-L211 PolarHBondContact O-N 2.91Å; C208-L211 PolarHBondContact O-N 3.4Å; L211-G215 WeakPolarHBondContact O-CA 3.41Å; L211-G215 PolarHBondContact O-N 3.41Å; L211-I265 HydrophobicContact CD2-CD1 4.43Å; L211-I265 HydrophobicContact CD2-CG1 4.21Å
212	T	93.1	Very high	91.3	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-66.1	-43.8	179.9	-53.8	0	0	0	0	111.5	C208 C209 S210 G215 C216 I265 L281 L284 L285	C208-T212 WeakPolarHBondContact O-CB 3.41Å; C208-T212 PolarHBondContact O-N 2.92Å; C208-T212 PolarHBondContact O-OG1 3.06Å; C209-T212 PolarHBondContact O-N 3.43Å; S210-T212 VanDerWaalsContact C-N 3.29Å; S210-T212 PolarHBondContact O-N 2.98Å; T212-G215 PolarHBondContact O-N 3.44Å; T212-C216 VanDerWaalsContact O-CB 3.27Å; T212-C216 WeakPolarHBondContact O-CB 3.4Å; T212-C216 PolarHBondContact O-N 3.09Å; T212-C216 PolarHBondContact O-SG 2.92Å; T212-I265 VanDerWaalsContact OG1-CD1 3.29Å; T212-I265 WeakPolarHBondContact OG1-CD1 3.43Å; T212-L281 HydrophobicContact CG2-CD1 3.84Å; T212-L281 WeakPolarHBondContact OG1-CD1 3.37Å; T212-L284 HydrophobicContact CG2-CD2 4.15Å; T212-L285 HydrophobicContact CG2-CD1 4.27Å; T212-L285 HydrophobicContact CG2-CD2 3.77Å; T212-L285 HydrophobicContact CG2-CG 3.98Å
213	R	93.9	Very high	91.5	Very high	96 Å²	96	45.4 Å²	45.4	36%	0.362	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-51	176.2	-72	176.9	-179.2	119.6	6.3	111.7	C209 S210 S217 E280 L284	C209-R213 WeakPolarHBondContact O-CG 3.29Å; C209-R213 PolarHBondContact O-N 3.33Å; S210-R213 PolarHBondContact O-N 3.48Å; R213-S217 WeakPolarHBondContact O-CB 3.36Å; R213-S217 PolarHBondContact O-N 3.19Å; R213-E280 IonicContact CZ-OE1 3.9Å; R213-E280 IonicContact NH1-OE1 3.45Å; R213-E280 PolarHBondContact NH1-OE1 3.01Å; R213-E280 VanDerWaalsContact NH1-OE1 3.13Å; R213-E280 IonicContact NH2-OE1 3.13Å; R213-E280 PolarHBondContact NH2-OE1 3.31Å; R213-L284 HydrophobicContact CG-CD1 3.93Å; R213-L284 HydrophobicContact CG-CD2 3.61Å; R213-L284 HydrophobicContact CG-CG 4.41Å
214	S	93.3	Very high	91.5	Very high	36 Å²	36	43.8 Å²	43.8	25%	0.252	23%	0.23	S	C	.	.	H	α-helix	trans	-64.9	-43.6	179.6	-59.3	0	0	0	0	111.5	H204 S210 S217 V218	H204-S214 PolarHBondContact NE2-OG 3.17Å; S210-S214 WeakPolarHBondContact O-CB 3.34Å; S210-S214 PolarHBondContact O-N 2.97Å; S210-S214 PolarHBondContact O-OG 2.89Å; S214-S217 WeakPolarHBondContact O-CB 3.24Å; S214-S217 PolarHBondContact O-N 3.45Å; S214-V218 WeakPolarHBondContact O-CG2 3.31Å; S214-V218 PolarHBondContact O-N 3.19Å
215	G	94.3	Very high	91.7	Very high	2 Å²	2	43 Å²	43	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-48.7	177.9	0	0	0	0	0	112.9	L211 T212 S217 V218 L219	L211-G215 WeakPolarHBondContact O-CA 3.41Å; L211-G215 PolarHBondContact O-N 3.41Å; T212-G215 PolarHBondContact O-N 3.44Å; G215-S217 VanDerWaalsContact C-N 3.29Å; G215-S217 PolarHBondContact O-N 2.98Å; G215-V218 PolarHBondContact O-N 2.97Å; G215-L219 WeakPolarHBondContact O-CG 3.39Å; G215-L219 PolarHBondContact O-N 3.1Å
216	C	95.3	Very high	92.4	Very high	4 Å²	4	40.1 Å²	40.1	3%	0.027	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-38.6	174.1	-69.3	0	0	0	0	111.6	T212 V218 L219 F220 V289	T212-C216 VanDerWaalsContact O-CB 3.27Å; T212-C216 WeakPolarHBondContact O-CB 3.4Å; T212-C216 PolarHBondContact O-N 3.09Å; T212-C216 PolarHBondContact O-SG 2.92Å; C216-V218 VanDerWaalsContact C-N 3.35Å; C216-V218 PolarHBondContact O-N 3.31Å; C216-L219 PolarHBondContact O-N 3.32Å; C216-F220 HydrophobicContact CB-CD2 4.43Å; C216-F220 HydrophobicContact CB-CE2 4.23Å; C216-F220 WeakPolarHBondContact O-CD2 3.39Å; C216-F220 PolarHBondContact O-N 3.38Å; C216-V289 HydrophobicContact CB-CG1 4.39Å; C216-V289 HydrophobicContact CB-CG2 4.49Å
217	S	94.4	Very high	93	Very high	71 Å²	71	31.6 Å²	31.6	50%	0.497	17%	0.166	S	C	.	.	H	α-helix	trans	-61.8	-41.8	176.3	-169.9	0	0	0	0	112.4	R213 S214 G215 R221	R213-S217 WeakPolarHBondContact O-CB 3.36Å; R213-S217 PolarHBondContact O-N 3.19Å; S214-S217 WeakPolarHBondContact O-CB 3.24Å; S214-S217 PolarHBondContact O-N 3.45Å; G215-S217 VanDerWaalsContact C-N 3.29Å; G215-S217 PolarHBondContact O-N 2.98Å; S217-R221 PolarHBondContact O-N 3.09Å
218	V	94	Very high	93.2	Very high	49 Å²	49	33.2 Å²	33.2	30%	0.297	17%	0.172	S	C	.	.	H	α-helix	trans	-65.8	-43.6	175.1	174	0	0	0	0	110.6	F193 T196 L200 S214 G215 C216 R221 L222	F193-V218 HydrophobicContact CD2-CG1 4.41Å; F193-V218 HydrophobicContact CE2-CG1 4Å; T196-V218 HydrophobicContact CG2-CG1 4.21Å; T196-V218 HydrophobicContact CG2-CG2 4.43Å; L200-V218 HydrophobicContact CD1-CG2 4.12Å; S214-V218 WeakPolarHBondContact O-CG2 3.31Å; S214-V218 PolarHBondContact O-N 3.19Å; G215-V218 PolarHBondContact O-N 2.97Å; C216-V218 VanDerWaalsContact C-N 3.35Å; C216-V218 PolarHBondContact O-N 3.31Å; V218-R221 PolarHBondContact O-N 3.06Å; V218-L222 WeakPolarHBondContact O-CB 3.48Å; V218-L222 PolarHBondContact O-N 3.01Å
219	L	96	Very high	93.3	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-43.7	177.9	-75.8	166.4	0	0	0	112.7	F193 G215 C216 L222 C223 A258 F261 L305	F193-L219 HydrophobicContact CE2-CD2 4.16Å; F193-L219 HydrophobicContact CZ-CD2 3.58Å; F193-L219 HydrophobicContact CZ-CG 4.38Å; G215-L219 WeakPolarHBondContact O-CG 3.39Å; G215-L219 PolarHBondContact O-N 3.1Å; C216-L219 PolarHBondContact O-N 3.32Å; L219-L222 WeakPolarHBondContact O-CB 3.4Å; L219-L222 PolarHBondContact O-N 3.32Å; L219-C223 PolarHBondContact O-N 2.95Å; L219-C223 PolarHBondContact O-SG 3.44Å; L219-A258 HydrophobicContact CD2-CB 4.17Å; L219-F261 HydrophobicContact CD1-CB 4.05Å; L219-F261 HydrophobicContact CD1-CD1 3.59Å; L219-F261 HydrophobicContact CD1-CE1 4.19Å; L219-F261 HydrophobicContact CD1-CG 3.84Å; L219-L305 HydrophobicContact CB-CD1 3.93Å; L219-L305 HydrophobicContact CB-CD2 4.15Å; L219-L305 HydrophobicContact CD1-CD1 3.77Å; L219-L305 HydrophobicContact CD2-CD1 4.35Å; L219-L305 HydrophobicContact CG-CD1 4.24Å
220	F	95.6	Very high	93.3	Very high	9 Å²	9	32.7 Å²	32.7	4%	0.039	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-46.7	176.7	-78.1	-60.5	0	0	0	111.8	C216 L222 C223 D224 V289 R293 Y302 L305	C216-F220 HydrophobicContact CB-CD2 4.43Å; C216-F220 HydrophobicContact CB-CE2 4.23Å; C216-F220 WeakPolarHBondContact O-CD2 3.39Å; C216-F220 PolarHBondContact O-N 3.38Å; F220-L222 VanDerWaalsContact C-N 3.3Å; F220-L222 PolarHBondContact O-N 2.9Å; F220-C223 WeakPolarHBondContact O-CB 3.49Å; F220-C223 PolarHBondContact O-N 2.84Å; F220-D224 PolarHBondContact O-N 3.14Å; F220-V289 HydrophobicContact CE2-CG1 3.81Å; F220-V289 HydrophobicContact CZ-CG1 3.73Å; F220-R293 HydrophobicContact CE1-CB 3.91Å; F220-R293 HydrophobicContact CE2-CB 4.4Å; F220-R293 HydrophobicContact CZ-CB 3.67Å; F220-R293 HydrophobicContact CZ-CG 4.33Å; F220-Y302 AromaticContact CD1-CD1 3.81Å; F220-Y302 HydrophobicContact CD1-CD1 3.81Å; F220-Y302 HydrophobicContact CD1-CD2 4.44Å; F220-Y302 AromaticContact CD1-CE1 3.72Å; F220-Y302 HydrophobicContact CD1-CE1 3.72Å; F220-Y302 HydrophobicContact CD1-CE2 4.33Å; F220-Y302 HydrophobicContact CD1-CG 4.19Å; F220-Y302 AromaticContact CD1-CZ 3.99Å; F220-Y302 HydrophobicContact CE1-CD1 4.11Å; F220-Y302 HydrophobicContact CE1-CD2 4.17Å; F220-Y302 HydrophobicContact CE1-CE1 4.36Å; F220-Y302 HydrophobicContact CE1-CE2 4.38Å; F220-Y302 HydrophobicContact CE1-CG 4.03Å; F220-L305 HydrophobicContact CD1-CD2 3.83Å; F220-L305 HydrophobicContact CE1-CD2 3.75Å; F220-L305 HydrophobicContact CG-CD2 4.4Å; F220-L305 HydrophobicContact CZ-CD2 4.28Å
221	R	93.4	Very high	93.2	Very high	152 Å²	152	34.7 Å²	34.7	57%	0.574	17%	0.169	S	C	*	.	H	α-helix	trans	-59.3	-44.5	176.7	178.7	173.5	176.5	152.1	1.1	111.3	S217 V218 C223 D224 D225	S217-R221 PolarHBondContact O-N 3.09Å; V218-R221 PolarHBondContact O-N 3.06Å; R221-C223 VanDerWaalsContact C-N 3.34Å; R221-C223 PolarHBondContact O-N 2.73Å; R221-D224 PolarHBondContact O-N 3.26Å; R221-D225 VanDerWaalsContact CG-OD2 3.32Å; R221-D225 WeakPolarHBondContact CG-OD2 3.41Å; R221-D225 IonicContact NE-OD2 3.42Å; R221-D225 PolarHBondContact NE-OD2 3.06Å; R221-D225 WeakPolarHBondContact O-CB 3.45Å; R221-D225 PolarHBondContact O-N 2.79Å
222	L	93	Very high	92.9	Very high	15 Å²	15	39.2 Å²	39.2	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-59.9	-43.5	176.6	178.7	65	0	0	0	112.1	V189 F193 V218 L219 F220 D225 E226 L257	V189-L222 HydrophobicContact CG1-CD1 3.81Å; F193-L222 HydrophobicContact CD2-CD2 3.8Å; F193-L222 HydrophobicContact CE2-CD2 3.68Å; F193-L222 HydrophobicContact CG-CD2 4.35Å; F193-L222 HydrophobicContact CZ-CD2 4.13Å; V218-L222 WeakPolarHBondContact O-CB 3.48Å; V218-L222 PolarHBondContact O-N 3.01Å; L219-L222 WeakPolarHBondContact O-CB 3.4Å; L219-L222 PolarHBondContact O-N 3.32Å; F220-L222 VanDerWaalsContact C-N 3.3Å; F220-L222 PolarHBondContact O-N 2.9Å; L222-D225 PolarHBondContact O-N 2.76Å; L222-E226 HydrophobicContact CD1-CG 4.02Å; L222-E226 WeakPolarHBondContact O-CB 3.34Å; L222-E226 VanDerWaalsContact O-CG 3.3Å; L222-E226 WeakPolarHBondContact O-CG 3.22Å; L222-E226 PolarHBondContact O-N 3.39Å; L222-L257 HydrophobicContact CD2-CB 4.36Å; L222-L257 HydrophobicContact CD2-CD1 3.88Å; L222-L257 HydrophobicContact CG-CD1 4.39Å
223	C	94.3	Very high	92.6	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-59.9	-45.8	175.4	-68.9	0	0	0	0	112	L219 F220 R221 Y227 I254 V301 Y302	L219-C223 PolarHBondContact O-N 2.95Å; L219-C223 PolarHBondContact O-SG 3.44Å; F220-C223 WeakPolarHBondContact O-CB 3.49Å; F220-C223 PolarHBondContact O-N 2.84Å; R221-C223 VanDerWaalsContact C-N 3.34Å; R221-C223 PolarHBondContact O-N 2.73Å; C223-Y227 WeakPolarHBondContact O-CB 3.21Å; C223-Y227 PolarHBondContact O-N 3.42Å; C223-I254 HydrophobicContact CB-CD1 4.42Å; C223-I254 WeakPolarHBondContact SG-CG2 3.31Å; C223-V301 HydrophobicContact CB-CG1 4.12Å; C223-Y302 HydrophobicContact CB-CD1 3.8Å; C223-Y302 HydrophobicContact CB-CE1 3.82Å
224	D	93.2	Very high	92.3	Very high	56 Å²	56	34.9 Å²	34.9	30%	0.299	17%	0.173	S	C	.	.	H	α-helix	trans	-66.9	-44.8	-179.8	-64.9	-29.2	0	0	0	111.2	F220 R221 Y227 N228 Y302	F220-D224 PolarHBondContact O-N 3.14Å; R221-D224 PolarHBondContact O-N 3.26Å; D224-Y227 PolarHBondContact O-N 3.2Å; D224-N228 WeakPolarHBondContact O-CB 3.48Å; D224-N228 VanDerWaalsContact O-CG 3.26Å; D224-N228 PolarHBondContact O-N 3.17Å; D224-N228 PolarHBondContact O-ND2 2.97Å; D224-Y302 WeakPolarHBondContact OD1-CE1 3.49Å; D224-Y302 PolarHBondContact OD1-OH 3.07Å; D224-Y302 PolarHBondContact OD2-OH 2.8Å
225	D	92	Very high	91.3	Very high	33 Å²	33	37.3 Å²	37.3	18%	0.176	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-45.6	179.4	-70.2	-22	0	0	0	111	F147 Y151 R221 L222 N228 L229	F147-D225 HydrophobicContact CE2-CB 4.47Å; F147-D225 WeakPolarHBondContact CE2-OD2 3.34Å; Y151-D225 HydrophobicContact CD1-CB 4.43Å; Y151-D225 HydrophobicContact CE1-CB 3.77Å; Y151-D225 HydrophobicContact CE2-CB 4.42Å; R221-D225 VanDerWaalsContact CG-OD2 3.32Å; R221-D225 WeakPolarHBondContact CG-OD2 3.41Å; R221-D225 IonicContact NE-OD2 3.42Å; R221-D225 PolarHBondContact NE-OD2 3.06Å; R221-D225 WeakPolarHBondContact O-CB 3.45Å; R221-D225 PolarHBondContact O-N 2.79Å; L222-D225 PolarHBondContact O-N 2.76Å; D225-N228 PolarHBondContact O-N 2.86Å; D225-L229 WeakPolarHBondContact O-CB 3.27Å; D225-L229 PolarHBondContact O-N 2.93Å
226	E	93.7	Very high	89.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.9	-35.9	177.9	-69.7	-64.8	142.8	0	0	112.8	Y151 R185 V189 L222 M230 F253 I254	Y151-E226 HydrophobicContact CE1-CG 4.42Å; Y151-E226 WeakPolarHBondContact CE1-OE1 3.08Å; Y151-E226 PolarHBondContact OH-OE1 2.99Å; R185-E226 IonicContact CZ-OE1 3.72Å; R185-E226 IonicContact NE-OE1 3.66Å; R185-E226 IonicContact NE-OE2 3.36Å; R185-E226 PolarHBondContact NE-OE2 3Å; R185-E226 IonicContact NH2-OE1 2.89Å; R185-E226 PolarHBondContact NH2-OE1 3.39Å; R185-E226 IonicContact NH2-OE2 3.91Å; V189-E226 WeakPolarHBondContact CG2-OE1 3.33Å; L222-E226 HydrophobicContact CD1-CG 4.02Å; L222-E226 WeakPolarHBondContact O-CB 3.34Å; L222-E226 VanDerWaalsContact O-CG 3.3Å; L222-E226 WeakPolarHBondContact O-CG 3.22Å; L222-E226 PolarHBondContact O-N 3.39Å; E226-M230 VanDerWaalsContact O-CB 3.25Å; E226-M230 WeakPolarHBondContact O-CB 3.31Å; E226-M230 PolarHBondContact O-N 3.17Å; E226-F253 HydrophobicContact CB-CE1 4.25Å; E226-F253 HydrophobicContact CG-CE1 3.84Å; E226-I254 HydrophobicContact CB-CD1 4.48Å
227	Y	92.4	Very high	88.2	Confident	31 Å²	31	40.2 Å²	40.2	12%	0.122	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-45.6	173.1	175.5	-111.3	0	0	0	111.5	C223 D224 M230 R231 L250 V299 V301	C223-Y227 WeakPolarHBondContact O-CB 3.21Å; C223-Y227 PolarHBondContact O-N 3.42Å; D224-Y227 PolarHBondContact O-N 3.2Å; Y227-M230 HydrophobicContact CD2-CE 3.69Å; Y227-M230 HydrophobicContact CE2-CE 4.04Å; Y227-R231 VanDerWaalsContact CE1-CD 3.4Å; Y227-R231 HydrophobicContact CE1-CG 4.38Å; Y227-R231 HydrophobicContact CE2-CG 4.2Å; Y227-R231 VanDerWaalsContact CZ-CD 3.43Å; Y227-R231 VanDerWaalsContact O-CG 3.3Å; Y227-R231 WeakPolarHBondContact O-CG 3.32Å; Y227-R231 PolarHBondContact O-N 2.89Å; Y227-L250 HydrophobicContact CD2-CD2 3.66Å; Y227-L250 HydrophobicContact CG-CD2 4.43Å; Y227-V299 HydrophobicContact CE1-CG1 4.1Å; Y227-V299 HydrophobicContact CE2-CG1 3.89Å; Y227-V299 VanDerWaalsContact CZ-CG1 3.43Å; Y227-V299 WeakPolarHBondContact OH-CG1 3.48Å; Y227-V301 HydrophobicContact CD1-CG2 3.83Å; Y227-V301 HydrophobicContact CD2-CG1 4.48Å; Y227-V301 HydrophobicContact CD2-CG2 3.77Å; Y227-V301 HydrophobicContact CE1-CG2 4.01Å; Y227-V301 HydrophobicContact CE2-CG2 3.98Å; Y227-V301 HydrophobicContact CG-CG1 4.09Å; Y227-V301 HydrophobicContact CG-CG2 3.7Å
228	N	91	Very high	86.3	Confident	73 Å²	73	42.1 Å²	42.1	39%	0.39	21%	0.213	S	C	.	.	H	α-helix	trans	-65.3	-44.5	179.2	-73.7	-41.6	0	0	0	111.8	D224 D225 R231 E232	D224-N228 WeakPolarHBondContact O-CB 3.48Å; D224-N228 VanDerWaalsContact O-CG 3.26Å; D224-N228 PolarHBondContact O-N 3.17Å; D224-N228 PolarHBondContact O-ND2 2.97Å; D225-N228 PolarHBondContact O-N 2.86Å; N228-R231 WeakPolarHBondContact O-CB 3.33Å; N228-R231 PolarHBondContact O-N 3.29Å; N228-E232 PolarHBondContact O-N 2.95Å
229	L	91.8	Very high	84.7	Confident	6 Å²	6	45.6 Å²	45.6	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-47.2	176.8	-176.6	67	0	0	0	111.9	Y151 F154 A155 Y181 D225 R231 E232 F233	Y151-L229 HydrophobicContact CD1-CB 4.07Å; Y151-L229 HydrophobicContact CD1-CD2 3.8Å; Y151-L229 HydrophobicContact CD1-CG 4.39Å; Y151-L229 HydrophobicContact CE1-CB 4.45Å; Y151-L229 HydrophobicContact CE1-CD2 4.18Å; F154-L229 HydrophobicContact CD1-CD2 4.02Å; A155-L229 HydrophobicContact CB-CD1 3.78Å; Y181-L229 WeakPolarHBondContact OH-CG 3.33Å; D225-L229 WeakPolarHBondContact O-CB 3.27Å; D225-L229 PolarHBondContact O-N 2.93Å; L229-R231 PolarHBondContact O-N 3.43Å; L229-E232 WeakPolarHBondContact O-CB 3.16Å; L229-E232 PolarHBondContact O-N 3.38Å; L229-F233 HydrophobicContact CD1-CE2 4.06Å; L229-F233 HydrophobicContact CG-CE2 4.38Å; L229-F233 WeakPolarHBondContact O-CD2 3.43Å
230	M	90.9	Very high	83.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.4	-38.3	176.5	177.2	-160.3	59.1	0	0	111.1	Y181 F182 E226 Y227 E232 F233 F234 R246 L250	Y181-M230 HydrophobicContact CE1-CB 4.3Å; Y181-M230 PolarHBondContact OH-N 2.78Å; F182-M230 HydrophobicContact CE2-SD 4.33Å; F182-M230 HydrophobicContact CZ-CG 4.12Å; F182-M230 HydrophobicContact CZ-SD 3.69Å; E226-M230 VanDerWaalsContact O-CB 3.25Å; E226-M230 WeakPolarHBondContact O-CB 3.31Å; E226-M230 PolarHBondContact O-N 3.17Å; Y227-M230 HydrophobicContact CD2-CE 3.69Å; Y227-M230 HydrophobicContact CE2-CE 4.04Å; M230-E232 VanDerWaalsContact C-N 3.31Å; M230-E232 PolarHBondContact O-N 3.47Å; M230-F233 PolarHBondContact O-N 2.94Å; M230-F234 HydrophobicContact CG-CD2 3.83Å; M230-F234 HydrophobicContact CG-CE2 4.44Å; M230-F234 WeakPolarHBondContact O-CD2 3.11Å; M230-F234 PolarHBondContact O-N 2.9Å; M230-R246 HydrophobicContact CE-CG 3.44Å; M230-R246 VanDerWaalsContact CE-CG 3.44Å; M230-R246 HydrophobicContact SD-CG 3.45Å; M230-R246 WeakPolarHBondContact SD-CG 3.2Å; M230-L250 HydrophobicContact CE-CB 4.46Å; M230-L250 HydrophobicContact CE-CD1 4.5Å; M230-L250 HydrophobicContact CE-CD2 3.98Å; M230-L250 HydrophobicContact SD-CB 4.09Å; M230-L250 HydrophobicContact SD-CD1 4.35Å
231	R	87.8	Confident	81.4	Confident	84 Å²	84	53.1 Å²	53.1	32%	0.317	27%	0.271	S	S	.	.	H	α-helix	trans	-60.3	-41	175.6	-76.7	176.5	66.5	-133.5	-3	111.8	Y227 N228 L229 F233 F234 L235	Y227-R231 VanDerWaalsContact CE1-CD 3.4Å; Y227-R231 HydrophobicContact CE1-CG 4.38Å; Y227-R231 HydrophobicContact CE2-CG 4.2Å; Y227-R231 VanDerWaalsContact CZ-CD 3.43Å; Y227-R231 VanDerWaalsContact O-CG 3.3Å; Y227-R231 WeakPolarHBondContact O-CG 3.32Å; Y227-R231 PolarHBondContact O-N 2.89Å; N228-R231 WeakPolarHBondContact O-CB 3.33Å; N228-R231 PolarHBondContact O-N 3.29Å; L229-R231 PolarHBondContact O-N 3.43Å; R231-F233 PolarHBondContact O-N 3.3Å; R231-F234 PolarHBondContact O-N 3.43Å; R231-L235 WeakPolarHBondContact O-CA 3.21Å; R231-L235 WeakPolarHBondContact O-CB 3.41Å; R231-L235 PolarHBondContact O-N 2.78Å
232	E	87.7	Confident	80.2	Confident	100 Å²	100	46.7 Å²	46.7	47%	0.467	25%	0.249	S	C	.	.	H	α-helix	trans	-58.4	-32.6	179.2	-65.3	-175.3	176.6	0	0	112.9	A155 A158 N228 L229 M230	A155-E232 WeakPolarHBondContact CB-OE2 3.47Å; A158-E232 HydrophobicContact CB-CB 4.12Å; N228-E232 PolarHBondContact O-N 2.95Å; L229-E232 WeakPolarHBondContact O-CB 3.16Å; L229-E232 PolarHBondContact O-N 3.38Å; M230-E232 VanDerWaalsContact C-N 3.31Å; M230-E232 PolarHBondContact O-N 3.47Å
233	F	87.5	Confident	79.4	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.009	27%	0.266	C	S	.	.	H	α-helix	trans	-82.8	-36	176.4	-74.6	-96.5	0	0	0	113.8	L125 F154 A158 V161 Y181 L229 M230 R231	L125-F233 HydrophobicContact CD2-CD1 4.22Å; L125-F233 HydrophobicContact CD2-CE1 3.77Å; L125-F233 HydrophobicContact CD2-CZ 4.43Å; F154-F233 AromaticContact CD1-CE2 3.84Å; F154-F233 HydrophobicContact CD1-CE2 3.84Å; F154-F233 AromaticContact CD1-CZ 3.77Å; F154-F233 HydrophobicContact CD1-CZ 3.77Å; F154-F233 HydrophobicContact CE1-CE1 4.48Å; F154-F233 AromaticContact CE1-CE2 3.92Å; F154-F233 HydrophobicContact CE1-CE2 3.92Å; F154-F233 AromaticContact CE1-CZ 3.71Å; F154-F233 HydrophobicContact CE1-CZ 3.71Å; F154-F233 WeakPolarHBondContact O-CZ 3.29Å; A158-F233 HydrophobicContact CB-CD1 4.12Å; A158-F233 HydrophobicContact CB-CD2 3.88Å; A158-F233 HydrophobicContact CB-CE1 4.01Å; A158-F233 HydrophobicContact CB-CE2 3.77Å; A158-F233 HydrophobicContact CB-CG 4.06Å; A158-F233 HydrophobicContact CB-CZ 3.84Å; V161-F233 HydrophobicContact CB-CD1 4.11Å; V161-F233 HydrophobicContact CB-CE1 4.48Å; V161-F233 HydrophobicContact CG1-CD1 4.1Å; V161-F233 HydrophobicContact CG2-CD1 4.46Å; V161-F233 HydrophobicContact CG2-CE1 4.39Å; Y181-F233 HydrophobicContact CD2-CG 4.45Å; Y181-F233 HydrophobicContact CE2-CB 4.39Å; Y181-F233 HydrophobicContact CE2-CD1 4.38Å; Y181-F233 AromaticContact CE2-CD2 3.73Å; Y181-F233 HydrophobicContact CE2-CD2 3.73Å; Y181-F233 HydrophobicContact CE2-CE2 4.05Å; Y181-F233 AromaticContact CE2-CG 3.91Å; Y181-F233 HydrophobicContact CE2-CG 3.91Å; Y181-F233 HydrophobicContact CE2-CZ 4.5Å; L229-F233 HydrophobicContact CD1-CE2 4.06Å; L229-F233 HydrophobicContact CG-CE2 4.38Å; L229-F233 WeakPolarHBondContact O-CD2 3.43Å; M230-F233 PolarHBondContact O-N 2.94Å; R231-F233 PolarHBondContact O-N 3.3Å
234	F	85.9	Confident	78.8	Confident	4 Å²	4	57 Å²	57	2%	0.018	30%	0.297	C	S	.	.	H	α-helix	trans	-121.7	6.1	-165.3	-59	-78.2	0	0	0	115.4	L165 Y178 Y181 M230 R231 T236 I237	L165-F234 HydrophobicContact CD1-CD1 3.88Å; L165-F234 HydrophobicContact CD1-CE1 3.61Å; Y178-F234 HydrophobicContact CD1-CD1 4.26Å; Y178-F234 HydrophobicContact CD1-CD2 4.07Å; Y178-F234 HydrophobicContact CD1-CE1 4.05Å; Y178-F234 AromaticContact CD1-CE2 3.87Å; Y178-F234 HydrophobicContact CD1-CE2 3.87Å; Y178-F234 HydrophobicContact CD1-CG 4.28Å; Y178-F234 AromaticContact CD1-CZ 3.85Å; Y178-F234 HydrophobicContact CD1-CZ 3.85Å; Y178-F234 HydrophobicContact CE1-CB 4Å; Y178-F234 AromaticContact CE1-CD1 3.62Å; Y178-F234 HydrophobicContact CE1-CD1 3.62Å; Y178-F234 AromaticContact CE1-CD2 3.54Å; Y178-F234 HydrophobicContact CE1-CD2 3.54Å; Y178-F234 AromaticContact CE1-CE1 3.89Å; Y178-F234 HydrophobicContact CE1-CE1 3.89Å; Y178-F234 AromaticContact CE1-CE2 3.83Å; Y178-F234 HydrophobicContact CE1-CE2 3.83Å; Y178-F234 AromaticContact CE1-CG 3.44Å; Y178-F234 HydrophobicContact CE1-CG 3.44Å; Y178-F234 VanDerWaalsContact CE1-CG 3.44Å; Y178-F234 AromaticContact CE1-CZ 3.99Å; Y178-F234 HydrophobicContact CE1-CZ 3.99Å; Y178-F234 AromaticContact CZ-CD1 3.77Å; Y178-F234 AromaticContact CZ-CG 3.87Å; Y181-F234 HydrophobicContact CD1-CE2 4.12Å; Y181-F234 AromaticContact CD2-CE2 3.86Å; Y181-F234 HydrophobicContact CD2-CE2 3.86Å; Y181-F234 HydrophobicContact CD2-CZ 4.31Å; Y181-F234 HydrophobicContact CE2-CE2 4.23Å; Y181-F234 AromaticContact CG-CE2 3.81Å; Y181-F234 HydrophobicContact CG-CE2 3.81Å; Y181-F234 HydrophobicContact CG-CZ 4.18Å; M230-F234 HydrophobicContact CG-CD2 3.83Å; M230-F234 HydrophobicContact CG-CE2 4.44Å; M230-F234 WeakPolarHBondContact O-CD2 3.11Å; M230-F234 PolarHBondContact O-N 2.9Å; R231-F234 PolarHBondContact O-N 3.43Å; F234-T236 VanDerWaalsContact C-N 3.32Å; F234-T236 PolarHBondContact O-N 3.33Å; F234-I237 HydrophobicContact CB-CD1 4.25Å; F234-I237 HydrophobicContact CD1-CD1 3.92Å
235	L	73.2	Confident	78.3	Confident	87 Å²	87	55.2 Å²	55.2	46%	0.455	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-31.9	-174.2	-174.2	67.7	0	0	0	114.2	R231 I237	R231-L235 WeakPolarHBondContact O-CA 3.21Å; R231-L235 WeakPolarHBondContact O-CB 3.41Å; R231-L235 PolarHBondContact O-N 2.78Å; L235-I237 PolarHBondContact O-N 3.4Å
236	T	64.2	Low	78	Confident	52 Å²	52	55.4 Å²	55.4	32%	0.319	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-1	-170.8	-45.9	0	0	0	0	114	Q162 K166 F234 S238	Q162-T236 WeakPolarHBondContact CG-OG1 3.46Å; Q162-T236 PolarHBondContact NE2-OG1 2.81Å; K166-T236 HydrophobicContact CB-CG2 4.28Å; K166-T236 HydrophobicContact CD-CG2 3.59Å; K166-T236 HydrophobicContact CG-CG2 3.74Å; F234-T236 VanDerWaalsContact C-N 3.32Å; F234-T236 PolarHBondContact O-N 3.33Å; T236-S238 PolarHBondContact O-N 3.43Å; T236-S238 VanDerWaalsContact O-N 3.09Å
237	I	60.9	Low	77.7	Confident	16 Å²	16	57.7 Å²	57.7	8%	0.082	30%	0.298	C	S	.	.			trans	-85.3	88.9	-176.1	-47.8	176.3	0	0	0	109.2	L174 F234 L235 F239 T242	L174-I237 HydrophobicContact CD1-CD1 4.32Å; L174-I237 HydrophobicContact CD1-CG2 4.08Å; L174-I237 HydrophobicContact CD2-CD1 3.84Å; F234-I237 HydrophobicContact CB-CD1 4.25Å; F234-I237 HydrophobicContact CD1-CD1 3.92Å; L235-I237 PolarHBondContact O-N 3.4Å; I237-F239 PolarHBondContact O-N 2.89Å; I237-T242 HydrophobicContact CG2-CG2 3.46Å; I237-T242 VanDerWaalsContact CG2-CG2 3.46Å; I237-T242 PolarHBondContact O-OG1 3.5Å
238	S	54.2	Low	77.7	Confident	110 Å²	110	63.8 Å²	63.8	77%	0.769	32%	0.322	S	S	*	.			trans	-85.8	39.9	-161.9	-175	0	0	0	0	116.3	T236	T236-S238 PolarHBondContact O-N 3.43Å; T236-S238 VanDerWaalsContact O-N 3.09Å
239	F	60.4	Low	77.8	Confident	123 Å²	123	61.3 Å²	61.3	54%	0.539	31%	0.308	S	S	.	.	S	Bend	trans	-124.4	151.8	176.7	-154.4	-98.1	0	0	0	114	I237 T241 T242 L243	I237-F239 PolarHBondContact O-N 2.89Å; F239-T241 VanDerWaalsContact C-N 3.25Å; F239-T241 HydrophobicContact CD1-CG2 3.91Å; F239-T241 WeakPolarHBondContact CD1-OG1 3.45Å; F239-T241 HydrophobicContact CE1-CG2 3.92Å; F239-T241 PolarHBondContact O-N 3.03Å; F239-T242 PolarHBondContact N-OG1 2.95Å; F239-T242 PolarHBondContact O-N 3.46Å; F239-T242 VanDerWaalsContact O-N 3.12Å; F239-T242 PolarHBondContact O-OG1 3.44Å; F239-L243 PolarHBondContact O-N 3.17Å
240	V	61.2	Low	77.9	Confident	90 Å²	90	61 Å²	61	55%	0.545	31%	0.307	S	S	.	.	H	α-helix	trans	-58.2	-36.9	-179.4	174.1	0	0	0	0	111.9	T242 L243 F244	V240-T242 VanDerWaalsContact C-N 3.31Å; V240-T242 PolarHBondContact O-N 3.02Å; V240-L243 WeakPolarHBondContact O-CB 3.47Å; V240-L243 PolarHBondContact O-N 3.16Å; V240-F244 HydrophobicContact CG1-CD2 4.33Å; V240-F244 HydrophobicContact CG1-CE2 3.69Å; V240-F244 VanDerWaalsContact O-CD2 3.25Å; V240-F244 WeakPolarHBondContact O-CD2 3.3Å
241	T	60.8	Low	78	Confident	81 Å²	81	62.2 Å²	62.2	50%	0.497	32%	0.315	S	S	.	.	H	α-helix	trans	-66.8	-31.1	179.1	58.3	0	0	0	0	113	F239 F244 A245	F239-T241 VanDerWaalsContact C-N 3.25Å; F239-T241 HydrophobicContact CD1-CG2 3.91Å; F239-T241 WeakPolarHBondContact CD1-OG1 3.45Å; F239-T241 HydrophobicContact CE1-CG2 3.92Å; F239-T241 PolarHBondContact O-N 3.03Å; T241-F244 PolarHBondContact O-N 3.17Å; T241-A245 PolarHBondContact O-N 3.11Å
242	T	68.3	Low	78.4	Confident	16 Å²	16	60.5 Å²	60.5	10%	0.098	32%	0.319	C	S	.	.	H	α-helix	trans	-79.7	-23.4	-178.9	54.9	0	0	0	0	111.4	L174 I237 F239 V240 R246	L174-T242 HydrophobicContact CD1-CG2 4.1Å; I237-T242 HydrophobicContact CG2-CG2 3.46Å; I237-T242 VanDerWaalsContact CG2-CG2 3.46Å; I237-T242 PolarHBondContact O-OG1 3.5Å; F239-T242 PolarHBondContact N-OG1 2.95Å; F239-T242 PolarHBondContact O-N 3.46Å; F239-T242 VanDerWaalsContact O-N 3.12Å; F239-T242 PolarHBondContact O-OG1 3.44Å; V240-T242 VanDerWaalsContact C-N 3.31Å; V240-T242 PolarHBondContact O-N 3.02Å; T242-R246 VanDerWaalsContact O-CB 3.24Å; T242-R246 WeakPolarHBondContact O-CB 3.12Å; T242-R246 PolarHBondContact O-N 3.26Å
243	L	76.8	Confident	78.9	Confident	83 Å²	83	56.2 Å²	56.2	44%	0.435	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-44.7	169.4	-63.4	175.4	0	0	0	111.8	F239 V240 R246 Q247	F239-L243 PolarHBondContact O-N 3.17Å; V240-L243 WeakPolarHBondContact O-CB 3.47Å; V240-L243 PolarHBondContact O-N 3.16Å; L243-R246 PolarHBondContact O-N 3.48Å; L243-Q247 WeakPolarHBondContact O-CB 3.46Å; L243-Q247 PolarHBondContact O-N 3.47Å
244	F	81.8	Confident	79.3	Confident	150 Å²	150	56.2 Å²	56.2	66%	0.658	30%	0.299	S	S	*	.	H	α-helix	trans	-65.5	-45.6	179	-69	-65.9	0	0	0	112.4	V240 T241 R246 Q247 Y248	V240-F244 HydrophobicContact CG1-CD2 4.33Å; V240-F244 HydrophobicContact CG1-CE2 3.69Å; V240-F244 VanDerWaalsContact O-CD2 3.25Å; V240-F244 WeakPolarHBondContact O-CD2 3.3Å; T241-F244 PolarHBondContact O-N 3.17Å; F244-R246 PolarHBondContact O-N 3.36Å; F244-Q247 PolarHBondContact O-N 3.39Å; F244-Y248 VanDerWaalsContact O-CB 3.3Å; F244-Y248 WeakPolarHBondContact O-CB 3.49Å; F244-Y248 PolarHBondContact O-N 3.2Å
245	A	82.7	Confident	79.8	Confident	18 Å²	18	57.5 Å²	57.5	15%	0.149	31%	0.307	C	S	.	.	H	α-helix	trans	-60	-46.7	176.6	0	0	0	0	0	111.2	Y178 T241 Q247 Y248 F249	Y178-A245 HydrophobicContact CE2-CB 4.49Å; T241-A245 PolarHBondContact O-N 3.11Å; A245-Q247 VanDerWaalsContact C-N 3.35Å; A245-Q247 PolarHBondContact O-N 3.33Å; A245-Y248 WeakPolarHBondContact O-CB 3.21Å; A245-Y248 PolarHBondContact O-N 3.11Å; A245-F249 HydrophobicContact CB-CD2 4.43Å; A245-F249 HydrophobicContact CB-CE2 4.3Å; A245-F249 WeakPolarHBondContact O-CD2 3.34Å; A245-F249 PolarHBondContact O-N 3.11Å
246	R	84.3	Confident	80.9	Confident	38 Å²	38	58.2 Å²	58.2	14%	0.143	31%	0.306	C	S	.	.	H	α-helix	trans	-56.8	-47.7	176.8	-172.3	-179.4	71.3	-176.3	2	112	Y178 M230 T242 L243 F244 Y248 L250	Y178-R246 HydrophobicContact CE1-CB 4.44Å; Y178-R246 HydrophobicContact CE1-CG 4.31Å; M230-R246 HydrophobicContact CE-CG 3.44Å; M230-R246 VanDerWaalsContact CE-CG 3.44Å; M230-R246 HydrophobicContact SD-CG 3.45Å; M230-R246 WeakPolarHBondContact SD-CG 3.2Å; T242-R246 VanDerWaalsContact O-CB 3.24Å; T242-R246 WeakPolarHBondContact O-CB 3.12Å; T242-R246 PolarHBondContact O-N 3.26Å; L243-R246 PolarHBondContact O-N 3.48Å; F244-R246 PolarHBondContact O-N 3.36Å; R246-Y248 VanDerWaalsContact C-N 3.34Å; R246-L250 VanDerWaalsContact O-CB 3.29Å; R246-L250 WeakPolarHBondContact O-CB 3.16Å; R246-L250 PolarHBondContact O-N 3.23Å
247	Q	88.1	Confident	82.4	Confident	47 Å²	47	55.8 Å²	55.8	22%	0.22	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-40.3	178	-176.6	56.1	45.2	0	0	111.9	L243 F244 A245 S251 V299 G300	L243-Q247 WeakPolarHBondContact O-CB 3.46Å; L243-Q247 PolarHBondContact O-N 3.47Å; F244-Q247 PolarHBondContact O-N 3.39Å; A245-Q247 VanDerWaalsContact C-N 3.35Å; A245-Q247 PolarHBondContact O-N 3.33Å; Q247-S251 WeakPolarHBondContact O-CB 3.48Å; Q247-S251 PolarHBondContact O-N 2.96Å; Q247-V299 PolarHBondContact OE1-O 3.19Å; Q247-G300 PolarHBondContact NE2-O 3.21Å
248	Y	91.4	Very high	84.1	Confident	159 Å²	159	55 Å²	55	62%	0.624	29%	0.287	S	S	*	.	H	α-helix	trans	-63.1	-52	178.2	175.9	-97.5	0	0	0	112.1	F244 A245 R246 S251 A252	F244-Y248 VanDerWaalsContact O-CB 3.3Å; F244-Y248 WeakPolarHBondContact O-CB 3.49Å; F244-Y248 PolarHBondContact O-N 3.2Å; A245-Y248 WeakPolarHBondContact O-CB 3.21Å; A245-Y248 PolarHBondContact O-N 3.11Å; R246-Y248 VanDerWaalsContact C-N 3.34Å; Y248-S251 PolarHBondContact O-N 3.14Å; Y248-A252 WeakPolarHBondContact O-CB 3.29Å; Y248-A252 PolarHBondContact O-N 3.13Å
249	F	93.1	Very high	86.1	Confident	21 Å²	21	53.4 Å²	53.4	9%	0.092	26%	0.264	C	S	.	.	H	α-helix	trans	-67.9	-40	-178.4	-72.1	-66.6	0	0	0	112.7	D175 Y178 N179 F182 A245 A252 F253	D175-F249 HydrophobicContact CB-CE2 3.95Å; D175-F249 HydrophobicContact CB-CZ 3.83Å; D175-F249 WeakPolarHBondContact OD1-CE2 3.36Å; Y178-F249 VanDerWaalsContact CB-CD2 3.45Å; Y178-F249 AromaticContact CD2-CD2 3.82Å; Y178-F249 HydrophobicContact CD2-CD2 3.82Å; Y178-F249 HydrophobicContact CD2-CE2 4.11Å; Y178-F249 AromaticContact CG-CD2 3.73Å; Y178-F249 HydrophobicContact CG-CD2 3.73Å; Y178-F249 HydrophobicContact CG-CE2 4.32Å; Y178-F249 HydrophobicContact CG-CG 4.29Å; N179-F249 VanDerWaalsContact CG-CE1 3.45Å; N179-F249 VanDerWaalsContact ND2-CE1 3.34Å; N179-F249 WeakPolarHBondContact ND2-CE1 3.46Å; N179-F249 WeakPolarHBondContact OD1-CE1 3.35Å; F182-F249 HydrophobicContact CD2-CB 3.8Å; F182-F249 HydrophobicContact CE2-CB 3.55Å; A245-F249 HydrophobicContact CB-CD2 4.43Å; A245-F249 HydrophobicContact CB-CE2 4.3Å; A245-F249 WeakPolarHBondContact O-CD2 3.34Å; A245-F249 PolarHBondContact O-N 3.11Å; F249-A252 PolarHBondContact O-N 2.91Å; F249-F253 WeakPolarHBondContact O-CB 3.48Å; F249-F253 PolarHBondContact O-N 3.43Å
250	L	94.2	Very high	87.8	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-47.9	173.2	-179.2	68.9	0	0	0	110.9	F182 Y227 M230 R246 A252 F253 I254 V301	F182-L250 HydrophobicContact CE1-CD1 4.14Å; F182-L250 HydrophobicContact CZ-CB 4.17Å; F182-L250 HydrophobicContact CZ-CD1 4.12Å; Y227-L250 HydrophobicContact CD2-CD2 3.66Å; Y227-L250 HydrophobicContact CG-CD2 4.43Å; M230-L250 HydrophobicContact CE-CB 4.46Å; M230-L250 HydrophobicContact CE-CD1 4.5Å; M230-L250 HydrophobicContact CE-CD2 3.98Å; M230-L250 HydrophobicContact SD-CB 4.09Å; M230-L250 HydrophobicContact SD-CD1 4.35Å; R246-L250 VanDerWaalsContact O-CB 3.29Å; R246-L250 WeakPolarHBondContact O-CB 3.16Å; R246-L250 PolarHBondContact O-N 3.23Å; L250-A252 VanDerWaalsContact C-N 3.34Å; L250-A252 PolarHBondContact O-N 3.38Å; L250-F253 PolarHBondContact O-N 3.35Å; L250-I254 HydrophobicContact CD1-CD1 4.49Å; L250-I254 HydrophobicContact CD1-CG1 4.11Å; L250-I254 HydrophobicContact CG-CG1 4.25Å; L250-I254 WeakPolarHBondContact O-CB 3.35Å; L250-I254 VanDerWaalsContact O-CG1 3.3Å; L250-I254 WeakPolarHBondContact O-CG1 3.14Å; L250-I254 PolarHBondContact O-N 3.06Å; L250-V301 HydrophobicContact CD2-CG1 4.44Å
251	S	94.6	Very high	89.4	Confident	24 Å²	24	45.7 Å²	45.7	17%	0.168	22%	0.222	C	C	.	.	H	α-helix	trans	-57.7	-47.2	177.8	-175.5	0	0	0	0	111.2	Q247 Y248 F253 I254 T255 G304	Q247-S251 WeakPolarHBondContact O-CB 3.48Å; Q247-S251 PolarHBondContact O-N 2.96Å; Y248-S251 PolarHBondContact O-N 3.14Å; S251-F253 PolarHBondContact O-N 3.47Å; S251-I254 PolarHBondContact O-N 2.73Å; S251-T255 WeakPolarHBondContact O-CB 3.18Å; S251-T255 PolarHBondContact O-N 2.96Å; S251-T255 PolarHBondContact O-OG1 3.46Å; S251-G304 VanDerWaalsContact OG-CA 3.31Å; S251-G304 WeakPolarHBondContact OG-CA 3.01Å; S251-G304 PolarHBondContact OG-N 2.91Å; S251-G304 VanDerWaalsContact OG-N 3.12Å
252	A	96.1	Very high	91.1	Very high	49 Å²	49	42.5 Å²	42.5	41%	0.405	20%	0.201	S	C	.	.	H	α-helix	trans	-60.4	-42.7	177.7	0	0	0	0	0	112.7	Y248 F249 L250 K256	Y248-A252 WeakPolarHBondContact O-CB 3.29Å; Y248-A252 PolarHBondContact O-N 3.13Å; F249-A252 PolarHBondContact O-N 2.91Å; L250-A252 VanDerWaalsContact C-N 3.34Å; L250-A252 PolarHBondContact O-N 3.38Å; A252-K256 PolarHBondContact O-N 2.87Å
253	F	96.5	Very high	92.4	Very high	9 Å²	9	46 Å²	46	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-64.4	-48.5	176.8	175	-113	0	0	0	112.3	F182 R185 E186 E226 F249 L250 S251 T255 K256 L257	F182-F253 HydrophobicContact CB-CB 4.31Å; F182-F253 HydrophobicContact CB-CD2 4Å; F182-F253 HydrophobicContact CB-CG 4.27Å; F182-F253 HydrophobicContact CD1-CB 3.56Å; F182-F253 AromaticContact CD1-CD1 3.47Å; F182-F253 HydrophobicContact CD1-CD1 3.47Å; F182-F253 VanDerWaalsContact CD1-CD1 3.47Å; F182-F253 AromaticContact CD1-CD2 3.75Å; F182-F253 HydrophobicContact CD1-CD2 3.75Å; F182-F253 AromaticContact CD1-CE1 3.98Å; F182-F253 HydrophobicContact CD1-CE1 3.98Å; F182-F253 HydrophobicContact CD1-CE2 4.24Å; F182-F253 AromaticContact CD1-CG 3.31Å; F182-F253 HydrophobicContact CD1-CG 3.31Å; F182-F253 HydrophobicContact CD1-CZ 4.33Å; F182-F253 HydrophobicContact CE1-CB 3.96Å; F182-F253 AromaticContact CE1-CD1 3.63Å; F182-F253 HydrophobicContact CE1-CD1 3.63Å; F182-F253 HydrophobicContact CE1-CE1 4.22Å; F182-F253 AromaticContact CE1-CG 3.86Å; F182-F253 HydrophobicContact CE1-CG 3.86Å; F182-F253 HydrophobicContact CG-CB 3.94Å; F182-F253 HydrophobicContact CG-CD2 4.25Å; F182-F253 HydrophobicContact CG-CG 4.03Å; R185-F253 HydrophobicContact CB-CE2 4.18Å; R185-F253 HydrophobicContact CB-CZ 3.83Å; E186-F253 HydrophobicContact CB-CE2 3.95Å; E226-F253 HydrophobicContact CB-CE1 4.25Å; E226-F253 HydrophobicContact CG-CE1 3.84Å; F249-F253 WeakPolarHBondContact O-CB 3.48Å; F249-F253 PolarHBondContact O-N 3.43Å; L250-F253 PolarHBondContact O-N 3.35Å; S251-F253 PolarHBondContact O-N 3.47Å; F253-T255 VanDerWaalsContact C-N 3.34Å; F253-T255 PolarHBondContact O-N 3.42Å; F253-K256 WeakPolarHBondContact O-CB 3.26Å; F253-K256 PolarHBondContact O-N 3.48Å; F253-K256 VanDerWaalsContact O-N 3.12Å; F253-L257 HydrophobicContact CD1-CD1 4.23Å; F253-L257 HydrophobicContact CE1-CD1 3.63Å; F253-L257 HydrophobicContact CE2-CD1 4.03Å; F253-L257 HydrophobicContact CE2-CD2 4.5Å; F253-L257 HydrophobicContact CE2-CG 4.26Å; F253-L257 HydrophobicContact CZ-CD1 3.53Å; F253-L257 HydrophobicContact CZ-CG 4.25Å; F253-L257 PolarHBondContact O-N 2.94Å
254	I	96.6	Very high	93.1	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-41.5	177.6	-65.9	-56.3	0	0	0	111	C223 E226 L250 S251 K256 L257 A258 L305	C223-I254 HydrophobicContact CB-CD1 4.42Å; C223-I254 WeakPolarHBondContact SG-CG2 3.31Å; E226-I254 HydrophobicContact CB-CD1 4.48Å; L250-I254 HydrophobicContact CD1-CD1 4.49Å; L250-I254 HydrophobicContact CD1-CG1 4.11Å; L250-I254 HydrophobicContact CG-CG1 4.25Å; L250-I254 WeakPolarHBondContact O-CB 3.35Å; L250-I254 VanDerWaalsContact O-CG1 3.3Å; L250-I254 WeakPolarHBondContact O-CG1 3.14Å; L250-I254 PolarHBondContact O-N 3.06Å; S251-I254 PolarHBondContact O-N 2.73Å; I254-K256 VanDerWaalsContact C-N 3.28Å; I254-K256 PolarHBondContact O-N 3Å; I254-L257 PolarHBondContact O-N 3.22Å; I254-A258 VanDerWaalsContact O-CB 3.25Å; I254-A258 WeakPolarHBondContact O-CB 3.14Å; I254-A258 PolarHBondContact O-N 3.31Å; I254-L305 HydrophobicContact CG2-CB 3.84Å
255	T	96.9	Very high	93.6	Very high	31 Å²	31	36 Å²	36	19%	0.19	18%	0.177	C	C	.	.	H	α-helix	trans	-57.3	-43.4	173.5	-63.4	0	0	0	0	111.2	S251 F253 A258 R259 G304 V308	S251-T255 WeakPolarHBondContact O-CB 3.18Å; S251-T255 PolarHBondContact O-N 2.96Å; S251-T255 PolarHBondContact O-OG1 3.46Å; F253-T255 VanDerWaalsContact C-N 3.34Å; F253-T255 PolarHBondContact O-N 3.42Å; T255-A258 PolarHBondContact O-N 3.32Å; T255-R259 WeakPolarHBondContact O-CB 3.31Å; T255-R259 PolarHBondContact O-N 3.15Å; T255-G304 WeakPolarHBondContact OG1-CA 3.14Å; T255-G304 PolarHBondContact OG1-O 3.09Å; T255-V308 HydrophobicContact CG2-CG2 3.91Å
256	K	96.1	Very high	94.2	Very high	102 Å²	102	40 Å²	40	44%	0.443	19%	0.188	S	C	.	.	H	α-helix	trans	-64	-42.8	178.7	-165.4	177.5	-172.7	-171.3	0	111.9	E186 A252 F253 I254 R259	E186-K256 WeakPolarHBondContact OE1-CD 3.21Å; E186-K256 WeakPolarHBondContact OE1-CE 3.38Å; E186-K256 IonicContact OE1-NZ 3.91Å; E186-K256 PolarHBondContact OE1-NZ 3.15Å; E186-K256 WeakPolarHBondContact OE2-CD 3.32Å; E186-K256 WeakPolarHBondContact OE2-CE 3.35Å; E186-K256 IonicContact OE2-NZ 3.5Å; E186-K256 PolarHBondContact OE2-NZ 2.69Å; A252-K256 PolarHBondContact O-N 2.87Å; F253-K256 WeakPolarHBondContact O-CB 3.26Å; F253-K256 PolarHBondContact O-N 3.48Å; F253-K256 VanDerWaalsContact O-N 3.12Å; I254-K256 VanDerWaalsContact C-N 3.28Å; I254-K256 PolarHBondContact O-N 3Å; K256-R259 WeakPolarHBondContact O-CB 3.47Å; K256-R259 PolarHBondContact O-N 2.84Å
257	L	95.3	Very high	94.6	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-68.4	-45.8	176.1	-65.1	-177.5	0	0	0	111.8	V189 F193 L222 F253 I254 R259 Y260	V189-L257 HydrophobicContact CG1-CD1 4.19Å; F193-L257 HydrophobicContact CE1-CB 4.48Å; F193-L257 VanDerWaalsContact CE1-O 3.27Å; F193-L257 WeakPolarHBondContact CE1-O 3.26Å; L222-L257 HydrophobicContact CD2-CB 4.36Å; L222-L257 HydrophobicContact CD2-CD1 3.88Å; L222-L257 HydrophobicContact CG-CD1 4.39Å; F253-L257 HydrophobicContact CD1-CD1 4.23Å; F253-L257 HydrophobicContact CE1-CD1 3.63Å; F253-L257 HydrophobicContact CE2-CD1 4.03Å; F253-L257 HydrophobicContact CE2-CD2 4.5Å; F253-L257 HydrophobicContact CE2-CG 4.26Å; F253-L257 HydrophobicContact CZ-CD1 3.53Å; F253-L257 HydrophobicContact CZ-CG 4.25Å; F253-L257 PolarHBondContact O-N 2.94Å; I254-L257 PolarHBondContact O-N 3.22Å; L257-R259 PolarHBondContact O-N 3.2Å; L257-Y260 HydrophobicContact CD2-CD2 4.49Å; L257-Y260 HydrophobicContact CD2-CE2 4.27Å; L257-Y260 WeakPolarHBondContact O-CD2 3.35Å; L257-Y260 PolarHBondContact O-N 2.89Å; L257-Y260 VanDerWaalsContact O-N 3.09Å
258	A	96.4	Very high	94.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-26.3	178.1	0	0	0	0	0	112.5	L219 I254 T255 Y260 F261 Y262 L305 V308	L219-A258 HydrophobicContact CD2-CB 4.17Å; I254-A258 VanDerWaalsContact O-CB 3.25Å; I254-A258 WeakPolarHBondContact O-CB 3.14Å; I254-A258 PolarHBondContact O-N 3.31Å; T255-A258 PolarHBondContact O-N 3.32Å; A258-Y260 VanDerWaalsContact C-N 3.28Å; A258-Y260 PolarHBondContact O-N 2.93Å; A258-F261 WeakPolarHBondContact O-CB 3.37Å; A258-F261 PolarHBondContact O-N 3.35Å; A258-Y262 PolarHBondContact O-N 2.89Å; A258-L305 HydrophobicContact CB-CD1 4.14Å; A258-V308 HydrophobicContact CB-CB 3.88Å; A258-V308 HydrophobicContact CB-CG1 4.01Å; A258-V308 HydrophobicContact CB-CG2 3.79Å
259	R	96.8	Very high	94.7	Very high	76 Å²	76	37.9 Å²	37.9	29%	0.287	19%	0.186	S	C	.	.	H	α-helix	trans	-58.8	-35.7	173.8	-169.1	64.5	64.3	-172.2	0.2	112.8	T255 K256 L257 F261 Y262 D263 E311	T255-R259 WeakPolarHBondContact O-CB 3.31Å; T255-R259 PolarHBondContact O-N 3.15Å; K256-R259 WeakPolarHBondContact O-CB 3.47Å; K256-R259 PolarHBondContact O-N 2.84Å; L257-R259 PolarHBondContact O-N 3.2Å; R259-F261 VanDerWaalsContact C-N 3.28Å; R259-F261 PolarHBondContact O-N 3.45Å; R259-Y262 WeakPolarHBondContact O-CB 3.36Å; R259-Y262 PolarHBondContact O-N 2.88Å; R259-Y262 VanDerWaalsContact O-N 3.17Å; R259-D263 PolarHBondContact O-N 3.29Å; R259-E311 IonicContact CZ-OE1 3.6Å; R259-E311 IonicContact CZ-OE2 3.75Å; R259-E311 IonicContact NH1-OE1 3.74Å; R259-E311 IonicContact NH1-OE2 3.39Å; R259-E311 PolarHBondContact NH1-OE2 3.14Å; R259-E311 IonicContact NH2-OE1 2.56Å; R259-E311 PolarHBondContact NH2-OE1 3.3Å; R259-E311 IonicContact NH2-OE2 2.71Å; R259-E311 PolarHBondContact NH2-OE2 2.89Å
260	Y	95	Very high	94.7	Very high	45 Å²	45	40.8 Å²	40.8	18%	0.176	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-35.9	174.7	-61.5	-70.6	0	0	0	112	R190 F193 E194 L257 A258 A264	R190-Y260 WeakPolarHBondContact CD-OH 3.44Å; R190-Y260 HydrophobicContact CG-CE2 4.29Å; R190-Y260 PolarHBondContact NE-OH 3.23Å; R190-Y260 VanDerWaalsContact NE-OH 3.15Å; R190-Y260 PolarHBondContact NH1-OH 2.93Å; F193-Y260 HydrophobicContact CD1-CD2 4.49Å; E194-Y260 HydrophobicContact CG-CD1 4.27Å; E194-Y260 HydrophobicContact CG-CG 4.4Å; E194-Y260 WeakPolarHBondContact OE1-CD1 3.2Å; E194-Y260 WeakPolarHBondContact OE1-CE1 3.38Å; L257-Y260 HydrophobicContact CD2-CD2 4.49Å; L257-Y260 HydrophobicContact CD2-CE2 4.27Å; L257-Y260 WeakPolarHBondContact O-CD2 3.35Å; L257-Y260 PolarHBondContact O-N 2.89Å; L257-Y260 VanDerWaalsContact O-N 3.09Å; A258-Y260 VanDerWaalsContact C-N 3.28Å; A258-Y260 PolarHBondContact O-N 2.93Å; Y260-A264 VanDerWaalsContact O-CB 3.28Å; Y260-A264 WeakPolarHBondContact O-CB 3.28Å; Y260-A264 PolarHBondContact O-N 3.43Å; Y260-A264 VanDerWaalsContact O-N 3.15Å
261	F	95.5	Very high	94.5	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-70.4	-40.2	173.5	179.9	-107.7	0	0	0	111.6	I197 L219 A258 R259 A264 I265 I312	I197-F261 HydrophobicContact CD1-CB 4.04Å; L219-F261 HydrophobicContact CD1-CB 4.05Å; L219-F261 HydrophobicContact CD1-CD1 3.59Å; L219-F261 HydrophobicContact CD1-CE1 4.19Å; L219-F261 HydrophobicContact CD1-CG 3.84Å; A258-F261 WeakPolarHBondContact O-CB 3.37Å; A258-F261 PolarHBondContact O-N 3.35Å; R259-F261 VanDerWaalsContact C-N 3.28Å; R259-F261 PolarHBondContact O-N 3.45Å; F261-A264 PolarHBondContact O-N 3.41Å; F261-I265 HydrophobicContact CE1-CD1 4.14Å; F261-I265 HydrophobicContact CE1-CG2 4.31Å; F261-I265 HydrophobicContact CE2-CD1 4.47Å; F261-I265 HydrophobicContact CZ-CB 4.42Å; F261-I265 HydrophobicContact CZ-CD1 3.72Å; F261-I265 VanDerWaalsContact O-CG2 3.31Å; F261-I265 WeakPolarHBondContact O-CG2 3.29Å; F261-I265 PolarHBondContact O-N 3.5Å; F261-I312 HydrophobicContact CD1-CD1 4.09Å; F261-I312 HydrophobicContact CE1-CD1 4.13Å
262	Y	96.4	Very high	94.3	Very high	14 Å²	14	46.8 Å²	46.8	6%	0.055	23%	0.227	C	C	.	.	H	α-helix	trans	-55.6	-52.8	173.4	175.7	-97	0	0	0	111.7	A258 R259 A264 I265 R266 V308 E311 I312 D315	A258-Y262 PolarHBondContact O-N 2.89Å; R259-Y262 WeakPolarHBondContact O-CB 3.36Å; R259-Y262 PolarHBondContact O-N 2.88Å; R259-Y262 VanDerWaalsContact O-N 3.17Å; Y262-A264 PolarHBondContact O-N 2.86Å; Y262-I265 PolarHBondContact O-N 2.88Å; Y262-R266 WeakPolarHBondContact O-CB 3.48Å; Y262-R266 PolarHBondContact O-N 3.25Å; Y262-R266 WeakPolarHBondContact OH-CD 3.37Å; Y262-R266 PolarHBondContact OH-NE 2.99Å; Y262-R266 PolarHBondContact OH-NH1 3.44Å; Y262-V308 HydrophobicContact CD2-CG1 4.36Å; Y262-V308 HydrophobicContact CG-CG1 4.36Å; Y262-E311 HydrophobicContact CE2-CB 4.17Å; Y262-I312 HydrophobicContact CD2-CD1 4.2Å; Y262-I312 HydrophobicContact CD2-CG1 3.47Å; Y262-I312 VanDerWaalsContact CD2-CG1 3.47Å; Y262-I312 HydrophobicContact CE2-CG1 4.05Å; Y262-D315 WeakPolarHBondContact CE2-OD2 3.42Å; Y262-D315 PolarHBondContact OH-OD2 3.4Å
263	D	96	Very high	94	Very high	90 Å²	90	50.4 Å²	50.4	48%	0.481	24%	0.236	S	C	.	.	H	α-helix	trans	-63.9	-32.8	-178.7	-66.8	-28.3	0	0	0	112	R259 P267	R259-D263 PolarHBondContact O-N 3.29Å; D263-P267 WeakPolarHBondContact O-CD 3.45Å
264	A	92.1	Very high	93.6	Very high	23 Å²	23	55.2 Å²	55.2	19%	0.19	26%	0.258	C	S	.	.	H	α-helix	trans	-70.6	-41.5	175.3	0	0	0	0	0	113.6	I197 L201 Y260 F261 Y262	I197-A264 HydrophobicContact CG2-CB 3.49Å; I197-A264 VanDerWaalsContact CG2-CB 3.49Å; L201-A264 HydrophobicContact CD1-CB 3.91Å; L201-A264 HydrophobicContact CD2-CB 4.32Å; L201-A264 HydrophobicContact CG-CB 4.44Å; Y260-A264 VanDerWaalsContact O-CB 3.28Å; Y260-A264 WeakPolarHBondContact O-CB 3.28Å; Y260-A264 PolarHBondContact O-N 3.43Å; Y260-A264 VanDerWaalsContact O-N 3.15Å; F261-A264 PolarHBondContact O-N 3.41Å; Y262-A264 PolarHBondContact O-N 2.86Å
265	I	92.8	Very high	93.2	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-87.4	-30.4	-174.3	-160.9	169.1	0	0	0	113.1	L211 T212 F261 Y262 R268 I269 I312	L211-I265 HydrophobicContact CD2-CD1 4.43Å; L211-I265 HydrophobicContact CD2-CG1 4.21Å; T212-I265 VanDerWaalsContact OG1-CD1 3.29Å; T212-I265 WeakPolarHBondContact OG1-CD1 3.43Å; F261-I265 HydrophobicContact CE1-CD1 4.14Å; F261-I265 HydrophobicContact CE1-CG2 4.31Å; F261-I265 HydrophobicContact CE2-CD1 4.47Å; F261-I265 HydrophobicContact CZ-CB 4.42Å; F261-I265 HydrophobicContact CZ-CD1 3.72Å; F261-I265 VanDerWaalsContact O-CG2 3.31Å; F261-I265 WeakPolarHBondContact O-CG2 3.29Å; F261-I265 PolarHBondContact O-N 3.5Å; Y262-I265 PolarHBondContact O-N 2.88Å; I265-R268 WeakPolarHBondContact O-CA 3.41Å; I265-R268 WeakPolarHBondContact O-CB 3.36Å; I265-R268 PolarHBondContact O-N 2.96Å; I265-I269 HydrophobicContact CD1-CD1 4.49Å; I265-I269 HydrophobicContact CG1-CD1 4.08Å; I265-I269 HydrophobicContact CG1-CG1 4.23Å; I265-I269 HydrophobicContact CG2-CD1 4Å; I265-I269 PolarHBondContact O-N 2.64Å; I265-I269 VanDerWaalsContact O-N 3.11Å; I265-I312 HydrophobicContact CG2-CD1 3.92Å; I265-I312 HydrophobicContact CG2-CG1 4.37Å
266	R	94.4	Very high	92.7	Very high	100 Å²	100	63.9 Å²	63.9	38%	0.377	30%	0.298	S	S	.	.	H	α-helix	trans	-53.8	-46.3	-175.7	-176.9	-174.1	-162.8	-179.8	5.8	113.8	Y262 R268 I269 I270 D315	Y262-R266 WeakPolarHBondContact O-CB 3.48Å; Y262-R266 PolarHBondContact O-N 3.25Å; Y262-R266 WeakPolarHBondContact OH-CD 3.37Å; Y262-R266 PolarHBondContact OH-NE 2.99Å; Y262-R266 PolarHBondContact OH-NH1 3.44Å; R266-R268 PolarHBondContact O-N 3.45Å; R266-I269 PolarHBondContact O-N 2.9Å; R266-I269 VanDerWaalsContact O-N 3.14Å; R266-I270 HydrophobicContact CG-CD1 3.95Å; R266-I270 WeakPolarHBondContact O-CG1 3.2Å; R266-I270 PolarHBondContact O-N 3.02Å; R266-I270 VanDerWaalsContact O-N 3.11Å; R266-D315 IonicContact NE-OD2 2.94Å
267	P	92.8	Very high	92.4	Very high	67 Å²	67	62 Å²	62	44%	0.435	29%	0.292	S	S	.	.	H	α-helix	trans	-58.9	-34.4	176.5	-24.5	34.9	0	0	0	112.7	D263 H271	D263-P267 WeakPolarHBondContact O-CD 3.45Å; P267-H271 PolarHBondContact O-CD2 3.29Å; P267-H271 PolarHBondContact O-N 3.41Å
268	R	90.2	Very high	92.1	Very high	131 Å²	131	62 Å²	62	49%	0.494	29%	0.291	S	S	.	.	H	α-helix	trans	-69	-43.8	177	-63.1	-63.3	-174.2	175.9	-0.7	111.3	I265 R266 I270 H271 V272	I265-R268 WeakPolarHBondContact O-CA 3.41Å; I265-R268 WeakPolarHBondContact O-CB 3.36Å; I265-R268 PolarHBondContact O-N 2.96Å; R266-R268 PolarHBondContact O-N 3.45Å; R268-I270 PolarHBondContact O-N 3.24Å; R268-H271 PolarHBondContact O-N 3.45Å; R268-H271 VanDerWaalsContact O-N 3.16Å; R268-V272 VanDerWaalsContact O-CG2 3.3Å; R268-V272 WeakPolarHBondContact O-CG2 3.34Å; R268-V272 PolarHBondContact O-N 2.85Å; R268-V272 VanDerWaalsContact O-N 3.17Å
269	I	92.1	Very high	91.7	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-58.9	-48	179.6	-67	167.3	0	0	0	111	I265 R266 H271 V272 L281 I312 D315 I316	I265-I269 HydrophobicContact CD1-CD1 4.49Å; I265-I269 HydrophobicContact CG1-CD1 4.08Å; I265-I269 HydrophobicContact CG1-CG1 4.23Å; I265-I269 HydrophobicContact CG2-CD1 4Å; I265-I269 PolarHBondContact O-N 2.64Å; I265-I269 VanDerWaalsContact O-N 3.11Å; R266-I269 PolarHBondContact O-N 2.9Å; R266-I269 VanDerWaalsContact O-N 3.14Å; I269-H271 PolarHBondContact O-N 3.28Å; I269-H271 VanDerWaalsContact O-N 3.17Å; I269-V272 PolarHBondContact O-N 3.41Å; I269-V272 VanDerWaalsContact O-N 3.11Å; I269-L281 HydrophobicContact CG1-CD2 4.4Å; I269-I312 HydrophobicContact CD1-CG2 3.63Å; I269-D315 HydrophobicContact CG2-CB 4.39Å; I269-I316 HydrophobicContact CD1-CD1 4.26Å; I269-I316 HydrophobicContact CD1-CG1 3.99Å; I269-I316 HydrophobicContact CG1-CG1 4.26Å; I269-I316 HydrophobicContact CG2-CG1 3.73Å
270	I	91.4	Very high	91.3	Very high	82 Å²	82	63.2 Å²	63.2	42%	0.421	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-28.9	-179.5	-64.7	168.7	0	0	0	111.6	R266 R268 R319	R266-I270 HydrophobicContact CG-CD1 3.95Å; R266-I270 WeakPolarHBondContact O-CG1 3.2Å; R266-I270 PolarHBondContact O-N 3.02Å; R266-I270 VanDerWaalsContact O-N 3.11Å; R268-I270 PolarHBondContact O-N 3.24Å; I270-R319 PolarHBondContact O-NE 3.31Å; I270-R319 VanDerWaalsContact O-NE 3.17Å; I270-R319 PolarHBondContact O-NH1 3.39Å; I270-R319 PolarHBondContact O-NH2 3.11Å
271	H	91.7	Very high	91.1	Very high	138 Å²	138	61.1 Å²	61.1	64%	0.639	29%	0.293	S	S	*	.	H	α-helix	trans	-93	-4.9	-180	-66.9	-49.3	0	0	0	114.8	P267 R268 I269 Q273	P267-H271 PolarHBondContact O-CD2 3.29Å; P267-H271 PolarHBondContact O-N 3.41Å; R268-H271 PolarHBondContact O-N 3.45Å; R268-H271 VanDerWaalsContact O-N 3.16Å; I269-H271 PolarHBondContact O-N 3.28Å; I269-H271 VanDerWaalsContact O-N 3.17Å; H271-Q273 PolarHBondContact O-N 3.18Å
272	V	89.6	Confident	90.8	Very high	14 Å²	14	61.9 Å²	61.9	9%	0.085	30%	0.297	C	S	.	.			trans	-62.8	127.7	175.3	-176	0	0	0	0	109.5	R268 I269 M277 L278 R319	R268-V272 VanDerWaalsContact O-CG2 3.3Å; R268-V272 WeakPolarHBondContact O-CG2 3.34Å; R268-V272 PolarHBondContact O-N 2.85Å; R268-V272 VanDerWaalsContact O-N 3.17Å; I269-V272 PolarHBondContact O-N 3.41Å; I269-V272 VanDerWaalsContact O-N 3.11Å; V272-M277 HydrophobicContact CG1-CB 4Å; V272-M277 HydrophobicContact CG1-CE 4.29Å; V272-L278 HydrophobicContact CB-CD2 3.92Å; V272-L278 HydrophobicContact CB-CG 4.16Å; V272-L278 HydrophobicContact CG1-CD1 4.42Å; V272-L278 HydrophobicContact CG1-CD2 4.01Å; V272-L278 HydrophobicContact CG1-CG 3.76Å; V272-R319 PolarHBondContact O-NE 3.24Å; V272-R319 VanDerWaalsContact O-NE 3.07Å; V272-R319 PolarHBondContact O-NH2 3.43Å
273	Q	89.2	Confident	90.4	Very high	124 Å²	124	63 Å²	63	58%	0.579	31%	0.31	S	S	*	.			trans	-102.4	-33.5	-178.1	-60.1	-173.9	11.4	0	0	112.7	H271 R323	H271-Q273 PolarHBondContact O-N 3.18Å; Q273-R323 VanDerWaalsContact O-CZ 3.29Å; Q273-R323 PolarHBondContact O-NE 3.47Å; Q273-R323 PolarHBondContact O-NH2 3.19Å
274	H	88.9	Confident	90.1	Very high	110 Å²	110	59.3 Å²	59.3	51%	0.509	29%	0.29	S	S	.	.			trans	-82.5	126.2	-173.4	-57.4	-89.5	0	0	0	110.8	E276 M277 L278	H274-E276 VanDerWaalsContact C-N 3.33Å; H274-E276 PolarHBondContact O-N 3.15Å; H274-M277 HydrophobicContact CB-CB 4.45Å; H274-M277 HydrophobicContact CB-CE 3.56Å; H274-M277 HydrophobicContact CB-CG 4.36Å; H274-M277 WeakPolarHBondContact CD2-CE 3.4Å; H274-M277 PolarHBondContact O-N 3.1Å; H274-L278 PolarHBondContact O-N 2.96Å
275	L	86.9	Confident	90.1	Very high	57 Å²	57	58.2 Å²	58.2	30%	0.298	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-42.5	-178.4	-163.8	74.6	0	0	0	111.3	M277 L278 I279 L320 R323 A324	L275-M277 VanDerWaalsContact C-N 3.31Å; L275-M277 PolarHBondContact O-N 3.46Å; L275-L278 WeakPolarHBondContact O-CB 2.94Å; L275-L278 PolarHBondContact O-N 3.03Å; L275-L278 VanDerWaalsContact O-N 3.13Å; L275-I279 HydrophobicContact CD2-CD1 4.1Å; L275-I279 HydrophobicContact CG-CD1 3.84Å; L275-I279 HydrophobicContact CG-CG1 4.36Å; L275-I279 WeakPolarHBondContact O-CB 3.36Å; L275-I279 WeakPolarHBondContact O-CG1 3.27Å; L275-I279 PolarHBondContact O-N 3.42Å; L275-L320 HydrophobicContact CD1-CD1 3.42Å; L275-L320 VanDerWaalsContact CD1-CD1 3.42Å; L275-L320 HydrophobicContact CG-CD1 3.98Å; L275-R323 HydrophobicContact CD1-CB 4.07Å; L275-A324 HydrophobicContact CD1-CB 3.91Å
276	E	87.9	Confident	89.9	Confident	159 Å²	159	65.7 Å²	65.7	74%	0.743	31%	0.309	S	S	*	.	H	α-helix	trans	-55.6	-43	179	-65.2	158.1	-168.9	0	0	112.6	H274 I279 E280	H274-E276 VanDerWaalsContact C-N 3.33Å; H274-E276 PolarHBondContact O-N 3.15Å; E276-I279 WeakPolarHBondContact O-CB 3.5Å; E276-I279 PolarHBondContact O-N 3.39Å; E276-E280 PolarHBondContact O-N 3.14Å
277	M	89	Confident	89.6	Confident	62 Å²	62	64.6 Å²	64.6	31%	0.305	31%	0.313	S	S	.	.	H	α-helix	trans	-67.1	-42.4	177.2	-74.6	-164.4	-81.5	0	0	112.2	V272 H274 L275 I279 E280 L281	V272-M277 HydrophobicContact CG1-CB 4Å; V272-M277 HydrophobicContact CG1-CE 4.29Å; H274-M277 HydrophobicContact CB-CB 4.45Å; H274-M277 HydrophobicContact CB-CE 3.56Å; H274-M277 HydrophobicContact CB-CG 4.36Å; H274-M277 WeakPolarHBondContact CD2-CE 3.4Å; H274-M277 PolarHBondContact O-N 3.1Å; L275-M277 VanDerWaalsContact C-N 3.31Å; L275-M277 PolarHBondContact O-N 3.46Å; M277-I279 VanDerWaalsContact C-N 3.25Å; M277-I279 PolarHBondContact O-N 3.48Å; M277-E280 PolarHBondContact O-N 2.88Å; M277-L281 WeakPolarHBondContact O-CB 3.5Å; M277-L281 PolarHBondContact O-N 2.9Å
278	L	89.9	Confident	89.5	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-38.8	176.8	-72.7	166.7	0	0	0	111.3	V272 H274 L275 N282 I316 R319 L320 R323	V272-L278 HydrophobicContact CB-CD2 3.92Å; V272-L278 HydrophobicContact CB-CG 4.16Å; V272-L278 HydrophobicContact CG1-CD1 4.42Å; V272-L278 HydrophobicContact CG1-CD2 4.01Å; V272-L278 HydrophobicContact CG1-CG 3.76Å; H274-L278 PolarHBondContact O-N 2.96Å; L275-L278 WeakPolarHBondContact O-CB 2.94Å; L275-L278 PolarHBondContact O-N 3.03Å; L275-L278 VanDerWaalsContact O-N 3.13Å; L278-N282 VanDerWaalsContact O-CB 3.31Å; L278-N282 WeakPolarHBondContact O-CB 3.05Å; L278-N282 PolarHBondContact O-N 3.13Å; L278-I316 HydrophobicContact CD2-CG2 4.31Å; L278-R319 HydrophobicContact CD1-CG 3.87Å; L278-R319 HydrophobicContact CD2-CB 4.15Å; L278-R319 HydrophobicContact CD2-CG 3.71Å; L278-R319 HydrophobicContact CG-CG 4.46Å; L278-L320 HydrophobicContact CB-CB 4.24Å; L278-L320 HydrophobicContact CB-CD1 3.81Å; L278-R323 HydrophobicContact CD1-CB 4.14Å; L278-R323 HydrophobicContact CD1-CG 3.84Å
279	I	87.1	Confident	89.6	Confident	25 Å²	25	61.1 Å²	61.1	13%	0.128	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-52.1	177.3	-76.8	176.5	0	0	0	111.3	L275 E276 M277 L281 N282 A283 L320 Y365	L275-I279 HydrophobicContact CD2-CD1 4.1Å; L275-I279 HydrophobicContact CG-CD1 3.84Å; L275-I279 HydrophobicContact CG-CG1 4.36Å; L275-I279 WeakPolarHBondContact O-CB 3.36Å; L275-I279 WeakPolarHBondContact O-CG1 3.27Å; L275-I279 PolarHBondContact O-N 3.42Å; E276-I279 WeakPolarHBondContact O-CB 3.5Å; E276-I279 PolarHBondContact O-N 3.39Å; M277-I279 VanDerWaalsContact C-N 3.25Å; M277-I279 PolarHBondContact O-N 3.48Å; I279-L281 PolarHBondContact O-N 3.33Å; I279-N282 PolarHBondContact O-N 3.42Å; I279-A283 PolarHBondContact O-N 3.38Å; I279-L320 HydrophobicContact CD1-CD1 4.35Å; I279-L320 HydrophobicContact CG1-CD1 3.54Å; I279-L320 HydrophobicContact CG1-CD2 4.2Å; I279-Y365 HydrophobicContact CB-CE1 4.26Å; I279-Y365 HydrophobicContact CD1-CD2 4.46Å; I279-Y365 HydrophobicContact CD1-CG 4.37Å; I279-Y365 HydrophobicContact CG2-CD1 3.32Å; I279-Y365 HydrophobicContact CG2-CD2 4.23Å; I279-Y365 HydrophobicContact CG2-CE1 2.82Å; I279-Y365 HydrophobicContact CG2-CE2 3.76Å; I279-Y365 HydrophobicContact CG2-CG 4.04Å; I279-Y365 VanDerWaalsContact CG2-OH 3.26Å; I279-Y365 WeakPolarHBondContact CG2-OH 3.48Å
280	E	88.7	Confident	89.6	Confident	78 Å²	78	61.1 Å²	61.1	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-59	-41.4	177.7	-170.3	-163	163.6	0	0	110.4	C209 R213 E276 M277 A283 L284	C209-E280 PolarHBondContact SG-OE2 2.75Å; R213-E280 IonicContact CZ-OE1 3.9Å; R213-E280 IonicContact NH1-OE1 3.45Å; R213-E280 PolarHBondContact NH1-OE1 3.01Å; R213-E280 VanDerWaalsContact NH1-OE1 3.13Å; R213-E280 IonicContact NH2-OE1 3.13Å; R213-E280 PolarHBondContact NH2-OE1 3.31Å; E276-E280 PolarHBondContact O-N 3.14Å; M277-E280 PolarHBondContact O-N 2.88Å; E280-A283 PolarHBondContact O-N 3.05Å; E280-L284 WeakPolarHBondContact O-CB 3.41Å; E280-L284 PolarHBondContact O-N 3.09Å
281	L	90.7	Very high	89.4	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-66	-42.8	179	-173.8	64.8	0	0	0	112.2	T212 I269 M277 I279 L284 L285 I316	T212-L281 HydrophobicContact CG2-CD1 3.84Å; T212-L281 WeakPolarHBondContact OG1-CD1 3.37Å; I269-L281 HydrophobicContact CG1-CD2 4.4Å; M277-L281 WeakPolarHBondContact O-CB 3.5Å; M277-L281 PolarHBondContact O-N 2.9Å; I279-L281 PolarHBondContact O-N 3.33Å; L281-L284 HydrophobicContact CD1-CD2 4.46Å; L281-L284 PolarHBondContact O-N 2.97Å; L281-L285 PolarHBondContact O-N 2.71Å; L281-I316 HydrophobicContact CD2-CD1 3.52Å; L281-I316 HydrophobicContact CD2-CG1 3.73Å; L281-I316 HydrophobicContact CD2-CG2 4.39Å; L281-I316 HydrophobicContact CG-CD1 3.59Å; L281-I316 HydrophobicContact CG-CG1 4.27Å
282	N	88.5	Confident	89.3	Confident	21 Å²	21	58.1 Å²	58.1	11%	0.112	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-48.3	175.1	-167.8	-75	0	0	0	110.9	L278 I279 L284 L285 R286 L313 I316 T317	L278-N282 VanDerWaalsContact O-CB 3.31Å; L278-N282 WeakPolarHBondContact O-CB 3.05Å; L278-N282 PolarHBondContact O-N 3.13Å; I279-N282 PolarHBondContact O-N 3.42Å; N282-L284 PolarHBondContact O-N 3.15Å; N282-L285 PolarHBondContact O-N 3.17Å; N282-R286 WeakPolarHBondContact O-CB 3.38Å; N282-R286 PolarHBondContact O-N 2.95Å; N282-L313 HydrophobicContact CB-CD1 4.49Å; N282-L313 WeakPolarHBondContact ND2-CD1 3.25Å; N282-I316 HydrophobicContact CB-CG2 4Å; N282-T317 PolarHBondContact ND2-OG1 3.05Å
283	A	88.1	Confident	89.4	Confident	39 Å²	39	63.8 Å²	63.8	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-63.4	-42.4	178.4	0	0	0	0	0	112.1	I279 E280 V287	I279-A283 PolarHBondContact O-N 3.38Å; E280-A283 PolarHBondContact O-N 3.05Å; A283-V287 WeakPolarHBondContact O-CB 3.43Å; A283-V287 PolarHBondContact O-N 3.35Å
284	L	90.5	Very high	89.5	Confident	11 Å²	11	58.4 Å²	58.4	6%	0.058	29%	0.285	C	S	.	.	I	π-helix	trans	-56.6	-54.1	175.4	173.4	67.3	0	0	0	110.9	T212 R213 E280 L281 N282 K288 V289	T212-L284 HydrophobicContact CG2-CD2 4.15Å; R213-L284 HydrophobicContact CG-CD1 3.93Å; R213-L284 HydrophobicContact CG-CD2 3.61Å; R213-L284 HydrophobicContact CG-CG 4.41Å; E280-L284 WeakPolarHBondContact O-CB 3.41Å; E280-L284 PolarHBondContact O-N 3.09Å; L281-L284 HydrophobicContact CD1-CD2 4.46Å; L281-L284 PolarHBondContact O-N 2.97Å; N282-L284 PolarHBondContact O-N 3.15Å; L284-K288 HydrophobicContact CD1-CB 4.23Å; L284-K288 HydrophobicContact CD1-CD 3.98Å; L284-K288 WeakPolarHBondContact O-CB 3.37Å; L284-K288 PolarHBondContact O-N 3.13Å; L284-K288 VanDerWaalsContact O-N 3.1Å; L284-V289 PolarHBondContact O-N 3.1Å; L284-V289 VanDerWaalsContact O-N 3.13Å
285	L	91.3	Very high	89.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.286	C	S	.	.	I	π-helix	trans	-69.5	-46.1	-176.9	-79.9	173.3	0	0	0	112.3	T212 L281 N282 V289 L290 L309 I312 L313 I316	T212-L285 HydrophobicContact CG2-CD1 4.27Å; T212-L285 HydrophobicContact CG2-CD2 3.77Å; T212-L285 HydrophobicContact CG2-CG 3.98Å; L281-L285 PolarHBondContact O-N 2.71Å; N282-L285 PolarHBondContact O-N 3.17Å; L285-V289 HydrophobicContact CD2-CB 4.22Å; L285-V289 HydrophobicContact CD2-CG1 4.3Å; L285-V289 HydrophobicContact CD2-CG2 4.23Å; L285-L290 WeakPolarHBondContact O-CB 3.45Å; L285-L290 WeakPolarHBondContact O-CG 3.5Å; L285-L290 PolarHBondContact O-N 2.83Å; L285-L309 HydrophobicContact CD2-CD2 3.96Å; L285-I312 HydrophobicContact CD1-CB 4.43Å; L285-I312 HydrophobicContact CD1-CG2 3.6Å; L285-L313 HydrophobicContact CB-CD1 4.32Å; L285-I316 HydrophobicContact CD1-CD1 3.31Å
286	R	90	Very high	89.6	Confident	159 Å²	159	60.2 Å²	60.2	60%	0.6	30%	0.298	S	S	*	.	I	π-helix	trans	-67.4	-47.6	-175.7	-173.1	176.2	-177	173.3	3.7	112.5	N282 G291 L313	N282-R286 WeakPolarHBondContact O-CB 3.38Å; N282-R286 PolarHBondContact O-N 2.95Å; R286-G291 PolarHBondContact O-N 2.97Å; R286-G291 VanDerWaalsContact O-N 3.09Å; R286-L313 HydrophobicContact CB-CD1 4.15Å; R286-L313 HydrophobicContact CB-CD2 4.04Å; R286-L313 HydrophobicContact CG-CD2 4.2Å
287	V	87.5	Confident	89.5	Confident	77 Å²	77	54.1 Å²	54.1	47%	0.467	27%	0.273	S	S	.	.	I	π-helix	trans	-89.9	-60.4	-173.5	-175.5	0	0	0	0	110.4	A283 G291 E292	A283-V287 WeakPolarHBondContact O-CB 3.43Å; A283-V287 PolarHBondContact O-N 3.35Å; V287-G291 WeakPolarHBondContact O-CA 3.5Å; V287-G291 PolarHBondContact O-N 3.46Å; V287-E292 WeakPolarHBondContact O-CG 3.21Å; V287-E292 PolarHBondContact O-N 2.98Å
288	K	90.5	Very high	89	Confident	114 Å²	114	60.7 Å²	60.7	50%	0.496	30%	0.303	S	S	.	.	I	π-helix	trans	-77.3	-29.3	-168.5	-55.9	-171.3	177.1	-174.3	0	114.1	L284	L284-K288 HydrophobicContact CD1-CB 4.23Å; L284-K288 HydrophobicContact CD1-CD 3.98Å; L284-K288 WeakPolarHBondContact O-CB 3.37Å; L284-K288 PolarHBondContact O-N 3.13Å; L284-K288 VanDerWaalsContact O-N 3.1Å
289	V	92.3	Very high	88.5	Confident	11 Å²	11	64.1 Å²	64.1	7%	0.067	32%	0.324	C	S	.	.	I	π-helix	trans	-99.1	-58.7	-176.1	-178.2	0	0	0	0	111	C216 F220 L284 L285 R293 C294 L309	C216-V289 HydrophobicContact CB-CG1 4.39Å; C216-V289 HydrophobicContact CB-CG2 4.49Å; F220-V289 HydrophobicContact CE2-CG1 3.81Å; F220-V289 HydrophobicContact CZ-CG1 3.73Å; L284-V289 PolarHBondContact O-N 3.1Å; L284-V289 VanDerWaalsContact O-N 3.13Å; L285-V289 HydrophobicContact CD2-CB 4.22Å; L285-V289 HydrophobicContact CD2-CG1 4.3Å; L285-V289 HydrophobicContact CD2-CG2 4.23Å; V289-R293 WeakPolarHBondContact O-CB 3.33Å; V289-R293 PolarHBondContact O-N 3.47Å; V289-C294 PolarHBondContact O-N 2.92Å; V289-C294 VanDerWaalsContact O-N 3.11Å; V289-C294 PolarHBondContact O-SG 3.43Å; V289-L309 HydrophobicContact CG1-CD1 3.48Å; V289-L309 VanDerWaalsContact CG1-CD1 3.48Å
290	L	91.1	Very high	88.4	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	33%	0.331	C	S	.	.	I	π-helix	trans	-73.6	-56	-178.3	-73.8	167.4	0	0	0	111.6	L285 C294 Y295 A306 L309 E310 L313	L285-L290 WeakPolarHBondContact O-CB 3.45Å; L285-L290 WeakPolarHBondContact O-CG 3.5Å; L285-L290 PolarHBondContact O-N 2.83Å; L290-C294 HydrophobicContact CD2-CB 4.21Å; L290-C294 WeakPolarHBondContact O-CB 3.47Å; L290-C294 PolarHBondContact O-N 3.22Å; L290-C294 VanDerWaalsContact O-N 3.14Å; L290-Y295 HydrophobicContact CB-CE2 4.01Å; L290-Y295 WeakPolarHBondContact O-CD2 3.48Å; L290-Y295 PolarHBondContact O-N 2.81Å; L290-A306 HydrophobicContact CD2-CB 4.06Å; L290-L309 HydrophobicContact CD2-CB 3.87Å; L290-L309 HydrophobicContact CD2-CD1 4.38Å; L290-L309 HydrophobicContact CG-CB 4.29Å; L290-E310 HydrophobicContact CD1-CG 4.1Å; L290-E310 HydrophobicContact CD2-CG 4.17Å; L290-L313 HydrophobicContact CD1-CB 4.5Å; L290-L313 HydrophobicContact CD1-CD2 3.85Å
291	G	88.3	Confident	88.5	Confident	34 Å²	34	60.7 Å²	60.7	35%	0.351	32%	0.315	S	S	.	.	I	π-helix	trans	-60.8	-60.2	-178.7	0	0	0	0	0	113.6	R286 V287	R286-G291 PolarHBondContact O-N 2.97Å; R286-G291 VanDerWaalsContact O-N 3.09Å; V287-G291 WeakPolarHBondContact O-CA 3.5Å; V287-G291 PolarHBondContact O-N 3.46Å
292	E	90.1	Very high	88.7	Confident	123 Å²	123	62.4 Å²	62.4	58%	0.575	32%	0.322	S	S	*	.	I	π-helix	trans	-75.8	-24.9	-171.9	-72.3	173.2	-165	0	0	114.5	V287 A296	V287-E292 WeakPolarHBondContact O-CG 3.21Å; V287-E292 PolarHBondContact O-N 2.98Å; E292-A296 VanDerWaalsContact O-CB 3.28Å; E292-A296 WeakPolarHBondContact O-CB 3.5Å
293	R	90.1	Very high	89	Confident	133 Å²	133	63.3 Å²	63.3	50%	0.502	33%	0.332	S	S	.	.	I	π-helix	trans	-116.5	-53.8	-176.3	-61.3	-173.1	172.9	-152.1	-2.3	113.9	F220 V289 S297	F220-R293 HydrophobicContact CE1-CB 3.91Å; F220-R293 HydrophobicContact CE2-CB 4.4Å; F220-R293 HydrophobicContact CZ-CB 3.67Å; F220-R293 HydrophobicContact CZ-CG 4.33Å; V289-R293 WeakPolarHBondContact O-CB 3.33Å; V289-R293 PolarHBondContact O-N 3.47Å; R293-S297 PolarHBondContact O-N 3.42Å
294	C	91.6	Very high	89.2	Confident	10 Å²	10	61.5 Å²	61.5	7%	0.068	32%	0.317	C	S	.	.	I	π-helix	trans	-68.1	-54.1	-173.2	-59.2	0	0	0	0	111.4	V289 L290 A296 S297 A306	V289-C294 PolarHBondContact O-N 2.92Å; V289-C294 VanDerWaalsContact O-N 3.11Å; V289-C294 PolarHBondContact O-SG 3.43Å; L290-C294 HydrophobicContact CD2-CB 4.21Å; L290-C294 WeakPolarHBondContact O-CB 3.47Å; L290-C294 PolarHBondContact O-N 3.22Å; L290-C294 VanDerWaalsContact O-N 3.14Å; C294-A296 VanDerWaalsContact C-N 3.32Å; C294-A296 PolarHBondContact O-N 3.5Å; C294-S297 PolarHBondContact O-N 3.22Å; C294-A306 HydrophobicContact CB-CB 4.03Å
295	Y	89.4	Confident	89.5	Confident	138 Å²	138	61 Å²	61	54%	0.541	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-19.3	-177.9	-55.3	-34.7	0	0	0	113.7	L290 S297 E310	L290-Y295 HydrophobicContact CB-CE2 4.01Å; L290-Y295 WeakPolarHBondContact O-CD2 3.48Å; L290-Y295 PolarHBondContact O-N 2.81Å; Y295-S297 VanDerWaalsContact C-N 3.27Å; Y295-S297 PolarHBondContact O-N 3.09Å; Y295-E310 PolarHBondContact OH-OE1 2.97Å
296	A	88.6	Confident	89.7	Confident	67 Å²	67	61.4 Å²	61.4	55%	0.554	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-12	174.7	0	0	0	0	0	113.3	E292 C294 E298	E292-A296 VanDerWaalsContact O-CB 3.28Å; E292-A296 WeakPolarHBondContact O-CB 3.5Å; C294-A296 VanDerWaalsContact C-N 3.32Å; C294-A296 PolarHBondContact O-N 3.5Å; A296-E298 PolarHBondContact O-N 2.91Å
297	S	85.9	Confident	90	Very high	31 Å²	31	56.8 Å²	56.8	22%	0.217	31%	0.307	C	S	.	.			trans	-79.5	113.4	-177.1	-174.4	0	0	0	0	112.2	R293 C294 Y295 V299 G300	R293-S297 PolarHBondContact O-N 3.42Å; C294-S297 PolarHBondContact O-N 3.22Å; Y295-S297 VanDerWaalsContact C-N 3.27Å; Y295-S297 PolarHBondContact O-N 3.09Å; S297-V299 VanDerWaalsContact C-N 3.32Å; S297-V299 PolarHBondContact O-N 2.84Å; S297-G300 PolarHBondContact O-N 3.39Å
298	E	79	Confident	90.4	Very high	200 Å²	200	53.2 Å²	53.2	94%	0.935	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-33.1	178.6	-62.9	-178	173.7	0	0	113.5	A296 G300	A296-E298 PolarHBondContact O-N 2.91Å; E298-G300 VanDerWaalsContact C-N 3.29Å; E298-G300 PolarHBondContact O-N 3.38Å
299	V	79.8	Confident	90.7	Very high	73 Å²	73	47.9 Å²	47.9	44%	0.442	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.8	-174.1	-179	0	0	0	0	111.5	Y227 Q247 S297 V301	Y227-V299 HydrophobicContact CE1-CG1 4.1Å; Y227-V299 HydrophobicContact CE2-CG1 3.89Å; Y227-V299 VanDerWaalsContact CZ-CG1 3.43Å; Y227-V299 WeakPolarHBondContact OH-CG1 3.48Å; Q247-V299 PolarHBondContact OE1-O 3.19Å; S297-V299 VanDerWaalsContact C-N 3.32Å; S297-V299 PolarHBondContact O-N 2.84Å; V299-V301 VanDerWaalsContact C-N 3.29Å; V299-V301 HydrophobicContact CB-CG2 3.92Å; V299-V301 HydrophobicContact CG1-CG2 3.56Å; V299-V301 PolarHBondContact O-N 3.13Å
300	G	85.2	Confident	90.8	Very high	25 Å²	25	51.2 Å²	51.2	26%	0.258	28%	0.277	S	S	.	.			trans	74.6	13.8	-179	0	0	0	0	0	114.4	Q247 S297 E298 Y302 A303	Q247-G300 PolarHBondContact NE2-O 3.21Å; S297-G300 PolarHBondContact O-N 3.39Å; E298-G300 VanDerWaalsContact C-N 3.29Å; E298-G300 PolarHBondContact O-N 3.38Å; G300-Y302 PolarHBondContact O-N 2.54Å; G300-Y302 VanDerWaalsContact O-N 3.08Å; G300-A303 WeakPolarHBondContact O-CB 3.39Å; G300-A303 PolarHBondContact O-N 2.93Å
301	V	90.3	Very high	91	Very high	5 Å²	5	54.4 Å²	54.4	3%	0.03	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-35.9	-177.6	178.9	0	0	0	0	112.2	C223 Y227 L250 V299 A303	C223-V301 HydrophobicContact CB-CG1 4.12Å; Y227-V301 HydrophobicContact CD1-CG2 3.83Å; Y227-V301 HydrophobicContact CD2-CG1 4.48Å; Y227-V301 HydrophobicContact CD2-CG2 3.77Å; Y227-V301 HydrophobicContact CE1-CG2 4.01Å; Y227-V301 HydrophobicContact CE2-CG2 3.98Å; Y227-V301 HydrophobicContact CG-CG1 4.09Å; Y227-V301 HydrophobicContact CG-CG2 3.7Å; L250-V301 HydrophobicContact CD2-CG1 4.44Å; V299-V301 VanDerWaalsContact C-N 3.29Å; V299-V301 HydrophobicContact CB-CG2 3.92Å; V299-V301 HydrophobicContact CG1-CG2 3.56Å; V299-V301 PolarHBondContact O-N 3.13Å; V301-A303 VanDerWaalsContact C-N 3.33Å; V301-A303 PolarHBondContact O-N 2.81Å
302	Y	95.2	Very high	91.3	Very high	38 Å²	38	52.9 Å²	52.9	15%	0.149	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	9.8	-175.7	-48.4	-48.1	0	0	0	114.2	F220 C223 D224 G300 G304 L305 A306	F220-Y302 AromaticContact CD1-CD1 3.81Å; F220-Y302 HydrophobicContact CD1-CD1 3.81Å; F220-Y302 HydrophobicContact CD1-CD2 4.44Å; F220-Y302 AromaticContact CD1-CE1 3.72Å; F220-Y302 HydrophobicContact CD1-CE1 3.72Å; F220-Y302 HydrophobicContact CD1-CE2 4.33Å; F220-Y302 HydrophobicContact CD1-CG 4.19Å; F220-Y302 AromaticContact CD1-CZ 3.99Å; F220-Y302 HydrophobicContact CE1-CD1 4.11Å; F220-Y302 HydrophobicContact CE1-CD2 4.17Å; F220-Y302 HydrophobicContact CE1-CE1 4.36Å; F220-Y302 HydrophobicContact CE1-CE2 4.38Å; F220-Y302 HydrophobicContact CE1-CG 4.03Å; C223-Y302 HydrophobicContact CB-CD1 3.8Å; C223-Y302 HydrophobicContact CB-CE1 3.82Å; D224-Y302 WeakPolarHBondContact OD1-CE1 3.49Å; D224-Y302 PolarHBondContact OD1-OH 3.07Å; D224-Y302 PolarHBondContact OD2-OH 2.8Å; G300-Y302 PolarHBondContact O-N 2.54Å; G300-Y302 VanDerWaalsContact O-N 3.08Å; Y302-G304 PolarHBondContact O-N 3.34Å; Y302-L305 PolarHBondContact O-N 3.49Å; Y302-A306 WeakPolarHBondContact O-CB 3.46Å; Y302-A306 PolarHBondContact O-N 3.43Å
303	A	93.3	Very high	91.4	Very high	40 Å²	40	48.2 Å²	48.2	33%	0.331	26%	0.255	S	S	.	.	H	α-helix	trans	-56.2	-49.6	-176	0	0	0	0	0	112.9	G300 V301 L305 A306 T307	G300-A303 WeakPolarHBondContact O-CB 3.39Å; G300-A303 PolarHBondContact O-N 2.93Å; V301-A303 VanDerWaalsContact C-N 3.33Å; V301-A303 PolarHBondContact O-N 2.81Å; A303-L305 VanDerWaalsContact C-N 3.34Å; A303-L305 PolarHBondContact O-N 2.81Å; A303-A306 WeakPolarHBondContact O-CB 3.27Å; A303-A306 PolarHBondContact O-N 2.91Å; A303-T307 PolarHBondContact O-N 3.36Å; A303-T307 VanDerWaalsContact O-N 3.13Å; A303-T307 PolarHBondContact O-OG1 3.28Å
304	G	93.7	Very high	91.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-67.2	-35	178.9	0	0	0	0	0	113.2	S251 T255 Y302 V308	S251-G304 VanDerWaalsContact OG-CA 3.31Å; S251-G304 WeakPolarHBondContact OG-CA 3.01Å; S251-G304 PolarHBondContact OG-N 2.91Å; S251-G304 VanDerWaalsContact OG-N 3.12Å; T255-G304 WeakPolarHBondContact OG1-CA 3.14Å; T255-G304 PolarHBondContact OG1-O 3.09Å; Y302-G304 PolarHBondContact O-N 3.34Å; G304-V308 PolarHBondContact O-N 2.89Å
305	L	96.4	Very high	91.4	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-43.3	173.9	175.8	59.2	0	0	0	111	L219 F220 I254 A258 Y302 A303 T307 V308 L309	L219-L305 HydrophobicContact CB-CD1 3.93Å; L219-L305 HydrophobicContact CB-CD2 4.15Å; L219-L305 HydrophobicContact CD1-CD1 3.77Å; L219-L305 HydrophobicContact CD2-CD1 4.35Å; L219-L305 HydrophobicContact CG-CD1 4.24Å; F220-L305 HydrophobicContact CD1-CD2 3.83Å; F220-L305 HydrophobicContact CE1-CD2 3.75Å; F220-L305 HydrophobicContact CG-CD2 4.4Å; F220-L305 HydrophobicContact CZ-CD2 4.28Å; I254-L305 HydrophobicContact CG2-CB 3.84Å; A258-L305 HydrophobicContact CB-CD1 4.14Å; Y302-L305 PolarHBondContact O-N 3.49Å; A303-L305 VanDerWaalsContact C-N 3.34Å; A303-L305 PolarHBondContact O-N 2.81Å; L305-T307 VanDerWaalsContact C-N 3.32Å; L305-T307 PolarHBondContact O-N 3.11Å; L305-V308 PolarHBondContact O-N 3.41Å; L305-L309 HydrophobicContact CD1-CD1 3.86Å; L305-L309 HydrophobicContact CD1-CD2 4.33Å; L305-L309 HydrophobicContact CD1-CG 3.85Å; L305-L309 HydrophobicContact CD2-CD1 4.31Å; L305-L309 HydrophobicContact CG-CD1 3.7Å; L305-L309 HydrophobicContact CG-CG 4.15Å; L305-L309 WeakPolarHBondContact O-CB 3.36Å; L305-L309 VanDerWaalsContact O-CG 3.27Å; L305-L309 WeakPolarHBondContact O-CG 3.27Å; L305-L309 PolarHBondContact O-N 3.12Å
306	A	95.7	Very high	91.4	Very high	9 Å²	9	38 Å²	38	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-59	-44	178.3	0	0	0	0	0	111.1	L290 C294 Y302 A303 V308 L309 E310	L290-A306 HydrophobicContact CD2-CB 4.06Å; C294-A306 HydrophobicContact CB-CB 4.03Å; Y302-A306 WeakPolarHBondContact O-CB 3.46Å; Y302-A306 PolarHBondContact O-N 3.43Å; A303-A306 WeakPolarHBondContact O-CB 3.27Å; A303-A306 PolarHBondContact O-N 2.91Å; A306-V308 VanDerWaalsContact C-N 3.34Å; A306-V308 PolarHBondContact O-N 3.48Å; A306-L309 PolarHBondContact O-N 2.9Å; A306-E310 WeakPolarHBondContact O-CB 3.4Å; A306-E310 VanDerWaalsContact O-CG 3.25Å; A306-E310 WeakPolarHBondContact O-CG 3.45Å; A306-E310 PolarHBondContact O-N 3.16Å
307	T	95.7	Very high	91.3	Very high	62 Å²	62	37.6 Å²	37.6	38%	0.38	22%	0.218	S	C	.	.	H	α-helix	trans	-54.7	-48.8	175.4	-56.4	0	0	0	0	111.8	A303 L305 E310 E311	A303-T307 PolarHBondContact O-N 3.36Å; A303-T307 VanDerWaalsContact O-N 3.13Å; A303-T307 PolarHBondContact O-OG1 3.28Å; L305-T307 VanDerWaalsContact C-N 3.32Å; L305-T307 PolarHBondContact O-N 3.11Å; T307-E310 PolarHBondContact O-N 2.93Å; T307-E311 WeakPolarHBondContact O-CG 3.4Å; T307-E311 PolarHBondContact O-N 3.31Å
308	V	96.9	Very high	91.4	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-69.2	-38.8	-180	179.6	0	0	0	0	111.9	T255 A258 Y262 G304 L305 A306 E310 E311 I312	T255-V308 HydrophobicContact CG2-CG2 3.91Å; A258-V308 HydrophobicContact CB-CB 3.88Å; A258-V308 HydrophobicContact CB-CG1 4.01Å; A258-V308 HydrophobicContact CB-CG2 3.79Å; Y262-V308 HydrophobicContact CD2-CG1 4.36Å; Y262-V308 HydrophobicContact CG-CG1 4.36Å; G304-V308 PolarHBondContact O-N 2.89Å; L305-V308 PolarHBondContact O-N 3.41Å; A306-V308 VanDerWaalsContact C-N 3.34Å; A306-V308 PolarHBondContact O-N 3.48Å; V308-E310 VanDerWaalsContact C-N 3.33Å; V308-E310 PolarHBondContact O-N 3.31Å; V308-E311 WeakPolarHBondContact O-CB 3.46Å; V308-E311 PolarHBondContact O-N 3.4Å; V308-I312 HydrophobicContact CG1-CD1 4.4Å; V308-I312 WeakPolarHBondContact O-CG1 3.25Å; V308-I312 PolarHBondContact O-N 3.27Å
309	L	95.8	Very high	92	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-68.7	-31.4	177.9	-67.9	175.6	0	0	0	112.7	L285 V289 L290 L305 A306 I312 L313	L285-L309 HydrophobicContact CD2-CD2 3.96Å; V289-L309 HydrophobicContact CG1-CD1 3.48Å; V289-L309 VanDerWaalsContact CG1-CD1 3.48Å; L290-L309 HydrophobicContact CD2-CB 3.87Å; L290-L309 HydrophobicContact CD2-CD1 4.38Å; L290-L309 HydrophobicContact CG-CB 4.29Å; L305-L309 HydrophobicContact CD1-CD1 3.86Å; L305-L309 HydrophobicContact CD1-CD2 4.33Å; L305-L309 HydrophobicContact CD1-CG 3.85Å; L305-L309 HydrophobicContact CD2-CD1 4.31Å; L305-L309 HydrophobicContact CG-CD1 3.7Å; L305-L309 HydrophobicContact CG-CG 4.15Å; L305-L309 WeakPolarHBondContact O-CB 3.36Å; L305-L309 VanDerWaalsContact O-CG 3.27Å; L305-L309 WeakPolarHBondContact O-CG 3.27Å; L305-L309 PolarHBondContact O-N 3.12Å; A306-L309 PolarHBondContact O-N 2.9Å; L309-I312 HydrophobicContact CD2-CD1 4.24Å; L309-I312 PolarHBondContact O-N 3.43Å; L309-L313 WeakPolarHBondContact O-CB 3.47Å; L309-L313 PolarHBondContact O-N 2.8Å
310	E	95.1	Very high	92.4	Very high	82 Å²	82	32.4 Å²	32.4	38%	0.383	18%	0.184	S	C	.	.	H	α-helix	trans	-65.9	-39.8	171.7	-77	169.4	-176	0	0	111.3	L290 Y295 A306 T307 V308 L313 G314	L290-E310 HydrophobicContact CD1-CG 4.1Å; L290-E310 HydrophobicContact CD2-CG 4.17Å; Y295-E310 PolarHBondContact OH-OE1 2.97Å; A306-E310 WeakPolarHBondContact O-CB 3.4Å; A306-E310 VanDerWaalsContact O-CG 3.25Å; A306-E310 WeakPolarHBondContact O-CG 3.45Å; A306-E310 PolarHBondContact O-N 3.16Å; T307-E310 PolarHBondContact O-N 2.93Å; V308-E310 VanDerWaalsContact C-N 3.33Å; V308-E310 PolarHBondContact O-N 3.31Å; E310-L313 PolarHBondContact O-N 2.97Å; E310-G314 PolarHBondContact O-N 2.85Å
311	E	95.1	Very high	92.3	Very high	68 Å²	68	34.3 Å²	34.3	32%	0.318	19%	0.188	S	C	.	.	H	α-helix	trans	-62.8	-44	172.5	-66.7	178.4	-142.6	0	0	111.5	R259 Y262 T307 V308 L313 G314 D315	R259-E311 IonicContact CZ-OE1 3.6Å; R259-E311 IonicContact CZ-OE2 3.75Å; R259-E311 IonicContact NH1-OE1 3.74Å; R259-E311 IonicContact NH1-OE2 3.39Å; R259-E311 PolarHBondContact NH1-OE2 3.14Å; R259-E311 IonicContact NH2-OE1 2.56Å; R259-E311 PolarHBondContact NH2-OE1 3.3Å; R259-E311 IonicContact NH2-OE2 2.71Å; R259-E311 PolarHBondContact NH2-OE2 2.89Å; Y262-E311 HydrophobicContact CE2-CB 4.17Å; T307-E311 WeakPolarHBondContact O-CG 3.4Å; T307-E311 PolarHBondContact O-N 3.31Å; V308-E311 WeakPolarHBondContact O-CB 3.46Å; V308-E311 PolarHBondContact O-N 3.4Å; E311-L313 VanDerWaalsContact C-N 3.32Å; E311-L313 PolarHBondContact O-N 2.83Å; E311-G314 WeakPolarHBondContact O-CA 3.47Å; E311-G314 PolarHBondContact O-N 3.18Å; E311-G314 VanDerWaalsContact O-N 3.15Å; E311-D315 PolarHBondContact O-N 2.93Å
312	I	95	Very high	92.2	Very high	2 Å²	2	40 Å²	40	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-59.9	-44.3	173.8	-65.6	173.8	0	0	0	110.6	F261 Y262 I265 I269 L285 V308 L309 G314 D315 I316	F261-I312 HydrophobicContact CD1-CD1 4.09Å; F261-I312 HydrophobicContact CE1-CD1 4.13Å; Y262-I312 HydrophobicContact CD2-CD1 4.2Å; Y262-I312 HydrophobicContact CD2-CG1 3.47Å; Y262-I312 VanDerWaalsContact CD2-CG1 3.47Å; Y262-I312 HydrophobicContact CE2-CG1 4.05Å; I265-I312 HydrophobicContact CG2-CD1 3.92Å; I265-I312 HydrophobicContact CG2-CG1 4.37Å; I269-I312 HydrophobicContact CD1-CG2 3.63Å; L285-I312 HydrophobicContact CD1-CB 4.43Å; L285-I312 HydrophobicContact CD1-CG2 3.6Å; V308-I312 HydrophobicContact CG1-CD1 4.4Å; V308-I312 WeakPolarHBondContact O-CG1 3.25Å; V308-I312 PolarHBondContact O-N 3.27Å; L309-I312 HydrophobicContact CD2-CD1 4.24Å; L309-I312 PolarHBondContact O-N 3.43Å; I312-G314 VanDerWaalsContact C-N 3.27Å; I312-G314 PolarHBondContact O-N 2.87Å; I312-D315 PolarHBondContact O-N 3.46Å; I312-I316 HydrophobicContact CG2-CD1 3.69Å; I312-I316 HydrophobicContact CG2-CG1 4.44Å; I312-I316 WeakPolarHBondContact O-CD1 3.31Å; I312-I316 VanDerWaalsContact O-CG1 3.26Å; I312-I316 WeakPolarHBondContact O-CG1 3.47Å; I312-I316 PolarHBondContact O-N 2.66Å
313	L	91.6	Very high	91.9	Very high	26 Å²	26	41.2 Å²	41.2	14%	0.136	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-37.1	177.1	-178.7	64.5	0	0	0	111.4	N282 L285 R286 L290 L309 E310 E311 I316 T317	N282-L313 HydrophobicContact CB-CD1 4.49Å; N282-L313 WeakPolarHBondContact ND2-CD1 3.25Å; L285-L313 HydrophobicContact CB-CD1 4.32Å; R286-L313 HydrophobicContact CB-CD1 4.15Å; R286-L313 HydrophobicContact CB-CD2 4.04Å; R286-L313 HydrophobicContact CG-CD2 4.2Å; L290-L313 HydrophobicContact CD1-CB 4.5Å; L290-L313 HydrophobicContact CD1-CD2 3.85Å; L309-L313 WeakPolarHBondContact O-CB 3.47Å; L309-L313 PolarHBondContact O-N 2.8Å; E310-L313 PolarHBondContact O-N 2.97Å; E311-L313 VanDerWaalsContact C-N 3.32Å; E311-L313 PolarHBondContact O-N 2.83Å; L313-I316 PolarHBondContact O-N 2.84Å; L313-T317 VanDerWaalsContact O-CB 3.29Å; L313-T317 WeakPolarHBondContact O-CB 3.37Å; L313-T317 PolarHBondContact O-N 3.27Å; L313-T317 PolarHBondContact O-OG1 3.24Å
314	G	89.6	Confident	91.5	Very high	38 Å²	38	39.9 Å²	39.9	39%	0.392	20%	0.203	S	C	.	.	H	α-helix	trans	-57.4	-54.8	171.7	0	0	0	0	0	111.7	E310 E311 I312 I316 T317 E318	E310-G314 PolarHBondContact O-N 2.85Å; E311-G314 WeakPolarHBondContact O-CA 3.47Å; E311-G314 PolarHBondContact O-N 3.18Å; E311-G314 VanDerWaalsContact O-N 3.15Å; I312-G314 VanDerWaalsContact C-N 3.27Å; I312-G314 PolarHBondContact O-N 2.87Å; G314-I316 VanDerWaalsContact C-N 3.3Å; G314-I316 PolarHBondContact O-N 3Å; G314-T317 PolarHBondContact O-N 3.12Å; G314-T317 VanDerWaalsContact O-N 3.09Å; G314-E318 PolarHBondContact O-N 3.39Å
315	D	91.6	Very high	91	Very high	29 Å²	29	43.4 Å²	43.4	16%	0.155	22%	0.22	C	C	.	.	H	α-helix	trans	-57.8	-41.1	178.3	-75.9	-26.2	0	0	0	111.9	Y262 R266 I269 E311 I312 R319	Y262-D315 WeakPolarHBondContact CE2-OD2 3.42Å; Y262-D315 PolarHBondContact OH-OD2 3.4Å; R266-D315 IonicContact NE-OD2 2.94Å; I269-D315 HydrophobicContact CG2-CB 4.39Å; E311-D315 PolarHBondContact O-N 2.93Å; I312-D315 PolarHBondContact O-N 3.46Å; D315-R319 WeakPolarHBondContact O-CB 3.35Å; D315-R319 PolarHBondContact O-N 3.45Å
316	I	89.5	Confident	90.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.2	-41.8	176.8	-65.9	157.4	0	0	0	111.2	I269 L278 L281 N282 L285 I312 L313 G314 R319 L320	I269-I316 HydrophobicContact CD1-CD1 4.26Å; I269-I316 HydrophobicContact CD1-CG1 3.99Å; I269-I316 HydrophobicContact CG1-CG1 4.26Å; I269-I316 HydrophobicContact CG2-CG1 3.73Å; L278-I316 HydrophobicContact CD2-CG2 4.31Å; L281-I316 HydrophobicContact CD2-CD1 3.52Å; L281-I316 HydrophobicContact CD2-CG1 3.73Å; L281-I316 HydrophobicContact CD2-CG2 4.39Å; L281-I316 HydrophobicContact CG-CD1 3.59Å; L281-I316 HydrophobicContact CG-CG1 4.27Å; N282-I316 HydrophobicContact CB-CG2 4Å; L285-I316 HydrophobicContact CD1-CD1 3.31Å; I312-I316 HydrophobicContact CG2-CD1 3.69Å; I312-I316 HydrophobicContact CG2-CG1 4.44Å; I312-I316 WeakPolarHBondContact O-CD1 3.31Å; I312-I316 VanDerWaalsContact O-CG1 3.26Å; I312-I316 WeakPolarHBondContact O-CG1 3.47Å; I312-I316 PolarHBondContact O-N 2.66Å; L313-I316 PolarHBondContact O-N 2.84Å; G314-I316 VanDerWaalsContact C-N 3.3Å; G314-I316 PolarHBondContact O-N 3Å; I316-R319 PolarHBondContact O-N 2.8Å; I316-L320 WeakPolarHBondContact O-CB 3.41Å; I316-L320 PolarHBondContact O-N 2.91Å
317	T	87.3	Confident	90	Very high	57 Å²	57	51.9 Å²	51.9	35%	0.35	25%	0.254	S	S	.	.	H	α-helix	trans	-66.4	-44.3	-178.8	-58.2	0	0	0	0	110.6	N282 L313 G314 L320 L321	N282-T317 PolarHBondContact ND2-OG1 3.05Å; L313-T317 VanDerWaalsContact O-CB 3.29Å; L313-T317 WeakPolarHBondContact O-CB 3.37Å; L313-T317 PolarHBondContact O-N 3.27Å; L313-T317 PolarHBondContact O-OG1 3.24Å; G314-T317 PolarHBondContact O-N 3.12Å; G314-T317 VanDerWaalsContact O-N 3.09Å; T317-L320 PolarHBondContact O-N 3.38Å; T317-L321 WeakPolarHBondContact O-CB 3.49Å; T317-L321 PolarHBondContact O-N 3.24Å
318	E	87.5	Confident	89.4	Confident	137 Å²	137	49.1 Å²	49.1	64%	0.64	24%	0.237	S	C	*	.	H	α-helix	trans	-61.7	-45.2	174.3	-173.8	177.8	178.7	0	0	110.9	G314 L320 L321 Y322	G314-E318 PolarHBondContact O-N 3.39Å; E318-L320 VanDerWaalsContact C-N 3.34Å; E318-L320 PolarHBondContact O-N 2.96Å; E318-L321 PolarHBondContact O-N 3.42Å; E318-Y322 WeakPolarHBondContact O-CB 3.12Å; E318-Y322 PolarHBondContact O-N 3.37Å
319	R	92.1	Very high	88.9	Confident	48 Å²	48	56.5 Å²	56.5	18%	0.181	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-41.2	177	-176.7	59	-179.4	-178.5	-4.2	112.3	I270 V272 L278 D315 I316 Y322 R323	I270-R319 PolarHBondContact O-NE 3.31Å; I270-R319 VanDerWaalsContact O-NE 3.17Å; I270-R319 PolarHBondContact O-NH1 3.39Å; I270-R319 PolarHBondContact O-NH2 3.11Å; V272-R319 PolarHBondContact O-NE 3.24Å; V272-R319 VanDerWaalsContact O-NE 3.07Å; V272-R319 PolarHBondContact O-NH2 3.43Å; L278-R319 HydrophobicContact CD1-CG 3.87Å; L278-R319 HydrophobicContact CD2-CB 4.15Å; L278-R319 HydrophobicContact CD2-CG 3.71Å; L278-R319 HydrophobicContact CG-CG 4.46Å; D315-R319 WeakPolarHBondContact O-CB 3.35Å; D315-R319 PolarHBondContact O-N 3.45Å; I316-R319 PolarHBondContact O-N 2.8Å; R319-Y322 PolarHBondContact O-N 2.87Å; R319-R323 WeakPolarHBondContact O-CG 3.34Å; R319-R323 PolarHBondContact O-N 2.91Å
320	L	87.6	Confident	88.5	Confident	11 Å²	11	60 Å²	60	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-46.8	176.5	177.1	61.8	0	0	0	110.8	L275 L278 I279 I316 T317 E318 R323 A324 M367	L275-L320 HydrophobicContact CD1-CD1 3.42Å; L275-L320 VanDerWaalsContact CD1-CD1 3.42Å; L275-L320 HydrophobicContact CG-CD1 3.98Å; L278-L320 HydrophobicContact CB-CB 4.24Å; L278-L320 HydrophobicContact CB-CD1 3.81Å; I279-L320 HydrophobicContact CD1-CD1 4.35Å; I279-L320 HydrophobicContact CG1-CD1 3.54Å; I279-L320 HydrophobicContact CG1-CD2 4.2Å; I316-L320 WeakPolarHBondContact O-CB 3.41Å; I316-L320 PolarHBondContact O-N 2.91Å; T317-L320 PolarHBondContact O-N 3.38Å; E318-L320 VanDerWaalsContact C-N 3.34Å; E318-L320 PolarHBondContact O-N 2.96Å; L320-R323 PolarHBondContact O-N 3.29Å; L320-A324 WeakPolarHBondContact O-CB 3.12Å; L320-A324 PolarHBondContact O-N 3.39Å; L320-M367 HydrophobicContact CD2-CE 4.31Å; L320-M367 HydrophobicContact CD2-SD 3.53Å; L320-M367 VanDerWaalsContact CD2-SD 3.53Å; L320-M367 HydrophobicContact CG-CE 3.96Å; L320-M367 HydrophobicContact CG-SD 3.84Å
321	L	83.6	Confident	88	Confident	65 Å²	65	61.2 Å²	61.2	34%	0.34	29%	0.289	S	S	.	.	H	α-helix	trans	-58.4	-50.2	176.6	179	60.7	0	0	0	111.2	T317 E318 R323 A324 Q325 M367 V369	T317-L321 WeakPolarHBondContact O-CB 3.49Å; T317-L321 PolarHBondContact O-N 3.24Å; E318-L321 PolarHBondContact O-N 3.42Å; L321-R323 PolarHBondContact O-N 2.77Å; L321-A324 PolarHBondContact O-N 3.12Å; L321-Q325 HydrophobicContact CD1-CG 4.26Å; L321-Q325 WeakPolarHBondContact O-CB 3.34Å; L321-Q325 WeakPolarHBondContact O-CG 3.45Å; L321-Q325 PolarHBondContact O-N 2.86Å; L321-M367 HydrophobicContact CB-CE 3.89Å; L321-M367 HydrophobicContact CD1-CE 3.92Å; L321-V369 HydrophobicContact CD1-CG2 3.55Å
322	Y	88.3	Confident	87.5	Confident	123 Å²	123	60 Å²	60	48%	0.482	29%	0.285	S	S	.	.	H	α-helix	trans	-58.1	-47.5	178.6	173.9	-101.4	0	0	0	112.4	E318 R319 Q325 L326	E318-Y322 WeakPolarHBondContact O-CB 3.12Å; E318-Y322 PolarHBondContact O-N 3.37Å; R319-Y322 PolarHBondContact O-N 2.87Å; Y322-Q325 PolarHBondContact O-N 3.42Å; Y322-L326 WeakPolarHBondContact O-CB 3.3Å; Y322-L326 PolarHBondContact O-N 3.41Å
323	R	88.2	Confident	86.7	Confident	64 Å²	64	61.7 Å²	61.7	24%	0.242	30%	0.302	C	S	.	.	H	α-helix	trans	-67.8	-37.9	179.7	-68.3	-61.6	-66.6	173.8	-1.1	112.2	Q273 L275 L278 R319 L320 L321 L326 Y327	Q273-R323 VanDerWaalsContact O-CZ 3.29Å; Q273-R323 PolarHBondContact O-NE 3.47Å; Q273-R323 PolarHBondContact O-NH2 3.19Å; L275-R323 HydrophobicContact CD1-CB 4.07Å; L278-R323 HydrophobicContact CD1-CB 4.14Å; L278-R323 HydrophobicContact CD1-CG 3.84Å; R319-R323 WeakPolarHBondContact O-CG 3.34Å; R319-R323 PolarHBondContact O-N 2.91Å; L320-R323 PolarHBondContact O-N 3.29Å; L321-R323 PolarHBondContact O-N 2.77Å; R323-L326 PolarHBondContact O-N 3.37Å; R323-Y327 WeakPolarHBondContact O-CB 3.34Å; R323-Y327 PolarHBondContact O-N 3.48Å
324	A	84.4	Confident	86.3	Confident	12 Å²	12	65.2 Å²	65.2	10%	0.099	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-42.6	177.1	0	0	0	0	0	111.8	L275 L320 L321 Y327 A328 V369	L275-A324 HydrophobicContact CD1-CB 3.91Å; L320-A324 WeakPolarHBondContact O-CB 3.12Å; L320-A324 PolarHBondContact O-N 3.39Å; L321-A324 PolarHBondContact O-N 3.12Å; A324-Y327 PolarHBondContact O-N 2.93Å; A324-A328 WeakPolarHBondContact O-CB 3.47Å; A324-A328 PolarHBondContact O-N 3.14Å; A324-V369 HydrophobicContact CB-CB 4.35Å; A324-V369 HydrophobicContact CB-CG1 3.9Å; A324-V369 HydrophobicContact CB-CG2 3.88Å
325	Q	84.3	Confident	86.1	Confident	75 Å²	75	68.7 Å²	68.7	35%	0.35	32%	0.323	S	S	.	.	H	α-helix	trans	-64.3	-42.5	174.4	-75.1	178.4	-31.9	0	0	112	L321 Y322 Y327 A328 R329 E372	L321-Q325 HydrophobicContact CD1-CG 4.26Å; L321-Q325 WeakPolarHBondContact O-CB 3.34Å; L321-Q325 WeakPolarHBondContact O-CG 3.45Å; L321-Q325 PolarHBondContact O-N 2.86Å; Y322-Q325 PolarHBondContact O-N 3.42Å; Q325-Y327 VanDerWaalsContact C-N 3.34Å; Q325-Y327 PolarHBondContact O-N 3.43Å; Q325-A328 PolarHBondContact O-N 3.03Å; Q325-R329 WeakPolarHBondContact O-CB 3.4Å; Q325-R329 PolarHBondContact O-N 2.86Å; Q325-E372 PolarHBondContact NE2-OE2 3.43Å
326	L	86	Confident	85.6	Confident	48 Å²	48	75 Å²	75	25%	0.251	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-42.8	176.3	-175.8	65.1	0	0	0	111.6	Y322 R323 R329 N330	Y322-L326 WeakPolarHBondContact O-CB 3.3Å; Y322-L326 PolarHBondContact O-N 3.41Å; R323-L326 PolarHBondContact O-N 3.37Å; L326-R329 PolarHBondContact O-N 3.34Å; L326-N330 WeakPolarHBondContact CD1-ND2 3.44Å; L326-N330 WeakPolarHBondContact O-CB 3.29Å; L326-N330 VanDerWaalsContact O-CG 3.25Å; L326-N330 PolarHBondContact O-N 2.99Å
327	Y	85.7	Confident	85.3	Confident	140 Å²	140	76 Å²	76	55%	0.549	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-50.4	174.4	-177.6	-86.5	0	0	0	111.1	R323 A324 Q325 R329 N330 E331	R323-Y327 WeakPolarHBondContact O-CB 3.34Å; R323-Y327 PolarHBondContact O-N 3.48Å; A324-Y327 PolarHBondContact O-N 2.93Å; Q325-Y327 VanDerWaalsContact C-N 3.34Å; Q325-Y327 PolarHBondContact O-N 3.43Å; Y327-R329 VanDerWaalsContact C-N 3.3Å; Y327-R329 PolarHBondContact O-N 3.15Å; Y327-N330 PolarHBondContact O-N 2.99Å; Y327-E331 HydrophobicContact CD1-CB 4.38Å; Y327-E331 HydrophobicContact CD1-CG 4.4Å; Y327-E331 HydrophobicContact CD2-CG 3.74Å; Y327-E331 HydrophobicContact CE1-CB 4.1Å; Y327-E331 HydrophobicContact CE1-CG 4.26Å; Y327-E331 HydrophobicContact CE2-CB 4.32Å; Y327-E331 HydrophobicContact CE2-CG 3.62Å; Y327-E331 HydrophobicContact CG-CG 4.14Å; Y327-E331 VanDerWaalsContact O-CB 3.31Å; Y327-E331 WeakPolarHBondContact O-CB 3.45Å; Y327-E331 PolarHBondContact O-N 2.78Å
328	A	83.1	Confident	85	Confident	4 Å²	4	75 Å²	75	3%	0.033	36%	0.359	C	S	.	.	I	π-helix	trans	-58.4	-42.9	178.1	0	0	0	0	0	111.7	A324 Q325 I332 G333 A373 M376	A324-A328 WeakPolarHBondContact O-CB 3.47Å; A324-A328 PolarHBondContact O-N 3.14Å; Q325-A328 PolarHBondContact O-N 3.03Å; A328-I332 HydrophobicContact CB-CD1 4.33Å; A328-I332 WeakPolarHBondContact O-CA 3.44Å; A328-I332 WeakPolarHBondContact O-CB 3.39Å; A328-I332 PolarHBondContact O-N 3.37Å; A328-I332 VanDerWaalsContact O-N 3.07Å; A328-G333 PolarHBondContact O-N 3.47Å; A328-A373 HydrophobicContact CB-CB 4.14Å; A328-M376 HydrophobicContact CB-SD 3.96Å
329	R	85.2	Confident	84.8	Confident	157 Å²	157	75.1 Å²	75.1	59%	0.592	37%	0.37	S	S	*	.	I	π-helix	trans	-65	-46.5	178.2	-175.9	178	179.7	177.9	-1.3	112.5	Q325 L326 Y327 G333 N334	Q325-R329 WeakPolarHBondContact O-CB 3.4Å; Q325-R329 PolarHBondContact O-N 2.86Å; L326-R329 PolarHBondContact O-N 3.34Å; Y327-R329 VanDerWaalsContact C-N 3.3Å; Y327-R329 PolarHBondContact O-N 3.15Å; R329-G333 PolarHBondContact O-N 2.96Å; R329-N334 WeakPolarHBondContact O-CB 3.49Å; R329-N334 PolarHBondContact O-N 3.01Å
330	N	87.7	Confident	84.2	Confident	73 Å²	73	75 Å²	75	39%	0.39	38%	0.383	S	S	.	.	I	π-helix	trans	-79.3	-45	-172.9	-68	-7.7	0	0	0	112.4	L326 Y327	L326-N330 WeakPolarHBondContact CD1-ND2 3.44Å; L326-N330 WeakPolarHBondContact O-CB 3.29Å; L326-N330 VanDerWaalsContact O-CG 3.25Å; L326-N330 PolarHBondContact O-N 2.99Å; Y327-N330 PolarHBondContact O-N 2.99Å
331	E	84.5	Confident	84	Confident	109 Å²	109	77.1 Å²	77.1	51%	0.509	40%	0.395	S	S	.	.	I	π-helix	trans	-90.2	-21.1	-173.1	-57.1	-60.9	137.9	0	0	113	Y327	Y327-E331 HydrophobicContact CD1-CB 4.38Å; Y327-E331 HydrophobicContact CD1-CG 4.4Å; Y327-E331 HydrophobicContact CD2-CG 3.74Å; Y327-E331 HydrophobicContact CE1-CB 4.1Å; Y327-E331 HydrophobicContact CE1-CG 4.26Å; Y327-E331 HydrophobicContact CE2-CB 4.32Å; Y327-E331 HydrophobicContact CE2-CG 3.62Å; Y327-E331 HydrophobicContact CG-CG 4.14Å; Y327-E331 VanDerWaalsContact O-CB 3.31Å; Y327-E331 WeakPolarHBondContact O-CB 3.45Å; Y327-E331 PolarHBondContact O-N 2.78Å
332	I	84.8	Confident	84	Confident	43 Å²	43	75.6 Å²	75.6	22%	0.221	39%	0.387	C	S	.	.	I	π-helix	trans	-114.9	-58.3	-178.2	-47	175.7	0	0	0	110.8	A328 Y335 A373 M376 C377 S380	A328-I332 HydrophobicContact CB-CD1 4.33Å; A328-I332 WeakPolarHBondContact O-CA 3.44Å; A328-I332 WeakPolarHBondContact O-CB 3.39Å; A328-I332 PolarHBondContact O-N 3.37Å; A328-I332 VanDerWaalsContact O-N 3.07Å; I332-Y335 WeakPolarHBondContact O-CB 3.33Å; I332-Y335 PolarHBondContact O-N 3.26Å; I332-A373 HydrophobicContact CD1-CB 4.31Å; I332-M376 HydrophobicContact CB-CB 4.48Å; I332-M376 HydrophobicContact CG2-CB 4.11Å; I332-C377 VanDerWaalsContact CG2-CA 3.48Å; I332-C377 HydrophobicContact CG2-CB 3.79Å; I332-S380 PolarHBondContact O-OG 3.23Å
333	G	78.4	Confident	83.8	Confident	36 Å²	36	71.5 Å²	71.5	37%	0.371	38%	0.378	S	S	.	.	I	π-helix	trans	-67.1	-41.2	-172.8	0	0	0	0	0	113.9	A328 R329	A328-G333 PolarHBondContact O-N 3.47Å; R329-G333 PolarHBondContact O-N 2.96Å
334	N	83.1	Confident	83.5	Confident	101 Å²	101	69.3 Å²	69.3	54%	0.54	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	12.8	179	-67.6	-15.8	0	0	0	113	R329 E336	R329-N334 WeakPolarHBondContact O-CB 3.49Å; R329-N334 PolarHBondContact O-N 3.01Å; N334-E336 PolarHBondContact O-N 2.94Å; N334-E336 VanDerWaalsContact O-N 3.15Å
335	Y	85.4	Confident	83.4	Confident	111 Å²	111	69.4 Å²	69.4	44%	0.435	37%	0.37	S	S	.	.			trans	-63	118.9	-179.1	-174.8	-101.1	0	0	0	110.6	I332 P337 D341	I332-Y335 WeakPolarHBondContact O-CB 3.33Å; I332-Y335 PolarHBondContact O-N 3.26Å; Y335-P337 HydrophobicContact CD1-CB 4.48Å; Y335-P337 HydrophobicContact CE1-CB 4.08Å; Y335-P337 WeakPolarHBondContact O-CD 3.02Å; Y335-D341 PolarHBondContact OH-OD2 3.34Å
336	E	81.6	Confident	83.3	Confident	160 Å²	160	69.2 Å²	69.2	75%	0.748	37%	0.369	S	S	*	.			trans	-94.1	112.3	171.3	-69.5	-166.1	161.5	0	0	109.4	N334 G338	N334-E336 PolarHBondContact O-N 2.94Å; N334-E336 VanDerWaalsContact O-N 3.15Å; E336-G338 PolarHBondContact O-N 3.46Å
337	P	82.2	Confident	83	Confident	22 Å²	22	70 Å²	70	14%	0.143	37%	0.37	C	S	.	.			trans	-67.6	127.5	-179.1	27.4	-34.4	0	0	0	110.6	Y335 D341 L342	Y335-P337 HydrophobicContact CD1-CB 4.48Å; Y335-P337 HydrophobicContact CE1-CB 4.08Å; Y335-P337 WeakPolarHBondContact O-CD 3.02Å; P337-D341 HydrophobicContact CB-CB 4.11Å; P337-L342 HydrophobicContact CB-CD1 4.25Å; P337-L342 HydrophobicContact CB-CD2 3.79Å; P337-L342 HydrophobicContact CB-CG 3.92Å; P337-L342 HydrophobicContact CG-CD1 4.09Å; P337-L342 HydrophobicContact CG-CD2 4.02Å; P337-L342 HydrophobicContact CG-CG 4.25Å
338	G	82.2	Confident	82.7	Confident	36 Å²	36	63.8 Å²	63.8	37%	0.371	35%	0.347	S	S	.	.			trans	-71.3	168.6	173.7	0	0	0	0	0	111.9	E336 G340 D341 L342	E336-G338 PolarHBondContact O-N 3.46Å; G338-G340 PolarHBondContact O-N 3.32Å; G338-D341 PolarHBondContact N-OD2 3.45Å; G338-D341 WeakPolarHBondContact O-CB 3.38Å; G338-D341 PolarHBondContact O-N 3.24Å; G338-L342 PolarHBondContact O-N 3.22Å
339	T	82	Confident	82.6	Confident	140 Å²	140	68.2 Å²	68.2	86%	0.859	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.1	179.1	51.5	0	0	0	0	112.7	A343	T339-A343 PolarHBondContact O-N 2.93Å
340	G	81	Confident	82	Confident	45 Å²	45	67.4 Å²	67.4	46%	0.464	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-18.5	175.4	0	0	0	0	0	115	G338 K347	G338-G340 PolarHBondContact O-N 3.32Å; G340-K347 PolarHBondContact O-NZ 3.34Å
341	D	82.9	Confident	81	Confident	56 Å²	56	68.4 Å²	68.4	30%	0.299	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-28.5	175.1	-64.1	-36.5	0	0	0	111.9	Y335 P337 G338 Y344	Y335-D341 PolarHBondContact OH-OD2 3.34Å; P337-D341 HydrophobicContact CB-CB 4.11Å; G338-D341 PolarHBondContact N-OD2 3.45Å; G338-D341 WeakPolarHBondContact O-CB 3.38Å; G338-D341 PolarHBondContact O-N 3.24Å; D341-Y344 WeakPolarHBondContact O-CE2 3.41Å
342	L	84.1	Confident	79.8	Confident	33 Å²	33	68 Å²	68	17%	0.173	37%	0.374	C	S	.	.	S	Bend	trans	-97.2	1.8	-177.6	-58.2	179.3	0	0	0	113.8	P337 G338 Y344 A384 R387 I388	P337-L342 HydrophobicContact CB-CD1 4.25Å; P337-L342 HydrophobicContact CB-CD2 3.79Å; P337-L342 HydrophobicContact CB-CG 3.92Å; P337-L342 HydrophobicContact CG-CD1 4.09Å; P337-L342 HydrophobicContact CG-CD2 4.02Å; P337-L342 HydrophobicContact CG-CG 4.25Å; G338-L342 PolarHBondContact O-N 3.22Å; L342-Y344 PolarHBondContact O-N 3.37Å; L342-A384 HydrophobicContact CD2-CB 4.09Å; L342-R387 HydrophobicContact CD1-CB 4.01Å; L342-I388 HydrophobicContact CD2-CD1 4.31Å; L342-I388 HydrophobicContact CD2-CG1 4.19Å
343	A	83.4	Confident	78.3	Confident	37 Å²	37	71.2 Å²	71.2	31%	0.306	40%	0.395	S	S	.	.			trans	-73.7	54.9	-177.7	0	0	0	0	0	113	T339 E346 K347	T339-A343 PolarHBondContact O-N 2.93Å; A343-E346 PolarHBondContact O-N 3.28Å; A343-K347 WeakPolarHBondContact O-CB 3.22Å; A343-K347 PolarHBondContact O-N 3.44Å
344	Y	82.4	Confident	76.4	Confident	17 Å²	17	74.9 Å²	74.9	7%	0.067	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	139.6	173.5	-74.8	-98.2	0	0	0	109.5	D341 L342 E346 K347 L348 I388 K392 F400 H404 Y550	D341-Y344 WeakPolarHBondContact O-CE2 3.41Å; L342-Y344 PolarHBondContact O-N 3.37Å; Y344-E346 VanDerWaalsContact C-OE2 3.23Å; Y344-K347 HydrophobicContact CE2-CD 4.14Å; Y344-L348 HydrophobicContact CD1-CD1 3.84Å; Y344-L348 HydrophobicContact CD1-CD2 4.4Å; Y344-L348 HydrophobicContact CD1-CG 3.81Å; Y344-L348 HydrophobicContact CE1-CD1 3.96Å; Y344-L348 HydrophobicContact CE1-CD2 3.82Å; Y344-L348 HydrophobicContact CE1-CG 3.76Å; Y344-I388 HydrophobicContact CD2-CD1 4.31Å; Y344-K392 WeakPolarHBondContact O-CG 3.1Å; Y344-F400 HydrophobicContact CD1-CD2 4.07Å; Y344-F400 AromaticContact CD2-CD2 3.69Å; Y344-F400 HydrophobicContact CD2-CD2 3.69Å; Y344-F400 AromaticContact CD2-CE2 3.85Å; Y344-F400 HydrophobicContact CD2-CE2 3.85Å; Y344-F400 HydrophobicContact CE1-CD2 4.05Å; Y344-F400 AromaticContact CE2-CD2 3.7Å; Y344-F400 HydrophobicContact CE2-CD2 3.7Å; Y344-F400 AromaticContact CE2-CE2 3.51Å; Y344-F400 HydrophobicContact CE2-CE2 3.51Å; Y344-F400 AromaticContact CG-CD2 3.9Å; Y344-F400 HydrophobicContact CG-CD2 3.9Å; Y344-F400 HydrophobicContact CG-CE2 4.5Å; Y344-F400 AromaticContact CZ-CD2 3.9Å; Y344-F400 AromaticContact CZ-CE2 3.89Å; Y344-H404 AromaticContact CZ-CE1 3.71Å; Y344-H404 PolarHBondContact OH-CE1 3.37Å; Y344-H404 PolarHBondContact OH-NE2 3.25Å; Y344-Y550 AromaticContact CD1-CE1 3.74Å; Y344-Y550 HydrophobicContact CD1-CE1 3.74Å; Y344-Y550 HydrophobicContact CE1-CE1 4.48Å
345	P	81.4	Confident	74.2	Confident	15 Å²	15	78 Å²	78	10%	0.097	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	cis	-86	-5.4	5.5	34	-35.3	0	0	0	115.5	K347 L348 E349 L549 Y550	P345-K347 VanDerWaalsContact C-N 3.25Å; P345-K347 PolarHBondContact O-N 2.87Å; P345-K347 VanDerWaalsContact O-N 3.13Å; P345-L348 WeakPolarHBondContact O-CB 3.37Å; P345-L348 PolarHBondContact O-N 3.21Å; P345-E349 PolarHBondContact O-N 2.87Å; P345-L549 HydrophobicContact CB-CD2 3.84Å; P345-Y550 HydrophobicContact CB-CE2 4.06Å
346	E	83.3	Confident	71.7	Confident	70 Å²	70	82.5 Å²	82.5	33%	0.327	43%	0.433	S	S	.	.	H	α-helix	trans	-56.7	-36.5	-170	-63.6	80.3	-176.4	0	0	113.2	A343 Y344 L348 E349 M350 K392	A343-E346 PolarHBondContact O-N 3.28Å; Y344-E346 VanDerWaalsContact C-OE2 3.23Å; E346-L348 VanDerWaalsContact C-N 3.28Å; E346-L348 PolarHBondContact O-N 2.91Å; E346-E349 PolarHBondContact O-N 3.01Å; E346-M350 WeakPolarHBondContact O-CG 3.38Å; E346-M350 PolarHBondContact O-N 3.19Å; E346-K392 WeakPolarHBondContact OE1-CE 3.3Å; E346-K392 IonicContact OE1-NZ 3.75Å; E346-K392 PolarHBondContact OE1-NZ 3.44Å; E346-K392 IonicContact OE2-NZ 3.71Å
347	K	79.7	Confident	69.3	Low	64 Å²	64	82.9 Å²	82.9	28%	0.278	44%	0.435	S	S	.	.	H	α-helix	trans	-60.3	-36.3	175.5	-176.4	174.1	-172.9	171	0	112.3	G340 A343 Y344 P345 I351	G340-K347 PolarHBondContact O-NZ 3.34Å; A343-K347 WeakPolarHBondContact O-CB 3.22Å; A343-K347 PolarHBondContact O-N 3.44Å; Y344-K347 HydrophobicContact CE2-CD 4.14Å; P345-K347 VanDerWaalsContact C-N 3.25Å; P345-K347 PolarHBondContact O-N 2.87Å; P345-K347 VanDerWaalsContact O-N 3.13Å; K347-I351 HydrophobicContact CG-CD1 3.94Å; K347-I351 WeakPolarHBondContact O-CD1 3.14Å; K347-I351 WeakPolarHBondContact O-CG1 3.3Å; K347-I351 PolarHBondContact O-N 3.2Å; K347-I351 VanDerWaalsContact O-N 3.11Å
348	L	79.4	Confident	67.1	Low	11 Å²	11	87.8 Å²	87.8	6%	0.058	46%	0.464	C	S	.	.	H	α-helix	trans	-75	-38.9	178.6	-63	-177.6	0	0	0	111.6	Y344 P345 E346 M350 I351 Q352 K403 L549 Y550	Y344-L348 HydrophobicContact CD1-CD1 3.84Å; Y344-L348 HydrophobicContact CD1-CD2 4.4Å; Y344-L348 HydrophobicContact CD1-CG 3.81Å; Y344-L348 HydrophobicContact CE1-CD1 3.96Å; Y344-L348 HydrophobicContact CE1-CD2 3.82Å; Y344-L348 HydrophobicContact CE1-CG 3.76Å; P345-L348 WeakPolarHBondContact O-CB 3.37Å; P345-L348 PolarHBondContact O-N 3.21Å; E346-L348 VanDerWaalsContact C-N 3.28Å; E346-L348 PolarHBondContact O-N 2.91Å; L348-M350 VanDerWaalsContact C-N 3.27Å; L348-M350 PolarHBondContact O-N 3.41Å; L348-I351 PolarHBondContact O-N 2.9Å; L348-Q352 PolarHBondContact O-N 3.49Å; L348-K403 HydrophobicContact CD1-CD 4.4Å; L348-L549 HydrophobicContact CB-CD1 3.83Å; L348-L549 HydrophobicContact CB-CG 3.98Å; L348-L549 HydrophobicContact CD1-CG 4.35Å; L348-Y550 HydrophobicContact CD1-CD1 3.63Å; L348-Y550 HydrophobicContact CD1-CD2 3.97Å; L348-Y550 HydrophobicContact CD1-CE1 3.86Å; L348-Y550 HydrophobicContact CD1-CE2 4.22Å; L348-Y550 HydrophobicContact CD1-CG 3.7Å
349	E	80.1	Confident	64.4	Low	96 Å²	96	94.6 Å²	94.6	45%	0.449	49%	0.486	S	S	.	.	H	α-helix	trans	-61.3	-39.3	175	-62.7	172.9	174.1	0	0	110.9	P345 E346 L549	P345-E349 PolarHBondContact O-N 2.87Å; E346-E349 PolarHBondContact O-N 3.01Å; E349-L549 HydrophobicContact CG-CD1 4.19Å; E349-L549 HydrophobicContact CG-CD2 3.95Å
350	M	71.6	Confident	62.3	Low	141 Å²	141	92.2 Å²	92.2	70%	0.695	47%	0.471	S	S	*	.	H	α-helix	trans	-68.6	-37.6	174	-72.4	-176.7	58.1	0	0	113.6	E346 L348 V353	E346-M350 WeakPolarHBondContact O-CG 3.38Å; E346-M350 PolarHBondContact O-N 3.19Å; L348-M350 VanDerWaalsContact C-N 3.27Å; L348-M350 PolarHBondContact O-N 3.41Å; M350-V353 WeakPolarHBondContact O-CB 3.28Å; M350-V353 PolarHBondContact O-N 3.14Å
351	I	67.3	Low	59.9	Low	93 Å²	93	94.9 Å²	94.9	48%	0.477	48%	0.48	S	S	.	.	H	α-helix	trans	-75.2	-30.8	-178.2	-69.9	165.4	0	0	0	112.1	K347 L348 V353 N354	K347-I351 HydrophobicContact CG-CD1 3.94Å; K347-I351 WeakPolarHBondContact O-CD1 3.14Å; K347-I351 WeakPolarHBondContact O-CG1 3.3Å; K347-I351 PolarHBondContact O-N 3.2Å; K347-I351 VanDerWaalsContact O-N 3.11Å; L348-I351 PolarHBondContact O-N 2.9Å; I351-V353 PolarHBondContact O-N 2.99Å; I351-N354 CarbonylContact O-C 3.58Å; I351-N354 PolarHBondContact O-N 3.11Å
352	Q	59.5	Low	57.7	Low	101 Å²	101	96.3 Å²	96.3	47%	0.472	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-20.3	174.3	-79.4	-171.1	-16.7	0	0	112.8	L348 L549	L348-Q352 PolarHBondContact O-N 3.49Å; Q352-L549 HydrophobicContact CG-CD1 4.29Å
353	V	52.8	Low	55.4	Low	111 Å²	111	101.8 Å²	101.8	67%	0.673	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-22.8	176.1	-172.4	0	0	0	0	112.9	M350 I351	M350-V353 WeakPolarHBondContact O-CB 3.28Å; M350-V353 PolarHBondContact O-N 3.14Å; I351-V353 PolarHBondContact O-N 2.99Å
354	N	40.1	Very low	53.2	Low	113 Å²	113	108.8 Å²	108.8	60%	0.604	55%	0.551	S	S	*	*	S	Bend	trans	-133.1	85.5	-173.2	-67.7	-40.9	0	0	0	111.6	I351 Y356	I351-N354 CarbonylContact O-C 3.58Å; I351-N354 PolarHBondContact O-N 3.11Å; N354-Y356 PolarHBondContact O-N 3.26Å
355	F	35.6	Very low	51.4	Low	166 Å²	166	114.5 Å²	114.5	73%	0.728	57%	0.573	S	S	*	*			trans	-67.9	108.6	175.8	-87.9	-94.4	0	0	0	111.8
356	Y	33.6	Very low	49.7	Very low	205 Å²	205	122.9 Å²	122.9	80%	0.804	60%	0.603	S	S	*	*			trans	-131	113.8	155.5	-69.5	-75.8	0	0	0	110.3	N354 V358	N354-Y356 PolarHBondContact O-N 3.26Å; Y356-V358 PolarHBondContact O-N 3.46Å
357	H	31.7	Very low	48	Very low	169 Å²	169	122.8 Å²	122.8	78%	0.782	60%	0.603	S	S	*	*			trans	-68.5	106.2	164.4	-73.1	-74.6	0	0	0	108.8	Q359	H357-Q359 PolarHBondContact O-N 2.98Å
358	V	34.4	Very low	46.4	Very low	124 Å²	124	125 Å²	125	75%	0.752	63%	0.625	S	S	*	*			trans	-80	98.8	166.3	-178.8	0	0	0	0	107.6	Y356 V360	Y356-V358 PolarHBondContact O-N 3.46Å; V358-V360 HydrophobicContact CG1-CG2 4.13Å
359	Q	26.2	Very low	45	Very low	180 Å²	180	125.3 Å²	125.3	84%	0.841	63%	0.628	S	S	*	*			trans	-77.4	114.4	163.4	-69.8	-179.4	-10.8	0	0	107.9	H357	H357-Q359 PolarHBondContact O-N 2.98Å
360	V	38.2	Very low	44.4	Very low	89 Å²	89	122.9 Å²	122.9	54%	0.539	62%	0.624	S	S	.	*			trans	-87.6	125.9	170.6	-174.3	0	0	0	0	108	V358 A362	V358-V360 HydrophobicContact CG1-CG2 4.13Å; V360-A362 PolarHBondContact O-N 3.42Å
361	P	30.1	Very low	44.3	Very low	102 Å²	102	120 Å²	120	66%	0.662	61%	0.606	S	S	*	*			trans	-57.3	136.1	178.2	-22.8	31.8	0	0	0	112.2	E363	P361-E363 PolarHBondContact O-N 3.43Å
362	A	36.3	Very low	44.5	Very low	86 Å²	86	119.5 Å²	119.5	71%	0.711	60%	0.602	S	S	*	*			trans	-86.6	95.1	176.5	0	0	0	0	0	109.6	V360	V360-A362 PolarHBondContact O-N 3.42Å
363	E	36.7	Very low	45.3	Very low	148 Å²	148	115.7 Å²	115.7	69%	0.692	59%	0.587	S	S	*	*			trans	-108.3	146.9	167.7	-83.2	176.2	175.5	0	0	112.2	P361 Y365	P361-E363 PolarHBondContact O-N 3.43Å; E363-Y365 HydrophobicContact CB-CE2 4.41Å; E363-Y365 PolarHBondContact O-N 2.96Å
364	Q	37.3	Very low	46.4	Very low	183 Å²	183	110.9 Å²	110.9	86%	0.855	56%	0.558	S	S	*	*			trans	-88.2	101.7	-152.6	-179.5	173.7	8.7	0	0	111.8
365	Y	43.4	Very low	48.4	Very low	138 Å²	138	107 Å²	107	54%	0.541	54%	0.538	S	S	.	.			trans	-134.7	114.3	172.4	-64.3	-63.2	0	0	0	113.3	I279 E363	I279-Y365 HydrophobicContact CB-CE1 4.26Å; I279-Y365 HydrophobicContact CD1-CD2 4.46Å; I279-Y365 HydrophobicContact CD1-CG 4.37Å; I279-Y365 HydrophobicContact CG2-CD1 3.32Å; I279-Y365 HydrophobicContact CG2-CD2 4.23Å; I279-Y365 HydrophobicContact CG2-CE1 2.82Å; I279-Y365 HydrophobicContact CG2-CE2 3.76Å; I279-Y365 HydrophobicContact CG2-CG 4.04Å; I279-Y365 VanDerWaalsContact CG2-OH 3.26Å; I279-Y365 WeakPolarHBondContact CG2-OH 3.48Å; E363-Y365 HydrophobicContact CB-CE2 4.41Å; E363-Y365 PolarHBondContact O-N 2.96Å
366	R	47.1	Very low	50.6	Low	190 Å²	190	100.9 Å²	100.9	72%	0.717	51%	0.512	S	S	*	.			trans	-89	110.4	175.7	-104.1	175.2	165.3	173.4	-4.1	108.7
367	M	46.1	Very low	53	Low	69 Å²	69	92.6 Å²	92.6	34%	0.34	48%	0.483	S	S	.	.			trans	-157.5	147.7	165.8	-124	167.2	94	0	0	114.2	L320 L321 V369 A370	L320-M367 HydrophobicContact CD2-CE 4.31Å; L320-M367 HydrophobicContact CD2-SD 3.53Å; L320-M367 VanDerWaalsContact CD2-SD 3.53Å; L320-M367 HydrophobicContact CG-CE 3.96Å; L320-M367 HydrophobicContact CG-SD 3.84Å; L321-M367 HydrophobicContact CB-CE 3.89Å; L321-M367 HydrophobicContact CD1-CE 3.92Å; M367-V369 HydrophobicContact CB-CG2 4.43Å; M367-V369 HydrophobicContact CE-CG2 3.52Å; M367-V369 PolarHBondContact O-N 3.08Å; M367-A370 WeakPolarHBondContact O-CB 3.47Å; M367-A370 PolarHBondContact O-N 3.48Å; M367-A370 VanDerWaalsContact O-N 3.09Å
368	C	46.2	Very low	55.4	Low	110 Å²	110	85.3 Å²	85.3	74%	0.743	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-17.8	177.2	-58.6	0	0	0	0	114.4	A370 Y371	C368-A370 PolarHBondContact O-N 3.5Å; C368-A370 VanDerWaalsContact O-N 3.14Å; C368-Y371 PolarHBondContact O-N 3.01Å
369	V	51.6	Low	57.9	Low	18 Å²	18	86.5 Å²	86.5	11%	0.109	45%	0.446	C	S	.	.	H	α-helix	trans	-61.5	-20	175.3	-169.1	0	0	0	0	112.2	L321 A324 M367 Y371 A373	L321-V369 HydrophobicContact CD1-CG2 3.55Å; A324-V369 HydrophobicContact CB-CB 4.35Å; A324-V369 HydrophobicContact CB-CG1 3.9Å; A324-V369 HydrophobicContact CB-CG2 3.88Å; M367-V369 HydrophobicContact CB-CG2 4.43Å; M367-V369 HydrophobicContact CE-CG2 3.52Å; M367-V369 PolarHBondContact O-N 3.08Å; V369-Y371 VanDerWaalsContact C-N 3.3Å; V369-Y371 PolarHBondContact O-N 3.42Å; V369-A373 WeakPolarHBondContact O-CB 3.09Å; V369-A373 PolarHBondContact O-N 3.05Å
370	A	66	Low	60.9	Low	44 Å²	44	79.3 Å²	79.3	36%	0.364	42%	0.415	S	S	.	.	H	α-helix	trans	-57.1	-40.6	178.6	0	0	0	0	0	112.8	M367 C368 V374 M416	M367-A370 WeakPolarHBondContact O-CB 3.47Å; M367-A370 PolarHBondContact O-N 3.48Å; M367-A370 VanDerWaalsContact O-N 3.09Å; C368-A370 PolarHBondContact O-N 3.5Å; C368-A370 VanDerWaalsContact O-N 3.14Å; A370-V374 VanDerWaalsContact O-CB 3.29Å; A370-V374 WeakPolarHBondContact O-CB 3.29Å; A370-V374 WeakPolarHBondContact O-CG2 3.45Å; A370-V374 PolarHBondContact O-N 2.94Å; A370-M416 HydrophobicContact CB-CE 4.13Å
371	Y	68.9	Low	63.3	Low	81 Å²	81	76.1 Å²	76.1	32%	0.318	40%	0.395	S	S	.	.	H	α-helix	trans	-69.2	-51.1	-177.2	178.4	-110.1	0	0	0	112.3	C368 V369 A373 V374 N375 I476	C368-Y371 PolarHBondContact O-N 3.01Å; V369-Y371 VanDerWaalsContact C-N 3.3Å; V369-Y371 PolarHBondContact O-N 3.42Å; Y371-A373 VanDerWaalsContact C-N 3.34Å; Y371-A373 PolarHBondContact O-N 2.92Å; Y371-V374 PolarHBondContact O-N 2.87Å; Y371-N375 WeakPolarHBondContact CE1-ND2 3.47Å; Y371-N375 PolarHBondContact O-N 3.43Å; Y371-N375 PolarHBondContact OH-ND2 3.17Å; Y371-I476 HydrophobicContact CD2-CB 4.4Å; Y371-I476 HydrophobicContact CD2-CG2 4.1Å; Y371-I476 HydrophobicContact CE1-CD1 3.93Å; Y371-I476 HydrophobicContact CE2-CB 3.95Å; Y371-I476 HydrophobicContact CE2-CD1 4.29Å; Y371-I476 HydrophobicContact CE2-CG2 3.27Å
372	E	71.6	Confident	66	Low	83 Å²	83	75.8 Å²	75.8	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-63	-41.9	-179.5	-174.8	171.7	-163.6	0	0	111.5	Q325 N375 M376	Q325-E372 PolarHBondContact NE2-OE2 3.43Å; E372-N375 PolarHBondContact O-N 2.98Å; E372-M376 HydrophobicContact CG-CE 3.7Å; E372-M376 HydrophobicContact CG-SD 4.41Å; E372-M376 WeakPolarHBondContact O-CG 3.4Å; E372-M376 PolarHBondContact O-N 3.34Å; E372-M376 WeakPolarHBondContact OE1-CE 3.25Å
373	A	76.2	Confident	68.5	Low	21 Å²	21	74.8 Å²	74.8	17%	0.174	37%	0.366	C	S	.	.	H	α-helix	trans	-63.7	-40.6	175.5	0	0	0	0	0	112.4	A328 I332 V369 Y371 M376 C377	A328-A373 HydrophobicContact CB-CB 4.14Å; I332-A373 HydrophobicContact CD1-CB 4.31Å; V369-A373 WeakPolarHBondContact O-CB 3.09Å; V369-A373 PolarHBondContact O-N 3.05Å; Y371-A373 VanDerWaalsContact C-N 3.34Å; Y371-A373 PolarHBondContact O-N 2.92Å; A373-M376 PolarHBondContact O-N 2.99Å; A373-C377 WeakPolarHBondContact O-CB 3.43Å; A373-C377 PolarHBondContact O-N 3.4Å
374	V	77.4	Confident	70.9	Confident	9 Å²	9	68.1 Å²	68.1	6%	0.055	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-44.8	174.7	166.5	0	0	0	0	110.5	A370 Y371 C377 V378 L408 I412 L482	A370-V374 VanDerWaalsContact O-CB 3.29Å; A370-V374 WeakPolarHBondContact O-CB 3.29Å; A370-V374 WeakPolarHBondContact O-CG2 3.45Å; A370-V374 PolarHBondContact O-N 2.94Å; Y371-V374 PolarHBondContact O-N 2.87Å; V374-C377 WeakPolarHBondContact O-CB 3.29Å; V374-C377 PolarHBondContact O-N 3.46Å; V374-V378 HydrophobicContact CG1-CG2 4.44Å; V374-V378 WeakPolarHBondContact O-CG2 3.35Å; V374-V378 PolarHBondContact O-N 2.72Å; V374-L408 HydrophobicContact CG1-CD2 4.39Å; V374-I412 HydrophobicContact CG2-CG2 3.98Å; V374-L482 HydrophobicContact CG1-CD1 4.47Å
375	N	80.7	Confident	73.4	Confident	33 Å²	33	60.8 Å²	60.8	18%	0.176	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-40.6	177.8	-77.9	-3.5	0	0	0	113.1	Y371 E372 C377 V378 K379	Y371-N375 WeakPolarHBondContact CE1-ND2 3.47Å; Y371-N375 PolarHBondContact O-N 3.43Å; Y371-N375 PolarHBondContact OH-ND2 3.17Å; E372-N375 PolarHBondContact O-N 2.98Å; N375-C377 VanDerWaalsContact C-N 3.29Å; N375-V378 PolarHBondContact O-N 3.26Å; N375-K379 WeakPolarHBondContact O-CB 3.45Å; N375-K379 WeakPolarHBondContact O-CG 3.16Å; N375-K379 PolarHBondContact O-N 3.44Å
376	M	81.9	Confident	75.5	Confident	37 Å²	37	61 Å²	61	18%	0.182	30%	0.302	C	S	.	.	H	α-helix	trans	-61.6	-41.2	173.4	-72.9	178.9	-179.1	0	0	110.9	A328 I332 E372 A373 K379 S380	A328-M376 HydrophobicContact CB-SD 3.96Å; I332-M376 HydrophobicContact CB-CB 4.48Å; I332-M376 HydrophobicContact CG2-CB 4.11Å; E372-M376 HydrophobicContact CG-CE 3.7Å; E372-M376 HydrophobicContact CG-SD 4.41Å; E372-M376 WeakPolarHBondContact O-CG 3.4Å; E372-M376 PolarHBondContact O-N 3.34Å; E372-M376 WeakPolarHBondContact OE1-CE 3.25Å; A373-M376 PolarHBondContact O-N 2.99Å; M376-K379 PolarHBondContact O-N 3.49Å; M376-S380 WeakPolarHBondContact O-CB 3.33Å; M376-S380 PolarHBondContact O-N 2.61Å
377	C	83.9	Confident	77.5	Confident	30 Å²	30	56.3 Å²	56.3	20%	0.203	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-48.3	175.8	-174.1	0	0	0	0	111.6	I332 A373 V374 N375 K379 S380 L381 L408	I332-C377 VanDerWaalsContact CG2-CA 3.48Å; I332-C377 HydrophobicContact CG2-CB 3.79Å; A373-C377 WeakPolarHBondContact O-CB 3.43Å; A373-C377 PolarHBondContact O-N 3.4Å; V374-C377 WeakPolarHBondContact O-CB 3.29Å; V374-C377 PolarHBondContact O-N 3.46Å; N375-C377 VanDerWaalsContact C-N 3.29Å; C377-K379 VanDerWaalsContact C-N 3.33Å; C377-K379 PolarHBondContact O-N 3.4Å; C377-S380 WeakPolarHBondContact O-CB 3.49Å; C377-S380 PolarHBondContact O-N 3.16Å; C377-L381 VanDerWaalsContact O-CG 3.31Å; C377-L381 WeakPolarHBondContact O-CG 3.42Å; C377-L381 PolarHBondContact O-N 3.42Å; C377-L408 HydrophobicContact CB-CD2 4.23Å
378	V	83.7	Confident	79.5	Confident	17 Å²	17	53 Å²	53	10%	0.103	27%	0.268	C	S	.	.	H	α-helix	trans	-58.8	-44.4	177.3	172.7	0	0	0	0	111.1	V374 N375 S380 L381 M382 L405 L408 L482 T485	V374-V378 HydrophobicContact CG1-CG2 4.44Å; V374-V378 WeakPolarHBondContact O-CG2 3.35Å; V374-V378 PolarHBondContact O-N 2.72Å; N375-V378 PolarHBondContact O-N 3.26Å; V378-S380 PolarHBondContact O-N 3.38Å; V378-L381 PolarHBondContact O-N 2.86Å; V378-M382 HydrophobicContact CG1-CG 4.46Å; V378-M382 HydrophobicContact CG1-SD 4.1Å; V378-M382 VanDerWaalsContact O-CG 3.28Å; V378-M382 WeakPolarHBondContact O-CG 3.45Å; V378-M382 PolarHBondContact O-N 3.04Å; V378-L405 HydrophobicContact CG2-CD2 4.04Å; V378-L408 HydrophobicContact CG2-CD2 4.08Å; V378-L482 HydrophobicContact CG2-CD2 3.62Å; V378-T485 HydrophobicContact CG1-CG2 4.43Å
379	K	86.9	Confident	81.4	Confident	149 Å²	149	52.3 Å²	52.3	65%	0.648	25%	0.254	S	S	*	.	H	α-helix	trans	-61.8	-43.6	176.3	-73.2	174.5	-178.5	179	0	112.3	N375 M376 C377 M382 E383	N375-K379 WeakPolarHBondContact O-CB 3.45Å; N375-K379 WeakPolarHBondContact O-CG 3.16Å; N375-K379 PolarHBondContact O-N 3.44Å; M376-K379 PolarHBondContact O-N 3.49Å; C377-K379 VanDerWaalsContact C-N 3.33Å; C377-K379 PolarHBondContact O-N 3.4Å; K379-M382 PolarHBondContact O-N 3.42Å; K379-E383 PolarHBondContact O-N 3.49Å
380	S	88.5	Confident	83.2	Confident	29 Å²	29	55.7 Å²	55.7	20%	0.203	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-44.2	176.6	-175.1	0	0	0	0	111.5	I332 M376 C377 V378 M382 E383 A384	I332-S380 PolarHBondContact O-OG 3.23Å; M376-S380 WeakPolarHBondContact O-CB 3.33Å; M376-S380 PolarHBondContact O-N 2.61Å; C377-S380 WeakPolarHBondContact O-CB 3.49Å; C377-S380 PolarHBondContact O-N 3.16Å; V378-S380 PolarHBondContact O-N 3.38Å; S380-M382 VanDerWaalsContact C-N 3.35Å; S380-M382 PolarHBondContact O-N 3.43Å; S380-E383 PolarHBondContact O-N 3.48Å; S380-A384 PolarHBondContact O-N 3.48Å
381	L	88.6	Confident	84.1	Confident	21 Å²	21	57.3 Å²	57.3	11%	0.11	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-36.8	175.1	-69	175.7	0	0	0	112.9	C377 V378 A384 Q385 F400 L401 H404 L405	C377-L381 VanDerWaalsContact O-CG 3.31Å; C377-L381 WeakPolarHBondContact O-CG 3.42Å; C377-L381 PolarHBondContact O-N 3.42Å; V378-L381 PolarHBondContact O-N 2.86Å; L381-A384 PolarHBondContact O-N 3.27Å; L381-Q385 WeakPolarHBondContact O-CB 3.35Å; L381-Q385 PolarHBondContact O-N 3.2Å; L381-F400 HydrophobicContact CD2-CE1 4.4Å; L381-F400 HydrophobicContact CD2-CZ 4.43Å; L381-L401 HydrophobicContact CB-CD1 3.7Å; L381-H404 HydrophobicContact CD1-CB 3.81Å; L381-H404 HydrophobicContact CD2-CB 3.58Å; L381-H404 HydrophobicContact CG-CB 4.33Å; L381-L405 HydrophobicContact CD1-CD2 4.07Å
382	M	87.3	Confident	84.9	Confident	95 Å²	95	57.5 Å²	57.5	47%	0.468	30%	0.295	S	S	.	.	H	α-helix	trans	-67.9	-37.5	175.8	-72.7	178	73.2	0	0	112.4	V378 K379 S380 Q385 R386	V378-M382 HydrophobicContact CG1-CG 4.46Å; V378-M382 HydrophobicContact CG1-SD 4.1Å; V378-M382 VanDerWaalsContact O-CG 3.28Å; V378-M382 WeakPolarHBondContact O-CG 3.45Å; V378-M382 PolarHBondContact O-N 3.04Å; K379-M382 PolarHBondContact O-N 3.42Å; S380-M382 VanDerWaalsContact C-N 3.35Å; S380-M382 PolarHBondContact O-N 3.43Å; M382-Q385 WeakPolarHBondContact O-CB 3.32Å; M382-Q385 PolarHBondContact O-N 2.82Å; M382-R386 PolarHBondContact O-N 3.42Å
383	E	88.4	Confident	85.5	Confident	65 Å²	65	54.7 Å²	54.7	30%	0.304	29%	0.289	S	S	.	.	H	α-helix	trans	-68.4	-39.2	173.3	176.9	54.7	-159.8	0	0	111.3	K379 S380 R386 R387	K379-E383 PolarHBondContact O-N 3.49Å; S380-E383 PolarHBondContact O-N 3.48Å; E383-R386 PolarHBondContact O-N 2.68Å; E383-R386 IonicContact OE1-CZ 3.24Å; E383-R386 IonicContact OE1-NE 2.64Å; E383-R386 IonicContact OE1-NH2 3.36Å; E383-R386 PolarHBondContact OE1-NH2 3.32Å; E383-R386 IonicContact OE2-CZ 3.74Å; E383-R386 IonicContact OE2-NE 2.89Å; E383-R386 PolarHBondContact OE2-NE 3.41Å; E383-R386 IonicContact OE2-NH2 2.74Å; E383-R387 WeakPolarHBondContact O-CG 3.3Å; E383-R387 PolarHBondContact O-N 2.86Å; E383-R387 VanDerWaalsContact O-N 3.14Å; E383-R387 IonicContact OE1-CZ 3.89Å; E383-R387 IonicContact OE1-NE 3.39Å; E383-R387 PolarHBondContact OE1-NE 3.36Å; E383-R387 IonicContact OE1-NH2 3.54Å
384	A	87.9	Confident	85.8	Confident	9 Å²	9	55.4 Å²	55.4	7%	0.074	29%	0.291	C	S	.	.	H	α-helix	trans	-62	-42	172.8	0	0	0	0	0	112	L342 S380 L381 R386 R387 I388 F400	L342-A384 HydrophobicContact CD2-CB 4.09Å; S380-A384 PolarHBondContact O-N 3.48Å; L381-A384 PolarHBondContact O-N 3.27Å; A384-R386 VanDerWaalsContact C-N 3.35Å; A384-R386 PolarHBondContact O-N 3.41Å; A384-R387 PolarHBondContact O-N 3.25Å; A384-I388 WeakPolarHBondContact O-CG1 3.32Å; A384-I388 PolarHBondContact O-N 3Å; A384-F400 HydrophobicContact CB-CE1 3.7Å; A384-F400 HydrophobicContact CB-CZ 3.87Å
385	Q	87.8	Confident	86	Confident	29 Å²	29	56.2 Å²	56.2	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-54.3	-50.4	172.4	176.9	-173.3	21.2	0	0	110.8	L381 M382 R387 I388 E389 A397 L401	L381-Q385 WeakPolarHBondContact O-CB 3.35Å; L381-Q385 PolarHBondContact O-N 3.2Å; M382-Q385 WeakPolarHBondContact O-CB 3.32Å; M382-Q385 PolarHBondContact O-N 2.82Å; Q385-R387 VanDerWaalsContact C-N 3.27Å; Q385-R387 PolarHBondContact O-N 3.46Å; Q385-I388 PolarHBondContact O-N 2.68Å; Q385-I388 VanDerWaalsContact O-N 3.15Å; Q385-E389 WeakPolarHBondContact O-CB 3.35Å; Q385-E389 PolarHBondContact O-N 2.92Å; Q385-A397 HydrophobicContact CG-CB 3.77Å; Q385-A397 WeakPolarHBondContact CG-O 3.36Å; Q385-A397 WeakPolarHBondContact O-CB 3.28Å; Q385-L401 HydrophobicContact CB-CB 4.33Å; Q385-L401 HydrophobicContact CG-CB 4.33Å
386	R	88.3	Confident	86.3	Confident	142 Å²	142	55.7 Å²	55.7	54%	0.536	29%	0.294	S	S	.	.	H	α-helix	trans	-58.9	-38.1	-179.4	-167.3	-170.3	71.4	81.3	4.1	112.5	M382 E383 A384 A390	M382-R386 PolarHBondContact O-N 3.42Å; E383-R386 PolarHBondContact O-N 2.68Å; E383-R386 IonicContact OE1-CZ 3.24Å; E383-R386 IonicContact OE1-NE 2.64Å; E383-R386 IonicContact OE1-NH2 3.36Å; E383-R386 PolarHBondContact OE1-NH2 3.32Å; E383-R386 IonicContact OE2-CZ 3.74Å; E383-R386 IonicContact OE2-NE 2.89Å; E383-R386 PolarHBondContact OE2-NE 3.41Å; E383-R386 IonicContact OE2-NH2 2.74Å; A384-R386 VanDerWaalsContact C-N 3.35Å; A384-R386 PolarHBondContact O-N 3.41Å; R386-A390 PolarHBondContact O-N 2.89Å
387	R	88.8	Confident	86.4	Confident	91 Å²	91	53.9 Å²	53.9	34%	0.343	29%	0.285	S	S	.	.	H	α-helix	trans	-71.2	-37.5	177.2	-66.4	-179.6	-173.9	-161.3	3.2	112.5	L342 E383 A384 Q385 S391	L342-R387 HydrophobicContact CD1-CB 4.01Å; E383-R387 WeakPolarHBondContact O-CG 3.3Å; E383-R387 PolarHBondContact O-N 2.86Å; E383-R387 VanDerWaalsContact O-N 3.14Å; E383-R387 IonicContact OE1-CZ 3.89Å; E383-R387 IonicContact OE1-NE 3.39Å; E383-R387 PolarHBondContact OE1-NE 3.36Å; E383-R387 IonicContact OE1-NH2 3.54Å; A384-R387 PolarHBondContact O-N 3.25Å; Q385-R387 VanDerWaalsContact C-N 3.27Å; Q385-R387 PolarHBondContact O-N 3.46Å; R387-S391 PolarHBondContact O-N 3.49Å; R387-S391 PolarHBondContact O-OG 2.94Å
388	I	88	Confident	86.4	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.9	-39.2	174.2	-66.9	168.5	0	0	0	110.3	L342 Y344 A384 Q385 A390 S391 K392 N396 A397 F400	L342-I388 HydrophobicContact CD2-CD1 4.31Å; L342-I388 HydrophobicContact CD2-CG1 4.19Å; Y344-I388 HydrophobicContact CD2-CD1 4.31Å; A384-I388 WeakPolarHBondContact O-CG1 3.32Å; A384-I388 PolarHBondContact O-N 3Å; Q385-I388 PolarHBondContact O-N 2.68Å; Q385-I388 VanDerWaalsContact O-N 3.15Å; I388-A390 VanDerWaalsContact C-N 3.31Å; I388-A390 PolarHBondContact O-N 2.95Å; I388-S391 PolarHBondContact O-N 2.68Å; I388-S391 VanDerWaalsContact O-N 3.1Å; I388-S391 PolarHBondContact O-OG 3.41Å; I388-S391 VanDerWaalsContact O-OG 3.13Å; I388-K392 HydrophobicContact CG2-CB 4.2Å; I388-K392 PolarHBondContact O-N 2.98Å; I388-N396 HydrophobicContact CG2-CB 4.24Å; I388-A397 HydrophobicContact CB-CB 4.33Å; I388-A397 HydrophobicContact CG2-CB 4.16Å; I388-F400 HydrophobicContact CD1-CB 3.96Å; I388-F400 HydrophobicContact CD1-CD1 3.64Å; I388-F400 HydrophobicContact CD1-CD2 3.37Å; I388-F400 HydrophobicContact CD1-CE1 3.95Å; I388-F400 HydrophobicContact CD1-CE2 3.68Å; I388-F400 HydrophobicContact CD1-CG 3.36Å; I388-F400 HydrophobicContact CD1-CZ 3.97Å
389	E	87.5	Confident	86.4	Confident	95 Å²	95	51.8 Å²	51.8	44%	0.444	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-44.4	177.3	-177	170.1	-163.6	0	0	111.5	Q385 S391 G393 P394 A397	Q385-E389 WeakPolarHBondContact O-CB 3.35Å; Q385-E389 PolarHBondContact O-N 2.92Å; E389-S391 VanDerWaalsContact C-N 3.26Å; E389-S391 PolarHBondContact O-N 2.93Å; E389-G393 WeakPolarHBondContact O-CA 3.38Å; E389-G393 PolarHBondContact O-N 3.36Å; E389-G393 VanDerWaalsContact O-N 3.12Å; E389-P394 HydrophobicContact CG-CB 4.3Å; E389-A397 HydrophobicContact CB-CB 3.59Å; E389-A397 HydrophobicContact CG-CB 4.41Å
390	A	88	Confident	86.4	Confident	89 Å²	89	45.2 Å²	45.2	74%	0.736	24%	0.243	S	C	*	.	H	α-helix	trans	-64.6	-25.7	177.8	0	0	0	0	0	114.1	R386 I388	R386-A390 PolarHBondContact O-N 2.89Å; I388-A390 VanDerWaalsContact C-N 3.31Å; I388-A390 PolarHBondContact O-N 2.95Å
391	S	86.5	Confident	86.2	Confident	79 Å²	79	44 Å²	44	55%	0.552	23%	0.234	S	C	*	.	H	α-helix	trans	-104.4	-36	-174.3	53.1	0	0	0	0	114	R387 I388 E389	R387-S391 PolarHBondContact O-N 3.49Å; R387-S391 PolarHBondContact O-OG 2.94Å; I388-S391 PolarHBondContact O-N 2.68Å; I388-S391 VanDerWaalsContact O-N 3.1Å; I388-S391 PolarHBondContact O-OG 3.41Å; I388-S391 VanDerWaalsContact O-OG 3.13Å; E389-S391 VanDerWaalsContact C-N 3.26Å; E389-S391 PolarHBondContact O-N 2.93Å
392	K	85	Confident	85.8	Confident	84 Å²	84	43 Å²	43	37%	0.365	23%	0.228	S	C	.	.	H	α-helix	trans	-128.5	3.1	-167.6	-61.5	-68.9	-166.5	179.9	0	113.8	Y344 E346 I388 N396	Y344-K392 WeakPolarHBondContact O-CG 3.1Å; E346-K392 WeakPolarHBondContact OE1-CE 3.3Å; E346-K392 IonicContact OE1-NZ 3.75Å; E346-K392 PolarHBondContact OE1-NZ 3.44Å; E346-K392 IonicContact OE2-NZ 3.71Å; I388-K392 HydrophobicContact CG2-CB 4.2Å; I388-K392 PolarHBondContact O-N 2.98Å; K392-N396 HydrophobicContact CB-CB 4.1Å; K392-N396 PolarHBondContact O-ND2 2.91Å
393	G	83.7	Confident	85.5	Confident	24 Å²	24	40.2 Å²	40.2	25%	0.247	21%	0.214	C	C	.	.			trans	87.9	166.2	177.8	0	0	0	0	0	114.6	E389 T395 A397	E389-G393 WeakPolarHBondContact O-CA 3.38Å; E389-G393 PolarHBondContact O-N 3.36Å; E389-G393 VanDerWaalsContact O-N 3.12Å; G393-T395 PolarHBondContact O-N 3.41Å; G393-A397 PolarHBondContact O-N 3.48Å
394	P	83.4	Confident	85.3	Confident	36 Å²	36	39 Å²	39	23%	0.234	21%	0.208	C	C	.	.	H	α-helix	trans	-67.7	-34	-170.9	24.7	-33.3	0	0	0	113.2	E389 A397 S398 E496	E389-P394 HydrophobicContact CG-CB 4.3Å; P394-A397 PolarHBondContact O-N 2.87Å; P394-S398 PolarHBondContact O-N 3.31Å; P394-E496 WeakPolarHBondContact CG-OE1 3.33Å
395	T	81.7	Confident	85	Confident	27 Å²	27	38.6 Å²	38.6	17%	0.166	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-49.6	179.5	-41.4	0	0	0	0	111.8	G393 A397 S398 L399 L493 L543 L546	G393-T395 PolarHBondContact O-N 3.41Å; T395-A397 VanDerWaalsContact C-N 3.34Å; T395-A397 PolarHBondContact O-N 3.19Å; T395-S398 PolarHBondContact O-N 3.12Å; T395-L399 HydrophobicContact CG2-CD1 4.26Å; T395-L399 WeakPolarHBondContact O-CB 3.39Å; T395-L399 VanDerWaalsContact O-CG 3.32Å; T395-L399 WeakPolarHBondContact O-CG 3.17Å; T395-L399 PolarHBondContact O-N 2.81Å; T395-L493 HydrophobicContact CG2-CD2 3.79Å; T395-L543 HydrophobicContact CG2-CD1 4.03Å; T395-L546 HydrophobicContact CG2-CD1 4.03Å
396	N	85.6	Confident	84.3	Confident	21 Å²	21	39.4 Å²	39.4	11%	0.112	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-40.3	177.7	-79.8	-60.3	0	0	0	111.6	I388 K392 L399 F400 Y550	I388-N396 HydrophobicContact CG2-CB 4.24Å; K392-N396 HydrophobicContact CB-CB 4.1Å; K392-N396 PolarHBondContact O-ND2 2.91Å; N396-L399 PolarHBondContact O-N 3.4Å; N396-F400 VanDerWaalsContact O-CB 3.23Å; N396-F400 WeakPolarHBondContact O-CB 3.26Å; N396-F400 PolarHBondContact O-N 2.94Å; N396-Y550 WeakPolarHBondContact OD1-CE2 3.25Å; N396-Y550 PolarHBondContact OD1-OH 2.83Å
397	A	85.8	Confident	83.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-48.8	178.2	0	0	0	0	0	112.2	Q385 I388 E389 G393 P394 T395 F400 L401	Q385-A397 HydrophobicContact CG-CB 3.77Å; Q385-A397 WeakPolarHBondContact CG-O 3.36Å; Q385-A397 WeakPolarHBondContact O-CB 3.28Å; I388-A397 HydrophobicContact CB-CB 4.33Å; I388-A397 HydrophobicContact CG2-CB 4.16Å; E389-A397 HydrophobicContact CB-CB 3.59Å; E389-A397 HydrophobicContact CG-CB 4.41Å; G393-A397 PolarHBondContact O-N 3.48Å; P394-A397 PolarHBondContact O-N 2.87Å; T395-A397 VanDerWaalsContact C-N 3.34Å; T395-A397 PolarHBondContact O-N 3.19Å; A397-F400 WeakPolarHBondContact O-CB 3.42Å; A397-F400 PolarHBondContact O-N 3.36Å; A397-L401 PolarHBondContact O-N 2.97Å
398	S	83	Confident	83.2	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-44.9	176.8	-76.3	0	0	0	0	112	P394 T395 F400 L401 I402 A489 L493	P394-S398 PolarHBondContact O-N 3.31Å; T395-S398 PolarHBondContact O-N 3.12Å; S398-F400 VanDerWaalsContact C-N 3.33Å; S398-F400 PolarHBondContact O-N 3.21Å; S398-L401 PolarHBondContact O-N 2.93Å; S398-L401 VanDerWaalsContact O-N 3.17Å; S398-I402 WeakPolarHBondContact O-CB 3.47Å; S398-I402 VanDerWaalsContact O-CD1 3.26Å; S398-I402 WeakPolarHBondContact O-CD1 3.32Å; S398-I402 WeakPolarHBondContact O-CG1 3.43Å; S398-I402 PolarHBondContact O-N 3.35Å; S398-A489 WeakPolarHBondContact CB-O 3.42Å; S398-A489 PolarHBondContact OG-O 3.14Å; S398-L493 VanDerWaalsContact CB-CD1 3.41Å
399	L	84	Confident	82.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-38.2	177.9	-71.6	174.2	0	0	0	112.4	T395 N396 I402 K403 L546 M547 Y550	T395-L399 HydrophobicContact CG2-CD1 4.26Å; T395-L399 WeakPolarHBondContact O-CB 3.39Å; T395-L399 VanDerWaalsContact O-CG 3.32Å; T395-L399 WeakPolarHBondContact O-CG 3.17Å; T395-L399 PolarHBondContact O-N 2.81Å; N396-L399 PolarHBondContact O-N 3.4Å; L399-I402 HydrophobicContact CD2-CD1 4.5Å; L399-I402 PolarHBondContact O-N 2.84Å; L399-K403 WeakPolarHBondContact O-CB 3.45Å; L399-K403 PolarHBondContact O-N 3.34Å; L399-L546 HydrophobicContact CD1-CB 3.54Å; L399-M547 HydrophobicContact CD2-CG 3.87Å; L399-Y550 HydrophobicContact CB-CD1 3.86Å; L399-Y550 HydrophobicContact CB-CD2 4.07Å; L399-Y550 HydrophobicContact CB-CE1 4.18Å; L399-Y550 HydrophobicContact CB-CE2 4.34Å; L399-Y550 HydrophobicContact CB-CG 3.79Å; L399-Y550 HydrophobicContact CD1-CD2 4.13Å; L399-Y550 HydrophobicContact CD1-CE2 4.44Å
400	F	87.3	Confident	81.4	Confident	10 Å²	10	35.7 Å²	35.7	4%	0.044	21%	0.212	C	C	.	.	H	α-helix	trans	-56.5	-52.3	170.1	167.5	-89.3	0	0	0	110.6	Y344 L381 A384 I388 N396 A397 S398 I402 K403 H404 Y550	Y344-F400 HydrophobicContact CD1-CD2 4.07Å; Y344-F400 AromaticContact CD2-CD2 3.69Å; Y344-F400 HydrophobicContact CD2-CD2 3.69Å; Y344-F400 AromaticContact CD2-CE2 3.85Å; Y344-F400 HydrophobicContact CD2-CE2 3.85Å; Y344-F400 HydrophobicContact CE1-CD2 4.05Å; Y344-F400 AromaticContact CE2-CD2 3.7Å; Y344-F400 HydrophobicContact CE2-CD2 3.7Å; Y344-F400 AromaticContact CE2-CE2 3.51Å; Y344-F400 HydrophobicContact CE2-CE2 3.51Å; Y344-F400 AromaticContact CG-CD2 3.9Å; Y344-F400 HydrophobicContact CG-CD2 3.9Å; Y344-F400 HydrophobicContact CG-CE2 4.5Å; Y344-F400 AromaticContact CZ-CD2 3.9Å; Y344-F400 AromaticContact CZ-CE2 3.89Å; L381-F400 HydrophobicContact CD2-CE1 4.4Å; L381-F400 HydrophobicContact CD2-CZ 4.43Å; A384-F400 HydrophobicContact CB-CE1 3.7Å; A384-F400 HydrophobicContact CB-CZ 3.87Å; I388-F400 HydrophobicContact CD1-CB 3.96Å; I388-F400 HydrophobicContact CD1-CD1 3.64Å; I388-F400 HydrophobicContact CD1-CD2 3.37Å; I388-F400 HydrophobicContact CD1-CE1 3.95Å; I388-F400 HydrophobicContact CD1-CE2 3.68Å; I388-F400 HydrophobicContact CD1-CG 3.36Å; I388-F400 HydrophobicContact CD1-CZ 3.97Å; N396-F400 VanDerWaalsContact O-CB 3.23Å; N396-F400 WeakPolarHBondContact O-CB 3.26Å; N396-F400 PolarHBondContact O-N 2.94Å; A397-F400 WeakPolarHBondContact O-CB 3.42Å; A397-F400 PolarHBondContact O-N 3.36Å; S398-F400 VanDerWaalsContact C-N 3.33Å; S398-F400 PolarHBondContact O-N 3.21Å; F400-I402 PolarHBondContact O-N 2.9Å; F400-K403 PolarHBondContact O-N 3.21Å; F400-H404 AromaticContact CD2-CE1 3.27Å; F400-H404 WeakPolarHBondContact CD2-CE1 3.48Å; F400-H404 AromaticContact CD2-ND1 3.49Å; F400-H404 WeakPolarHBondContact CD2-ND1 3.15Å; F400-H404 AromaticContact CE2-CE1 3.04Å; F400-H404 WeakPolarHBondContact CE2-CE1 3.14Å; F400-H404 AromaticContact CE2-ND1 3.42Å; F400-H404 WeakPolarHBondContact CE2-ND1 3.35Å; F400-H404 AromaticContact CE2-NE2 3.79Å; F400-H404 AromaticContact CG-ND1 3.85Å; F400-H404 AromaticContact CZ-CE1 3.69Å; F400-H404 AromaticContact CZ-ND1 3.69Å; F400-H404 PolarHBondContact O-N 3.07Å; F400-H404 VanDerWaalsContact O-N 3.1Å; F400-H404 PolarHBondContact O-ND1 3.39Å; F400-Y550 HydrophobicContact CB-CE1 4.02Å
401	L	84.1	Confident	80.4	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-46.7	-179.1	179.5	62.3	0	0	0	110.7	L381 Q385 A397 S398 K403 H404 L405 A489	L381-L401 HydrophobicContact CB-CD1 3.7Å; Q385-L401 HydrophobicContact CB-CB 4.33Å; Q385-L401 HydrophobicContact CG-CB 4.33Å; A397-L401 PolarHBondContact O-N 2.97Å; S398-L401 PolarHBondContact O-N 2.93Å; S398-L401 VanDerWaalsContact O-N 3.17Å; L401-K403 PolarHBondContact O-N 3.15Å; L401-H404 PolarHBondContact O-N 2.76Å; L401-L405 HydrophobicContact CD1-CD1 3.85Å; L401-L405 HydrophobicContact CD1-CD2 4.18Å; L401-L405 HydrophobicContact CD1-CG 3.78Å; L401-L405 HydrophobicContact CD2-CD1 4.16Å; L401-L405 HydrophobicContact CG-CD1 3.67Å; L401-L405 HydrophobicContact CG-CG 4.04Å; L401-L405 WeakPolarHBondContact O-CB 3.32Å; L401-L405 VanDerWaalsContact O-CG 3.23Å; L401-L405 WeakPolarHBondContact O-CG 3.46Å; L401-L405 PolarHBondContact O-N 3.33Å; L401-A489 HydrophobicContact CD2-CB 3.69Å; L401-A489 HydrophobicContact CG-CB 4.33Å
402	I	79	Confident	79.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.7	-49.3	178.9	-68.5	154.2	0	0	0	110.9	S398 L399 F400 H404 L405 L406 A489 F490 L493 L551 L560	S398-I402 WeakPolarHBondContact O-CB 3.47Å; S398-I402 VanDerWaalsContact O-CD1 3.26Å; S398-I402 WeakPolarHBondContact O-CD1 3.32Å; S398-I402 WeakPolarHBondContact O-CG1 3.43Å; S398-I402 PolarHBondContact O-N 3.35Å; L399-I402 HydrophobicContact CD2-CD1 4.5Å; L399-I402 PolarHBondContact O-N 2.84Å; F400-I402 PolarHBondContact O-N 2.9Å; I402-H404 VanDerWaalsContact C-N 3.32Å; I402-H404 PolarHBondContact O-N 3.41Å; I402-L405 PolarHBondContact O-N 3.26Å; I402-L406 HydrophobicContact CG2-CD1 3.84Å; I402-L406 HydrophobicContact CG2-CG 4.3Å; I402-L406 WeakPolarHBondContact O-CB 3.24Å; I402-L406 VanDerWaalsContact O-CG 3.26Å; I402-L406 WeakPolarHBondContact O-CG 3.45Å; I402-L406 PolarHBondContact O-N 3.38Å; I402-A489 HydrophobicContact CG1-CB 4.18Å; I402-F490 HydrophobicContact CB-CE2 4.19Å; I402-F490 HydrophobicContact CB-CZ 4.46Å; I402-F490 HydrophobicContact CD1-CD1 3.76Å; I402-F490 HydrophobicContact CD1-CD2 3.5Å; I402-F490 VanDerWaalsContact CD1-CD2 3.5Å; I402-F490 HydrophobicContact CD1-CE1 3.57Å; I402-F490 HydrophobicContact CD1-CE2 3.27Å; I402-F490 HydrophobicContact CD1-CG 3.72Å; I402-F490 HydrophobicContact CD1-CZ 3.31Å; I402-F490 HydrophobicContact CG1-CD2 3.82Å; I402-F490 HydrophobicContact CG1-CE2 3.54Å; I402-F490 HydrophobicContact CG1-CG 4.49Å; I402-F490 HydrophobicContact CG1-CZ 4.01Å; I402-F490 HydrophobicContact CG2-CE2 3.56Å; I402-F490 HydrophobicContact CG2-CZ 3.8Å; I402-L493 HydrophobicContact CD1-CD1 4.45Å; I402-L551 HydrophobicContact CG2-CD2 4.1Å; I402-L560 HydrophobicContact CG2-CD1 4.36Å
403	K	81.4	Confident	78.5	Confident	38 Å²	38	31.1 Å²	31.1	17%	0.165	18%	0.177	C	C	.	.	H	α-helix	trans	-54.6	-49.5	178	-177.9	-176.6	-174	124.5	0	110.9	L348 L399 F400 L401 L406 I407 Y550	L348-K403 HydrophobicContact CD1-CD 4.4Å; L399-K403 WeakPolarHBondContact O-CB 3.45Å; L399-K403 PolarHBondContact O-N 3.34Å; F400-K403 PolarHBondContact O-N 3.21Å; L401-K403 PolarHBondContact O-N 3.15Å; K403-L406 PolarHBondContact O-N 2.97Å; K403-I407 HydrophobicContact CG-CD1 4.11Å; K403-I407 VanDerWaalsContact O-CG1 3.28Å; K403-I407 WeakPolarHBondContact O-CG1 3.32Å; K403-I407 PolarHBondContact O-N 3.41Å; K403-Y550 HydrophobicContact CB-CD1 4.47Å; K403-Y550 HydrophobicContact CD-CD1 4.23Å; K403-Y550 WeakPolarHBondContact CD-O 3.37Å; K403-Y550 VanDerWaalsContact CE-O 3.31Å; K403-Y550 WeakPolarHBondContact CE-O 3.39Å; K403-Y550 WeakPolarHBondContact CG-O 3.13Å; K403-Y550 PolarHBondContact NZ-O 2.96Å
404	H	84.3	Confident	77.3	Confident	40 Å²	40	34.6 Å²	34.6	19%	0.185	20%	0.196	C	C	.	.	H	α-helix	trans	-72.4	-33.9	-177	-67.8	85.6	0	0	0	113.1	Y344 L381 F400 L401 I402 I407 L408	Y344-H404 AromaticContact CZ-CE1 3.71Å; Y344-H404 PolarHBondContact OH-CE1 3.37Å; Y344-H404 PolarHBondContact OH-NE2 3.25Å; L381-H404 HydrophobicContact CD1-CB 3.81Å; L381-H404 HydrophobicContact CD2-CB 3.58Å; L381-H404 HydrophobicContact CG-CB 4.33Å; F400-H404 AromaticContact CD2-CE1 3.27Å; F400-H404 WeakPolarHBondContact CD2-CE1 3.48Å; F400-H404 AromaticContact CD2-ND1 3.49Å; F400-H404 WeakPolarHBondContact CD2-ND1 3.15Å; F400-H404 AromaticContact CE2-CE1 3.04Å; F400-H404 WeakPolarHBondContact CE2-CE1 3.14Å; F400-H404 AromaticContact CE2-ND1 3.42Å; F400-H404 WeakPolarHBondContact CE2-ND1 3.35Å; F400-H404 AromaticContact CE2-NE2 3.79Å; F400-H404 AromaticContact CG-ND1 3.85Å; F400-H404 AromaticContact CZ-CE1 3.69Å; F400-H404 AromaticContact CZ-ND1 3.69Å; F400-H404 PolarHBondContact O-N 3.07Å; F400-H404 VanDerWaalsContact O-N 3.1Å; F400-H404 PolarHBondContact O-ND1 3.39Å; L401-H404 PolarHBondContact O-N 2.76Å; I402-H404 VanDerWaalsContact C-N 3.32Å; I402-H404 PolarHBondContact O-N 3.41Å; H404-I407 PolarHBondContact O-N 3.12Å; H404-L408 WeakPolarHBondContact O-CB 3.48Å; H404-L408 PolarHBondContact O-N 3.34Å
405	L	81.3	Confident	76.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68	-36.7	173	-68.6	178.5	0	0	0	112.2	V378 L381 L401 I402 L408 R409 L482 T485 V486	V378-L405 HydrophobicContact CG2-CD2 4.04Å; L381-L405 HydrophobicContact CD1-CD2 4.07Å; L401-L405 HydrophobicContact CD1-CD1 3.85Å; L401-L405 HydrophobicContact CD1-CD2 4.18Å; L401-L405 HydrophobicContact CD1-CG 3.78Å; L401-L405 HydrophobicContact CD2-CD1 4.16Å; L401-L405 HydrophobicContact CG-CD1 3.67Å; L401-L405 HydrophobicContact CG-CG 4.04Å; L401-L405 WeakPolarHBondContact O-CB 3.32Å; L401-L405 VanDerWaalsContact O-CG 3.23Å; L401-L405 WeakPolarHBondContact O-CG 3.46Å; L401-L405 PolarHBondContact O-N 3.33Å; I402-L405 PolarHBondContact O-N 3.26Å; L405-L408 PolarHBondContact O-N 2.96Å; L405-R409 VanDerWaalsContact O-CB 3.26Å; L405-R409 WeakPolarHBondContact O-CB 3.06Å; L405-R409 PolarHBondContact O-N 3.46Å; L405-L482 HydrophobicContact CD2-CD2 3.69Å; L405-T485 HydrophobicContact CD1-CG2 3.64Å; L405-V486 HydrophobicContact CB-CG2 3.73Å; L405-V486 HydrophobicContact CD1-CG2 3.83Å; L405-V486 HydrophobicContact CG-CG2 4.46Å
406	L	74.1	Confident	74.5	Confident	46 Å²	46	40.5 Å²	40.5	24%	0.241	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-41.7	174	-71.8	173.9	0	0	0	111.4	I402 K403 R409 A410 L551 T556 L560	I402-L406 HydrophobicContact CG2-CD1 3.84Å; I402-L406 HydrophobicContact CG2-CG 4.3Å; I402-L406 WeakPolarHBondContact O-CB 3.24Å; I402-L406 VanDerWaalsContact O-CG 3.26Å; I402-L406 WeakPolarHBondContact O-CG 3.45Å; I402-L406 PolarHBondContact O-N 3.38Å; K403-L406 PolarHBondContact O-N 2.97Å; L406-R409 PolarHBondContact O-N 2.82Å; L406-A410 WeakPolarHBondContact O-CB 3.27Å; L406-A410 PolarHBondContact O-N 3.42Å; L406-L551 HydrophobicContact CD1-CD2 3.71Å; L406-T556 HydrophobicContact CD1-CG2 4.04Å; L406-L560 HydrophobicContact CD1-CD1 4.28Å
407	I	77.1	Confident	72.5	Confident	83 Å²	83	43.6 Å²	43.6	43%	0.426	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-49.7	172.8	-67.2	164.7	0	0	0	109.9	K403 H404 R409 A410 Q411	K403-I407 HydrophobicContact CG-CD1 4.11Å; K403-I407 VanDerWaalsContact O-CG1 3.28Å; K403-I407 WeakPolarHBondContact O-CG1 3.32Å; K403-I407 PolarHBondContact O-N 3.41Å; H404-I407 PolarHBondContact O-N 3.12Å; I407-R409 VanDerWaalsContact C-N 3.34Å; I407-R409 PolarHBondContact O-N 3.3Å; I407-A410 PolarHBondContact O-N 2.85Å; I407-A410 VanDerWaalsContact O-N 3.17Å; I407-Q411 HydrophobicContact CG2-CG 4.43Å; I407-Q411 VanDerWaalsContact O-CG 3.31Å; I407-Q411 WeakPolarHBondContact O-CG 3.21Å; I407-Q411 PolarHBondContact O-N 3.3Å
408	L	75.6	Confident	70.3	Confident	28 Å²	28	52.6 Å²	52.6	15%	0.147	28%	0.278	C	S	.	.	H	α-helix	trans	-58	-46.8	178.7	-177.6	60.6	0	0	0	111.3	V374 C377 V378 H404 L405 A410 Q411 I412 L482	V374-L408 HydrophobicContact CG1-CD2 4.39Å; C377-L408 HydrophobicContact CB-CD2 4.23Å; V378-L408 HydrophobicContact CG2-CD2 4.08Å; H404-L408 WeakPolarHBondContact O-CB 3.48Å; H404-L408 PolarHBondContact O-N 3.34Å; L405-L408 PolarHBondContact O-N 2.96Å; L408-A410 PolarHBondContact O-N 2.95Å; L408-Q411 PolarHBondContact O-N 3.34Å; L408-I412 HydrophobicContact CD1-CG2 4.38Å; L408-I412 WeakPolarHBondContact O-CG1 3.4Å; L408-I412 PolarHBondContact O-N 3.09Å; L408-L482 HydrophobicContact CD2-CD2 3.94Å
409	R	69.9	Low	68.3	Low	79 Å²	79	56.8 Å²	56.8	30%	0.298	30%	0.303	S	S	.	.	H	α-helix	trans	-58.2	-45.6	175.3	179.6	179.1	155.2	-168.7	-14.4	111.7	L405 L406 I407 Q411 I412 A413 L482 D483	L405-R409 VanDerWaalsContact O-CB 3.26Å; L405-R409 WeakPolarHBondContact O-CB 3.06Å; L405-R409 PolarHBondContact O-N 3.46Å; L406-R409 PolarHBondContact O-N 2.82Å; I407-R409 VanDerWaalsContact C-N 3.34Å; I407-R409 PolarHBondContact O-N 3.3Å; R409-Q411 VanDerWaalsContact C-N 3.27Å; R409-Q411 PolarHBondContact O-N 3.42Å; R409-I412 VanDerWaalsContact O-CG1 3.32Å; R409-I412 WeakPolarHBondContact O-CG1 3.38Å; R409-I412 PolarHBondContact O-N 3.07Å; R409-A413 WeakPolarHBondContact O-CB 3.16Å; R409-A413 PolarHBondContact O-N 2.87Å; R409-L482 HydrophobicContact CB-CD1 4.38Å; R409-D483 IonicContact CZ-OD1 3Å; R409-D483 IonicContact NE-OD1 3.59Å; R409-D483 IonicContact NH1-OD1 3.52Å; R409-D483 PolarHBondContact NH1-OD1 3.43Å; R409-D483 IonicContact NH1-OD2 3.66Å
410	A	68.1	Low	66.2	Low	60 Å²	60	65.2 Å²	65.2	50%	0.496	34%	0.34	S	S	.	.	H	α-helix	trans	-63.2	-33.9	178.8	0	0	0	0	0	112.2	L406 I407 L408 P414	L406-A410 WeakPolarHBondContact O-CB 3.27Å; L406-A410 PolarHBondContact O-N 3.42Å; I407-A410 PolarHBondContact O-N 2.85Å; I407-A410 VanDerWaalsContact O-N 3.17Å; L408-A410 PolarHBondContact O-N 2.95Å; A410-P414 WeakPolarHBondContact O-CD 3.3Å
411	Q	68.2	Low	63.7	Low	81 Å²	81	67.6 Å²	67.6	38%	0.379	36%	0.358	S	S	.	.	H	α-helix	trans	-77.9	-31.9	179.4	-66.8	-62	-28.9	0	0	113.6	I407 L408 R409 R415	I407-Q411 HydrophobicContact CG2-CG 4.43Å; I407-Q411 VanDerWaalsContact O-CG 3.31Å; I407-Q411 WeakPolarHBondContact O-CG 3.21Å; I407-Q411 PolarHBondContact O-N 3.3Å; L408-Q411 PolarHBondContact O-N 3.34Å; R409-Q411 VanDerWaalsContact C-N 3.27Å; R409-Q411 PolarHBondContact O-N 3.42Å; Q411-R415 WeakPolarHBondContact O-CD 3.3Å
412	I	66.1	Low	61.3	Low	20 Å²	20	75.5 Å²	75.5	10%	0.103	40%	0.395	C	S	.	.	H	α-helix	trans	-83	-29.3	178.1	65.5	171.4	0	0	0	112.9	V374 L408 R409 R415 M416 L482	V374-I412 HydrophobicContact CG2-CG2 3.98Å; L408-I412 HydrophobicContact CD1-CG2 4.38Å; L408-I412 WeakPolarHBondContact O-CG1 3.4Å; L408-I412 PolarHBondContact O-N 3.09Å; R409-I412 VanDerWaalsContact O-CG1 3.32Å; R409-I412 WeakPolarHBondContact O-CG1 3.38Å; R409-I412 PolarHBondContact O-N 3.07Å; I412-R415 PolarHBondContact O-N 3.4Å; I412-M416 HydrophobicContact CB-CE 4.31Å; I412-M416 HydrophobicContact CD1-CE 4.42Å; I412-M416 PolarHBondContact O-N 3.19Å; I412-L482 HydrophobicContact CD1-CD1 3.37Å; I412-L482 HydrophobicContact CG1-CD1 4.47Å
413	A	64.1	Low	59.4	Low	54 Å²	54	80.3 Å²	80.3	45%	0.446	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-41.6	-171.7	0	0	0	0	0	114.2	R409 R415	R409-A413 WeakPolarHBondContact O-CB 3.16Å; R409-A413 PolarHBondContact O-N 2.87Å; A413-R415 VanDerWaalsContact C-N 3.29Å; A413-R415 PolarHBondContact O-N 2.89Å
414	P	58.1	Low	57.3	Low	98 Å²	98	80.9 Å²	80.9	64%	0.636	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-21.7	175.3	-17	31	0	0	0	113.6	A410	A410-P414 WeakPolarHBondContact O-CD 3.3Å
415	R	58.7	Low	55.4	Low	121 Å²	121	82.8 Å²	82.8	46%	0.457	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-22.3	-169.3	-62.7	-179.8	179.6	161.4	1	113.2	Q411 I412 A413 C417	Q411-R415 WeakPolarHBondContact O-CD 3.3Å; I412-R415 PolarHBondContact O-N 3.4Å; A413-R415 VanDerWaalsContact C-N 3.29Å; A413-R415 PolarHBondContact O-N 2.89Å; R415-C417 PolarHBondContact O-N 3.43Å
416	M	48.6	Very low	53.6	Low	66 Å²	66	86 Å²	86	33%	0.325	47%	0.466	S	S	.	.			trans	-85.9	82.4	176.3	-67.5	-158.3	174	0	0	111.4	A370 I412 S478	A370-M416 HydrophobicContact CB-CE 4.13Å; I412-M416 HydrophobicContact CB-CE 4.31Å; I412-M416 HydrophobicContact CD1-CE 4.42Å; I412-M416 PolarHBondContact O-N 3.19Å; M416-S478 WeakPolarHBondContact CE-OG 3.32Å; M416-S478 PolarHBondContact SD-OG 2.96Å
417	C	44.3	Very low	52.4	Low	85 Å²	85	90.8 Å²	90.8	57%	0.574	49%	0.486	S	S	*	.			trans	-79.3	113.4	157	-69.6	0	0	0	0	108.6	R415 V419	R415-C417 PolarHBondContact O-N 3.43Å; C417-V419 PolarHBondContact O-N 3.44Å
418	E	38.4	Very low	51.5	Low	189 Å²	189	89.3 Å²	89.3	88%	0.883	49%	0.491	S	S	*	.			trans	19.2	83	163.1	-63.6	179.3	179	0	0	114.4
419	V	42.3	Very low	50.4	Low	91 Å²	91	93.5 Å²	93.5	55%	0.552	51%	0.508	S	S	*	.			trans	-64.3	133.4	-178.4	178.3	0	0	0	0	109.8	C417 S421	C417-V419 PolarHBondContact O-N 3.44Å; V419-S421 PolarHBondContact O-N 3.09Å
420	F	39.7	Very low	49.7	Very low	177 Å²	177	91.9 Å²	91.9	78%	0.776	51%	0.505	S	S	*	.			trans	-43.8	131	179.7	-87.1	-101.4	0	0	0	113.1
421	S	34.2	Very low	49.1	Very low	60 Å²	60	97.5 Å²	97.5	42%	0.42	52%	0.518	S	S	.	.			trans	-85.7	106.6	-176.8	168.4	0	0	0	0	111.3	V419	V419-S421 PolarHBondContact O-N 3.09Å
422	E	34.7	Very low	48.5	Very low	170 Å²	170	95.3 Å²	95.3	79%	0.794	52%	0.518	S	S	*	.			trans	-82.3	131.3	160.1	-80.2	-175.6	176.8	0	0	110.3	S424	E422-S424 PolarHBondContact O-N 3.24Å
423	P	37.8	Very low	47.8	Very low	100 Å²	100	97.5 Å²	97.5	65%	0.649	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	114.4	-177.6	30.4	-31.7	0	0	0	111.2	T471	P423-T471 HydrophobicContact CB-CG2 4.41Å
424	S	37.8	Very low	47.1	Very low	51 Å²	51	100.7 Å²	100.7	36%	0.357	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	160	165.7	62.9	0	0	0	0	111.5	E422 A472	E422-S424 PolarHBondContact O-N 3.24Å; S424-A472 PolarHBondContact O-N 3.06Å
425	V	43.8	Very low	47	Very low	79 Å²	79	98.9 Å²	98.9	48%	0.479	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	131.7	-171.5	-176	0	0	0	0	110.7	F427	V425-F427 HydrophobicContact CB-CE2 4.41Å; V425-F427 WeakPolarHBondContact O-CD2 3.32Å
426	D	43.7	Very low	46.8	Very low	67 Å²	67	100.2 Å²	100.2	36%	0.358	53%	0.529	S	S	.	.			trans	-94.7	116.9	-177.7	-179.9	9.9	0	0	0	112	G428 A472	D426-G428 PolarHBondContact OD1-N 2.9Å; D426-A472 HydrophobicContact CB-CB 3.33Å
427	F	48.9	Very low	47	Very low	148 Å²	148	98.2 Å²	98.2	65%	0.649	52%	0.518	S	S	*	.			trans	-88.1	-4	179.5	-65.5	-93.7	0	0	0	112.9	V425 K429 I430	V425-F427 HydrophobicContact CB-CE2 4.41Å; V425-F427 WeakPolarHBondContact O-CD2 3.32Å; F427-K429 VanDerWaalsContact C-N 3.32Å; F427-K429 PolarHBondContact O-N 3.22Å; F427-I430 HydrophobicContact CB-CD1 4.19Å; F427-I430 HydrophobicContact CD1-CD1 3.52Å; F427-I430 HydrophobicContact CE1-CD1 4.33Å; F427-I430 HydrophobicContact CG-CD1 4.26Å; F427-I430 WeakPolarHBondContact O-CB 3.43Å; F427-I430 PolarHBondContact O-N 2.73Å; F427-I430 VanDerWaalsContact O-N 3.15Å
428	G	57.8	Low	47.4	Very low	52 Å²	52	95.1 Å²	95.1	54%	0.536	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-34.4	-175.7	0	0	0	0	0	114.1	D426 I430	D426-G428 PolarHBondContact OD1-N 2.9Å; G428-I430 VanDerWaalsContact C-N 3.27Å; G428-I430 PolarHBondContact O-N 3.5Å
429	K	53.2	Low	48	Very low	116 Å²	116	93.6 Å²	93.6	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-69.7	-21.9	178.2	-68.4	-179	-177.9	172.4	0	113.5	F427 G432 N433	F427-K429 VanDerWaalsContact C-N 3.32Å; F427-K429 PolarHBondContact O-N 3.22Å; K429-G432 PolarHBondContact O-N 3.46Å; K429-N433 WeakPolarHBondContact O-CB 3.25Å; K429-N433 PolarHBondContact O-N 3.14Å
430	I	54.5	Low	48.3	Very low	44 Å²	44	97.7 Å²	97.7	23%	0.226	50%	0.501	C	S	.	.	H	α-helix	trans	-66.9	-41.9	-179.8	-60.4	174.3	0	0	0	110.2	F427 G428 G432 N433 W434	F427-I430 HydrophobicContact CB-CD1 4.19Å; F427-I430 HydrophobicContact CD1-CD1 3.52Å; F427-I430 HydrophobicContact CE1-CD1 4.33Å; F427-I430 HydrophobicContact CG-CD1 4.26Å; F427-I430 WeakPolarHBondContact O-CB 3.43Å; F427-I430 PolarHBondContact O-N 2.73Å; F427-I430 VanDerWaalsContact O-N 3.15Å; G428-I430 VanDerWaalsContact C-N 3.27Å; G428-I430 PolarHBondContact O-N 3.5Å; I430-G432 PolarHBondContact O-N 3.18Å; I430-N433 PolarHBondContact O-N 3.07Å; I430-W434 VanDerWaalsContact O-CB 3.25Å; I430-W434 WeakPolarHBondContact O-CB 3.45Å; I430-W434 PolarHBondContact O-N 2.96Å
431	K	56.1	Low	48.7	Very low	178 Å²	178	90.7 Å²	90.7	77%	0.774	47%	0.473	S	S	*	.	H	α-helix	trans	-63.2	-41.1	180	-168.9	175	-178.7	178.2	0	112.1	S435	K431-S435 PolarHBondContact O-N 2.87Å
432	G	54.8	Low	49.3	Very low	36 Å²	36	93.5 Å²	93.5	37%	0.371	49%	0.487	S	S	.	.	H	α-helix	trans	-66.9	-45.9	176.9	0	0	0	0	0	113	K429 I430 S435 K436	K429-G432 PolarHBondContact O-N 3.46Å; I430-G432 PolarHBondContact O-N 3.18Å; G432-S435 PolarHBondContact O-N 3.49Å; G432-S435 PolarHBondContact O-OG 3.49Å; G432-K436 PolarHBondContact O-N 2.88Å
433	N	52.2	Low	50.1	Low	65 Å²	65	89.7 Å²	89.7	35%	0.348	49%	0.485	S	S	.	.	H	α-helix	trans	-71.8	-31.8	179.5	-71.8	-14.5	0	0	0	112.6	K429 I430 S435 K436 F437 V466	K429-N433 WeakPolarHBondContact O-CB 3.25Å; K429-N433 PolarHBondContact O-N 3.14Å; I430-N433 PolarHBondContact O-N 3.07Å; N433-S435 VanDerWaalsContact C-N 3.31Å; N433-S435 PolarHBondContact O-N 3.46Å; N433-K436 PolarHBondContact O-N 3.19Å; N433-K436 VanDerWaalsContact O-N 3.12Å; N433-F437 WeakPolarHBondContact O-CB 3.41Å; N433-F437 PolarHBondContact O-N 3.3Å; N433-V466 HydrophobicContact CB-CG1 3.5Å; N433-V466 VanDerWaalsContact CB-CG1 3.5Å
434	W	50.4	Low	50.3	Low	122 Å²	122	88.6 Å²	88.6	46%	0.462	48%	0.48	S	S	.	.	H	α-helix	trans	-58.2	-43.2	171.7	-171	-97.2	0	0	0	111.7	I430 K436 F437 G438 W450 F462	I430-W434 VanDerWaalsContact O-CB 3.25Å; I430-W434 WeakPolarHBondContact O-CB 3.45Å; I430-W434 PolarHBondContact O-N 2.96Å; W434-K436 VanDerWaalsContact C-N 3.27Å; W434-K436 PolarHBondContact O-N 3.45Å; W434-F437 PolarHBondContact O-N 3.48Å; W434-G438 WeakPolarHBondContact O-CA 3.34Å; W434-G438 PolarHBondContact O-N 3.05Å; W434-W450 AromaticContact CH2-CH2 3.81Å; W434-W450 HydrophobicContact CH2-CH2 3.81Å; W434-W450 AromaticContact CZ2-CH2 4Å; W434-W450 HydrophobicContact CZ2-CH2 4Å; W434-F462 HydrophobicContact CE3-CD2 4.11Å; W434-F462 HydrophobicContact CE3-CE1 4.41Å; W434-F462 AromaticContact CE3-CE2 3.43Å; W434-F462 HydrophobicContact CE3-CE2 3.43Å; W434-F462 VanDerWaalsContact CE3-CE2 3.43Å; W434-F462 AromaticContact CE3-CZ 3.61Å; W434-F462 HydrophobicContact CE3-CZ 3.61Å; W434-F462 HydrophobicContact CZ3-CD1 4.33Å; W434-F462 HydrophobicContact CZ3-CD2 4.1Å; W434-F462 AromaticContact CZ3-CE1 3.93Å; W434-F462 HydrophobicContact CZ3-CE1 3.93Å; W434-F462 AromaticContact CZ3-CE2 3.68Å; W434-F462 HydrophobicContact CZ3-CE2 3.68Å; W434-F462 HydrophobicContact CZ3-CG 4.42Å; W434-F462 AromaticContact CZ3-CZ 3.58Å; W434-F462 HydrophobicContact CZ3-CZ 3.58Å
435	S	55.9	Low	50.7	Low	59 Å²	59	94.5 Å²	94.5	41%	0.413	51%	0.507	S	S	.	.	H	α-helix	trans	-64.5	-31.3	177.1	78	0	0	0	0	113	K431 G432 N433 K439	K431-S435 PolarHBondContact O-N 2.87Å; G432-S435 PolarHBondContact O-N 3.49Å; G432-S435 PolarHBondContact O-OG 3.49Å; N433-S435 VanDerWaalsContact C-N 3.31Å; N433-S435 PolarHBondContact O-N 3.46Å; S435-K439 VanDerWaalsContact O-CB 3.28Å; S435-K439 WeakPolarHBondContact O-CB 3.26Å; S435-K439 WeakPolarHBondContact O-CG 3.26Å; S435-K439 PolarHBondContact O-N 2.74Å; S435-K439 VanDerWaalsContact O-N 3.14Å
436	K	54.6	Low	50.5	Low	150 Å²	150	92.2 Å²	92.2	65%	0.652	49%	0.494	S	S	*	.	H	α-helix	trans	-78.8	-41.6	177.2	-71.2	-178.5	179.2	175.7	0	112	G432 N433 W434 K440	G432-K436 PolarHBondContact O-N 2.88Å; N433-K436 PolarHBondContact O-N 3.19Å; N433-K436 VanDerWaalsContact O-N 3.12Å; W434-K436 VanDerWaalsContact C-N 3.27Å; W434-K436 PolarHBondContact O-N 3.45Å; K436-K440 PolarHBondContact O-N 3.39Å; K436-K440 VanDerWaalsContact O-N 3.08Å
437	F	53	Low	50.8	Low	24 Å²	24	93.2 Å²	93.2	11%	0.105	51%	0.512	C	S	.	.	H	α-helix	trans	-68.2	-49.2	177.3	-165.9	-97.5	0	0	0	110.4	N433 W434 K439 K440 T441 A458 Q461 F462	N433-F437 WeakPolarHBondContact O-CB 3.41Å; N433-F437 PolarHBondContact O-N 3.3Å; W434-F437 PolarHBondContact O-N 3.48Å; F437-K439 PolarHBondContact O-N 3.17Å; F437-K440 PolarHBondContact O-N 3.35Å; F437-T441 HydrophobicContact CD1-CG2 4.31Å; F437-T441 HydrophobicContact CE1-CG2 3.84Å; F437-T441 HydrophobicContact CZ-CG2 4.18Å; F437-T441 PolarHBondContact O-N 3.26Å; F437-T441 PolarHBondContact O-OG1 3.33Å; F437-A458 HydrophobicContact CE1-CB 4.22Å; F437-A458 HydrophobicContact CZ-CB 4.06Å; F437-A458 WeakPolarHBondContact CZ-O 3.39Å; F437-Q461 HydrophobicContact CE2-CB 4.32Å; F437-Q461 HydrophobicContact CE2-CG 4.42Å; F437-Q461 HydrophobicContact CZ-CB 4.34Å; F437-F462 HydrophobicContact CD1-CB 4.3Å; F437-F462 HydrophobicContact CD1-CD2 4.32Å; F437-F462 HydrophobicContact CE1-CB 3.97Å; F437-F462 HydrophobicContact CG-CD2 4.41Å; F437-F462 HydrophobicContact CZ-CB 4.11Å
438	G	52	Low	50.9	Low	19 Å²	19	90.4 Å²	90.4	20%	0.196	52%	0.516	C	S	.	.	H	α-helix	trans	-53	-48.2	173.4	0	0	0	0	0	112.2	W434 K440 T441 V442	W434-G438 WeakPolarHBondContact O-CA 3.34Å; W434-G438 PolarHBondContact O-N 3.05Å; G438-K440 PolarHBondContact O-N 2.9Å; G438-T441 WeakPolarHBondContact CA-OG1 3.49Å; G438-T441 PolarHBondContact O-N 2.88Å; G438-T441 PolarHBondContact O-OG1 3.44Å; G438-V442 WeakPolarHBondContact O-CB 3.22Å; G438-V442 WeakPolarHBondContact O-CG2 3.32Å; G438-V442 PolarHBondContact O-N 2.89Å
439	K	50.4	Low	50.7	Low	157 Å²	157	92.1 Å²	92.1	68%	0.683	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-36.5	175.8	-77.9	178	-179.1	-173.1	0	113.5	S435 F437 A443	S435-K439 VanDerWaalsContact O-CB 3.28Å; S435-K439 WeakPolarHBondContact O-CB 3.26Å; S435-K439 WeakPolarHBondContact O-CG 3.26Å; S435-K439 PolarHBondContact O-N 2.74Å; S435-K439 VanDerWaalsContact O-N 3.14Å; F437-K439 PolarHBondContact O-N 3.17Å; K439-A443 VanDerWaalsContact O-CB 3.29Å; K439-A443 WeakPolarHBondContact O-CB 3.31Å; K439-A443 PolarHBondContact O-N 2.84Å; K439-A443 VanDerWaalsContact O-N 3.11Å
440	K	49.6	Very low	50.9	Low	178 Å²	178	90.7 Å²	90.7	77%	0.774	50%	0.502	S	S	*	.	H	α-helix	trans	-68.5	-37.8	175.5	-104.4	-175.3	174.2	-177	0	112.6	K436 F437 G438	K436-K440 PolarHBondContact O-N 3.39Å; K436-K440 VanDerWaalsContact O-N 3.08Å; F437-K440 PolarHBondContact O-N 3.35Å; G438-K440 PolarHBondContact O-N 2.9Å
441	T	48.2	Very low	51.1	Low	29 Å²	29	96.2 Å²	96.2	18%	0.178	53%	0.525	C	S	.	.	H	α-helix	trans	-78.1	-24.9	175.9	42.5	0	0	0	0	113.6	F437 G438 A458	F437-T441 HydrophobicContact CD1-CG2 4.31Å; F437-T441 HydrophobicContact CE1-CG2 3.84Å; F437-T441 HydrophobicContact CZ-CG2 4.18Å; F437-T441 PolarHBondContact O-N 3.26Å; F437-T441 PolarHBondContact O-OG1 3.33Å; G438-T441 WeakPolarHBondContact CA-OG1 3.49Å; G438-T441 PolarHBondContact O-N 2.88Å; G438-T441 PolarHBondContact O-OG1 3.44Å; T441-A458 HydrophobicContact CG2-CB 4.06Å
442	V	46.1	Very low	51	Low	120 Å²	120	89.2 Å²	89.2	73%	0.727	50%	0.5	S	S	*	.	H	α-helix	trans	-86.1	-22.4	-179.4	170.5	0	0	0	0	112	G438 S444	G438-V442 WeakPolarHBondContact O-CB 3.22Å; G438-V442 WeakPolarHBondContact O-CG2 3.32Å; G438-V442 PolarHBondContact O-N 2.89Å; V442-S444 VanDerWaalsContact C-N 3.29Å; V442-S444 PolarHBondContact O-N 3.26Å
443	A	51.7	Low	51	Low	90 Å²	90	96.2 Å²	96.2	74%	0.744	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	6.6	-178.8	0	0	0	0	0	115.1	K439	K439-A443 VanDerWaalsContact O-CB 3.29Å; K439-A443 WeakPolarHBondContact O-CB 3.31Å; K439-A443 PolarHBondContact O-N 2.84Å; K439-A443 VanDerWaalsContact O-N 3.11Å
444	S	41.1	Very low	50.8	Low	77 Å²	77	96.8 Å²	96.8	54%	0.538	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.2	129.6	171.9	-175	0	0	0	0	107.8	V442 S446	V442-S444 VanDerWaalsContact C-N 3.29Å; V442-S444 PolarHBondContact O-N 3.26Å; S444-S446 PolarHBondContact O-N 3.06Å
445	D	46.3	Very low	50.9	Low	175 Å²	175	95 Å²	95	94%	0.936	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	68.2	-172.3	-84.8	-34.5	0	0	0	114.1
446	S	41	Very low	50.6	Low	30 Å²	30	98.3 Å²	98.3	21%	0.21	57%	0.57	C	S	.	*			trans	-142	33.9	-171.1	-71.4	0	0	0	0	111.2	S444 A448 Q449	S444-S446 PolarHBondContact O-N 3.06Å; S446-A448 PolarHBondContact O-N 3.41Å; S446-A448 VanDerWaalsContact O-N 3.1Å; S446-Q449 WeakPolarHBondContact O-CB 3.41Å; S446-Q449 PolarHBondContact O-N 2.87Å; S446-Q449 PolarHBondContact OG-NE2 2.94Å
447	A	49	Very low	50.9	Low	89 Å²	89	92.7 Å²	92.7	74%	0.736	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-52.8	-26	161.6	0	0	0	0	0	111.5	Q449	A447-Q449 VanDerWaalsContact C-N 3.26Å; A447-Q449 PolarHBondContact O-N 3.45Å
448	A	50.4	Low	51.2	Low	88 Å²	88	91.9 Å²	91.9	73%	0.727	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-68.2	-13.4	171.8	0	0	0	0	0	115	S446	S446-A448 PolarHBondContact O-N 3.41Å; S446-A448 VanDerWaalsContact O-N 3.1Å
449	Q	53.3	Low	51.8	Low	88 Å²	88	95.3 Å²	95.3	41%	0.411	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-90.2	-4.2	-179.5	-66.9	-176.8	-4.4	0	0	114.4	S446 A447 F451 A458	S446-Q449 WeakPolarHBondContact O-CB 3.41Å; S446-Q449 PolarHBondContact O-N 2.87Å; S446-Q449 PolarHBondContact OG-NE2 2.94Å; A447-Q449 VanDerWaalsContact C-N 3.26Å; A447-Q449 PolarHBondContact O-N 3.45Å; Q449-F451 PolarHBondContact O-N 3.38Å; Q449-A458 PolarHBondContact O-N 3.22Å
450	W	57.4	Low	52.1	Low	87 Å²	87	92.3 Å²	92.3	33%	0.33	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-61	-24.3	174.6	-91.5	57.5	0	0	0	113.5	W434 N457	W434-W450 AromaticContact CH2-CH2 3.81Å; W434-W450 HydrophobicContact CH2-CH2 3.81Å; W434-W450 AromaticContact CZ2-CH2 4Å; W434-W450 HydrophobicContact CZ2-CH2 4Å; W450-N457 PolarHBondContact O-OD1 2.99Å
451	F	58.9	Low	52.5	Low	160 Å²	160	88.5 Å²	88.5	70%	0.702	53%	0.53	S	S	*	.	S	Bend	trans	-135.5	12.8	179.9	-59.5	-70.7	0	0	0	113	Q449 L453 N457	Q449-F451 PolarHBondContact O-N 3.38Å; F451-L453 PolarHBondContact O-N 2.82Å; F451-N457 VanDerWaalsContact C-ND2 3.33Å; F451-N457 WeakPolarHBondContact CA-ND2 3.41Å
452	A	55.8	Low	53.2	Low	30 Å²	30	88.8 Å²	88.8	25%	0.248	53%	0.529	C	S	.	.			trans	-63.1	124.4	177.3	0	0	0	0	0	109.9	S454 N457	A452-S454 PolarHBondContact O-N 3.31Å; A452-N457 WeakPolarHBondContact O-CB 3.49Å; A452-N457 PolarHBondContact O-ND2 3.19Å
453	L	53.7	Low	53.7	Low	184 Å²	184	87.2 Å²	87.2	96%	0.963	52%	0.515	S	S	*	.	S	Bend	trans	-73.5	19.5	179.7	-85.7	151.1	0	0	0	113.7	F451	F451-L453 PolarHBondContact O-N 2.82Å
454	S	47.8	Very low	54.1	Low	76 Å²	76	90 Å²	90	53%	0.531	52%	0.517	S	S	.	.	S	Bend	trans	-95.6	162.4	168.9	82.4	0	0	0	0	110.3	A452 N456 N457	A452-S454 PolarHBondContact O-N 3.31Å; S454-N456 PolarHBondContact O-N 2.88Å; S454-N457 PolarHBondContact O-N 3.42Å
455	G	52.6	Low	54.9	Low	86 Å²	86	92.7 Å²	92.7	89%	0.887	52%	0.521	S	S	*	.	S	Bend	trans	-59.5	0.8	-175.4	0	0	0	0	0	116.8
456	N	49.7	Very low	55.1	Low	128 Å²	128	85.1 Å²	85.1	68%	0.684	48%	0.481	S	S	*	.			trans	-109.2	40.4	178.2	-73.3	-12.9	0	0	0	112.7	S454 A458	S454-N456 PolarHBondContact O-N 2.88Å; N456-A458 PolarHBondContact O-N 3.35Å
457	N	61.9	Low	55.4	Low	31 Å²	31	90 Å²	90	17%	0.166	50%	0.502	C	S	.	.			trans	-80.3	117.1	-179	-162.8	-41.6	0	0	0	111.9	W450 F451 A452 S454 F459 L460 Q461	W450-N457 PolarHBondContact O-OD1 2.99Å; F451-N457 VanDerWaalsContact C-ND2 3.33Å; F451-N457 WeakPolarHBondContact CA-ND2 3.41Å; A452-N457 WeakPolarHBondContact O-CB 3.49Å; A452-N457 PolarHBondContact O-ND2 3.19Å; S454-N457 PolarHBondContact O-N 3.42Å; N457-F459 VanDerWaalsContact C-N 3.26Å; N457-F459 PolarHBondContact O-N 3.23Å; N457-F459 PolarHBondContact OD1-N 2.99Å; N457-L460 PolarHBondContact O-N 3.43Å; N457-Q461 PolarHBondContact O-N 2.8Å
458	A	58.3	Low	55.1	Low	8 Å²	8	87.7 Å²	87.7	7%	0.066	48%	0.479	C	S	.	.	H	α-helix	trans	-60.8	-30.6	-172.2	0	0	0	0	0	113.5	F437 T441 Q449 N456 Q461 F462	F437-A458 HydrophobicContact CE1-CB 4.22Å; F437-A458 HydrophobicContact CZ-CB 4.06Å; F437-A458 WeakPolarHBondContact CZ-O 3.39Å; T441-A458 HydrophobicContact CG2-CB 4.06Å; Q449-A458 PolarHBondContact O-N 3.22Å; N456-A458 PolarHBondContact O-N 3.35Å; A458-Q461 PolarHBondContact O-N 3.41Å; A458-F462 PolarHBondContact O-N 2.91Å
459	F	63.6	Low	54.7	Low	90 Å²	90	90.1 Å²	90.1	40%	0.395	49%	0.485	S	S	.	.	H	α-helix	trans	-66.2	-42.6	179.9	-180	-100.3	0	0	0	112.7	N457 Q461 F462 M463	N457-F459 VanDerWaalsContact C-N 3.26Å; N457-F459 PolarHBondContact O-N 3.23Å; N457-F459 PolarHBondContact OD1-N 2.99Å; F459-Q461 VanDerWaalsContact C-N 3.31Å; F459-Q461 PolarHBondContact O-N 3.37Å; F459-F462 WeakPolarHBondContact O-CB 3.47Å; F459-F462 PolarHBondContact O-N 2.85Å; F459-M463 HydrophobicContact CD1-CE 4.47Å; F459-M463 HydrophobicContact CE1-CE 3.78Å; F459-M463 HydrophobicContact CE1-CG 3.95Å; F459-M463 HydrophobicContact CE1-SD 3.73Å; F459-M463 HydrophobicContact CE2-CG 4.5Å; F459-M463 HydrophobicContact CZ-CE 4.47Å; F459-M463 HydrophobicContact CZ-CG 3.95Å; F459-M463 HydrophobicContact CZ-SD 3.81Å; F459-M463 PolarHBondContact O-N 3.34Å
460	L	58.4	Low	54	Low	94 Å²	94	92 Å²	92	49%	0.492	49%	0.494	S	S	.	.	H	α-helix	trans	-66.1	-37.2	177.5	-71	176.9	0	0	0	111.3	N457 F462 M463 L464	N457-L460 PolarHBondContact O-N 3.43Å; L460-F462 VanDerWaalsContact C-N 3.32Å; L460-F462 PolarHBondContact O-N 2.99Å; L460-M463 HydrophobicContact CD2-CE 4.14Å; L460-M463 PolarHBondContact O-N 2.91Å; L460-L464 WeakPolarHBondContact O-CB 3.26Å; L460-L464 WeakPolarHBondContact O-CG 3.22Å; L460-L464 PolarHBondContact O-N 3.43Å
461	Q	57.4	Low	52.8	Low	99 Å²	99	92.4 Å²	92.4	46%	0.463	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-38.4	175.5	-158.6	-177.3	31.4	0	0	111.7	F437 N457 A458 F459 Q465	F437-Q461 HydrophobicContact CE2-CB 4.32Å; F437-Q461 HydrophobicContact CE2-CG 4.42Å; F437-Q461 HydrophobicContact CZ-CB 4.34Å; N457-Q461 PolarHBondContact O-N 2.8Å; A458-Q461 PolarHBondContact O-N 3.41Å; F459-Q461 VanDerWaalsContact C-N 3.31Å; F459-Q461 PolarHBondContact O-N 3.37Å; Q461-Q465 HydrophobicContact CG-CG 4.37Å; Q461-Q465 VanDerWaalsContact O-CB 3.28Å; Q461-Q465 WeakPolarHBondContact O-CB 3.29Å; Q461-Q465 WeakPolarHBondContact O-CG 3.44Å; Q461-Q465 PolarHBondContact O-N 2.93Å
462	F	62.2	Low	51.9	Low	34 Å²	34	86.3 Å²	86.3	15%	0.149	49%	0.485	C	S	.	.	H	α-helix	trans	-62.3	-49.1	173.2	172.9	-102.5	0	0	0	112.1	W434 F437 A458 F459 L460 L464 Q465 V466	W434-F462 HydrophobicContact CE3-CD2 4.11Å; W434-F462 HydrophobicContact CE3-CE1 4.41Å; W434-F462 AromaticContact CE3-CE2 3.43Å; W434-F462 HydrophobicContact CE3-CE2 3.43Å; W434-F462 VanDerWaalsContact CE3-CE2 3.43Å; W434-F462 AromaticContact CE3-CZ 3.61Å; W434-F462 HydrophobicContact CE3-CZ 3.61Å; W434-F462 HydrophobicContact CZ3-CD1 4.33Å; W434-F462 HydrophobicContact CZ3-CD2 4.1Å; W434-F462 AromaticContact CZ3-CE1 3.93Å; W434-F462 HydrophobicContact CZ3-CE1 3.93Å; W434-F462 AromaticContact CZ3-CE2 3.68Å; W434-F462 HydrophobicContact CZ3-CE2 3.68Å; W434-F462 HydrophobicContact CZ3-CG 4.42Å; W434-F462 AromaticContact CZ3-CZ 3.58Å; W434-F462 HydrophobicContact CZ3-CZ 3.58Å; F437-F462 HydrophobicContact CD1-CB 4.3Å; F437-F462 HydrophobicContact CD1-CD2 4.32Å; F437-F462 HydrophobicContact CE1-CB 3.97Å; F437-F462 HydrophobicContact CG-CD2 4.41Å; F437-F462 HydrophobicContact CZ-CB 4.11Å; A458-F462 PolarHBondContact O-N 2.91Å; F459-F462 WeakPolarHBondContact O-CB 3.47Å; F459-F462 PolarHBondContact O-N 2.85Å; L460-F462 VanDerWaalsContact C-N 3.32Å; L460-F462 PolarHBondContact O-N 2.99Å; F462-L464 PolarHBondContact O-N 3.44Å; F462-Q465 PolarHBondContact O-N 2.87Å; F462-V466 HydrophobicContact CD2-CB 3.8Å; F462-V466 HydrophobicContact CD2-CG1 4.17Å; F462-V466 HydrophobicContact CD2-CG2 3.71Å; F462-V466 HydrophobicContact CE2-CB 3.72Å; F462-V466 HydrophobicContact CE2-CG1 3.62Å; F462-V466 HydrophobicContact CE2-CG2 4.05Å; F462-V466 HydrophobicContact CZ-CB 4.45Å; F462-V466 HydrophobicContact CZ-CG1 4.34Å; F462-V466 VanDerWaalsContact O-CB 3.28Å; F462-V466 WeakPolarHBondContact O-CB 3.36Å; F462-V466 PolarHBondContact O-N 3.26Å
463	M	57.7	Low	50.8	Low	87 Å²	87	91.6 Å²	91.6	43%	0.429	51%	0.505	S	S	.	.	H	α-helix	trans	-62.9	-41	-179.8	-73.1	-149	-55.3	0	0	112.8	F459 L460	F459-M463 HydrophobicContact CD1-CE 4.47Å; F459-M463 HydrophobicContact CE1-CE 3.78Å; F459-M463 HydrophobicContact CE1-CG 3.95Å; F459-M463 HydrophobicContact CE1-SD 3.73Å; F459-M463 HydrophobicContact CE2-CG 4.5Å; F459-M463 HydrophobicContact CZ-CE 4.47Å; F459-M463 HydrophobicContact CZ-CG 3.95Å; F459-M463 HydrophobicContact CZ-SD 3.81Å; F459-M463 PolarHBondContact O-N 3.34Å; L460-M463 HydrophobicContact CD2-CE 4.14Å; L460-M463 PolarHBondContact O-N 2.91Å
464	L	59.9	Low	50.2	Low	150 Å²	150	89.5 Å²	89.5	79%	0.785	49%	0.49	S	S	*	.	H	α-helix	trans	-76	-30.4	-177.3	-69.9	171.1	0	0	0	113.4	L460 F462	L460-L464 WeakPolarHBondContact O-CB 3.26Å; L460-L464 WeakPolarHBondContact O-CG 3.22Å; L460-L464 PolarHBondContact O-N 3.43Å; F462-L464 PolarHBondContact O-N 3.44Å
465	Q	56.7	Low	49.9	Very low	133 Å²	133	89.6 Å²	89.6	62%	0.621	49%	0.487	S	S	*	.	H	α-helix	trans	-100.9	-24.3	-174.6	-65.1	-174.1	-12.7	0	0	114.5	Q461 F462	Q461-Q465 HydrophobicContact CG-CG 4.37Å; Q461-Q465 VanDerWaalsContact O-CB 3.28Å; Q461-Q465 WeakPolarHBondContact O-CB 3.29Å; Q461-Q465 WeakPolarHBondContact O-CG 3.44Å; Q461-Q465 PolarHBondContact O-N 2.93Å; F462-Q465 PolarHBondContact O-N 2.87Å
466	V	50.7	Low	49.8	Very low	16 Å²	16	89 Å²	89	10%	0.097	46%	0.462	C	S	.	.	H	α-helix	trans	-110.7	-15.9	-165.7	-171.5	0	0	0	0	114.1	N433 F462 P468	N433-V466 HydrophobicContact CB-CG1 3.5Å; N433-V466 VanDerWaalsContact CB-CG1 3.5Å; F462-V466 HydrophobicContact CD2-CB 3.8Å; F462-V466 HydrophobicContact CD2-CG1 4.17Å; F462-V466 HydrophobicContact CD2-CG2 3.71Å; F462-V466 HydrophobicContact CE2-CB 3.72Å; F462-V466 HydrophobicContact CE2-CG1 3.62Å; F462-V466 HydrophobicContact CE2-CG2 4.05Å; F462-V466 HydrophobicContact CZ-CB 4.45Å; F462-V466 HydrophobicContact CZ-CG1 4.34Å; F462-V466 VanDerWaalsContact O-CB 3.28Å; F462-V466 WeakPolarHBondContact O-CB 3.36Å; F462-V466 PolarHBondContact O-N 3.26Å; V466-P468 WeakPolarHBondContact O-CD 3.44Å
467	M	47.1	Very low	50	Low	133 Å²	133	85.1 Å²	85.1	66%	0.655	44%	0.442	S	S	*	.	S	Bend	trans	-64.3	118.7	172.7	-84.2	-82.4	164.8	0	0	110.2	T469	M467-T469 PolarHBondContact O-N 2.89Å
468	P	42.8	Very low	49.8	Very low	40 Å²	40	83.8 Å²	83.8	26%	0.26	44%	0.435	S	S	.	.			trans	-70.3	122	-175.7	26.3	-31.1	0	0	0	111	V466 Q470	V466-P468 WeakPolarHBondContact O-CD 3.44Å; P468-Q470 VanDerWaalsContact C-N 3.25Å; P468-Q470 PolarHBondContact O-N 3.17Å
469	T	42.1	Very low	49.7	Very low	138 Å²	138	89.2 Å²	89.2	85%	0.847	45%	0.454	S	S	*	.			trans	-82.8	2.5	172.1	49.5	0	0	0	0	113.5	M467	M467-T469 PolarHBondContact O-N 2.89Å
470	Q	39.9	Very low	49.7	Very low	129 Å²	129	92.9 Å²	92.9	60%	0.603	47%	0.465	S	S	*	.			trans	-116.2	111.9	-173.5	-64.8	-178.9	9.7	0	0	110.3	P468 A472	P468-Q470 VanDerWaalsContact C-N 3.25Å; P468-Q470 PolarHBondContact O-N 3.17Å; Q470-A472 PolarHBondContact O-N 3.23Å
471	T	32.1	Very low	49.9	Very low	94 Å²	94	92 Å²	92	58%	0.577	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.6	123.6	165.4	43.3	0	0	0	0	108.8	P423	P423-T471 HydrophobicContact CB-CG2 4.41Å
472	A	39.1	Very low	50.1	Low	33 Å²	33	87.4 Å²	87.4	27%	0.273	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.9	174	0	0	0	0	0	109.1	S424 D426 Q470 H474	S424-A472 PolarHBondContact O-N 3.06Å; D426-A472 HydrophobicContact CB-CB 3.33Å; Q470-A472 PolarHBondContact O-N 3.23Å; A472-H474 PolarHBondContact O-N 3.02Å
473	Q	33.7	Very low	50.2	Low	140 Å²	140	87.9 Å²	87.9	65%	0.654	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	114.9	-176.7	-61.4	170.3	-26.5	0	0	109.5	V475	Q473-V475 HydrophobicContact CB-CG2 4.24Å; Q473-V475 PolarHBondContact O-N 3.22Å
474	H	39.7	Very low	50.7	Low	140 Å²	140	88.8 Å²	88.8	65%	0.648	45%	0.447	S	S	*	.			trans	-81.3	60.3	170.3	-135.9	-77.7	0	0	0	108.8	A472 I476	A472-H474 PolarHBondContact O-N 3.02Å; H474-I476 VanDerWaalsContact ND1-CG1 3.34Å; H474-I476 WeakPolarHBondContact ND1-CG1 3.45Å; H474-I476 PolarHBondContact O-N 3.42Å
475	V	42.9	Very low	50.9	Low	78 Å²	78	83 Å²	83	47%	0.473	42%	0.417	S	S	.	.			trans	-68.3	94	161.3	-179.2	0	0	0	0	104.4	Q473 D477	Q473-V475 HydrophobicContact CB-CG2 4.24Å; Q473-V475 PolarHBondContact O-N 3.22Å; V475-D477 PolarHBondContact O-N 3.25Å
476	I	49.8	Very low	51.3	Low	73 Å²	73	77.2 Å²	77.2	37%	0.374	39%	0.391	S	S	.	.			trans	-65.8	91.6	167.9	-55.5	172	0	0	0	104.7	Y371 H474 S478	Y371-I476 HydrophobicContact CD2-CB 4.4Å; Y371-I476 HydrophobicContact CD2-CG2 4.1Å; Y371-I476 HydrophobicContact CE1-CD1 3.93Å; Y371-I476 HydrophobicContact CE2-CB 3.95Å; Y371-I476 HydrophobicContact CE2-CD1 4.29Å; Y371-I476 HydrophobicContact CE2-CG2 3.27Å; H474-I476 VanDerWaalsContact ND1-CG1 3.34Å; H474-I476 WeakPolarHBondContact ND1-CG1 3.45Å; H474-I476 PolarHBondContact O-N 3.42Å; I476-S478 PolarHBondContact O-N 3.02Å
477	D	54	Low	52.1	Low	47 Å²	47	83.9 Å²	83.9	25%	0.251	42%	0.419	S	S	.	.			trans	-69.1	86.2	177.3	-170.5	-4.8	0	0	0	106	V475 R479 R480 E481	V475-D477 PolarHBondContact O-N 3.25Å; D477-R479 CarbonylContact O-C 3.47Å; D477-R479 PolarHBondContact O-N 3.2Å; D477-R479 WeakPolarHBondContact OD1-CB 3.3Å; D477-R479 PolarHBondContact OD1-N 3.22Å; D477-R480 HydrophobicContact CB-CB 3.99Å; D477-R480 HydrophobicContact CB-CG 3.88Å; D477-R480 WeakPolarHBondContact O-CA 3.32Å; D477-R480 WeakPolarHBondContact O-CB 3.38Å; D477-R480 PolarHBondContact O-N 2.93Å; D477-R480 WeakPolarHBondContact OD2-CD 3.4Å; D477-R480 VanDerWaalsContact OD2-CG 3.24Å; D477-R480 WeakPolarHBondContact OD2-CG 3.44Å; D477-R480 IonicContact OD2-CZ 3.98Å; D477-R480 IonicContact OD2-NE 3.78Å; D477-R480 PolarHBondContact OD2-NE 3.46Å; D477-R480 IonicContact OD2-NH2 2.9Å; D477-E481 PolarHBondContact O-N 3.34Å
478	S	57	Low	53	Low	4 Å²	4	80.7 Å²	80.7	3%	0.028	41%	0.407	C	S	.	.	H	α-helix	trans	-49.6	-27.9	176.2	59.9	0	0	0	0	111.2	M416 I476 E481 L482	M416-S478 WeakPolarHBondContact CE-OG 3.32Å; M416-S478 PolarHBondContact SD-OG 2.96Å; I476-S478 PolarHBondContact O-N 3.02Å; S478-E481 PolarHBondContact O-N 2.84Å; S478-L482 WeakPolarHBondContact O-CB 3.33Å; S478-L482 WeakPolarHBondContact O-CD1 3.45Å; S478-L482 WeakPolarHBondContact O-CG 3.06Å; S478-L482 PolarHBondContact O-N 3.02Å
479	R	56.7	Low	54	Low	122 Å²	122	79.2 Å²	79.2	46%	0.46	40%	0.398	S	S	.	.	H	α-helix	trans	-66.1	-44.7	171.6	-173.6	-174.5	171.8	167.2	-0.2	112.5	D477 E481 L482 D483	D477-R479 CarbonylContact O-C 3.47Å; D477-R479 PolarHBondContact O-N 3.2Å; D477-R479 WeakPolarHBondContact OD1-CB 3.3Å; D477-R479 PolarHBondContact OD1-N 3.22Å; R479-E481 VanDerWaalsContact C-N 3.34Å; R479-L482 PolarHBondContact O-N 2.75Å; R479-D483 WeakPolarHBondContact O-CB 3.41Å; R479-D483 PolarHBondContact O-N 3.13Å
480	R	63.4	Low	55.1	Low	167 Å²	167	73.3 Å²	73.3	63%	0.63	36%	0.361	S	S	*	.	H	α-helix	trans	-62.8	-42.5	173.7	-75.6	174.2	-152.1	-176.5	-2.6	111.3	D477 D483 I484	D477-R480 HydrophobicContact CB-CB 3.99Å; D477-R480 HydrophobicContact CB-CG 3.88Å; D477-R480 WeakPolarHBondContact O-CA 3.32Å; D477-R480 WeakPolarHBondContact O-CB 3.38Å; D477-R480 PolarHBondContact O-N 2.93Å; D477-R480 WeakPolarHBondContact OD2-CD 3.4Å; D477-R480 VanDerWaalsContact OD2-CG 3.24Å; D477-R480 WeakPolarHBondContact OD2-CG 3.44Å; D477-R480 IonicContact OD2-CZ 3.98Å; D477-R480 IonicContact OD2-NE 3.78Å; D477-R480 PolarHBondContact OD2-NE 3.46Å; D477-R480 IonicContact OD2-NH2 2.9Å; R480-D483 PolarHBondContact O-N 3.35Å; R480-I484 WeakPolarHBondContact O-CB 3.42Å; R480-I484 VanDerWaalsContact O-CG1 3.23Å; R480-I484 WeakPolarHBondContact O-CG1 3.14Å; R480-I484 PolarHBondContact O-N 3.09Å
481	E	62.9	Low	56.3	Low	74 Å²	74	73.9 Å²	73.9	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-62.1	-46.4	177.7	-170.5	171.1	178.8	0	0	110.6	D477 S478 R479 D483 I484 T485	D477-E481 PolarHBondContact O-N 3.34Å; S478-E481 PolarHBondContact O-N 2.84Å; R479-E481 VanDerWaalsContact C-N 3.34Å; E481-D483 PolarHBondContact O-N 2.82Å; E481-I484 PolarHBondContact O-N 3.2Å; E481-T485 WeakPolarHBondContact O-CB 3.31Å; E481-T485 PolarHBondContact O-N 3.2Å; E481-T485 PolarHBondContact O-OG1 3.27Å
482	L	62.2	Low	57.8	Low	4 Å²	4	72 Å²	72	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-60	-42.6	172.9	-71.6	169	0	0	0	112.3	V374 V378 L405 L408 R409 I412 S478 R479 I484 T485 V486	V374-L482 HydrophobicContact CG1-CD1 4.47Å; V378-L482 HydrophobicContact CG2-CD2 3.62Å; L405-L482 HydrophobicContact CD2-CD2 3.69Å; L408-L482 HydrophobicContact CD2-CD2 3.94Å; R409-L482 HydrophobicContact CB-CD1 4.38Å; I412-L482 HydrophobicContact CD1-CD1 3.37Å; I412-L482 HydrophobicContact CG1-CD1 4.47Å; S478-L482 WeakPolarHBondContact O-CB 3.33Å; S478-L482 WeakPolarHBondContact O-CD1 3.45Å; S478-L482 WeakPolarHBondContact O-CG 3.06Å; S478-L482 PolarHBondContact O-N 3.02Å; R479-L482 PolarHBondContact O-N 2.75Å; L482-I484 VanDerWaalsContact C-N 3.33Å; L482-I484 PolarHBondContact O-N 3.16Å; L482-T485 PolarHBondContact O-N 3.26Å; L482-V486 WeakPolarHBondContact O-CB 3.34Å; L482-V486 VanDerWaalsContact O-CG2 3.28Å; L482-V486 WeakPolarHBondContact O-CG2 3.22Å; L482-V486 PolarHBondContact O-N 3.27Å
483	D	64.4	Low	58.7	Low	44 Å²	44	71.2 Å²	71.2	24%	0.235	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-36.6	177.9	-74.2	-21.9	0	0	0	111.8	R409 R479 R480 E481 K487	R409-D483 IonicContact CZ-OD1 3Å; R409-D483 IonicContact NE-OD1 3.59Å; R409-D483 IonicContact NH1-OD1 3.52Å; R409-D483 PolarHBondContact NH1-OD1 3.43Å; R409-D483 IonicContact NH1-OD2 3.66Å; R479-D483 WeakPolarHBondContact O-CB 3.41Å; R479-D483 PolarHBondContact O-N 3.13Å; R480-D483 PolarHBondContact O-N 3.35Å; E481-D483 PolarHBondContact O-N 2.82Å; D483-K487 WeakPolarHBondContact O-CB 3.35Å; D483-K487 VanDerWaalsContact O-CG 3.29Å; D483-K487 WeakPolarHBondContact O-CG 3.43Å; D483-K487 PolarHBondContact O-N 2.72Å
484	I	67.4	Low	59.9	Low	105 Å²	105	65.9 Å²	65.9	54%	0.538	31%	0.313	S	S	.	.	H	α-helix	trans	-68.3	-43.4	173.1	-68.8	163.6	0	0	0	110.4	R480 E481 L482 K487 T488	R480-I484 WeakPolarHBondContact O-CB 3.42Å; R480-I484 VanDerWaalsContact O-CG1 3.23Å; R480-I484 WeakPolarHBondContact O-CG1 3.14Å; R480-I484 PolarHBondContact O-N 3.09Å; E481-I484 PolarHBondContact O-N 3.2Å; L482-I484 VanDerWaalsContact C-N 3.33Å; L482-I484 PolarHBondContact O-N 3.16Å; I484-K487 PolarHBondContact O-N 3.34Å; I484-T488 WeakPolarHBondContact O-CB 3.14Å; I484-T488 PolarHBondContact O-N 3.12Å; I484-T488 PolarHBondContact O-OG1 3.18Å
485	T	65.5	Low	60.6	Low	28 Å²	28	65.6 Å²	65.6	17%	0.172	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-41.1	178	-58	0	0	0	0	110.8	V378 L405 E481 L482 T488 A489	V378-T485 HydrophobicContact CG1-CG2 4.43Å; L405-T485 HydrophobicContact CD1-CG2 3.64Å; E481-T485 WeakPolarHBondContact O-CB 3.31Å; E481-T485 PolarHBondContact O-N 3.2Å; E481-T485 PolarHBondContact O-OG1 3.27Å; L482-T485 PolarHBondContact O-N 3.26Å; T485-T488 PolarHBondContact O-N 3.1Å; T485-A489 VanDerWaalsContact O-CB 3.29Å; T485-A489 WeakPolarHBondContact O-CB 3.14Å; T485-A489 PolarHBondContact O-N 2.92Å
486	V	64.7	Low	61	Low	13 Å²	13	66.9 Å²	66.9	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-59.5	-51.2	172.5	170.3	0	0	0	0	110.3	L405 L482 T488 A489 F490	L405-V486 HydrophobicContact CB-CG2 3.73Å; L405-V486 HydrophobicContact CD1-CG2 3.83Å; L405-V486 HydrophobicContact CG-CG2 4.46Å; L482-V486 WeakPolarHBondContact O-CB 3.34Å; L482-V486 VanDerWaalsContact O-CG2 3.28Å; L482-V486 WeakPolarHBondContact O-CG2 3.22Å; L482-V486 PolarHBondContact O-N 3.27Å; V486-T488 PolarHBondContact O-N 2.96Å; V486-A489 PolarHBondContact O-N 3.43Å; V486-F490 HydrophobicContact CG1-CD2 3.87Å; V486-F490 HydrophobicContact CG1-CE2 3.84Å; V486-F490 VanDerWaalsContact O-CD2 3.29Å; V486-F490 WeakPolarHBondContact O-CD2 3.47Å; V486-F490 PolarHBondContact O-N 2.63Å
487	K	67	Low	61.3	Low	156 Å²	156	64.3 Å²	64.3	68%	0.678	30%	0.295	S	S	*	.	H	α-helix	trans	-58.4	-36.9	176.6	-74.6	174.7	-179.1	179.9	0	112.8	D483 I484 R491	D483-K487 WeakPolarHBondContact O-CB 3.35Å; D483-K487 VanDerWaalsContact O-CG 3.29Å; D483-K487 WeakPolarHBondContact O-CG 3.43Å; D483-K487 PolarHBondContact O-N 2.72Å; I484-K487 PolarHBondContact O-N 3.34Å; K487-R491 PolarHBondContact O-N 3.41Å
488	T	66.4	Low	61.1	Low	66 Å²	66	63.5 Å²	63.5	41%	0.405	29%	0.292	S	S	.	.	H	α-helix	trans	-72	-40.5	178.2	-55.5	0	0	0	0	111.3	I484 T485 V486 F490 R491 P492	I484-T488 WeakPolarHBondContact O-CB 3.14Å; I484-T488 PolarHBondContact O-N 3.12Å; I484-T488 PolarHBondContact O-OG1 3.18Å; T485-T488 PolarHBondContact O-N 3.1Å; V486-T488 PolarHBondContact O-N 2.96Å; T488-F490 VanDerWaalsContact C-N 3.26Å; T488-F490 PolarHBondContact O-N 3.15Å; T488-R491 VanDerWaalsContact O-CB 3.28Å; T488-R491 WeakPolarHBondContact O-CB 3.23Å; T488-R491 PolarHBondContact O-N 2.89Å; T488-P492 VanDerWaalsContact O-CD 3.29Å; T488-P492 WeakPolarHBondContact O-CD 3.11Å
489	A	63	Low	61	Low	8 Å²	8	65.3 Å²	65.3	7%	0.066	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-28.5	176.7	0	0	0	0	0	112.9	S398 L401 I402 T485 V486 P492	S398-A489 WeakPolarHBondContact CB-O 3.42Å; S398-A489 PolarHBondContact OG-O 3.14Å; L401-A489 HydrophobicContact CD2-CB 3.69Å; L401-A489 HydrophobicContact CG-CB 4.33Å; I402-A489 HydrophobicContact CG1-CB 4.18Å; T485-A489 VanDerWaalsContact O-CB 3.29Å; T485-A489 WeakPolarHBondContact O-CB 3.14Å; T485-A489 PolarHBondContact O-N 2.92Å; V486-A489 PolarHBondContact O-N 3.43Å; A489-P492 WeakPolarHBondContact O-CD 3.44Å
490	F	65	Low	60.7	Low	15 Å²	15	66.9 Å²	66.9	7%	0.066	31%	0.312	C	S	.	.	H	α-helix	trans	-73.7	-28.9	171.2	-89.9	-76.4	0	0	0	113.2	I402 V486 T488 P492 L493 F494 L560	I402-F490 HydrophobicContact CB-CE2 4.19Å; I402-F490 HydrophobicContact CB-CZ 4.46Å; I402-F490 HydrophobicContact CD1-CD1 3.76Å; I402-F490 HydrophobicContact CD1-CD2 3.5Å; I402-F490 VanDerWaalsContact CD1-CD2 3.5Å; I402-F490 HydrophobicContact CD1-CE1 3.57Å; I402-F490 HydrophobicContact CD1-CE2 3.27Å; I402-F490 HydrophobicContact CD1-CG 3.72Å; I402-F490 HydrophobicContact CD1-CZ 3.31Å; I402-F490 HydrophobicContact CG1-CD2 3.82Å; I402-F490 HydrophobicContact CG1-CE2 3.54Å; I402-F490 HydrophobicContact CG1-CG 4.49Å; I402-F490 HydrophobicContact CG1-CZ 4.01Å; I402-F490 HydrophobicContact CG2-CE2 3.56Å; I402-F490 HydrophobicContact CG2-CZ 3.8Å; V486-F490 HydrophobicContact CG1-CD2 3.87Å; V486-F490 HydrophobicContact CG1-CE2 3.84Å; V486-F490 VanDerWaalsContact O-CD2 3.29Å; V486-F490 WeakPolarHBondContact O-CD2 3.47Å; V486-F490 PolarHBondContact O-N 2.63Å; T488-F490 VanDerWaalsContact C-N 3.26Å; T488-F490 PolarHBondContact O-N 3.15Å; F490-P492 VanDerWaalsContact C-CD 3.49Å; F490-L493 HydrophobicContact CD1-CD1 4.16Å; F490-L493 WeakPolarHBondContact O-CB 3.44Å; F490-L493 PolarHBondContact O-N 3.19Å; F490-F494 HydrophobicContact CB-CE2 3.82Å; F490-F494 WeakPolarHBondContact O-CD2 3.46Å; F490-F494 WeakPolarHBondContact O-CE2 3.24Å; F490-L560 HydrophobicContact CD2-CD2 4.38Å; F490-L560 HydrophobicContact CE1-CB 4.17Å; F490-L560 HydrophobicContact CE2-CB 4.27Å; F490-L560 HydrophobicContact CE2-CD1 3.84Å; F490-L560 HydrophobicContact CE2-CD2 3.6Å; F490-L560 HydrophobicContact CE2-CG 4.09Å; F490-L560 HydrophobicContact CZ-CB 3.67Å; F490-L560 HydrophobicContact CZ-CD1 3.58Å; F490-L560 HydrophobicContact CZ-CD2 3.91Å; F490-L560 HydrophobicContact CZ-CG 3.89Å
491	R	65.1	Low	60.1	Low	140 Å²	140	59.3 Å²	59.3	53%	0.528	29%	0.285	S	S	.	.	H	α-helix	trans	-52.5	-44.8	-173.8	-163.8	-176.1	-66.2	171.6	0.1	114.5	K487 T488 L493 F494 Y495	K487-R491 PolarHBondContact O-N 3.41Å; T488-R491 VanDerWaalsContact O-CB 3.28Å; T488-R491 WeakPolarHBondContact O-CB 3.23Å; T488-R491 PolarHBondContact O-N 2.89Å; R491-L493 VanDerWaalsContact C-N 3.3Å; R491-L493 PolarHBondContact O-N 2.76Å; R491-F494 PolarHBondContact O-N 2.69Å; R491-F494 VanDerWaalsContact O-N 3.11Å; R491-Y495 HydrophobicContact CG-CD2 4.05Å; R491-Y495 HydrophobicContact CG-CE2 3.63Å; R491-Y495 WeakPolarHBondContact O-CD2 3.19Å; R491-Y495 PolarHBondContact O-N 3.23Å
492	P	63.4	Low	59.6	Low	56 Å²	56	56.9 Å²	56.9	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-59.4	-36.1	178	-23.8	34	0	0	0	113.6	T488 A489 F490 F494 Y495 E496	T488-P492 VanDerWaalsContact O-CD 3.29Å; T488-P492 WeakPolarHBondContact O-CD 3.11Å; A489-P492 WeakPolarHBondContact O-CD 3.44Å; F490-P492 VanDerWaalsContact C-CD 3.49Å; P492-F494 PolarHBondContact O-N 3.28Å; P492-Y495 PolarHBondContact O-N 3.01Å; P492-Y495 VanDerWaalsContact O-N 3.14Å; P492-E496 PolarHBondContact O-N 3.1Å
493	L	59.6	Low	59.2	Low	15 Å²	15	62.3 Å²	62.3	8%	0.079	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-27.3	177.3	-71.2	112.3	0	0	0	112.4	T395 S398 I402 F490 R491 L543	T395-L493 HydrophobicContact CG2-CD2 3.79Å; S398-L493 VanDerWaalsContact CB-CD1 3.41Å; I402-L493 HydrophobicContact CD1-CD1 4.45Å; F490-L493 HydrophobicContact CD1-CD1 4.16Å; F490-L493 WeakPolarHBondContact O-CB 3.44Å; F490-L493 PolarHBondContact O-N 3.19Å; R491-L493 VanDerWaalsContact C-N 3.3Å; R491-L493 PolarHBondContact O-N 2.76Å; L493-L543 HydrophobicContact CD2-CD1 3.47Å; L493-L543 VanDerWaalsContact CD2-CD1 3.47Å
494	F	58.2	Low	58.6	Low	28 Å²	28	62 Å²	62	12%	0.123	30%	0.303	C	S	.	.	H	α-helix	trans	-82	-31.6	176.9	-56.6	-94.7	0	0	0	113.3	F490 R491 P492 E496 L497 P563 V564 Q567	F490-F494 HydrophobicContact CB-CE2 3.82Å; F490-F494 WeakPolarHBondContact O-CD2 3.46Å; F490-F494 WeakPolarHBondContact O-CE2 3.24Å; R491-F494 PolarHBondContact O-N 2.69Å; R491-F494 VanDerWaalsContact O-N 3.11Å; P492-F494 PolarHBondContact O-N 3.28Å; F494-E496 VanDerWaalsContact C-N 3.32Å; F494-L497 PolarHBondContact O-N 3.4Å; F494-P563 HydrophobicContact CE1-CB 4.26Å; F494-P563 HydrophobicContact CZ-CB 4.13Å; F494-V564 HydrophobicContact CD1-CB 4.24Å; F494-V564 HydrophobicContact CD1-CG1 4.37Å; F494-V564 HydrophobicContact CD1-CG2 3.86Å; F494-V564 VanDerWaalsContact CE1-CA 3.41Å; F494-V564 HydrophobicContact CE1-CB 3.83Å; F494-V564 HydrophobicContact CE1-CG1 4.44Å; F494-V564 HydrophobicContact CE1-CG2 3.26Å; F494-V564 HydrophobicContact CZ-CG2 3.76Å; F494-Q567 HydrophobicContact CD1-CB 4.38Å; F494-Q567 VanDerWaalsContact CG-OE1 3.29Å
495	Y	55.2	Low	58	Low	134 Å²	134	57.5 Å²	57.5	53%	0.525	28%	0.28	S	S	.	.	H	α-helix	trans	-71.9	-26.6	178.9	-81.2	-68.8	0	0	0	112.7	R491 P492 L497 F499	R491-Y495 HydrophobicContact CG-CD2 4.05Å; R491-Y495 HydrophobicContact CG-CE2 3.63Å; R491-Y495 WeakPolarHBondContact O-CD2 3.19Å; R491-Y495 PolarHBondContact O-N 3.23Å; P492-Y495 PolarHBondContact O-N 3.01Å; P492-Y495 VanDerWaalsContact O-N 3.14Å; Y495-L497 VanDerWaalsContact C-N 3.31Å; Y495-F499 AromaticContact CD1-CD1 3.96Å; Y495-F499 HydrophobicContact CD1-CD1 3.96Å; Y495-F499 HydrophobicContact CD1-CE1 4.32Å; Y495-F499 HydrophobicContact CD1-CG 4.39Å; Y495-F499 HydrophobicContact CE1-CD1 4.09Å; Y495-F499 AromaticContact CE1-CE1 3.96Å; Y495-F499 HydrophobicContact CE1-CE1 3.96Å
496	E	51.2	Low	57.4	Low	106 Å²	106	61.1 Å²	61.1	50%	0.495	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-20.8	174.4	-66.4	-169.1	150.3	0	0	113.3	P394 P492 F494	P394-E496 WeakPolarHBondContact CG-OE1 3.33Å; P492-E496 PolarHBondContact O-N 3.1Å; F494-E496 VanDerWaalsContact C-N 3.32Å
497	L	54.4	Low	56.6	Low	19 Å²	19	63.8 Å²	63.8	10%	0.099	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	151.4	170.2	-63.1	168	0	0	0	108.7	F494 Y495 F499 L536 R539 V564 I568	F494-L497 PolarHBondContact O-N 3.4Å; Y495-L497 VanDerWaalsContact C-N 3.31Å; L497-F499 VanDerWaalsContact C-N 3.32Å; L497-F499 PolarHBondContact O-N 3.47Å; L497-L536 HydrophobicContact CD2-CD2 4.01Å; L497-R539 HydrophobicContact CD2-CB 4.14Å; L497-V564 HydrophobicContact CD1-CG1 3.92Å; L497-I568 HydrophobicContact CD1-CD1 4.26Å
498	P	51.4	Low	55.7	Low	30 Å²	30	57.9 Å²	57.9	20%	0.195	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	80.9	-142.9	27.4	-34.5	0	0	0	114.2	A532 L536	P498-A532 HydrophobicContact CB-CB 3.75Å; P498-A532 HydrophobicContact CG-CB 4.08Å; P498-L536 HydrophobicContact CG-CD1 4.07Å; P498-L536 HydrophobicContact CG-CD2 4.39Å; P498-L536 HydrophobicContact CG-CG 4.05Å
499	F	54.6	Low	54.9	Low	42 Å²	42	64.3 Å²	64.3	18%	0.184	33%	0.327	C	S	.	.			trans	-85.1	-14.4	171.7	-161.2	-119.4	0	0	0	112	Y495 L497 A501 E502 Q503	Y495-F499 AromaticContact CD1-CD1 3.96Å; Y495-F499 HydrophobicContact CD1-CD1 3.96Å; Y495-F499 HydrophobicContact CD1-CE1 4.32Å; Y495-F499 HydrophobicContact CD1-CG 4.39Å; Y495-F499 HydrophobicContact CE1-CD1 4.09Å; Y495-F499 AromaticContact CE1-CE1 3.96Å; Y495-F499 HydrophobicContact CE1-CE1 3.96Å; L497-F499 VanDerWaalsContact C-N 3.32Å; L497-F499 PolarHBondContact O-N 3.47Å; F499-A501 PolarHBondContact O-N 3.15Å; F499-E502 HydrophobicContact CD2-CB 4.35Å; F499-E502 HydrophobicContact CE2-CB 4.37Å; F499-E502 HydrophobicContact CE2-CG 4.48Å; F499-E502 PolarHBondContact O-N 3.35Å; F499-Q503 HydrophobicContact CD1-CG 3.53Å; F499-Q503 VanDerWaalsContact CE1-CD 3.5Å; F499-Q503 HydrophobicContact CE1-CG 3.32Å; F499-Q503 HydrophobicContact CG-CG 4.46Å; F499-Q503 HydrophobicContact CZ-CG 4.06Å; F499-Q503 PolarHBondContact O-N 3.47Å
500	Q	50.3	Low	53.9	Low	154 Å²	154	67.6 Å²	67.6	72%	0.72	35%	0.347	S	S	*	.	H	α-helix	trans	-56.9	-33.2	175.5	-69.4	-172.6	-22.4	0	0	112.3	A504	Q500-A504 WeakPolarHBondContact O-CB 3.48Å; Q500-A504 PolarHBondContact O-N 3.21Å
501	A	50.9	Low	53.1	Low	8 Å²	8	76.7 Å²	76.7	7%	0.066	39%	0.389	C	S	.	.	H	α-helix	trans	-74	-36.9	178.7	0	0	0	0	0	113.1	F499 L505 L528 L575	F499-A501 PolarHBondContact O-N 3.15Å; A501-L505 WeakPolarHBondContact O-CD1 3.41Å; A501-L505 WeakPolarHBondContact O-CG 3.24Å; A501-L528 HydrophobicContact CB-CD2 4.12Å; A501-L575 HydrophobicContact CB-CD2 4.35Å
502	E	51.5	Low	52.3	Low	24 Å²	24	77.4 Å²	77.4	11%	0.112	40%	0.396	C	S	.	.	H	α-helix	trans	-78.2	-41.7	-178.8	-171.6	166.5	-157.7	0	0	112	F499 A504 L505 Q506 T571 S574	F499-E502 HydrophobicContact CD2-CB 4.35Å; F499-E502 HydrophobicContact CE2-CB 4.37Å; F499-E502 HydrophobicContact CE2-CG 4.48Å; F499-E502 PolarHBondContact O-N 3.35Å; E502-A504 VanDerWaalsContact C-N 3.34Å; E502-A504 PolarHBondContact O-N 3.21Å; E502-L505 PolarHBondContact O-N 2.91Å; E502-L505 VanDerWaalsContact O-N 3.1Å; E502-Q506 HydrophobicContact CG-CG 4.21Å; E502-Q506 PolarHBondContact O-N 3.47Å; E502-Q506 PolarHBondContact OE1-NE2 3.41Å; E502-T571 HydrophobicContact CB-CG2 4.14Å; E502-T571 WeakPolarHBondContact OE2-CG2 3.24Å; E502-T571 PolarHBondContact OE2-OG1 3Å; E502-T571 VanDerWaalsContact OE2-OG1 3.12Å; E502-S574 PolarHBondContact OE1-OG 3.47Å
503	Q	53.8	Low	51.7	Low	117 Å²	117	78 Å²	78	55%	0.547	40%	0.402	S	S	.	.	H	α-helix	trans	-63	-38.2	176.4	-81.7	-173.4	-16.6	0	0	113.1	F499 L505 G507	F499-Q503 HydrophobicContact CD1-CG 3.53Å; F499-Q503 VanDerWaalsContact CE1-CD 3.5Å; F499-Q503 HydrophobicContact CE1-CG 3.32Å; F499-Q503 HydrophobicContact CG-CG 4.46Å; F499-Q503 HydrophobicContact CZ-CG 4.06Å; F499-Q503 PolarHBondContact O-N 3.47Å; Q503-L505 PolarHBondContact O-N 3.05Å; Q503-G507 PolarHBondContact O-N 3.09Å; Q503-G507 VanDerWaalsContact O-N 3.16Å
504	A	52.9	Low	51.3	Low	39 Å²	39	78.1 Å²	78.1	32%	0.322	40%	0.403	S	S	.	.	H	α-helix	trans	-59.7	-28.9	175.7	0	0	0	0	0	112.1	Q500 E502 F519	Q500-A504 WeakPolarHBondContact O-CB 3.48Å; Q500-A504 PolarHBondContact O-N 3.21Å; E502-A504 VanDerWaalsContact C-N 3.34Å; E502-A504 PolarHBondContact O-N 3.21Å; A504-F519 WeakPolarHBondContact O-CE2 3.5Å
505	L	53.1	Low	51.1	Low	9 Å²	9	81.4 Å²	81.4	5%	0.047	42%	0.417	C	S	.	.	H	α-helix	trans	-97.4	-28.1	-177.2	-67	169.4	0	0	0	114	A501 E502 Q503 L514 L525 L575 L578	A501-L505 WeakPolarHBondContact O-CD1 3.41Å; A501-L505 WeakPolarHBondContact O-CG 3.24Å; E502-L505 PolarHBondContact O-N 2.91Å; E502-L505 VanDerWaalsContact O-N 3.1Å; Q503-L505 PolarHBondContact O-N 3.05Å; L505-L514 HydrophobicContact CD2-CD2 4.29Å; L505-L525 HydrophobicContact CD2-CD2 4.43Å; L505-L575 HydrophobicContact CD1-CD1 3.14Å; L505-L578 HydrophobicContact CB-CD1 4.1Å; L505-L578 HydrophobicContact CD1-CD1 4.45Å
506	Q	54	Low	51	Low	104 Å²	104	79.9 Å²	79.9	49%	0.486	42%	0.422	S	S	.	.	H	α-helix	trans	-87.3	-23.1	180	-74.6	-178.8	0.2	0	0	114	E502 T508	E502-Q506 HydrophobicContact CG-CG 4.21Å; E502-Q506 PolarHBondContact O-N 3.47Å; E502-Q506 PolarHBondContact OE1-NE2 3.41Å; Q506-T508 PolarHBondContact O-N 3.31Å
507	G	47.6	Very low	51.2	Low	69 Å²	69	78.4 Å²	78.4	71%	0.711	41%	0.412	S	S	*	.	S	Bend	trans	-65.9	2.1	-177.1	0	0	0	0	0	116.1	Q503	Q503-G507 PolarHBondContact O-N 3.09Å; Q503-G507 VanDerWaalsContact O-N 3.16Å
508	T	49.2	Very low	51.5	Low	33 Å²	33	82.3 Å²	82.3	20%	0.202	44%	0.439	C	S	.	.			trans	-109.5	82.2	179.8	58.7	0	0	0	0	110.7	Q506 T510 L514 Y517 F519	Q506-T508 PolarHBondContact O-N 3.31Å; T508-T510 PolarHBondContact O-N 3.22Å; T508-T510 VanDerWaalsContact O-N 3.14Å; T508-L514 HydrophobicContact CG2-CD2 4.42Å; T508-Y517 HydrophobicContact CG2-CD2 4.45Å; T508-Y517 HydrophobicContact CG2-CE2 3.95Å; T508-F519 HydrophobicContact CG2-CZ 4.36Å
509	E	47.7	Very low	52	Low	200 Å²	200	84.8 Å²	84.8	94%	0.935	45%	0.446	S	S	*	.			trans	-69.9	6.2	168.2	-84.6	-169	161.9	0	0	113.5
510	T	43.6	Very low	52.4	Low	78 Å²	78	82.9 Å²	82.9	48%	0.479	44%	0.438	S	S	.	.	S	Bend	trans	-97.9	123.8	177.6	54.7	0	0	0	0	110	T508 K512	T508-T510 PolarHBondContact O-N 3.22Å; T508-T510 VanDerWaalsContact O-N 3.14Å; T510-K512 PolarHBondContact O-N 3.33Å
511	E	47.5	Very low	53.3	Low	205 Å²	205	80.8 Å²	80.8	96%	0.958	43%	0.429	S	S	*	.			trans	-52.3	14.2	173.8	-67.6	178.2	138.8	0	0	116
512	K	48.1	Very low	54.3	Low	155 Å²	155	81.7 Å²	81.7	67%	0.674	43%	0.434	S	S	*	.	S	Bend	trans	-86.2	127.3	174.3	-65.7	-172.6	178.8	-179	0	109.9	T510 L514	T510-K512 PolarHBondContact O-N 3.33Å; K512-L514 PolarHBondContact O-N 3.47Å
513	S	51.3	Low	55.4	Low	70 Å²	70	87.9 Å²	87.9	49%	0.49	46%	0.46	S	S	.	.			trans	-44.6	118.3	178.7	-167.2	0	0	0	0	111.9	K515 T516	S513-K515 PolarHBondContact O-N 3.1Å; S513-T516 PolarHBondContact O-N 2.87Å; S513-T516 PolarHBondContact O-OG1 3.19Å
514	L	51.3	Low	56.4	Low	16 Å²	16	85.9 Å²	85.9	8%	0.084	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-50.8	-28	179.9	-87.8	141.5	0	0	0	112.8	L505 T508 K512 T516 Y517 F519 A520 R582	L505-L514 HydrophobicContact CD2-CD2 4.29Å; T508-L514 HydrophobicContact CG2-CD2 4.42Å; K512-L514 PolarHBondContact O-N 3.47Å; L514-T516 PolarHBondContact O-N 3.23Å; L514-Y517 PolarHBondContact O-N 3.27Å; L514-F519 HydrophobicContact CD2-CE2 4.11Å; L514-F519 HydrophobicContact CD2-CZ 4.23Å; L514-A520 HydrophobicContact CB-CB 4.41Å; L514-A520 WeakPolarHBondContact O-CB 3.28Å; L514-R582 HydrophobicContact CD1-CG 4.34Å
515	K	53.2	Low	57.3	Low	97 Å²	97	84.4 Å²	84.4	42%	0.422	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-53	-18.1	175	-62.9	-171.8	176.4	-168.2	0	114.4	S513 D584 D587	S513-K515 PolarHBondContact O-N 3.1Å; K515-D584 IonicContact NZ-OD2 3.77Å; K515-D584 PolarHBondContact NZ-OD2 2.84Å; K515-D587 IonicContact NZ-OD2 2.84Å
516	T	53.1	Low	58.5	Low	102 Å²	102	85.8 Å²	85.8	63%	0.626	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-83.7	-13.8	178.4	52.2	0	0	0	0	114.3	S513 L514	S513-T516 PolarHBondContact O-N 2.87Å; S513-T516 PolarHBondContact O-OG1 3.19Å; L514-T516 PolarHBondContact O-N 3.23Å
517	Y	56.5	Low	59.5	Low	75 Å²	75	85.5 Å²	85.5	29%	0.294	45%	0.446	S	S	.	.	S	Bend	trans	-91.3	133.7	178.7	-64.9	-77.5	0	0	0	111.1	T508 L514 F519 A520	T508-Y517 HydrophobicContact CG2-CD2 4.45Å; T508-Y517 HydrophobicContact CG2-CE2 3.95Å; L514-Y517 PolarHBondContact O-N 3.27Å; Y517-F519 AromaticContact CD1-CE1 3.85Å; Y517-F519 HydrophobicContact CD1-CE1 3.85Å; Y517-F519 HydrophobicContact CD2-CE1 4.18Å; Y517-F519 HydrophobicContact CD2-CZ 4.12Å; Y517-F519 HydrophobicContact CG-CD1 4.27Å; Y517-F519 AromaticContact CG-CE1 3.49Å; Y517-F519 HydrophobicContact CG-CE1 3.49Å; Y517-F519 VanDerWaalsContact CG-CE1 3.49Å; Y517-F519 AromaticContact CG-CZ 3.88Å; Y517-F519 HydrophobicContact CG-CZ 3.88Å; Y517-F519 PolarHBondContact O-N 2.72Å; Y517-A520 WeakPolarHBondContact O-CB 3.42Å; Y517-A520 PolarHBondContact O-N 3.4Å
518	P	60.4	Low	60.7	Low	101 Å²	101	84.7 Å²	84.7	66%	0.656	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-56.7	-26.1	-179.8	-24.4	31.9	0	0	0	114.3	A520 I524	P518-A520 VanDerWaalsContact C-N 3.28Å; P518-A520 PolarHBondContact O-N 2.66Å; P518-I524 WeakPolarHBondContact O-CD1 3.26Å
519	F	61.1	Low	62	Low	82 Å²	82	83.3 Å²	83.3	36%	0.36	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-77.1	-13.1	179.2	68.3	-101	0	0	0	113.7	A504 T508 L514 Y517	A504-F519 WeakPolarHBondContact O-CE2 3.5Å; T508-F519 HydrophobicContact CG2-CZ 4.36Å; L514-F519 HydrophobicContact CD2-CE2 4.11Å; L514-F519 HydrophobicContact CD2-CZ 4.23Å; Y517-F519 AromaticContact CD1-CE1 3.85Å; Y517-F519 HydrophobicContact CD1-CE1 3.85Å; Y517-F519 HydrophobicContact CD2-CE1 4.18Å; Y517-F519 HydrophobicContact CD2-CZ 4.12Å; Y517-F519 HydrophobicContact CG-CD1 4.27Å; Y517-F519 AromaticContact CG-CE1 3.49Å; Y517-F519 HydrophobicContact CG-CE1 3.49Å; Y517-F519 VanDerWaalsContact CG-CE1 3.49Å; Y517-F519 AromaticContact CG-CZ 3.88Å; Y517-F519 HydrophobicContact CG-CZ 3.88Å; Y517-F519 PolarHBondContact O-N 2.72Å
520	A	63.4	Low	63.5	Low	2 Å²	2	77.3 Å²	77.3	2%	0.017	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-99.5	9.1	-173.1	0	0	0	0	0	113.3	L514 Y517 P518 L525 Y583	L514-A520 HydrophobicContact CB-CB 4.41Å; L514-A520 WeakPolarHBondContact O-CB 3.28Å; Y517-A520 WeakPolarHBondContact O-CB 3.42Å; Y517-A520 PolarHBondContact O-N 3.4Å; P518-A520 VanDerWaalsContact C-N 3.28Å; P518-A520 PolarHBondContact O-N 2.66Å; A520-L525 WeakPolarHBondContact O-CD1 3.31Å; A520-Y583 PolarHBondContact O-OH 3.17Å
521	E	69.8	Low	65	Low	110 Å²	110	80.4 Å²	80.4	51%	0.514	39%	0.393	S	S	.	.			trans	-63.5	135.3	173.6	-69.4	-172.7	175.4	0	0	110.6	K523 I524 L525	E521-K523 PolarHBondContact O-N 3.27Å; E521-I524 HydrophobicContact CB-CB 4.49Å; E521-I524 HydrophobicContact CB-CD1 4.09Å; E521-I524 HydrophobicContact CB-CG1 4.28Å; E521-I524 HydrophobicContact CG-CD1 4.49Å; E521-I524 PolarHBondContact O-N 3.41Å; E521-L525 PolarHBondContact O-N 3.48Å
522	P	70.3	Confident	66.2	Low	28 Å²	28	71.1 Å²	71.1	18%	0.182	35%	0.351	C	S	.	.	H	α-helix	trans	-51.3	-35	-178.2	-31.1	35.7	0	0	0	114.5	N526 Y583 D587 I590 I591	P522-N526 WeakPolarHBondContact O-CB 3.49Å; P522-N526 PolarHBondContact O-N 2.74Å; P522-Y583 HydrophobicContact CG-CD1 4.42Å; P522-D587 HydrophobicContact CB-CB 4.46Å; P522-D587 HydrophobicContact CG-CB 3.96Å; P522-I590 HydrophobicContact CB-CB 4.1Å; P522-I590 HydrophobicContact CB-CG2 3.78Å; P522-I591 HydrophobicContact CB-CD1 4.38Å; P522-I591 HydrophobicContact CB-CG1 3.92Å
523	K	75.2	Confident	67.6	Low	153 Å²	153	66.7 Å²	66.7	67%	0.665	33%	0.33	S	S	*	.	H	α-helix	trans	-69.5	-41.8	177.7	-66.9	-178.9	179.7	176.2	0	112.8	E521 L525 N526 E527 I590	E521-K523 PolarHBondContact O-N 3.27Å; K523-L525 VanDerWaalsContact C-N 3.32Å; K523-N526 WeakPolarHBondContact O-CB 3.35Å; K523-N526 PolarHBondContact O-N 3.39Å; K523-E527 PolarHBondContact O-N 3Å; K523-I590 HydrophobicContact CG-CG2 4.09Å
524	I	74.9	Confident	68.9	Low	75 Å²	75	68.5 Å²	68.5	39%	0.385	33%	0.331	S	S	.	.	H	α-helix	trans	-68.1	-38.7	177.8	-64.6	171.9	0	0	0	109.7	P518 E521 E527 L528	P518-I524 WeakPolarHBondContact O-CD1 3.26Å; E521-I524 HydrophobicContact CB-CB 4.49Å; E521-I524 HydrophobicContact CB-CD1 4.09Å; E521-I524 HydrophobicContact CB-CG1 4.28Å; E521-I524 HydrophobicContact CG-CD1 4.49Å; E521-I524 PolarHBondContact O-N 3.41Å; I524-E527 PolarHBondContact O-N 3.09Å; I524-L528 WeakPolarHBondContact O-CB 3.39Å; I524-L528 PolarHBondContact O-N 3.43Å
525	L	72	Confident	70.1	Confident	8 Å²	8	72.2 Å²	72.2	4%	0.042	35%	0.351	C	S	.	.	H	α-helix	trans	-62.2	-43.8	172.7	-79.9	157.8	0	0	0	112.1	L505 A520 E521 K523 L528 V529 Y583 I591	L505-L525 HydrophobicContact CD2-CD2 4.43Å; A520-L525 WeakPolarHBondContact O-CD1 3.31Å; E521-L525 PolarHBondContact O-N 3.48Å; K523-L525 VanDerWaalsContact C-N 3.32Å; L525-L528 PolarHBondContact O-N 3.41Å; L525-V529 WeakPolarHBondContact O-CB 3.13Å; L525-V529 VanDerWaalsContact O-CG2 3.28Å; L525-V529 WeakPolarHBondContact O-CG2 3.48Å; L525-V529 PolarHBondContact O-N 3.06Å; L525-Y583 HydrophobicContact CD1-CE1 3.94Å; L525-Y583 HydrophobicContact CD1-CE2 4.28Å; L525-Y583 VanDerWaalsContact CD1-OH 3.29Å; L525-Y583 WeakPolarHBondContact CD1-OH 3.46Å; L525-I591 HydrophobicContact CB-CD1 4.46Å; L525-I591 HydrophobicContact CB-CG1 3.98Å; L525-I591 HydrophobicContact CB-CG2 4.19Å; L525-I591 HydrophobicContact CD1-CD1 4.06Å; L525-I591 HydrophobicContact CD1-CG1 4.43Å
526	N	77.9	Confident	71.3	Confident	38 Å²	38	67.6 Å²	67.6	20%	0.203	33%	0.331	C	S	.	.	H	α-helix	trans	-58.4	-48.6	174.3	-179.3	-105.4	0	0	0	111.9	P522 K523 L528 V529 I530 I590 I591	P522-N526 WeakPolarHBondContact O-CB 3.49Å; P522-N526 PolarHBondContact O-N 2.74Å; K523-N526 WeakPolarHBondContact O-CB 3.35Å; K523-N526 PolarHBondContact O-N 3.39Å; N526-L528 VanDerWaalsContact C-N 3.29Å; N526-L528 PolarHBondContact O-N 2.85Å; N526-V529 PolarHBondContact O-N 3.12Å; N526-I530 WeakPolarHBondContact O-CG1 3.31Å; N526-I530 PolarHBondContact O-N 2.97Å; N526-I530 VanDerWaalsContact OD1-CD1 3.25Å; N526-I530 WeakPolarHBondContact OD1-CD1 3.28Å; N526-I590 VanDerWaalsContact CB-O 3.31Å; N526-I590 WeakPolarHBondContact CB-O 3.47Å; N526-I590 PolarHBondContact ND2-O 2.93Å; N526-I590 VanDerWaalsContact ND2-O 3.13Å; N526-I591 PolarHBondContact ND2-O 3.24Å
527	E	76	Confident	72.6	Confident	99 Å²	99	69.1 Å²	69.1	46%	0.463	33%	0.329	S	S	.	.	H	α-helix	trans	-59.1	-41.4	176.2	-73.9	-168.4	-162	0	0	112	K523 I524 R531	K523-E527 PolarHBondContact O-N 3Å; I524-E527 PolarHBondContact O-N 3.09Å; E527-R531 WeakPolarHBondContact O-CB 3.35Å; E527-R531 WeakPolarHBondContact O-CG 3.48Å; E527-R531 PolarHBondContact O-N 3.42Å; E527-R531 IonicContact OE2-CZ 2.73Å; E527-R531 IonicContact OE2-NH2 3.67Å; E527-R531 PolarHBondContact OE2-NH2 3.33Å
528	L	73	Confident	73.7	Confident	52 Å²	52	70.1 Å²	70.1	27%	0.272	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-43	178.2	-171.7	68.9	0	0	0	111.7	A501 I524 L525 N526 R531 A532	A501-L528 HydrophobicContact CB-CD2 4.12Å; I524-L528 WeakPolarHBondContact O-CB 3.39Å; I524-L528 PolarHBondContact O-N 3.43Å; L525-L528 PolarHBondContact O-N 3.41Å; N526-L528 VanDerWaalsContact C-N 3.29Å; N526-L528 PolarHBondContact O-N 2.85Å; L528-R531 PolarHBondContact O-N 3.08Å; L528-A532 VanDerWaalsContact O-CB 3.28Å; L528-A532 WeakPolarHBondContact O-CB 3.2Å; L528-A532 PolarHBondContact O-N 3.37Å
529	V	75.9	Confident	74.6	Confident	4 Å²	4	71.5 Å²	71.5	2%	0.024	33%	0.331	C	S	.	.	H	α-helix	trans	-64.4	-46.2	177.3	168	0	0	0	0	111.1	L525 N526 R531 A532 Y533 L575 I591 L593	L525-V529 WeakPolarHBondContact O-CB 3.13Å; L525-V529 VanDerWaalsContact O-CG2 3.28Å; L525-V529 WeakPolarHBondContact O-CG2 3.48Å; L525-V529 PolarHBondContact O-N 3.06Å; N526-V529 PolarHBondContact O-N 3.12Å; V529-R531 PolarHBondContact O-N 2.87Å; V529-A532 PolarHBondContact O-N 3.18Å; V529-Y533 PolarHBondContact O-N 3.1Å; V529-L575 HydrophobicContact CG2-CD2 4.39Å; V529-I591 HydrophobicContact CG2-CG2 4.42Å; V529-L593 HydrophobicContact CG1-CD1 3.9Å; V529-L593 HydrophobicContact CG2-CD1 3.9Å
530	I	78.3	Confident	75.6	Confident	73 Å²	73	67.8 Å²	67.8	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-61.7	-45.8	178	-69.5	172.1	0	0	0	110.1	N526 A532 Y533 Q534	N526-I530 WeakPolarHBondContact O-CG1 3.31Å; N526-I530 PolarHBondContact O-N 2.97Å; N526-I530 VanDerWaalsContact OD1-CD1 3.25Å; N526-I530 WeakPolarHBondContact OD1-CD1 3.28Å; I530-A532 VanDerWaalsContact C-N 3.35Å; I530-A532 PolarHBondContact O-N 3.28Å; I530-Y533 PolarHBondContact O-N 3.35Å; I530-Q534 HydrophobicContact CG2-CG 4.39Å; I530-Q534 WeakPolarHBondContact O-CB 3.26Å; I530-Q534 VanDerWaalsContact O-CG 3.32Å; I530-Q534 WeakPolarHBondContact O-CG 3.27Å; I530-Q534 PolarHBondContact O-N 2.95Å
531	R	75.5	Confident	76.6	Confident	143 Å²	143	71.4 Å²	71.4	54%	0.54	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-42.9	175.9	-73.1	176.5	-161	179.8	10	111.5	E527 L528 V529 Q534 N535	E527-R531 WeakPolarHBondContact O-CB 3.35Å; E527-R531 WeakPolarHBondContact O-CG 3.48Å; E527-R531 PolarHBondContact O-N 3.42Å; E527-R531 IonicContact OE2-CZ 2.73Å; E527-R531 IonicContact OE2-NH2 3.67Å; E527-R531 PolarHBondContact OE2-NH2 3.33Å; L528-R531 PolarHBondContact O-N 3.08Å; V529-R531 PolarHBondContact O-N 2.87Å; R531-Q534 PolarHBondContact O-N 3.49Å; R531-N535 WeakPolarHBondContact O-CB 3.16Å; R531-N535 PolarHBondContact O-N 2.92Å; R531-N535 PolarHBondContact O-ND2 3Å
532	A	72.4	Confident	77.2	Confident	10 Å²	10	70.7 Å²	70.7	8%	0.083	33%	0.334	C	S	.	.	H	α-helix	trans	-60.9	-44.4	176.6	0	0	0	0	0	112.1	P498 L528 V529 I530 N535 L536	P498-A532 HydrophobicContact CB-CB 3.75Å; P498-A532 HydrophobicContact CG-CB 4.08Å; L528-A532 VanDerWaalsContact O-CB 3.28Å; L528-A532 WeakPolarHBondContact O-CB 3.2Å; L528-A532 PolarHBondContact O-N 3.37Å; V529-A532 PolarHBondContact O-N 3.18Å; I530-A532 VanDerWaalsContact C-N 3.35Å; I530-A532 PolarHBondContact O-N 3.28Å; A532-N535 PolarHBondContact O-N 3.42Å; A532-L536 WeakPolarHBondContact O-CG 3.43Å; A532-L536 PolarHBondContact O-N 3.42Å
533	Y	77.6	Confident	77.7	Confident	62 Å²	62	70.2 Å²	70.2	24%	0.243	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-41.6	178	-175.7	-101.7	0	0	0	112.8	V529 I530 N535 L536 K537 T594 L602	V529-Y533 PolarHBondContact O-N 3.1Å; I530-Y533 PolarHBondContact O-N 3.35Å; Y533-N535 VanDerWaalsContact C-N 3.34Å; Y533-N535 PolarHBondContact O-N 2.88Å; Y533-L536 WeakPolarHBondContact O-CB 3.31Å; Y533-L536 PolarHBondContact O-N 2.77Å; Y533-K537 PolarHBondContact O-N 2.75Å; Y533-T594 HydrophobicContact CD2-CG2 3.71Å; Y533-T594 HydrophobicContact CE2-CG2 3.61Å; Y533-T594 HydrophobicContact CG-CG2 4.43Å; Y533-L602 HydrophobicContact CE2-CD2 4.23Å
534	Q	79	Confident	78.1	Confident	109 Å²	109	66.7 Å²	66.7	51%	0.509	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-41.9	174.6	-73.4	177.2	-5	0	0	111.7	I530 R531 L536 K537 I538	I530-Q534 HydrophobicContact CG2-CG 4.39Å; I530-Q534 WeakPolarHBondContact O-CB 3.26Å; I530-Q534 VanDerWaalsContact O-CG 3.32Å; I530-Q534 WeakPolarHBondContact O-CG 3.27Å; I530-Q534 PolarHBondContact O-N 2.95Å; R531-Q534 PolarHBondContact O-N 3.49Å; Q534-L536 VanDerWaalsContact C-N 3.33Å; Q534-L536 PolarHBondContact O-N 2.88Å; Q534-K537 PolarHBondContact O-N 3.41Å; Q534-I538 PolarHBondContact O-N 2.81Å
535	N	75.9	Confident	78.6	Confident	93 Å²	93	69.2 Å²	69.2	50%	0.497	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-42.4	174.4	-75.5	-23.2	0	0	0	111.5	R531 A532 Y533 K537 I538 R539	R531-N535 WeakPolarHBondContact O-CB 3.16Å; R531-N535 PolarHBondContact O-N 2.92Å; R531-N535 PolarHBondContact O-ND2 3Å; A532-N535 PolarHBondContact O-N 3.42Å; Y533-N535 VanDerWaalsContact C-N 3.34Å; Y533-N535 PolarHBondContact O-N 2.88Å; N535-K537 PolarHBondContact O-N 2.88Å; N535-I538 PolarHBondContact O-N 3.35Å; N535-R539 VanDerWaalsContact O-CB 3.32Å; N535-R539 WeakPolarHBondContact O-CB 3.49Å; N535-R539 VanDerWaalsContact O-CG 3.3Å; N535-R539 WeakPolarHBondContact O-CG 3.47Å; N535-R539 PolarHBondContact O-N 2.75Å
536	L	78.8	Confident	79.1	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-60.6	-43.2	174.1	-79.4	170.3	0	0	0	112.3	L497 P498 A532 Y533 Q534 I538 R539 I540 I568 Y572 L602	L497-L536 HydrophobicContact CD2-CD2 4.01Å; P498-L536 HydrophobicContact CG-CD1 4.07Å; P498-L536 HydrophobicContact CG-CD2 4.39Å; P498-L536 HydrophobicContact CG-CG 4.05Å; A532-L536 WeakPolarHBondContact O-CG 3.43Å; A532-L536 PolarHBondContact O-N 3.42Å; Y533-L536 WeakPolarHBondContact O-CB 3.31Å; Y533-L536 PolarHBondContact O-N 2.77Å; Q534-L536 VanDerWaalsContact C-N 3.33Å; Q534-L536 PolarHBondContact O-N 2.88Å; L536-I538 PolarHBondContact O-N 3.43Å; L536-R539 PolarHBondContact O-N 3.21Å; L536-I540 HydrophobicContact CD2-CD1 4.31Å; L536-I540 HydrophobicContact CD2-CG1 4.17Å; L536-I540 WeakPolarHBondContact O-CB 3.26Å; L536-I540 WeakPolarHBondContact O-CG1 3.33Å; L536-I540 PolarHBondContact O-N 3.28Å; L536-I568 HydrophobicContact CD1-CG2 4.28Å; L536-I568 HydrophobicContact CD2-CD1 3.95Å; L536-I568 HydrophobicContact CD2-CG2 4.49Å; L536-Y572 HydrophobicContact CD1-CE2 3.6Å; L536-Y572 WeakPolarHBondContact CD1-OH 3.5Å; L536-L602 HydrophobicContact CB-CD2 3.89Å
537	K	80.1	Confident	79.3	Confident	134 Å²	134	69 Å²	69	58%	0.583	32%	0.321	S	S	*	.	H	α-helix	trans	-62	-30	-178.6	-172.1	173.4	-178.3	179.5	0	113.4	Y533 Q534 N535 P541 L602	Y533-K537 PolarHBondContact O-N 2.75Å; Q534-K537 PolarHBondContact O-N 3.41Å; N535-K537 PolarHBondContact O-N 2.88Å; K537-P541 WeakPolarHBondContact O-CD 3.47Å; K537-P541 WeakPolarHBondContact O-CG 3.4Å; K537-L602 HydrophobicContact CB-CD1 4.21Å; K537-L602 HydrophobicContact CG-CD1 4.09Å
538	I	80.9	Confident	79.6	Confident	96 Å²	96	66.9 Å²	66.9	49%	0.492	32%	0.317	S	S	.	.	H	α-helix	trans	-87.7	-48.4	178.4	-62.7	169.9	0	0	0	110.8	Q534 N535 L536 I540 P541 E542	Q534-I538 PolarHBondContact O-N 2.81Å; N535-I538 PolarHBondContact O-N 3.35Å; L536-I538 PolarHBondContact O-N 3.43Å; I538-I540 PolarHBondContact O-N 3.44Å; I538-P541 WeakPolarHBondContact O-CD 3.42Å; I538-E542 WeakPolarHBondContact CG2-OE1 3.35Å; I538-E542 WeakPolarHBondContact O-CG 3.39Å; I538-E542 PolarHBondContact O-N 2.8Å
539	R	78.4	Confident	80.1	Confident	130 Å²	130	64.7 Å²	64.7	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-72.3	-31.2	-171.6	-68.9	-70	179.5	145.4	-2.2	113.9	L497 N535 L536 E542 L543	L497-R539 HydrophobicContact CD2-CB 4.14Å; N535-R539 VanDerWaalsContact O-CB 3.32Å; N535-R539 WeakPolarHBondContact O-CB 3.49Å; N535-R539 VanDerWaalsContact O-CG 3.3Å; N535-R539 WeakPolarHBondContact O-CG 3.47Å; N535-R539 PolarHBondContact O-N 2.75Å; L536-R539 PolarHBondContact O-N 3.21Å; R539-E542 IonicContact NE-OE2 3.78Å; R539-L543 VanDerWaalsContact O-CB 3.22Å; R539-L543 WeakPolarHBondContact O-CB 3.41Å; R539-L543 PolarHBondContact O-N 2.89Å
540	I	82.7	Confident	80.4	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-66.4	-49.4	-179.1	-65.6	-69.3	0	0	0	111.8	L536 I538 L543 R544 F561 I568 L603	L536-I540 HydrophobicContact CD2-CD1 4.31Å; L536-I540 HydrophobicContact CD2-CG1 4.17Å; L536-I540 WeakPolarHBondContact O-CB 3.26Å; L536-I540 WeakPolarHBondContact O-CG1 3.33Å; L536-I540 PolarHBondContact O-N 3.28Å; I538-I540 PolarHBondContact O-N 3.44Å; I540-L543 PolarHBondContact O-N 3.4Å; I540-R544 WeakPolarHBondContact O-CG 3.1Å; I540-R544 PolarHBondContact O-N 3.36Å; I540-F561 HydrophobicContact CD1-CE2 4.4Å; I540-F561 HydrophobicContact CD1-CZ 4.06Å; I540-F561 HydrophobicContact CG2-CZ 4.05Å; I540-I568 HydrophobicContact CD1-CD1 3.99Å; I540-L603 HydrophobicContact CD1-CD2 3.86Å; I540-L603 HydrophobicContact CG1-CD2 4.23Å
541	P	83.3	Confident	80.4	Confident	77 Å²	77	62.2 Å²	62.2	50%	0.5	29%	0.293	S	S	.	.	H	α-helix	trans	-59.2	-43.6	172.8	-26.3	34.3	0	0	0	113.8	K537 I538 R544 H545	K537-P541 WeakPolarHBondContact O-CD 3.47Å; K537-P541 WeakPolarHBondContact O-CG 3.4Å; I538-P541 WeakPolarHBondContact O-CD 3.42Å; P541-R544 PolarHBondContact O-N 3.21Å; P541-H545 PolarHBondContact O-N 2.77Å
542	E	82.7	Confident	80.4	Confident	95 Å²	95	59.3 Å²	59.3	44%	0.444	30%	0.295	S	S	.	.	H	α-helix	trans	-59.7	-47.3	177.2	-72.9	175.4	174.9	0	0	111.5	I538 R539 R544 H545 L546	I538-E542 WeakPolarHBondContact CG2-OE1 3.35Å; I538-E542 WeakPolarHBondContact O-CG 3.39Å; I538-E542 PolarHBondContact O-N 2.8Å; R539-E542 IonicContact NE-OE2 3.78Å; E542-R544 PolarHBondContact O-N 2.78Å; E542-H545 PolarHBondContact O-N 2.83Å; E542-L546 WeakPolarHBondContact O-CG 3.34Å; E542-L546 PolarHBondContact O-N 3Å
543	L	81.8	Confident	80.5	Confident	18 Å²	18	62.3 Å²	62.3	9%	0.094	31%	0.309	C	S	.	.	H	α-helix	trans	-61.7	-43	177.4	178	59.2	0	0	0	111.5	T395 L493 R539 I540 L546 M547 F561	T395-L543 HydrophobicContact CG2-CD1 4.03Å; L493-L543 HydrophobicContact CD2-CD1 3.47Å; L493-L543 VanDerWaalsContact CD2-CD1 3.47Å; R539-L543 VanDerWaalsContact O-CB 3.22Å; R539-L543 WeakPolarHBondContact O-CB 3.41Å; R539-L543 PolarHBondContact O-N 2.89Å; I540-L543 PolarHBondContact O-N 3.4Å; L543-L546 PolarHBondContact O-N 3.05Å; L543-M547 HydrophobicContact CD1-CG 4.09Å; L543-M547 HydrophobicContact CD1-SD 4.26Å; L543-M547 HydrophobicContact CG-CG 4.36Å; L543-M547 HydrophobicContact CG-SD 4.07Å; L543-M547 WeakPolarHBondContact O-CB 3.19Å; L543-M547 VanDerWaalsContact O-CG 3.25Å; L543-M547 WeakPolarHBondContact O-CG 3.36Å; L543-M547 PolarHBondContact O-N 3.35Å; L543-F561 HydrophobicContact CD2-CE2 4.18Å
544	R	83.2	Confident	80.5	Confident	80 Å²	80	66.5 Å²	66.5	30%	0.302	33%	0.331	S	S	.	.	H	α-helix	trans	-62.3	-42.7	176.5	-78.8	-168	171.1	-152.8	6.2	112.3	I540 P541 E542 M547 S548 L603 R604	I540-R544 WeakPolarHBondContact O-CG 3.1Å; I540-R544 PolarHBondContact O-N 3.36Å; P541-R544 PolarHBondContact O-N 3.21Å; E542-R544 PolarHBondContact O-N 2.78Å; R544-M547 PolarHBondContact O-N 3.34Å; R544-S548 WeakPolarHBondContact O-CB 3.3Å; R544-S548 PolarHBondContact O-N 2.9Å; R544-L603 PolarHBondContact NH2-O 3.33Å; R544-R604 PolarHBondContact NH1-O 3.33Å; R544-R604 PolarHBondContact NH2-O 3.01Å
545	H	85.3	Confident	80.1	Confident	128 Å²	128	68 Å²	68	59%	0.593	34%	0.338	S	S	*	.	H	α-helix	trans	-61.7	-47.3	177.2	-179.4	61.8	0	0	0	111.5	P541 E542 S548 L549	P541-H545 PolarHBondContact O-N 2.77Å; E542-H545 PolarHBondContact O-N 2.83Å; H545-S548 WeakPolarHBondContact O-CB 3.41Å; H545-S548 PolarHBondContact O-N 3.24Å; H545-L549 PolarHBondContact O-N 3.16Å
546	L	83.3	Confident	79.9	Confident	34 Å²	34	65.4 Å²	65.4	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-41.5	175.7	-68.4	173.4	0	0	0	112	T395 L399 E542 L543 S548 L549 Y550	T395-L546 HydrophobicContact CG2-CD1 4.03Å; L399-L546 HydrophobicContact CD1-CB 3.54Å; E542-L546 WeakPolarHBondContact O-CG 3.34Å; E542-L546 PolarHBondContact O-N 3Å; L543-L546 PolarHBondContact O-N 3.05Å; L546-S548 VanDerWaalsContact C-N 3.31Å; L546-S548 PolarHBondContact O-N 3.45Å; L546-L549 PolarHBondContact O-N 3.45Å; L546-Y550 HydrophobicContact CD2-CE2 4.49Å; L546-Y550 VanDerWaalsContact O-CD2 3.26Å; L546-Y550 WeakPolarHBondContact O-CD2 3.27Å; L546-Y550 PolarHBondContact O-N 2.88Å
547	M	80.8	Confident	79.6	Confident	7 Å²	7	66.8 Å²	66.8	3%	0.034	33%	0.332	C	S	.	.	H	α-helix	trans	-58.9	-43.4	175.2	-77.6	-177.7	69.8	0	0	111.4	L399 L543 R544 Y550 L551 E557 L560 F561	L399-M547 HydrophobicContact CD2-CG 3.87Å; L543-M547 HydrophobicContact CD1-CG 4.09Å; L543-M547 HydrophobicContact CD1-SD 4.26Å; L543-M547 HydrophobicContact CG-CG 4.36Å; L543-M547 HydrophobicContact CG-SD 4.07Å; L543-M547 WeakPolarHBondContact O-CB 3.19Å; L543-M547 VanDerWaalsContact O-CG 3.25Å; L543-M547 WeakPolarHBondContact O-CG 3.36Å; L543-M547 PolarHBondContact O-N 3.35Å; R544-M547 PolarHBondContact O-N 3.34Å; M547-Y550 PolarHBondContact O-N 3.48Å; M547-L551 HydrophobicContact CB-CD1 4.45Å; M547-L551 HydrophobicContact CE-CD1 3.97Å; M547-L551 VanDerWaalsContact O-CB 3.27Å; M547-L551 WeakPolarHBondContact O-CB 3.43Å; M547-L551 WeakPolarHBondContact O-CG 3.48Å; M547-L551 PolarHBondContact O-N 3.17Å; M547-E557 HydrophobicContact CB-CG 4.36Å; M547-E557 HydrophobicContact CE-CB 4.34Å; M547-L560 HydrophobicContact CE-CB 4.15Å; M547-F561 HydrophobicContact CE-CB 4.28Å; M547-F561 HydrophobicContact SD-CD2 4.06Å
548	S	83.3	Confident	79.3	Confident	54 Å²	54	63.8 Å²	63.8	38%	0.378	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-42.8	176.1	-171.3	0	0	0	0	112.5	R544 H545 L546 S552 E557	R544-S548 WeakPolarHBondContact O-CB 3.3Å; R544-S548 PolarHBondContact O-N 2.9Å; H545-S548 WeakPolarHBondContact O-CB 3.41Å; H545-S548 PolarHBondContact O-N 3.24Å; L546-S548 VanDerWaalsContact C-N 3.31Å; L546-S548 PolarHBondContact O-N 3.45Å; S548-S552 WeakPolarHBondContact O-CA 3.37Å; S548-S552 PolarHBondContact O-N 3.46Å; S548-E557 WeakPolarHBondContact CA-OE1 3.31Å
549	L	83.6	Confident	78.9	Confident	7 Å²	7	64.4 Å²	64.4	4%	0.037	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-43.1	176.7	-178.8	61.9	0	0	0	112.5	P345 L348 E349 Q352 H545 L546	P345-L549 HydrophobicContact CB-CD2 3.84Å; L348-L549 HydrophobicContact CB-CD1 3.83Å; L348-L549 HydrophobicContact CB-CG 3.98Å; L348-L549 HydrophobicContact CD1-CG 4.35Å; E349-L549 HydrophobicContact CG-CD1 4.19Å; E349-L549 HydrophobicContact CG-CD2 3.95Å; Q352-L549 HydrophobicContact CG-CD1 4.29Å; H545-L549 PolarHBondContact O-N 3.16Å; L546-L549 PolarHBondContact O-N 3.45Å
550	Y	81.6	Confident	78.6	Confident	1 Å²	1	59.7 Å²	59.7	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-80.7	-44	-176.7	-82.8	-102.1	0	0	0	113.5	Y344 P345 L348 N396 L399 F400 K403 L546 M547	Y344-Y550 AromaticContact CD1-CE1 3.74Å; Y344-Y550 HydrophobicContact CD1-CE1 3.74Å; Y344-Y550 HydrophobicContact CE1-CE1 4.48Å; P345-Y550 HydrophobicContact CB-CE2 4.06Å; L348-Y550 HydrophobicContact CD1-CD1 3.63Å; L348-Y550 HydrophobicContact CD1-CD2 3.97Å; L348-Y550 HydrophobicContact CD1-CE1 3.86Å; L348-Y550 HydrophobicContact CD1-CE2 4.22Å; L348-Y550 HydrophobicContact CD1-CG 3.7Å; N396-Y550 WeakPolarHBondContact OD1-CE2 3.25Å; N396-Y550 PolarHBondContact OD1-OH 2.83Å; L399-Y550 HydrophobicContact CB-CD1 3.86Å; L399-Y550 HydrophobicContact CB-CD2 4.07Å; L399-Y550 HydrophobicContact CB-CE1 4.18Å; L399-Y550 HydrophobicContact CB-CE2 4.34Å; L399-Y550 HydrophobicContact CB-CG 3.79Å; L399-Y550 HydrophobicContact CD1-CD2 4.13Å; L399-Y550 HydrophobicContact CD1-CE2 4.44Å; F400-Y550 HydrophobicContact CB-CE1 4.02Å; K403-Y550 HydrophobicContact CB-CD1 4.47Å; K403-Y550 HydrophobicContact CD-CD1 4.23Å; K403-Y550 WeakPolarHBondContact CD-O 3.37Å; K403-Y550 VanDerWaalsContact CE-O 3.31Å; K403-Y550 WeakPolarHBondContact CE-O 3.39Å; K403-Y550 WeakPolarHBondContact CG-O 3.13Å; K403-Y550 PolarHBondContact NZ-O 2.96Å; L546-Y550 HydrophobicContact CD2-CE2 4.49Å; L546-Y550 VanDerWaalsContact O-CD2 3.26Å; L546-Y550 WeakPolarHBondContact O-CD2 3.27Å; L546-Y550 PolarHBondContact O-N 2.88Å; M547-Y550 PolarHBondContact O-N 3.48Å
551	L	77.5	Confident	78.2	Confident	24 Å²	24	59.8 Å²	59.8	13%	0.126	31%	0.31	C	S	.	.	H	α-helix	trans	-90.8	-34.3	-171.9	-60.2	175.5	0	0	0	112.7	I402 L406 M547 N553 E557 L560	I402-L551 HydrophobicContact CG2-CD2 4.1Å; L406-L551 HydrophobicContact CD1-CD2 3.71Å; M547-L551 HydrophobicContact CB-CD1 4.45Å; M547-L551 HydrophobicContact CE-CD1 3.97Å; M547-L551 VanDerWaalsContact O-CB 3.27Å; M547-L551 WeakPolarHBondContact O-CB 3.43Å; M547-L551 WeakPolarHBondContact O-CG 3.48Å; M547-L551 PolarHBondContact O-N 3.17Å; L551-N553 PolarHBondContact O-N 2.77Å; L551-N553 VanDerWaalsContact O-N 3.09Å; L551-E557 HydrophobicContact CB-CG 3.87Å; L551-E557 HydrophobicContact CD1-CG 3.73Å; L551-E557 HydrophobicContact CG-CG 4.39Å; L551-L560 HydrophobicContact CD1-CD1 3.89Å
552	S	75.5	Confident	77.9	Confident	82 Å²	82	58.2 Å²	58.2	57%	0.573	30%	0.304	S	S	*	.			trans	50.7	31.3	179.9	-47.7	0	0	0	0	113.5	S548	S548-S552 WeakPolarHBondContact O-CA 3.37Å; S548-S552 PolarHBondContact O-N 3.46Å
553	N	75.5	Confident	77.2	Confident	73 Å²	73	56.9 Å²	56.9	39%	0.39	30%	0.303	S	S	.	.			trans	-150.2	107.4	-179.3	-179.3	-35.4	0	0	0	109.3	L551 E555 T556 E557	L551-N553 PolarHBondContact O-N 2.77Å; L551-N553 VanDerWaalsContact O-N 3.09Å; N553-E555 VanDerWaalsContact C-N 3.31Å; N553-E555 PolarHBondContact O-N 2.77Å; N553-E555 WeakPolarHBondContact OD1-CB 3.49Å; N553-E555 PolarHBondContact OD1-N 2.79Å; N553-T556 PolarHBondContact O-N 2.86Å; N553-T556 PolarHBondContact OD1-N 3.46Å; N553-T556 VanDerWaalsContact OD1-N 3.1Å; N553-E557 PolarHBondContact N-OE1 2.85Å; N553-E557 VanDerWaalsContact N-OE1 3.08Å; N553-E557 WeakPolarHBondContact O-CB 3.19Å; N553-E557 VanDerWaalsContact O-CG 3.24Å; N553-E557 WeakPolarHBondContact O-CG 3.25Å; N553-E557 PolarHBondContact O-N 2.91Å
554	E	76.3	Confident	76.7	Confident	149 Å²	149	56.3 Å²	56.3	70%	0.696	30%	0.301	S	S	*	.	H	α-helix	trans	-59.9	-36.7	-176.2	-173.6	179	-178.1	0	0	113.2	E557 N558	E554-E557 PolarHBondContact O-N 3.45Å; E554-N558 WeakPolarHBondContact O-CB 3.09Å; E554-N558 VanDerWaalsContact O-CG 3.29Å; E554-N558 PolarHBondContact O-N 3.47Å; E554-N558 PolarHBondContact O-ND2 3.05Å
555	E	72.3	Confident	76.2	Confident	140 Å²	140	55.1 Å²	55.1	65%	0.654	30%	0.297	S	S	*	.	H	α-helix	trans	-66.8	-44.8	178.5	-173	179	-173.4	0	0	110.9	N553 N558 I559	N553-E555 VanDerWaalsContact C-N 3.31Å; N553-E555 PolarHBondContact O-N 2.77Å; N553-E555 WeakPolarHBondContact OD1-CB 3.49Å; N553-E555 PolarHBondContact OD1-N 2.79Å; E555-N558 PolarHBondContact O-N 3.25Å; E555-I559 HydrophobicContact CG-CD1 4.09Å; E555-I559 VanDerWaalsContact O-CG1 3.27Å; E555-I559 WeakPolarHBondContact O-CG1 3.29Å; E555-I559 PolarHBondContact O-N 3.13Å
556	T	71.5	Confident	75.7	Confident	39 Å²	39	53.8 Å²	53.8	24%	0.239	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-41.3	177.8	-59.2	0	0	0	0	111	L406 N553 N558 I559 L560	L406-T556 HydrophobicContact CD1-CG2 4.04Å; N553-T556 PolarHBondContact O-N 2.86Å; N553-T556 PolarHBondContact OD1-N 3.46Å; N553-T556 VanDerWaalsContact OD1-N 3.1Å; T556-N558 PolarHBondContact O-N 2.8Å; T556-I559 PolarHBondContact O-N 2.85Å; T556-L560 HydrophobicContact CG2-CD1 3.63Å; T556-L560 HydrophobicContact CG2-CG 4.33Å; T556-L560 WeakPolarHBondContact O-CB 3.35Å; T556-L560 WeakPolarHBondContact O-CG 3.39Å; T556-L560 PolarHBondContact O-N 3.39Å
557	E	71.5	Confident	75.1	Confident	30 Å²	30	55.8 Å²	55.8	14%	0.14	31%	0.307	C	S	.	.	H	α-helix	trans	-58.1	-47.3	174.4	-72.5	163.4	-141.9	0	0	111.5	M547 S548 L551 N553 E554 L560 F561	M547-E557 HydrophobicContact CB-CG 4.36Å; M547-E557 HydrophobicContact CE-CB 4.34Å; S548-E557 WeakPolarHBondContact CA-OE1 3.31Å; L551-E557 HydrophobicContact CB-CG 3.87Å; L551-E557 HydrophobicContact CD1-CG 3.73Å; L551-E557 HydrophobicContact CG-CG 4.39Å; N553-E557 PolarHBondContact N-OE1 2.85Å; N553-E557 VanDerWaalsContact N-OE1 3.08Å; N553-E557 WeakPolarHBondContact O-CB 3.19Å; N553-E557 VanDerWaalsContact O-CG 3.24Å; N553-E557 WeakPolarHBondContact O-CG 3.25Å; N553-E557 PolarHBondContact O-N 2.91Å; E554-E557 PolarHBondContact O-N 3.45Å; E557-L560 PolarHBondContact O-N 3.19Å; E557-F561 WeakPolarHBondContact O-CB 3.49Å; E557-F561 PolarHBondContact O-N 2.91Å
558	N	74.8	Confident	74.8	Confident	72 Å²	72	56 Å²	56	39%	0.385	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-42.9	179.1	-79.5	-44.3	0	0	0	112.7	E554 E555 T556 L560 F561 A562	E554-N558 WeakPolarHBondContact O-CB 3.09Å; E554-N558 VanDerWaalsContact O-CG 3.29Å; E554-N558 PolarHBondContact O-N 3.47Å; E554-N558 PolarHBondContact O-ND2 3.05Å; E555-N558 PolarHBondContact O-N 3.25Å; T556-N558 PolarHBondContact O-N 2.8Å; N558-L560 VanDerWaalsContact C-N 3.33Å; N558-L560 PolarHBondContact O-N 2.88Å; N558-F561 PolarHBondContact O-N 3.28Å; N558-A562 PolarHBondContact O-N 2.99Å
559	I	72.8	Confident	74.5	Confident	109 Å²	109	56.9 Å²	56.9	56%	0.559	31%	0.305	S	S	*	.	H	α-helix	trans	-62	-42.6	176.5	-69.6	166.9	0	0	0	110.7	E555 T556 P563	E555-I559 HydrophobicContact CG-CD1 4.09Å; E555-I559 VanDerWaalsContact O-CG1 3.27Å; E555-I559 WeakPolarHBondContact O-CG1 3.29Å; E555-I559 PolarHBondContact O-N 3.13Å; T556-I559 PolarHBondContact O-N 2.85Å; I559-P563 VanDerWaalsContact O-CD 3.29Å; I559-P563 WeakPolarHBondContact O-CD 3.22Å
560	L	71	Confident	74.1	Confident	31 Å²	31	58.4 Å²	58.4	16%	0.162	32%	0.323	C	S	.	.	H	α-helix	trans	-76.7	-28.1	-178.3	-65.4	173	0	0	0	112.7	I402 L406 F490 M547 L551 T556 E557 N558 P563	I402-L560 HydrophobicContact CG2-CD1 4.36Å; L406-L560 HydrophobicContact CD1-CD1 4.28Å; F490-L560 HydrophobicContact CD2-CD2 4.38Å; F490-L560 HydrophobicContact CE1-CB 4.17Å; F490-L560 HydrophobicContact CE2-CB 4.27Å; F490-L560 HydrophobicContact CE2-CD1 3.84Å; F490-L560 HydrophobicContact CE2-CD2 3.6Å; F490-L560 HydrophobicContact CE2-CG 4.09Å; F490-L560 HydrophobicContact CZ-CB 3.67Å; F490-L560 HydrophobicContact CZ-CD1 3.58Å; F490-L560 HydrophobicContact CZ-CD2 3.91Å; F490-L560 HydrophobicContact CZ-CG 3.89Å; M547-L560 HydrophobicContact CE-CB 4.15Å; L551-L560 HydrophobicContact CD1-CD1 3.89Å; T556-L560 HydrophobicContact CG2-CD1 3.63Å; T556-L560 HydrophobicContact CG2-CG 4.33Å; T556-L560 WeakPolarHBondContact O-CB 3.35Å; T556-L560 WeakPolarHBondContact O-CG 3.39Å; T556-L560 PolarHBondContact O-N 3.39Å; E557-L560 PolarHBondContact O-N 3.19Å; N558-L560 VanDerWaalsContact C-N 3.33Å; N558-L560 PolarHBondContact O-N 2.88Å; L560-P563 WeakPolarHBondContact O-CD 3.3Å
561	F	75.4	Confident	73.6	Confident	5 Å²	5	59.3 Å²	59.3	2%	0.022	33%	0.328	C	S	.	.	H	α-helix	trans	-82.6	-20.5	177.1	-163.5	-110.3	0	0	0	113.3	I540 L543 M547 E557 N558 V564 K565 L603	I540-F561 HydrophobicContact CD1-CE2 4.4Å; I540-F561 HydrophobicContact CD1-CZ 4.06Å; I540-F561 HydrophobicContact CG2-CZ 4.05Å; L543-F561 HydrophobicContact CD2-CE2 4.18Å; M547-F561 HydrophobicContact CE-CB 4.28Å; M547-F561 HydrophobicContact SD-CD2 4.06Å; E557-F561 WeakPolarHBondContact O-CB 3.49Å; E557-F561 PolarHBondContact O-N 2.91Å; N558-F561 PolarHBondContact O-N 3.28Å; F561-V564 HydrophobicContact CD2-CB 4.16Å; F561-V564 HydrophobicContact CD2-CG1 4.47Å; F561-V564 HydrophobicContact CD2-CG2 4.25Å; F561-V564 HydrophobicContact CE2-CB 4.26Å; F561-V564 HydrophobicContact CE2-CG1 4.1Å; F561-V564 WeakPolarHBondContact O-CB 3.39Å; F561-V564 PolarHBondContact O-N 3.43Å; F561-V564 VanDerWaalsContact O-N 3.07Å; F561-K565 HydrophobicContact CD1-CD 3.81Å; F561-K565 VanDerWaalsContact CD1-CE 3.41Å; F561-K565 HydrophobicContact CD1-CG 3.71Å; F561-K565 HydrophobicContact CE1-CD 4.06Å; F561-K565 VanDerWaalsContact CE1-CE 3.49Å; F561-K565 HydrophobicContact CE1-CG 3.66Å; F561-K565 PolarHBondContact O-N 2.87Å; F561-K565 VanDerWaalsContact O-N 3.07Å; F561-L603 HydrophobicContact CZ-CD2 4.47Å
562	A	75.2	Confident	73.5	Confident	44 Å²	44	58.8 Å²	58.8	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-55.9	-48	179.4	0	0	0	0	0	113.6	N558 V564 K565 T566	N558-A562 PolarHBondContact O-N 2.99Å; A562-V564 PolarHBondContact O-N 2.85Å; A562-K565 WeakPolarHBondContact O-CB 3.47Å; A562-K565 PolarHBondContact O-N 3.38Å; A562-T566 PolarHBondContact O-N 2.87Å; A562-T566 PolarHBondContact O-OG1 2.63Å
563	P	69.5	Low	73.6	Confident	67 Å²	67	56.5 Å²	56.5	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-58.6	-33.8	174.4	-25.6	34.7	0	0	0	113.6	F494 I559 L560 T566 Q567	F494-P563 HydrophobicContact CE1-CB 4.26Å; F494-P563 HydrophobicContact CZ-CB 4.13Å; I559-P563 VanDerWaalsContact O-CD 3.29Å; I559-P563 WeakPolarHBondContact O-CD 3.22Å; L560-P563 WeakPolarHBondContact O-CD 3.3Å; P563-T566 PolarHBondContact O-N 3.35Å; P563-Q567 WeakPolarHBondContact O-CB 3.39Å; P563-Q567 PolarHBondContact O-N 3.41Å
564	V	70.8	Confident	73.7	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-66.1	-46.1	178.1	-176	0	0	0	0	109.7	F494 L497 F561 A562 T566 Q567 I568	F494-V564 HydrophobicContact CD1-CB 4.24Å; F494-V564 HydrophobicContact CD1-CG1 4.37Å; F494-V564 HydrophobicContact CD1-CG2 3.86Å; F494-V564 VanDerWaalsContact CE1-CA 3.41Å; F494-V564 HydrophobicContact CE1-CB 3.83Å; F494-V564 HydrophobicContact CE1-CG1 4.44Å; F494-V564 HydrophobicContact CE1-CG2 3.26Å; F494-V564 HydrophobicContact CZ-CG2 3.76Å; L497-V564 HydrophobicContact CD1-CG1 3.92Å; F561-V564 HydrophobicContact CD2-CB 4.16Å; F561-V564 HydrophobicContact CD2-CG1 4.47Å; F561-V564 HydrophobicContact CD2-CG2 4.25Å; F561-V564 HydrophobicContact CE2-CB 4.26Å; F561-V564 HydrophobicContact CE2-CG1 4.1Å; F561-V564 WeakPolarHBondContact O-CB 3.39Å; F561-V564 PolarHBondContact O-N 3.43Å; F561-V564 VanDerWaalsContact O-N 3.07Å; A562-V564 PolarHBondContact O-N 2.85Å; V564-T566 VanDerWaalsContact C-N 3.33Å; V564-T566 PolarHBondContact O-N 3.47Å; V564-Q567 PolarHBondContact O-N 2.86Å; V564-I568 HydrophobicContact CG1-CD1 3.8Å; V564-I568 HydrophobicContact CG1-CG1 4.47Å; V564-I568 WeakPolarHBondContact O-CG1 3.47Å; V564-I568 PolarHBondContact O-N 3.16Å
565	K	73.7	Confident	73.6	Confident	54 Å²	54	47.2 Å²	47.2	24%	0.235	27%	0.267	C	S	.	.	H	α-helix	trans	-56.9	-48.1	173.9	-67.2	172.9	158.3	161.2	0	111.1	F561 A562 K569 L603	F561-K565 HydrophobicContact CD1-CD 3.81Å; F561-K565 VanDerWaalsContact CD1-CE 3.41Å; F561-K565 HydrophobicContact CD1-CG 3.71Å; F561-K565 HydrophobicContact CE1-CD 4.06Å; F561-K565 VanDerWaalsContact CE1-CE 3.49Å; F561-K565 HydrophobicContact CE1-CG 3.66Å; F561-K565 PolarHBondContact O-N 2.87Å; F561-K565 VanDerWaalsContact O-N 3.07Å; A562-K565 WeakPolarHBondContact O-CB 3.47Å; A562-K565 PolarHBondContact O-N 3.38Å; K565-K569 WeakPolarHBondContact O-CB 3.46Å; K565-K569 VanDerWaalsContact O-CG 3.24Å; K565-K569 WeakPolarHBondContact O-CG 3.45Å; K565-K569 PolarHBondContact O-N 3.43Å; K565-K569 VanDerWaalsContact O-N 3.13Å; K565-L603 WeakPolarHBondContact CE-O 3.13Å; K565-L603 HydrophobicContact CG-CB 4.28Å
566	T	75	Confident	73.8	Confident	101 Å²	101	41.7 Å²	41.7	62%	0.62	25%	0.248	S	C	*	.	H	α-helix	trans	-64.1	-41.8	-179.5	-56.9	0	0	0	0	112.2	A562 P563 V564 G570	A562-T566 PolarHBondContact O-N 2.87Å; A562-T566 PolarHBondContact O-OG1 2.63Å; P563-T566 PolarHBondContact O-N 3.35Å; V564-T566 VanDerWaalsContact C-N 3.33Å; V564-T566 PolarHBondContact O-N 3.47Å; T566-G570 PolarHBondContact O-N 2.94Å
567	Q	70.6	Confident	74.1	Confident	76 Å²	76	47.4 Å²	47.4	36%	0.355	27%	0.265	S	S	.	.	H	α-helix	trans	-67.8	-45.8	-179.7	-175.1	171.7	-10.6	0	0	112.2	F494 P563 V564 K569 G570 T571	F494-Q567 HydrophobicContact CD1-CB 4.38Å; F494-Q567 VanDerWaalsContact CG-OE1 3.29Å; P563-Q567 WeakPolarHBondContact O-CB 3.39Å; P563-Q567 PolarHBondContact O-N 3.41Å; V564-Q567 PolarHBondContact O-N 2.86Å; Q567-K569 VanDerWaalsContact C-N 3.33Å; Q567-K569 PolarHBondContact O-N 2.94Å; Q567-G570 WeakPolarHBondContact O-CA 3.34Å; Q567-G570 PolarHBondContact O-N 3.48Å; Q567-G570 VanDerWaalsContact O-N 3.12Å; Q567-T571 PolarHBondContact O-N 3.11Å; Q567-T571 PolarHBondContact O-OG1 3.44Å
568	I	73.7	Confident	74.2	Confident	12 Å²	12	47.8 Å²	47.8	6%	0.062	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-45.1	177.8	-66.1	167.2	0	0	0	110.3	L497 L536 I540 V564 G570 T571 Y572 V599 L603	L497-I568 HydrophobicContact CD1-CD1 4.26Å; L536-I568 HydrophobicContact CD1-CG2 4.28Å; L536-I568 HydrophobicContact CD2-CD1 3.95Å; L536-I568 HydrophobicContact CD2-CG2 4.49Å; I540-I568 HydrophobicContact CD1-CD1 3.99Å; V564-I568 HydrophobicContact CG1-CD1 3.8Å; V564-I568 HydrophobicContact CG1-CG1 4.47Å; V564-I568 WeakPolarHBondContact O-CG1 3.47Å; V564-I568 PolarHBondContact O-N 3.16Å; I568-G570 VanDerWaalsContact C-N 3.33Å; I568-G570 PolarHBondContact O-N 2.9Å; I568-T571 PolarHBondContact O-N 3.34Å; I568-Y572 HydrophobicContact CG2-CD2 3.97Å; I568-Y572 HydrophobicContact CG2-CE2 4.16Å; I568-Y572 WeakPolarHBondContact O-CD2 3.32Å; I568-Y572 PolarHBondContact O-N 2.83Å; I568-V599 HydrophobicContact CG2-CG1 3.73Å; I568-L603 HydrophobicContact CB-CD1 4.16Å; I568-L603 HydrophobicContact CD1-CD2 3.71Å; I568-L603 HydrophobicContact CG2-CD1 4.02Å
569	K	77.3	Confident	74.2	Confident	71 Å²	71	44.8 Å²	44.8	31%	0.309	25%	0.252	S	S	.	.	H	α-helix	trans	-59.1	-44.5	174.1	-70.8	-180	-174.5	-140.8	0	111.8	K565 Q567 Y572 A573 S600 L603	K565-K569 WeakPolarHBondContact O-CB 3.46Å; K565-K569 VanDerWaalsContact O-CG 3.24Å; K565-K569 WeakPolarHBondContact O-CG 3.45Å; K565-K569 PolarHBondContact O-N 3.43Å; K565-K569 VanDerWaalsContact O-N 3.13Å; Q567-K569 VanDerWaalsContact C-N 3.33Å; Q567-K569 PolarHBondContact O-N 2.94Å; K569-Y572 PolarHBondContact O-N 3.28Å; K569-A573 VanDerWaalsContact O-CB 3.29Å; K569-A573 WeakPolarHBondContact O-CB 3.49Å; K569-A573 PolarHBondContact O-N 2.93Å; K569-S600 WeakPolarHBondContact CE-OG 3.46Å; K569-S600 PolarHBondContact NZ-OG 2.82Å; K569-L603 HydrophobicContact CG-CD1 4.39Å
570	G	73.8	Confident	74.4	Confident	40 Å²	40	41.6 Å²	41.6	41%	0.412	24%	0.242	S	C	.	.	H	α-helix	trans	-60.1	-44.7	177.1	0	0	0	0	0	113.4	T566 Q567 I568 A573 S574	T566-G570 PolarHBondContact O-N 2.94Å; Q567-G570 WeakPolarHBondContact O-CA 3.34Å; Q567-G570 PolarHBondContact O-N 3.48Å; Q567-G570 VanDerWaalsContact O-N 3.12Å; I568-G570 VanDerWaalsContact C-N 3.33Å; I568-G570 PolarHBondContact O-N 2.9Å; G570-A573 PolarHBondContact O-N 3.08Å; G570-S574 VanDerWaalsContact O-CB 3.27Å; G570-S574 WeakPolarHBondContact O-CB 3.24Å; G570-S574 PolarHBondContact O-N 3.41Å
571	T	72.8	Confident	74.8	Confident	19 Å²	19	46.5 Å²	46.5	12%	0.117	26%	0.264	C	S	.	.	H	α-helix	trans	-66.5	-42.8	177.2	-65.2	0	0	0	0	111.5	E502 Q567 I568 A573 S574 L575	E502-T571 HydrophobicContact CB-CG2 4.14Å; E502-T571 WeakPolarHBondContact OE2-CG2 3.24Å; E502-T571 PolarHBondContact OE2-OG1 3Å; E502-T571 VanDerWaalsContact OE2-OG1 3.12Å; Q567-T571 PolarHBondContact O-N 3.11Å; Q567-T571 PolarHBondContact O-OG1 3.44Å; I568-T571 PolarHBondContact O-N 3.34Å; T571-A573 VanDerWaalsContact C-N 3.34Å; T571-A573 PolarHBondContact O-N 2.93Å; T571-S574 WeakPolarHBondContact O-CB 3.31Å; T571-S574 PolarHBondContact O-N 3Å; T571-L575 VanDerWaalsContact O-CB 3.23Å; T571-L575 WeakPolarHBondContact O-CB 3.04Å; T571-L575 PolarHBondContact O-N 3.04Å
572	Y	75.8	Confident	74.7	Confident	13 Å²	13	53 Å²	53	5%	0.051	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-36.7	174.3	-89.9	-95.6	0	0	0	112.4	L536 I568 K569 G576 L593 V599	L536-Y572 HydrophobicContact CD1-CE2 3.6Å; L536-Y572 WeakPolarHBondContact CD1-OH 3.5Å; I568-Y572 HydrophobicContact CG2-CD2 3.97Å; I568-Y572 HydrophobicContact CG2-CE2 4.16Å; I568-Y572 WeakPolarHBondContact O-CD2 3.32Å; I568-Y572 PolarHBondContact O-N 2.83Å; K569-Y572 PolarHBondContact O-N 3.28Å; Y572-G576 PolarHBondContact O-N 3.04Å; Y572-L593 HydrophobicContact CD1-CD1 4.07Å; Y572-L593 HydrophobicContact CE1-CD1 4.15Å; Y572-V599 HydrophobicContact CD1-CG2 3.79Å; Y572-V599 HydrophobicContact CD2-CG1 4.23Å; Y572-V599 HydrophobicContact CD2-CG2 4.35Å; Y572-V599 HydrophobicContact CE1-CG2 3.77Å; Y572-V599 HydrophobicContact CE2-CG1 4.45Å; Y572-V599 HydrophobicContact CE2-CG2 4.34Å; Y572-V599 HydrophobicContact CG-CG2 4.08Å
573	A	76.9	Confident	74.8	Confident	34 Å²	34	51.3 Å²	51.3	28%	0.281	27%	0.273	S	S	.	.	H	α-helix	trans	-70.3	-36.9	174.5	0	0	0	0	0	112.7	K569 G570 T571 R577	K569-A573 VanDerWaalsContact O-CB 3.29Å; K569-A573 WeakPolarHBondContact O-CB 3.49Å; K569-A573 PolarHBondContact O-N 2.93Å; G570-A573 PolarHBondContact O-N 3.08Å; T571-A573 VanDerWaalsContact C-N 3.34Å; T571-A573 PolarHBondContact O-N 2.93Å; A573-R577 WeakPolarHBondContact O-CB 3.45Å; A573-R577 WeakPolarHBondContact O-CG 3.39Å; A573-R577 PolarHBondContact O-N 3.06Å
574	S	76.7	Confident	75.2	Confident	16 Å²	16	52.8 Å²	52.8	11%	0.112	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-49.6	172.7	-173.3	0	0	0	0	110.8	E502 G570 T571 G576 R577 L578	E502-S574 PolarHBondContact OE1-OG 3.47Å; G570-S574 VanDerWaalsContact O-CB 3.27Å; G570-S574 WeakPolarHBondContact O-CB 3.24Å; G570-S574 PolarHBondContact O-N 3.41Å; T571-S574 WeakPolarHBondContact O-CB 3.31Å; T571-S574 PolarHBondContact O-N 3Å; S574-G576 PolarHBondContact O-N 3.25Å; S574-R577 PolarHBondContact O-N 3.1Å; S574-L578 WeakPolarHBondContact O-CG 3.45Å; S574-L578 PolarHBondContact O-N 2.92Å
575	L	74.9	Confident	75.4	Confident	11 Å²	11	57.9 Å²	57.9	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-60.2	-44.4	176	-178.2	59.6	0	0	0	111.6	A501 L505 V529 T571 R577 L578 I579 L593	A501-L575 HydrophobicContact CB-CD2 4.35Å; L505-L575 HydrophobicContact CD1-CD1 3.14Å; V529-L575 HydrophobicContact CG2-CD2 4.39Å; T571-L575 VanDerWaalsContact O-CB 3.23Å; T571-L575 WeakPolarHBondContact O-CB 3.04Å; T571-L575 PolarHBondContact O-N 3.04Å; L575-R577 PolarHBondContact O-N 3.47Å; L575-L578 PolarHBondContact O-N 3.47Å; L575-I579 HydrophobicContact CD1-CD1 3.78Å; L575-I579 HydrophobicContact CD1-CG1 4.27Å; L575-I579 HydrophobicContact CG-CD1 3.78Å; L575-I579 WeakPolarHBondContact O-CB 3.22Å; L575-I579 WeakPolarHBondContact O-CD1 3.24Å; L575-I579 VanDerWaalsContact O-CG1 3.27Å; L575-I579 WeakPolarHBondContact O-CG1 3.5Å; L575-I579 PolarHBondContact O-N 3.22Å; L575-L593 HydrophobicContact CD2-CD1 3.58Å; L575-L593 HydrophobicContact CG-CD1 4.03Å; L575-L593 HydrophobicContact CG-CD2 4.36Å
576	G	75.3	Confident	75.6	Confident	25 Å²	25	61.5 Å²	61.5	26%	0.258	33%	0.326	S	S	.	.	H	α-helix	trans	-60.7	-43.2	175.4	0	0	0	0	0	112.9	Y572 S574 A580 L593	Y572-G576 PolarHBondContact O-N 3.04Å; S574-G576 PolarHBondContact O-N 3.25Å; G576-A580 VanDerWaalsContact O-CB 3.3Å; G576-A580 WeakPolarHBondContact O-CB 3.27Å; G576-A580 PolarHBondContact O-N 2.95Å; G576-L593 VanDerWaalsContact CA-CD2 3.43Å
577	R	78.5	Confident	75.7	Confident	158 Å²	158	58.4 Å²	58.4	60%	0.596	31%	0.306	S	S	*	.	H	α-helix	trans	-64	-46.2	174.4	-77	-174.7	-66.2	158.6	0.9	112.4	A573 S574 L575 I579 A580 E581	A573-R577 WeakPolarHBondContact O-CB 3.45Å; A573-R577 WeakPolarHBondContact O-CG 3.39Å; A573-R577 PolarHBondContact O-N 3.06Å; S574-R577 PolarHBondContact O-N 3.1Å; L575-R577 PolarHBondContact O-N 3.47Å; R577-I579 VanDerWaalsContact C-N 3.32Å; R577-I579 PolarHBondContact O-N 2.85Å; R577-A580 PolarHBondContact O-N 2.61Å; R577-E581 WeakPolarHBondContact O-CB 3.4Å; R577-E581 WeakPolarHBondContact O-CG 3.25Å; R577-E581 PolarHBondContact O-N 2.83Å
578	L	74.6	Confident	75.9	Confident	39 Å²	39	59.2 Å²	59.2	20%	0.204	31%	0.306	C	S	.	.	H	α-helix	trans	-61.1	-42	178.2	-77.9	165.5	0	0	0	112	L505 S574 L575 E581 R582	L505-L578 HydrophobicContact CB-CD1 4.1Å; L505-L578 HydrophobicContact CD1-CD1 4.45Å; S574-L578 WeakPolarHBondContact O-CG 3.45Å; S574-L578 PolarHBondContact O-N 2.92Å; L575-L578 PolarHBondContact O-N 3.47Å; L578-E581 PolarHBondContact O-N 2.89Å; L578-R582 WeakPolarHBondContact O-CB 3.49Å; L578-R582 WeakPolarHBondContact O-CG 3.2Å; L578-R582 PolarHBondContact O-N 3.24Å
579	I	74.8	Confident	76.1	Confident	8 Å²	8	66.4 Å²	66.4	4%	0.041	34%	0.339	C	S	.	.	H	α-helix	trans	-66.3	-43	176.6	-69.8	163.9	0	0	0	110.3	L575 R577 E581 R582 Y583 R588 I591 L593	L575-I579 HydrophobicContact CD1-CD1 3.78Å; L575-I579 HydrophobicContact CD1-CG1 4.27Å; L575-I579 HydrophobicContact CG-CD1 3.78Å; L575-I579 WeakPolarHBondContact O-CB 3.22Å; L575-I579 WeakPolarHBondContact O-CD1 3.24Å; L575-I579 VanDerWaalsContact O-CG1 3.27Å; L575-I579 WeakPolarHBondContact O-CG1 3.5Å; L575-I579 PolarHBondContact O-N 3.22Å; R577-I579 VanDerWaalsContact C-N 3.32Å; R577-I579 PolarHBondContact O-N 2.85Å; I579-E581 PolarHBondContact O-N 3.37Å; I579-R582 PolarHBondContact O-N 2.95Å; I579-Y583 HydrophobicContact CB-CD2 4.48Å; I579-Y583 HydrophobicContact CG2-CD2 4.35Å; I579-Y583 WeakPolarHBondContact O-CB 3.49Å; I579-Y583 PolarHBondContact O-N 3.11Å; I579-R588 HydrophobicContact CG2-CG 4.02Å; I579-I591 HydrophobicContact CD1-CG2 3.84Å; I579-I591 HydrophobicContact CG2-CD1 3.98Å; I579-L593 HydrophobicContact CD1-CB 4.42Å; I579-L593 HydrophobicContact CD1-CD1 4.45Å; I579-L593 HydrophobicContact CD1-CD2 4.2Å
580	A	76.3	Confident	76	Confident	43 Å²	43	66.7 Å²	66.7	36%	0.355	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-41.5	175.9	0	0	0	0	0	112.4	G576 R577 R582 R588	G576-A580 VanDerWaalsContact O-CB 3.3Å; G576-A580 WeakPolarHBondContact O-CB 3.27Å; G576-A580 PolarHBondContact O-N 2.95Å; R577-A580 PolarHBondContact O-N 2.61Å; A580-R582 PolarHBondContact O-N 3.48Å; A580-R588 PolarHBondContact O-NH2 3.31Å
581	E	78.4	Confident	76	Confident	134 Å²	134	64.8 Å²	64.8	63%	0.626	32%	0.323	S	S	*	.	H	α-helix	trans	-73	-26.5	-177.8	-74.3	174.2	-169.1	0	0	113.8	R577 L578 I579	R577-E581 WeakPolarHBondContact O-CB 3.4Å; R577-E581 WeakPolarHBondContact O-CG 3.25Å; R577-E581 PolarHBondContact O-N 2.83Å; L578-E581 PolarHBondContact O-N 2.89Å; I579-E581 PolarHBondContact O-N 3.37Å
582	R	74.2	Confident	76.2	Confident	142 Å²	142	66.4 Å²	66.4	54%	0.536	34%	0.338	S	S	.	.	H	α-helix	trans	-116.8	-14.5	-165.4	-57.2	-63	-176.3	164.6	1.5	115.3	L514 L578 I579 A580	L514-R582 HydrophobicContact CD1-CG 4.34Å; L578-R582 WeakPolarHBondContact O-CB 3.49Å; L578-R582 WeakPolarHBondContact O-CG 3.2Å; L578-R582 PolarHBondContact O-N 3.24Å; I579-R582 PolarHBondContact O-N 2.95Å; A580-R582 PolarHBondContact O-N 3.48Å
583	Y	76.6	Confident	76.2	Confident	8 Å²	8	68.1 Å²	68.1	3%	0.031	35%	0.348	C	S	.	.	S	Bend	trans	-122.4	143	-177.1	-63.9	-92.9	0	0	0	111.6	A520 P522 L525 I579 D587 R588 I591	A520-Y583 PolarHBondContact O-OH 3.17Å; P522-Y583 HydrophobicContact CG-CD1 4.42Å; L525-Y583 HydrophobicContact CD1-CE1 3.94Å; L525-Y583 HydrophobicContact CD1-CE2 4.28Å; L525-Y583 VanDerWaalsContact CD1-OH 3.29Å; L525-Y583 WeakPolarHBondContact CD1-OH 3.46Å; I579-Y583 HydrophobicContact CB-CD2 4.48Å; I579-Y583 HydrophobicContact CG2-CD2 4.35Å; I579-Y583 WeakPolarHBondContact O-CB 3.49Å; I579-Y583 PolarHBondContact O-N 3.11Å; Y583-D587 HydrophobicContact CD1-CB 4.02Å; Y583-D587 HydrophobicContact CG-CB 4.41Å; Y583-R588 PolarHBondContact O-NE 2.92Å; Y583-I591 HydrophobicContact CD1-CD1 3.89Å; Y583-I591 HydrophobicContact CD2-CD1 4.22Å; Y583-I591 HydrophobicContact CE1-CD1 4.26Å; Y583-I591 HydrophobicContact CG-CD1 3.87Å
584	D	77.9	Confident	76.2	Confident	97 Å²	97	67.5 Å²	67.5	52%	0.519	34%	0.341	S	S	.	.			trans	-73.8	163.4	179.2	-55.5	-47.1	0	0	0	110.4	K515 D586 D587 R588	K515-D584 IonicContact NZ-OD2 3.77Å; K515-D584 PolarHBondContact NZ-OD2 2.84Å; D584-D586 VanDerWaalsContact C-N 3.27Å; D584-D586 PolarHBondContact O-N 3.38Å; D584-D587 WeakPolarHBondContact O-CB 3.48Å; D584-D587 PolarHBondContact O-N 3.34Å; D584-R588 WeakPolarHBondContact O-CG 3.3Å; D584-R588 PolarHBondContact O-N 2.85Å
585	D	76.5	Confident	75.9	Confident	114 Å²	114	69 Å²	69	61%	0.61	35%	0.351	S	S	*	.	H	α-helix	trans	-60.2	-34.2	-172.8	-72.1	-33.7	0	0	0	113.8	R588 H589	D585-R588 PolarHBondContact O-N 2.93Å; D585-R588 IonicContact OD1-CZ 2.8Å; D585-R588 IonicContact OD1-NE 2.72Å; D585-R588 IonicContact OD1-NH1 3.52Å; D585-R588 PolarHBondContact OD1-NH1 3.28Å; D585-H589 PolarHBondContact O-N 3.5Å; D585-H589 VanDerWaalsContact O-N 3.08Å
586	D	76.9	Confident	75.7	Confident	131 Å²	131	73.5 Å²	73.5	70%	0.701	37%	0.372	S	S	*	.	H	α-helix	trans	-65.7	-43.9	174.2	-67.5	-27.9	0	0	0	111.7	D584 R588 H589 I590	D584-D586 VanDerWaalsContact C-N 3.27Å; D584-D586 PolarHBondContact O-N 3.38Å; D586-R588 VanDerWaalsContact C-N 3.3Å; D586-R588 PolarHBondContact O-N 3.34Å; D586-H589 PolarHBondContact O-N 2.92Å; D586-I590 WeakPolarHBondContact O-CG1 3.25Å; D586-I590 PolarHBondContact O-N 3.47Å; D586-I590 VanDerWaalsContact O-N 3.11Å
587	D	77.8	Confident	75.7	Confident	35 Å²	35	79.7 Å²	79.7	19%	0.187	39%	0.394	C	S	.	.	H	α-helix	trans	-63.3	-38.1	176.7	-71.8	-23	0	0	0	110.7	K515 P522 Y583 D584 I590 I591	K515-D587 IonicContact NZ-OD2 2.84Å; P522-D587 HydrophobicContact CB-CB 4.46Å; P522-D587 HydrophobicContact CG-CB 3.96Å; Y583-D587 HydrophobicContact CD1-CB 4.02Å; Y583-D587 HydrophobicContact CG-CB 4.41Å; D584-D587 WeakPolarHBondContact O-CB 3.48Å; D584-D587 PolarHBondContact O-N 3.34Å; D587-I590 PolarHBondContact O-N 2.97Å; D587-I591 VanDerWaalsContact O-CG1 3.23Å; D587-I591 WeakPolarHBondContact O-CG1 3.47Å; D587-I591 PolarHBondContact O-N 3.35Å
588	R	75.2	Confident	75.6	Confident	94 Å²	94	76.9 Å²	76.9	36%	0.355	39%	0.388	S	S	.	.	H	α-helix	trans	-64.2	-39.3	176	-65.5	174.9	-168.1	174.4	-3.8	112.2	I579 A580 Y583 D584 D585 D586 I590 I591 A592	I579-R588 HydrophobicContact CG2-CG 4.02Å; A580-R588 PolarHBondContact O-NH2 3.31Å; Y583-R588 PolarHBondContact O-NE 2.92Å; D584-R588 WeakPolarHBondContact O-CG 3.3Å; D584-R588 PolarHBondContact O-N 2.85Å; D585-R588 PolarHBondContact O-N 2.93Å; D585-R588 IonicContact OD1-CZ 2.8Å; D585-R588 IonicContact OD1-NE 2.72Å; D585-R588 IonicContact OD1-NH1 3.52Å; D585-R588 PolarHBondContact OD1-NH1 3.28Å; D586-R588 VanDerWaalsContact C-N 3.3Å; D586-R588 PolarHBondContact O-N 3.34Å; R588-I590 VanDerWaalsContact C-N 3.3Å; R588-I591 PolarHBondContact O-N 3.06Å; R588-A592 PolarHBondContact O-N 3.32Å
589	H	77.4	Confident	75.7	Confident	163 Å²	163	75.1 Å²	75.1	76%	0.755	38%	0.379	S	S	*	.	H	α-helix	trans	-65.6	-36.6	176.4	-163.8	65.3	0	0	0	111.6	D585 D586	D585-H589 PolarHBondContact O-N 3.5Å; D585-H589 VanDerWaalsContact O-N 3.08Å; D586-H589 PolarHBondContact O-N 2.92Å
590	I	75.5	Confident	75.8	Confident	76 Å²	76	75.9 Å²	75.9	39%	0.39	39%	0.385	S	S	.	.	H	α-helix	trans	-67.8	-44.2	174.1	-63.9	166.4	0	0	0	110.9	P522 K523 N526 D586 D587 R588 A592	P522-I590 HydrophobicContact CB-CB 4.1Å; P522-I590 HydrophobicContact CB-CG2 3.78Å; K523-I590 HydrophobicContact CG-CG2 4.09Å; N526-I590 VanDerWaalsContact CB-O 3.31Å; N526-I590 WeakPolarHBondContact CB-O 3.47Å; N526-I590 PolarHBondContact ND2-O 2.93Å; N526-I590 VanDerWaalsContact ND2-O 3.13Å; D586-I590 WeakPolarHBondContact O-CG1 3.25Å; D586-I590 PolarHBondContact O-N 3.47Å; D586-I590 VanDerWaalsContact O-N 3.11Å; D587-I590 PolarHBondContact O-N 2.97Å; R588-I590 VanDerWaalsContact C-N 3.3Å; I590-A592 VanDerWaalsContact C-N 3.28Å; I590-A592 PolarHBondContact O-N 3.28Å
591	I	73.2	Confident	75.9	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-64.6	-35	179.9	-65.7	162.4	0	0	0	111	P522 L525 N526 V529 I579 Y583 D587 R588 L593	P522-I591 HydrophobicContact CB-CD1 4.38Å; P522-I591 HydrophobicContact CB-CG1 3.92Å; L525-I591 HydrophobicContact CB-CD1 4.46Å; L525-I591 HydrophobicContact CB-CG1 3.98Å; L525-I591 HydrophobicContact CB-CG2 4.19Å; L525-I591 HydrophobicContact CD1-CD1 4.06Å; L525-I591 HydrophobicContact CD1-CG1 4.43Å; N526-I591 PolarHBondContact ND2-O 3.24Å; V529-I591 HydrophobicContact CG2-CG2 4.42Å; I579-I591 HydrophobicContact CD1-CG2 3.84Å; I579-I591 HydrophobicContact CG2-CD1 3.98Å; Y583-I591 HydrophobicContact CD1-CD1 3.89Å; Y583-I591 HydrophobicContact CD2-CD1 4.22Å; Y583-I591 HydrophobicContact CE1-CD1 4.26Å; Y583-I591 HydrophobicContact CG-CD1 3.87Å; D587-I591 VanDerWaalsContact O-CG1 3.23Å; D587-I591 WeakPolarHBondContact O-CG1 3.47Å; D587-I591 PolarHBondContact O-N 3.35Å; R588-I591 PolarHBondContact O-N 3.06Å; I591-L593 PolarHBondContact O-N 2.8Å
592	A	77.9	Confident	75.9	Confident	53 Å²	53	74.4 Å²	74.4	44%	0.438	38%	0.375	S	S	.	.			trans	46.8	56.2	175.6	0	0	0	0	0	113.1	R588 I590 T594	R588-A592 PolarHBondContact O-N 3.32Å; I590-A592 VanDerWaalsContact C-N 3.28Å; I590-A592 PolarHBondContact O-N 3.28Å; A592-T594 PolarHBondContact O-N 2.83Å
593	L	75.5	Confident	75.9	Confident	49 Å²	49	67.8 Å²	67.8	26%	0.257	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-60.4	126.6	177.5	-175.6	68.4	0	0	0	110.6	V529 Y572 L575 G576 I579 I591 S595	V529-L593 HydrophobicContact CG1-CD1 3.9Å; V529-L593 HydrophobicContact CG2-CD1 3.9Å; Y572-L593 HydrophobicContact CD1-CD1 4.07Å; Y572-L593 HydrophobicContact CE1-CD1 4.15Å; L575-L593 HydrophobicContact CD2-CD1 3.58Å; L575-L593 HydrophobicContact CG-CD1 4.03Å; L575-L593 HydrophobicContact CG-CD2 4.36Å; G576-L593 VanDerWaalsContact CA-CD2 3.43Å; I579-L593 HydrophobicContact CD1-CB 4.42Å; I579-L593 HydrophobicContact CD1-CD1 4.45Å; I579-L593 HydrophobicContact CD1-CD2 4.2Å; I591-L593 PolarHBondContact O-N 2.8Å; L593-S595 PolarHBondContact O-N 3.47Å
594	T	75.3	Confident	75.6	Confident	21 Å²	21	77.7 Å²	77.7	13%	0.129	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-54.4	131.5	173.2	-46.9	0	0	0	0	110.3	Y533 A592 E598 V599	Y533-T594 HydrophobicContact CD2-CG2 3.71Å; Y533-T594 HydrophobicContact CE2-CG2 3.61Å; Y533-T594 HydrophobicContact CG-CG2 4.43Å; A592-T594 PolarHBondContact O-N 2.83Å; T594-E598 HydrophobicContact CG2-CB 3.76Å; T594-E598 VanDerWaalsContact CG2-OE2 3.26Å; T594-E598 WeakPolarHBondContact CG2-OE2 3.47Å; T594-V599 HydrophobicContact CG2-CG2 3.87Å
595	S	71.6	Confident	75.4	Confident	48 Å²	48	76.7 Å²	76.7	34%	0.336	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-65	150.8	-176.3	67.9	0	0	0	0	111.8	L593 E597 E598 V599	L593-S595 PolarHBondContact O-N 3.47Å; S595-E597 PolarHBondContact O-N 2.83Å; S595-E598 PolarHBondContact N-OE2 2.7Å; S595-E598 PolarHBondContact O-N 3.46Å; S595-E598 WeakPolarHBondContact OG-CB 3.45Å; S595-E598 VanDerWaalsContact OG-CG 3.25Å; S595-E598 WeakPolarHBondContact OG-CG 3.24Å; S595-E598 PolarHBondContact OG-N 2.93Å; S595-E598 PolarHBondContact OG-OE2 3.3Å; S595-V599 WeakPolarHBondContact O-CG2 3.48Å; S595-V599 PolarHBondContact O-N 3.2Å; S595-V599 VanDerWaalsContact O-N 3.09Å
596	E	70.9	Confident	75.4	Confident	106 Å²	106	74.7 Å²	74.7	50%	0.495	37%	0.368	S	S	.	.	H	α-helix	trans	-58.2	-30.3	176.1	-172.8	-178.5	168.7	0	0	111.9	S600	E596-S600 WeakPolarHBondContact O-CB 3.18Å; E596-S600 PolarHBondContact O-N 3.46Å; E596-S600 PolarHBondContact O-OG 2.91Å
597	E	73.9	Confident	75.3	Confident	154 Å²	154	71.6 Å²	71.6	72%	0.72	35%	0.35	S	S	*	.	H	α-helix	trans	-68.5	-46.3	177	-63.5	-173.8	173	0	0	112.1	S595 V599 S600 L601	S595-E597 PolarHBondContact O-N 2.83Å; E597-V599 PolarHBondContact O-N 2.86Å; E597-S600 CarbonylContact O-C 3.59Å; E597-S600 WeakPolarHBondContact O-CB 3.35Å; E597-S600 PolarHBondContact O-N 3.27Å; E597-L601 WeakPolarHBondContact O-CG 3.01Å; E597-L601 PolarHBondContact O-N 2.83Å
598	E	76.9	Confident	75.2	Confident	100 Å²	100	73.8 Å²	73.8	47%	0.467	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-41.1	176.3	-76.7	170.3	162	0	0	111.9	T594 S595 S600 L601 L602	T594-E598 HydrophobicContact CG2-CB 3.76Å; T594-E598 VanDerWaalsContact CG2-OE2 3.26Å; T594-E598 WeakPolarHBondContact CG2-OE2 3.47Å; S595-E598 PolarHBondContact N-OE2 2.7Å; S595-E598 PolarHBondContact O-N 3.46Å; S595-E598 WeakPolarHBondContact OG-CB 3.45Å; S595-E598 VanDerWaalsContact OG-CG 3.25Å; S595-E598 WeakPolarHBondContact OG-CG 3.24Å; S595-E598 PolarHBondContact OG-N 2.93Å; S595-E598 PolarHBondContact OG-OE2 3.3Å; E598-S600 VanDerWaalsContact C-N 3.34Å; E598-L601 PolarHBondContact O-N 3.2Å; E598-L602 PolarHBondContact O-N 2.98Å
599	V	76.5	Confident	75.1	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.006	36%	0.36	C	S	.	.	H	α-helix	trans	-65.3	-40.7	173.6	177.2	0	0	0	0	110.4	I568 Y572 T594 S595 E597 L601 L602 L603	I568-V599 HydrophobicContact CG2-CG1 3.73Å; Y572-V599 HydrophobicContact CD1-CG2 3.79Å; Y572-V599 HydrophobicContact CD2-CG1 4.23Å; Y572-V599 HydrophobicContact CD2-CG2 4.35Å; Y572-V599 HydrophobicContact CE1-CG2 3.77Å; Y572-V599 HydrophobicContact CE2-CG1 4.45Å; Y572-V599 HydrophobicContact CE2-CG2 4.34Å; Y572-V599 HydrophobicContact CG-CG2 4.08Å; T594-V599 HydrophobicContact CG2-CG2 3.87Å; S595-V599 WeakPolarHBondContact O-CG2 3.48Å; S595-V599 PolarHBondContact O-N 3.2Å; S595-V599 VanDerWaalsContact O-N 3.09Å; E597-V599 PolarHBondContact O-N 2.86Å; V599-L601 VanDerWaalsContact C-N 3.31Å; V599-L601 PolarHBondContact O-N 3.31Å; V599-L602 PolarHBondContact O-N 3Å; V599-L603 HydrophobicContact CG1-CD1 3.97Å; V599-L603 WeakPolarHBondContact O-CG 3.39Å; V599-L603 PolarHBondContact O-N 3.35Å; V599-L603 VanDerWaalsContact O-N 3.15Å
600	S	77.2	Confident	75	Confident	25 Å²	25	66.5 Å²	66.5	18%	0.175	33%	0.333	C	S	.	.	H	α-helix	trans	-63.7	-34.1	176	-68.1	0	0	0	0	113.1	K569 E596 E597 E598	K569-S600 WeakPolarHBondContact CE-OG 3.46Å; K569-S600 PolarHBondContact NZ-OG 2.82Å; E596-S600 WeakPolarHBondContact O-CB 3.18Å; E596-S600 PolarHBondContact O-N 3.46Å; E596-S600 PolarHBondContact O-OG 2.91Å; E597-S600 CarbonylContact O-C 3.59Å; E597-S600 WeakPolarHBondContact O-CB 3.35Å; E597-S600 PolarHBondContact O-N 3.27Å; E598-S600 VanDerWaalsContact C-N 3.34Å
601	L	78.6	Confident	75	Confident	105 Å²	105	65.8 Å²	65.8	55%	0.55	33%	0.329	S	S	.	.	H	α-helix	trans	-69.9	-43.2	175.3	-76.6	166.4	0	0	0	111.8	E597 E598 V599 L603 R604	E597-L601 WeakPolarHBondContact O-CG 3.01Å; E597-L601 PolarHBondContact O-N 2.83Å; E598-L601 PolarHBondContact O-N 3.2Å; V599-L601 VanDerWaalsContact C-N 3.31Å; V599-L601 PolarHBondContact O-N 3.31Å; L601-L603 PolarHBondContact O-N 3.21Å; L601-R604 PolarHBondContact O-N 3.06Å
602	L	77.4	Confident	75.1	Confident	41 Å²	41	70.8 Å²	70.8	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-59.1	-33.7	175.2	-171.6	85.5	0	0	0	112.2	Y533 L536 K537 E598 V599	Y533-L602 HydrophobicContact CE2-CD2 4.23Å; L536-L602 HydrophobicContact CB-CD2 3.89Å; K537-L602 HydrophobicContact CB-CD1 4.21Å; K537-L602 HydrophobicContact CG-CD1 4.09Å; E598-L602 PolarHBondContact O-N 2.98Å; V599-L602 PolarHBondContact O-N 3Å
603	L	74.3	Confident	74.9	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.01	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-9.4	-176.2	-69.8	171.6	0	0	0	114.3	I540 R544 F561 K565 I568 K569 V599 L601	I540-L603 HydrophobicContact CD1-CD2 3.86Å; I540-L603 HydrophobicContact CG1-CD2 4.23Å; R544-L603 PolarHBondContact NH2-O 3.33Å; F561-L603 HydrophobicContact CZ-CD2 4.47Å; K565-L603 WeakPolarHBondContact CE-O 3.13Å; K565-L603 HydrophobicContact CG-CB 4.28Å; I568-L603 HydrophobicContact CB-CD1 4.16Å; I568-L603 HydrophobicContact CD1-CD2 3.71Å; I568-L603 HydrophobicContact CG2-CD1 4.02Å; K569-L603 HydrophobicContact CG-CD1 4.39Å; V599-L603 HydrophobicContact CG1-CD1 3.97Å; V599-L603 WeakPolarHBondContact O-CG 3.39Å; V599-L603 PolarHBondContact O-N 3.35Å; V599-L603 VanDerWaalsContact O-N 3.15Å; L601-L603 PolarHBondContact O-N 3.21Å
604	R	70.3	Confident	74.8	Confident	216 Å²	216	74.5 Å²	74.5	82%	0.815	36%	0.356	S	S	*	.			trans	-66	0	175.3	-74.6	-174.6	179.3	-179.2	1	110.9	R544 L601	R544-R604 PolarHBondContact NH1-O 3.33Å; R544-R604 PolarHBondContact NH2-O 3.01Å; L601-R604 PolarHBondContact O-N 3.06Å

Retrieved 604 of 604 residues in 1528.6 ms (Link to these results)

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