A0A3Q0KD63_SCHMA Loading...

Putative rac gtpase activating protein

AlphaFold DB , UniProt , Accession A0A3Q0KD63, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 610 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	39.7	Very low	224 Å²	224	150.5 Å²	150.5	100%	1.103	77%	0.765	S	S	*	*				0	-21.6	0	-75.4	-159	-98.2	0	0	115.3
2	A	39	Very low	40.2	Very low	80 Å²	80	153.5 Å²	153.5	66%	0.661	77%	0.769	S	S	*	*			trans	-72.5	-33	-179.8	0	0	0	0	0	114.7	G4 R5	A2-G4 VanDerWaalsContact C-N 3.31Å; A2-G4 PolarHBondContact O-N 2.94Å; A2-R5 PolarHBondContact O-N 3.03Å
3	A	39.6	Very low	41.2	Very low	80 Å²	80	149 Å²	149	66%	0.661	76%	0.761	S	S	*	*	H	α-helix	trans	-63	-32.2	-178.1	0	0	0	0	0	114.1	R5 L6	A3-R5 VanDerWaalsContact C-N 3.31Å; A3-R5 PolarHBondContact O-N 3.2Å; A3-L6 PolarHBondContact O-N 3.23Å
4	G	43	Very low	42.5	Very low	51 Å²	51	142.1 Å²	142.1	53%	0.526	73%	0.729	S	S	.	*	H	α-helix	trans	-71	-20.7	-179	0	0	0	0	0	114.7	A2	A2-G4 VanDerWaalsContact C-N 3.31Å; A2-G4 PolarHBondContact O-N 2.94Å
5	R	40.2	Very low	44.5	Very low	205 Å²	205	136.5 Å²	136.5	77%	0.774	71%	0.708	S	S	*	*	H	α-helix	trans	-84.9	-21.3	179.3	-65.4	-169.6	-159.3	-143.7	5	113.2	A2 A3	A2-R5 PolarHBondContact O-N 3.03Å; A3-R5 VanDerWaalsContact C-N 3.31Å; A3-R5 PolarHBondContact O-N 3.2Å
6	L	38.3	Very low	46.5	Very low	138 Å²	138	133.6 Å²	133.6	72%	0.723	69%	0.688	S	S	*	*	H	α-helix	trans	-74.2	-35.4	177.1	-96.1	103.4	0	0	0	113	A3 K8 R9	A3-L6 PolarHBondContact O-N 3.23Å; L6-K8 VanDerWaalsContact C-N 3.28Å; L6-K8 PolarHBondContact O-N 3.44Å; L6-R9 PolarHBondContact O-N 3.3Å
7	I	42.9	Very low	48.3	Very low	146 Å²	146	132.4 Å²	132.4	75%	0.749	68%	0.679	S	S	*	*	H	α-helix	trans	-68.8	-28.4	-177.6	-60.1	173.6	0	0	0	111.5	R9	I7-R9 PolarHBondContact O-N 3.31Å
8	K	39.9	Very low	50.2	Low	192 Å²	192	128 Å²	128	84%	0.835	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-6.4	-178.6	-86.4	-176.5	177.1	176.6	0	115.7	L6	L6-K8 VanDerWaalsContact C-N 3.28Å; L6-K8 PolarHBondContact O-N 3.44Å
9	R	35.9	Very low	51.7	Low	220 Å²	220	121.6 Å²	121.6	83%	0.83	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-7.8	179.8	-83.3	-175.5	174	166.8	-1.8	115.9	L6 I7 N11	L6-R9 PolarHBondContact O-N 3.3Å; I7-R9 PolarHBondContact O-N 3.31Å; R9-N11 PolarHBondContact O-N 2.9Å
10	K	40.9	Very low	53.2	Low	155 Å²	155	121.1 Å²	121.1	67%	0.674	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	4.8	-173.1	-92.1	-168.2	173.2	-170.5	0	117.6	D46	K10-D46 IonicContact NZ-OD2 2.67Å
11	N	41.6	Very low	54.8	Low	165 Å²	165	118.9 Å²	118.9	88%	0.882	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	17.4	180	-80.6	-9.1	0	0	0	115.7	R9 S13	R9-N11 PolarHBondContact O-N 2.9Å; N11-S13 PolarHBondContact O-N 3.18Å; N11-S13 VanDerWaalsContact O-N 3.17Å
12	K	45.8	Very low	57.1	Low	186 Å²	186	111.1 Å²	111.1	81%	0.809	57%	0.57	S	S	*	*	S	Bend	trans	-66.4	116.6	159.1	-83.6	-176.5	177.1	-177.7	0	106.3	T14	K12-T14 PolarHBondContact O-N 3.18Å
13	S	53.1	Low	59.4	Low	95 Å²	95	108.6 Å²	108.6	66%	0.664	55%	0.545	S	S	*	.			trans	-60.1	85.6	176.2	56.7	0	0	0	0	109.5	N11 S15	N11-S13 PolarHBondContact O-N 3.18Å; N11-S13 VanDerWaalsContact O-N 3.17Å; S13-S15 PolarHBondContact O-N 3.06Å
14	T	59.2	Low	61.6	Low	52 Å²	52	109 Å²	109	32%	0.319	54%	0.536	S	S	.	.			trans	-52.6	120.5	169.9	34.1	0	0	0	0	107.4	K12 T18 K54	K12-T14 PolarHBondContact O-N 3.18Å; T14-T18 HydrophobicContact CG2-CG2 4.05Å; T14-K54 PolarHBondContact O-NZ 3.23Å
15	S	72.8	Confident	63.5	Low	58 Å²	58	109.4 Å²	109.4	41%	0.406	53%	0.53	S	S	.	.			trans	-61.4	161.5	-179.3	69.4	0	0	0	0	109.3	S13 Q17 T18 L19	S13-S15 PolarHBondContact O-N 3.06Å; S15-Q17 PolarHBondContact O-N 3.26Å; S15-Q17 WeakPolarHBondContact OG-CB 3.43Å; S15-Q17 PolarHBondContact OG-N 3.13Å; S15-T18 PolarHBondContact N-OG1 3.45Å; S15-T18 PolarHBondContact O-N 2.87Å; S15-T18 PolarHBondContact OG-N 3.32Å; S15-T18 VanDerWaalsContact OG-N 3.08Å; S15-T18 PolarHBondContact OG-OG1 2.67Å; S15-L19 PolarHBondContact O-N 3.04Å; S15-L19 VanDerWaalsContact O-N 3.09Å
16	F	76	Confident	65.4	Low	90 Å²	90	101.7 Å²	101.7	40%	0.395	50%	0.501	S	S	.	.	H	α-helix	trans	-55.4	-33.6	171.9	-75.3	-61.3	0	0	0	111	L19 F20 K54 W55	F16-L19 PolarHBondContact O-N 3.33Å; F16-F20 WeakPolarHBondContact O-CB 3.41Å; F16-F20 PolarHBondContact O-N 3.47Å; F16-K54 HydrophobicContact CD1-CD 4.34Å; F16-K54 HydrophobicContact CE1-CB 4.17Å; F16-K54 HydrophobicContact CE1-CD 3.8Å; F16-K54 HydrophobicContact CE1-CG 3.68Å; F16-K54 HydrophobicContact CZ-CD 4.23Å; F16-K54 HydrophobicContact CZ-CG 3.9Å; F16-W55 AromaticContact CD1-CD1 3.96Å; F16-W55 AromaticContact CD1-NE1 3.75Å; F16-W55 AromaticContact CE1-CD1 3.32Å; F16-W55 HydrophobicContact CE1-CG 4.46Å; F16-W55 AromaticContact CE1-NE1 3.56Å
17	Q	77.9	Confident	67.5	Low	113 Å²	113	99.1 Å²	99.1	53%	0.528	49%	0.488	S	S	.	.	H	α-helix	trans	-57.5	-52.1	170.9	-166.2	62.1	39.8	0	0	111.9	S15 L19 F20 D21	S15-Q17 PolarHBondContact O-N 3.26Å; S15-Q17 WeakPolarHBondContact OG-CB 3.43Å; S15-Q17 PolarHBondContact OG-N 3.13Å; Q17-L19 VanDerWaalsContact C-N 3.25Å; Q17-L19 PolarHBondContact O-N 3.46Å; Q17-F20 WeakPolarHBondContact O-CA 3.4Å; Q17-F20 WeakPolarHBondContact O-CB 3.49Å; Q17-F20 PolarHBondContact O-N 2.95Å; Q17-D21 PolarHBondContact NE2-OD1 3.01Å; Q17-D21 PolarHBondContact O-N 3.49Å
18	T	81.8	Confident	69.5	Low	54 Å²	54	97 Å²	97	33%	0.331	47%	0.474	S	S	.	.	H	α-helix	trans	-60.7	-35.8	-179.6	-45.3	0	0	0	0	112.8	T14 S15 Q22	T14-T18 HydrophobicContact CG2-CG2 4.05Å; S15-T18 PolarHBondContact N-OG1 3.45Å; S15-T18 PolarHBondContact O-N 2.87Å; S15-T18 PolarHBondContact OG-N 3.32Å; S15-T18 VanDerWaalsContact OG-N 3.08Å; S15-T18 PolarHBondContact OG-OG1 2.67Å; T18-Q22 WeakPolarHBondContact O-CB 3.32Å; T18-Q22 VanDerWaalsContact O-CG 3.24Å; T18-Q22 WeakPolarHBondContact O-CG 3.48Å; T18-Q22 PolarHBondContact O-N 3.04Å; T18-Q22 VanDerWaalsContact O-N 3.09Å
19	L	79.3	Confident	71.4	Confident	7 Å²	7	92.5 Å²	92.5	4%	0.037	46%	0.455	C	S	.	.	H	α-helix	trans	-69.8	-38.8	176	-76.1	173.6	0	0	0	111.7	S15 F16 Q17 Q22 I23 V47 N50 C51 K54	S15-L19 PolarHBondContact O-N 3.04Å; S15-L19 VanDerWaalsContact O-N 3.09Å; F16-L19 PolarHBondContact O-N 3.33Å; Q17-L19 VanDerWaalsContact C-N 3.25Å; Q17-L19 PolarHBondContact O-N 3.46Å; L19-Q22 WeakPolarHBondContact O-CB 3.27Å; L19-Q22 PolarHBondContact O-N 3.2Å; L19-I23 WeakPolarHBondContact O-CG1 3.49Å; L19-I23 PolarHBondContact O-N 3.19Å; L19-I23 VanDerWaalsContact O-N 3.1Å; L19-V47 HydrophobicContact CD2-CG1 4.37Å; L19-N50 HydrophobicContact CD2-CB 4.49Å; L19-C51 VanDerWaalsContact CB-SG 3.6Å; L19-K54 HydrophobicContact CD1-CD 3.67Å
20	F	81.8	Confident	73.5	Confident	110 Å²	110	84.4 Å²	84.4	48%	0.482	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-48.1	174.8	-176.2	-101.2	0	0	0	111.6	F16 Q17 Q22 I23 L24	F16-F20 WeakPolarHBondContact O-CB 3.41Å; F16-F20 PolarHBondContact O-N 3.47Å; Q17-F20 WeakPolarHBondContact O-CA 3.4Å; Q17-F20 WeakPolarHBondContact O-CB 3.49Å; Q17-F20 PolarHBondContact O-N 2.95Å; F20-Q22 PolarHBondContact O-N 3.44Å; F20-I23 WeakPolarHBondContact O-CB 3.4Å; F20-I23 PolarHBondContact O-N 3.28Å; F20-L24 HydrophobicContact CD1-CD1 3.94Å; F20-L24 HydrophobicContact CD1-CG 4.35Å; F20-L24 HydrophobicContact CE1-CD1 3.47Å; F20-L24 VanDerWaalsContact CE1-CD1 3.47Å; F20-L24 HydrophobicContact CE1-CD2 4.49Å; F20-L24 HydrophobicContact CE1-CG 4.02Å; F20-L24 HydrophobicContact CZ-CD1 4.1Å; F20-L24 HydrophobicContact CZ-CD2 4.32Å; F20-L24 HydrophobicContact CZ-CG 4.29Å; F20-L24 PolarHBondContact O-N 3.42Å
21	D	86.2	Confident	75.4	Confident	75 Å²	75	87.1 Å²	87.1	40%	0.401	44%	0.435	S	S	.	.	H	α-helix	trans	-59.1	-36.4	176.5	-55.6	-25.4	0	0	0	111.1	Q17 L24 C25	Q17-D21 PolarHBondContact NE2-OD1 3.01Å; Q17-D21 PolarHBondContact O-N 3.49Å; D21-L24 PolarHBondContact O-N 3.33Å; D21-C25 VanDerWaalsContact O-CB 3.32Å; D21-C25 WeakPolarHBondContact O-CB 3.42Å; D21-C25 PolarHBondContact O-N 2.96Å
22	Q	84.9	Confident	77.3	Confident	61 Å²	61	86.4 Å²	86.4	29%	0.285	42%	0.424	S	S	.	.	H	α-helix	trans	-67.6	-30.9	175.1	-86.3	-176.7	46.6	0	0	114.3	T18 L19 F20 R26 V47	T18-Q22 WeakPolarHBondContact O-CB 3.32Å; T18-Q22 VanDerWaalsContact O-CG 3.24Å; T18-Q22 WeakPolarHBondContact O-CG 3.48Å; T18-Q22 PolarHBondContact O-N 3.04Å; T18-Q22 VanDerWaalsContact O-N 3.09Å; L19-Q22 WeakPolarHBondContact O-CB 3.27Å; L19-Q22 PolarHBondContact O-N 3.2Å; F20-Q22 PolarHBondContact O-N 3.44Å; Q22-R26 WeakPolarHBondContact O-CG 3.25Å; Q22-R26 PolarHBondContact O-N 3.01Å; Q22-R26 PolarHBondContact O-NH1 3.35Å; Q22-V47 HydrophobicContact CB-CG1 4.04Å
23	I	86	Confident	78.6	Confident	28 Å²	28	80.6 Å²	80.6	14%	0.144	42%	0.418	C	S	.	.	H	α-helix	trans	-70.1	-50	173.1	-70.6	166.6	0	0	0	108.9	L19 F20 C25 R26 L27 L44 V47 L48	L19-I23 WeakPolarHBondContact O-CG1 3.49Å; L19-I23 PolarHBondContact O-N 3.19Å; L19-I23 VanDerWaalsContact O-N 3.1Å; F20-I23 WeakPolarHBondContact O-CB 3.4Å; F20-I23 PolarHBondContact O-N 3.28Å; I23-C25 PolarHBondContact O-N 3.46Å; I23-R26 PolarHBondContact O-N 3.35Å; I23-L27 HydrophobicContact CG2-CD1 3.75Å; I23-L27 HydrophobicContact CG2-CG 4.4Å; I23-L27 PolarHBondContact O-N 3.34Å; I23-L44 HydrophobicContact CG2-CD1 4.16Å; I23-V47 HydrophobicContact CD1-CG1 4.33Å; I23-V47 HydrophobicContact CG1-CB 4.44Å; I23-V47 HydrophobicContact CG1-CG1 3.59Å; I23-L48 HydrophobicContact CD1-CD2 3.77Å; I23-L48 HydrophobicContact CG1-CD2 4.17Å
24	L	86	Confident	79.2	Confident	87 Å²	87	78.1 Å²	78.1	46%	0.455	40%	0.4	S	S	.	.	H	α-helix	trans	-57.4	-50.6	179.7	-68.3	-178.1	0	0	0	111.9	F20 D21 R26 L27 E28	F20-L24 HydrophobicContact CD1-CD1 3.94Å; F20-L24 HydrophobicContact CD1-CG 4.35Å; F20-L24 HydrophobicContact CE1-CD1 3.47Å; F20-L24 VanDerWaalsContact CE1-CD1 3.47Å; F20-L24 HydrophobicContact CE1-CD2 4.49Å; F20-L24 HydrophobicContact CE1-CG 4.02Å; F20-L24 HydrophobicContact CZ-CD1 4.1Å; F20-L24 HydrophobicContact CZ-CD2 4.32Å; F20-L24 HydrophobicContact CZ-CG 4.29Å; F20-L24 PolarHBondContact O-N 3.42Å; D21-L24 PolarHBondContact O-N 3.33Å; L24-R26 PolarHBondContact O-N 3.29Å; L24-L27 PolarHBondContact O-N 3.05Å; L24-E28 PolarHBondContact O-N 3.44Å
25	C	83.3	Confident	79.6	Confident	61 Å²	61	83 Å²	83	41%	0.412	43%	0.429	S	S	.	.	H	α-helix	trans	-59.4	-33.5	-180	-179.6	0	0	0	0	112.7	D21 I23 K29	D21-C25 VanDerWaalsContact O-CB 3.32Å; D21-C25 WeakPolarHBondContact O-CB 3.42Å; D21-C25 PolarHBondContact O-N 2.96Å; I23-C25 PolarHBondContact O-N 3.46Å; C25-K29 WeakPolarHBondContact O-CG 3.42Å; C25-K29 PolarHBondContact O-N 3.42Å
26	R	80.6	Confident	79.5	Confident	42 Å²	42	86.2 Å²	86.2	16%	0.158	44%	0.436	C	S	.	.	H	α-helix	trans	-81.2	-37.7	179.5	-74.8	-178.4	175.3	102.9	-21.8	112.9	Q22 I23 L24 E28 K29 L30 L44	Q22-R26 WeakPolarHBondContact O-CG 3.25Å; Q22-R26 PolarHBondContact O-N 3.01Å; Q22-R26 PolarHBondContact O-NH1 3.35Å; I23-R26 PolarHBondContact O-N 3.35Å; L24-R26 PolarHBondContact O-N 3.29Å; R26-E28 VanDerWaalsContact C-N 3.28Å; R26-E28 PolarHBondContact O-N 3.29Å; R26-K29 PolarHBondContact O-N 3.46Å; R26-L30 PolarHBondContact O-N 3.35Å; R26-L44 HydrophobicContact CB-CB 4.29Å; R26-L44 HydrophobicContact CB-CD1 4.09Å
27	L	82.8	Confident	79.5	Confident	85 Å²	85	84.6 Å²	84.6	45%	0.445	44%	0.436	S	S	.	.	H	α-helix	trans	-60.2	-40.8	172.1	-77.1	169.1	0	0	0	111.3	I23 L24 K29 L30 Y31 L44	I23-L27 HydrophobicContact CG2-CD1 3.75Å; I23-L27 HydrophobicContact CG2-CG 4.4Å; I23-L27 PolarHBondContact O-N 3.34Å; L24-L27 PolarHBondContact O-N 3.05Å; L27-K29 VanDerWaalsContact C-N 3.33Å; L27-K29 PolarHBondContact O-N 3.49Å; L27-L30 PolarHBondContact O-N 3.5Å; L27-Y31 PolarHBondContact O-N 3.27Å; L27-L44 HydrophobicContact CD2-CD2 3.68Å; L27-L44 HydrophobicContact CG-CD1 4.38Å; L27-L44 HydrophobicContact CG-CD2 4.15Å
28	E	83.9	Confident	79.7	Confident	100 Å²	100	84.7 Å²	84.7	47%	0.467	44%	0.44	S	S	.	.	H	α-helix	trans	-61.6	-40.2	177	-166.3	-171.9	163.7	0	0	112.4	L24 R26 L30 Y31 K32	L24-E28 PolarHBondContact O-N 3.44Å; R26-E28 VanDerWaalsContact C-N 3.28Å; R26-E28 PolarHBondContact O-N 3.29Å; E28-L30 VanDerWaalsContact C-N 3.31Å; E28-L30 PolarHBondContact O-N 3.35Å; E28-Y31 PolarHBondContact O-N 3.4Å; E28-K32 HydrophobicContact CG-CD 4.33Å; E28-K32 WeakPolarHBondContact O-CG 3.48Å; E28-K32 PolarHBondContact O-N 2.97Å; E28-K32 WeakPolarHBondContact OE1-CE 3.41Å; E28-K32 IonicContact OE1-NZ 3.03Å; E28-K32 PolarHBondContact OE1-NZ 3.13Å
29	K	80.1	Confident	79.8	Confident	99 Å²	99	86.4 Å²	86.4	43%	0.43	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-33.5	175.8	-72.5	177.2	-178.1	-175.4	0	113.2	C25 R26 L27	C25-K29 WeakPolarHBondContact O-CG 3.42Å; C25-K29 PolarHBondContact O-N 3.42Å; R26-K29 PolarHBondContact O-N 3.46Å; L27-K29 VanDerWaalsContact C-N 3.33Å; L27-K29 PolarHBondContact O-N 3.49Å
30	L	79.7	Confident	79.9	Confident	50 Å²	50	86.7 Å²	86.7	26%	0.262	45%	0.446	S	S	.	.	H	α-helix	trans	-71.8	-42.9	175	-69.4	173.7	0	0	0	111.3	R26 L27 E28 K32 G33 S37 N40 I41 L44	R26-L30 PolarHBondContact O-N 3.35Å; L27-L30 PolarHBondContact O-N 3.5Å; E28-L30 VanDerWaalsContact C-N 3.31Å; E28-L30 PolarHBondContact O-N 3.35Å; L30-K32 VanDerWaalsContact C-N 3.35Å; L30-K32 PolarHBondContact O-N 2.98Å; L30-G33 PolarHBondContact O-N 3.14Å; L30-S37 WeakPolarHBondContact CD2-O 3.33Å; L30-N40 HydrophobicContact CD2-CB 3.5Å; L30-N40 VanDerWaalsContact CD2-CB 3.5Å; L30-N40 HydrophobicContact CG-CB 4.07Å; L30-I41 HydrophobicContact CD1-CG1 4.12Å; L30-I41 HydrophobicContact CD2-CG1 3.63Å; L30-L44 HydrophobicContact CD1-CD2 3.76Å
31	Y	81	Confident	80.1	Confident	212 Å²	212	85.1 Å²	85.1	83%	0.831	44%	0.442	S	S	*	.	H	α-helix	trans	-63.7	-38.1	179.1	-174.2	-100.8	0	0	0	112.7	L27 E28 G33	L27-Y31 PolarHBondContact O-N 3.27Å; E28-Y31 PolarHBondContact O-N 3.4Å; Y31-G33 PolarHBondContact O-N 3.38Å; Y31-G33 VanDerWaalsContact O-N 3.13Å
32	K	81	Confident	80.1	Confident	149 Å²	149	87.4 Å²	87.4	65%	0.648	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	5.7	179.5	-74	178	171.5	171.1	0	115	E28 L30	E28-K32 HydrophobicContact CG-CD 4.33Å; E28-K32 WeakPolarHBondContact O-CG 3.48Å; E28-K32 PolarHBondContact O-N 2.97Å; E28-K32 WeakPolarHBondContact OE1-CE 3.41Å; E28-K32 IonicContact OE1-NZ 3.03Å; E28-K32 PolarHBondContact OE1-NZ 3.13Å; L30-K32 VanDerWaalsContact C-N 3.35Å; L30-K32 PolarHBondContact O-N 2.98Å
33	G	72.7	Confident	80.1	Confident	65 Å²	65	87.6 Å²	87.6	67%	0.67	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	46.9	173.1	0	0	0	0	0	114.4	L30 Y31	L30-G33 PolarHBondContact O-N 3.14Å; Y31-G33 PolarHBondContact O-N 3.38Å; Y31-G33 VanDerWaalsContact O-N 3.13Å
34	S	67.3	Low	80.1	Confident	42 Å²	42	87.2 Å²	87.2	29%	0.294	45%	0.452	S	S	.	.			trans	-69.6	145	-179.7	92.8	0	0	0	0	112.6	K36 S37 N40	S34-K36 PolarHBondContact O-N 3.42Å; S34-K36 PolarHBondContact OG-N 3.22Å; S34-S37 PolarHBondContact O-N 3.28Å; S34-N40 PolarHBondContact OG-ND2 3.48Å
35	V	66.5	Low	80.2	Confident	154 Å²	154	87.6 Å²	87.6	93%	0.933	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-15.7	171.5	-177.3	0	0	0	0	113.6
36	K	71.2	Confident	80.5	Confident	126 Å²	126	88 Å²	88	55%	0.548	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	41.1	179.7	-63	179.9	158.4	-143.6	0	112.7	S34 D38 E39 N40	S34-K36 PolarHBondContact O-N 3.42Å; S34-K36 PolarHBondContact OG-N 3.22Å; K36-D38 VanDerWaalsContact C-N 3.29Å; K36-D38 PolarHBondContact O-N 3.43Å; K36-E39 HydrophobicContact CB-CB 4.23Å; K36-E39 WeakPolarHBondContact CD-OE2 3.35Å; K36-E39 IonicContact NZ-OE2 2.79Å; K36-E39 PolarHBondContact NZ-OE2 2.79Å; K36-E39 PolarHBondContact O-N 3.41Å; K36-N40 PolarHBondContact O-N 3.19Å; K36-N40 PolarHBondContact O-ND2 2.95Å
37	S	75.9	Confident	80.7	Confident	56 Å²	56	86.1 Å²	86.1	39%	0.392	45%	0.446	S	S	.	.	H	α-helix	trans	-50.7	-48.4	-178.7	52.1	0	0	0	0	112.1	L30 S34 E39 N40 I41	L30-S37 WeakPolarHBondContact CD2-O 3.33Å; S34-S37 PolarHBondContact O-N 3.28Å; S37-E39 PolarHBondContact O-N 3.32Å; S37-N40 PolarHBondContact O-N 3.46Å; S37-I41 VanDerWaalsContact O-CG1 3.32Å; S37-I41 WeakPolarHBondContact O-CG1 3.32Å; S37-I41 PolarHBondContact O-N 2.94Å
38	D	82.2	Confident	80.9	Confident	116 Å²	116	85.9 Å²	85.9	62%	0.62	44%	0.444	S	S	*	.	H	α-helix	trans	-65.4	-41.4	-175.5	-64.6	-5.8	0	0	0	112.1	K36 N40 I41 L42	K36-D38 VanDerWaalsContact C-N 3.29Å; K36-D38 PolarHBondContact O-N 3.43Å; D38-N40 VanDerWaalsContact C-N 3.33Å; D38-N40 PolarHBondContact O-N 3.03Å; D38-I41 PolarHBondContact O-N 3.43Å; D38-L42 WeakPolarHBondContact O-CG 3.33Å; D38-L42 PolarHBondContact O-N 3.44Å
39	E	84.6	Confident	81.1	Confident	89 Å²	89	83.8 Å²	83.8	42%	0.416	44%	0.437	S	S	.	.	H	α-helix	trans	-62.6	-42.1	176	-161.3	-171.5	158.2	0	0	110.7	K36 S37 L42 Q43	K36-E39 HydrophobicContact CB-CB 4.23Å; K36-E39 WeakPolarHBondContact CD-OE2 3.35Å; K36-E39 IonicContact NZ-OE2 2.79Å; K36-E39 PolarHBondContact NZ-OE2 2.79Å; K36-E39 PolarHBondContact O-N 3.41Å; S37-E39 PolarHBondContact O-N 3.32Å; E39-L42 PolarHBondContact O-N 3.49Å; E39-Q43 WeakPolarHBondContact O-CB 3.42Å; E39-Q43 VanDerWaalsContact O-CG 3.27Å; E39-Q43 WeakPolarHBondContact O-CG 3.4Å; E39-Q43 PolarHBondContact O-N 3.41Å; E39-Q43 PolarHBondContact OE1-NE2 3.31Å
40	N	80.5	Confident	81.5	Confident	14 Å²	14	82.2 Å²	82.2	8%	0.075	43%	0.433	C	S	.	.	H	α-helix	trans	-68.2	-36.9	178.5	-74.4	-39.5	0	0	0	112.6	L30 S34 K36 S37 D38 Q43 L44	L30-N40 HydrophobicContact CD2-CB 3.5Å; L30-N40 VanDerWaalsContact CD2-CB 3.5Å; L30-N40 HydrophobicContact CG-CB 4.07Å; S34-N40 PolarHBondContact OG-ND2 3.48Å; K36-N40 PolarHBondContact O-N 3.19Å; K36-N40 PolarHBondContact O-ND2 2.95Å; S37-N40 PolarHBondContact O-N 3.46Å; D38-N40 VanDerWaalsContact C-N 3.33Å; D38-N40 PolarHBondContact O-N 3.03Å; N40-Q43 PolarHBondContact O-N 3.38Å; N40-L44 WeakPolarHBondContact O-CB 3.48Å; N40-L44 PolarHBondContact O-N 2.94Å
41	I	85.1	Confident	81.7	Confident	77 Å²	77	80.8 Å²	80.8	40%	0.395	43%	0.427	S	S	.	.	H	α-helix	trans	-62.3	-50.2	174.5	-68.6	168.6	0	0	0	109.8	L30 S37 D38 Q43 L44 L45	L30-I41 HydrophobicContact CD1-CG1 4.12Å; L30-I41 HydrophobicContact CD2-CG1 3.63Å; S37-I41 VanDerWaalsContact O-CG1 3.32Å; S37-I41 WeakPolarHBondContact O-CG1 3.32Å; S37-I41 PolarHBondContact O-N 2.94Å; D38-I41 PolarHBondContact O-N 3.43Å; I41-Q43 VanDerWaalsContact C-N 3.32Å; I41-Q43 PolarHBondContact O-N 3.26Å; I41-L44 WeakPolarHBondContact O-CB 3.49Å; I41-L44 PolarHBondContact O-N 3.33Å; I41-L44 VanDerWaalsContact O-N 3.14Å; I41-L45 HydrophobicContact CG2-CD1 4.17Å; I41-L45 WeakPolarHBondContact O-CG 3.24Å; I41-L45 PolarHBondContact O-N 2.99Å
42	L	87.3	Confident	82.1	Confident	122 Å²	122	77.8 Å²	77.8	64%	0.639	41%	0.414	S	S	*	.	H	α-helix	trans	-60.7	-41.8	179.5	-70.6	174.7	0	0	0	112.1	D38 E39 L44 L45 D46	D38-L42 WeakPolarHBondContact O-CG 3.33Å; D38-L42 PolarHBondContact O-N 3.44Å; E39-L42 PolarHBondContact O-N 3.49Å; L42-L44 VanDerWaalsContact C-N 3.35Å; L42-L44 PolarHBondContact O-N 2.92Å; L42-L45 PolarHBondContact O-N 3.31Å; L42-D46 PolarHBondContact O-N 3.38Å
43	Q	84.5	Confident	82.5	Confident	65 Å²	65	74 Å²	74	30%	0.304	40%	0.401	S	S	.	.	H	α-helix	trans	-66.7	-35	176.4	-71.1	-177.8	23.4	0	0	112.8	E39 N40 I41 D46 V47	E39-Q43 WeakPolarHBondContact O-CB 3.42Å; E39-Q43 VanDerWaalsContact O-CG 3.27Å; E39-Q43 WeakPolarHBondContact O-CG 3.4Å; E39-Q43 PolarHBondContact O-N 3.41Å; E39-Q43 PolarHBondContact OE1-NE2 3.31Å; N40-Q43 PolarHBondContact O-N 3.38Å; I41-Q43 VanDerWaalsContact C-N 3.32Å; I41-Q43 PolarHBondContact O-N 3.26Å; Q43-D46 PolarHBondContact O-N 3.24Å; Q43-V47 VanDerWaalsContact O-CG2 3.25Å; Q43-V47 WeakPolarHBondContact O-CG2 3.4Å; Q43-V47 PolarHBondContact O-N 2.83Å
44	L	85.6	Confident	83	Confident	20 Å²	20	73.5 Å²	73.5	11%	0.105	38%	0.38	C	S	.	.	H	α-helix	trans	-65.3	-43.8	174.4	176.5	62.1	0	0	0	110.8	I23 R26 L27 L30 N40 I41 L42 D46 V47 L48	I23-L44 HydrophobicContact CG2-CD1 4.16Å; R26-L44 HydrophobicContact CB-CB 4.29Å; R26-L44 HydrophobicContact CB-CD1 4.09Å; L27-L44 HydrophobicContact CD2-CD2 3.68Å; L27-L44 HydrophobicContact CG-CD1 4.38Å; L27-L44 HydrophobicContact CG-CD2 4.15Å; L30-L44 HydrophobicContact CD1-CD2 3.76Å; N40-L44 WeakPolarHBondContact O-CB 3.48Å; N40-L44 PolarHBondContact O-N 2.94Å; I41-L44 WeakPolarHBondContact O-CB 3.49Å; I41-L44 PolarHBondContact O-N 3.33Å; I41-L44 VanDerWaalsContact O-N 3.14Å; L42-L44 VanDerWaalsContact C-N 3.35Å; L42-L44 PolarHBondContact O-N 2.92Å; L44-D46 VanDerWaalsContact C-N 3.34Å; L44-D46 PolarHBondContact O-N 2.95Å; L44-V47 PolarHBondContact O-N 3.09Å; L44-V47 VanDerWaalsContact O-N 3.13Å; L44-L48 HydrophobicContact CD1-CD1 4.45Å; L44-L48 HydrophobicContact CD1-CG 4.4Å; L44-L48 HydrophobicContact CG-CD1 4.16Å; L44-L48 WeakPolarHBondContact O-CG 3.41Å; L44-L48 PolarHBondContact O-N 3.1Å
45	L	88.9	Confident	83.9	Confident	95 Å²	95	80.1 Å²	80.1	50%	0.497	40%	0.399	S	S	.	.	H	α-helix	trans	-60	-41	176	-68.6	174.2	0	0	0	112.2	I41 L42 V47 L48 D49	I41-L45 HydrophobicContact CG2-CD1 4.17Å; I41-L45 WeakPolarHBondContact O-CG 3.24Å; I41-L45 PolarHBondContact O-N 2.99Å; L42-L45 PolarHBondContact O-N 3.31Å; L45-V47 VanDerWaalsContact C-N 3.3Å; L45-V47 PolarHBondContact O-N 3.22Å; L45-L48 PolarHBondContact O-N 2.8Å; L45-D49 PolarHBondContact O-N 2.71Å
46	D	88.2	Confident	85	Confident	71 Å²	71	79.3 Å²	79.3	38%	0.38	38%	0.383	S	S	.	.	H	α-helix	trans	-59.3	-41	174.6	-175.5	43.4	0	0	0	111.3	K10 L42 Q43 L44 D49 N50	K10-D46 IonicContact NZ-OD2 2.67Å; L42-D46 PolarHBondContact O-N 3.38Å; Q43-D46 PolarHBondContact O-N 3.24Å; L44-D46 VanDerWaalsContact C-N 3.34Å; L44-D46 PolarHBondContact O-N 2.95Å; D46-D49 PolarHBondContact O-N 2.84Å; D46-N50 WeakPolarHBondContact O-CB 3.28Å; D46-N50 PolarHBondContact O-N 3.28Å; D46-N50 PolarHBondContact O-ND2 3.19Å; D46-N50 PolarHBondContact OD1-ND2 3.09Å
47	V	85.9	Confident	85.8	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.006	37%	0.374	C	S	.	.	H	α-helix	trans	-68.9	-42.9	179.2	-177.9	0	0	0	0	111.4	L19 Q22 I23 Q43 L44 L45 D49 N50 C51	L19-V47 HydrophobicContact CD2-CG1 4.37Å; Q22-V47 HydrophobicContact CB-CG1 4.04Å; I23-V47 HydrophobicContact CD1-CG1 4.33Å; I23-V47 HydrophobicContact CG1-CB 4.44Å; I23-V47 HydrophobicContact CG1-CG1 3.59Å; Q43-V47 VanDerWaalsContact O-CG2 3.25Å; Q43-V47 WeakPolarHBondContact O-CG2 3.4Å; Q43-V47 PolarHBondContact O-N 2.83Å; L44-V47 PolarHBondContact O-N 3.09Å; L44-V47 VanDerWaalsContact O-N 3.13Å; L45-V47 VanDerWaalsContact C-N 3.3Å; L45-V47 PolarHBondContact O-N 3.22Å; V47-D49 VanDerWaalsContact C-N 3.33Å; V47-D49 PolarHBondContact O-N 2.88Å; V47-N50 WeakPolarHBondContact O-CB 3.39Å; V47-N50 PolarHBondContact O-N 3.17Å; V47-C51 PolarHBondContact O-N 2.79Å; V47-C51 PolarHBondContact O-SG 3.19Å; V47-C51 VanDerWaalsContact O-SG 3.33Å
48	L	87.1	Confident	86.3	Confident	80 Å²	80	75.3 Å²	75.3	42%	0.419	37%	0.369	S	S	.	.	H	α-helix	trans	-61.9	-41.9	177	-69.6	172.8	0	0	0	111.2	I23 L44 L45 C51 R52	I23-L48 HydrophobicContact CD1-CD2 3.77Å; I23-L48 HydrophobicContact CG1-CD2 4.17Å; L44-L48 HydrophobicContact CD1-CD1 4.45Å; L44-L48 HydrophobicContact CD1-CG 4.4Å; L44-L48 HydrophobicContact CG-CD1 4.16Å; L44-L48 WeakPolarHBondContact O-CG 3.41Å; L44-L48 PolarHBondContact O-N 3.1Å; L45-L48 PolarHBondContact O-N 2.8Å; L48-C51 WeakPolarHBondContact O-CB 3.41Å; L48-C51 PolarHBondContact O-N 3.23Å; L48-R52 PolarHBondContact O-N 3.35Å
49	D	88.5	Confident	86.7	Confident	57 Å²	57	76.3 Å²	76.3	31%	0.305	37%	0.368	S	S	.	.	H	α-helix	trans	-64.7	-42.3	175	-166.1	69.3	0	0	0	111.5	L45 D46 V47 C51 R52 N53	L45-D49 PolarHBondContact O-N 2.71Å; D46-D49 PolarHBondContact O-N 2.84Å; V47-D49 VanDerWaalsContact C-N 3.33Å; V47-D49 PolarHBondContact O-N 2.88Å; D49-C51 VanDerWaalsContact C-N 3.34Å; D49-C51 PolarHBondContact O-N 3.23Å; D49-R52 PolarHBondContact O-N 3.42Å; D49-R52 IonicContact OD1-CZ 2.59Å; D49-R52 IonicContact OD1-NH1 2.84Å; D49-R52 PolarHBondContact OD1-NH1 3.3Å; D49-R52 IonicContact OD1-NH2 3.44Å; D49-R52 PolarHBondContact OD1-NH2 3Å; D49-N53 WeakPolarHBondContact O-CB 3.39Å; D49-N53 VanDerWaalsContact O-CG 3.23Å; D49-N53 PolarHBondContact O-N 2.72Å; D49-N53 PolarHBondContact O-ND2 3.02Å; D49-N53 PolarHBondContact OD2-ND2 3.21Å
50	N	87.1	Confident	87.1	Confident	66 Å²	66	77 Å²	77	35%	0.353	37%	0.373	S	S	.	.	H	α-helix	trans	-60.1	-41.7	173.7	-75.8	-49.2	0	0	0	112.2	L19 D46 V47 K54	L19-N50 HydrophobicContact CD2-CB 4.49Å; D46-N50 WeakPolarHBondContact O-CB 3.28Å; D46-N50 PolarHBondContact O-N 3.28Å; D46-N50 PolarHBondContact O-ND2 3.19Å; D46-N50 PolarHBondContact OD1-ND2 3.09Å; V47-N50 WeakPolarHBondContact O-CB 3.39Å; V47-N50 PolarHBondContact O-N 3.17Å; N50-K54 VanDerWaalsContact O-CB 3.28Å; N50-K54 WeakPolarHBondContact O-CB 3.36Å; N50-K54 PolarHBondContact O-N 2.93Å
51	C	85.5	Confident	87.4	Confident	20 Å²	20	82.1 Å²	82.1	14%	0.135	40%	0.395	C	S	.	.	H	α-helix	trans	-59.4	-51.2	172.9	-75.4	0	0	0	0	111.5	L19 V47 L48 D49 N53 K54 W55	L19-C51 VanDerWaalsContact CB-SG 3.6Å; V47-C51 PolarHBondContact O-N 2.79Å; V47-C51 PolarHBondContact O-SG 3.19Å; V47-C51 VanDerWaalsContact O-SG 3.33Å; L48-C51 WeakPolarHBondContact O-CB 3.41Å; L48-C51 PolarHBondContact O-N 3.23Å; D49-C51 VanDerWaalsContact C-N 3.34Å; D49-C51 PolarHBondContact O-N 3.23Å; C51-N53 PolarHBondContact O-N 3.36Å; C51-K54 PolarHBondContact O-N 2.94Å; C51-W55 PolarHBondContact O-N 2.93Å
52	R	87.8	Confident	87.7	Confident	149 Å²	149	83.9 Å²	83.9	56%	0.562	41%	0.405	S	S	*	.	H	α-helix	trans	-58.3	-47.6	-180	-166.3	-170.5	79.9	-123.9	-13.9	111.4	L48 D49 K54 W55 K56	L48-R52 PolarHBondContact O-N 3.35Å; D49-R52 PolarHBondContact O-N 3.42Å; D49-R52 IonicContact OD1-CZ 2.59Å; D49-R52 IonicContact OD1-NH1 2.84Å; D49-R52 PolarHBondContact OD1-NH1 3.3Å; D49-R52 IonicContact OD1-NH2 3.44Å; D49-R52 PolarHBondContact OD1-NH2 3Å; R52-K54 VanDerWaalsContact C-N 3.3Å; R52-K54 PolarHBondContact O-N 3.03Å; R52-W55 PolarHBondContact O-N 2.55Å; R52-K56 WeakPolarHBondContact O-CB 3.39Å; R52-K56 PolarHBondContact O-N 3.09Å
53	N	89.4	Confident	88	Confident	69 Å²	69	85 Å²	85	37%	0.369	40%	0.401	S	S	.	.	H	α-helix	trans	-64.2	-37.7	-180	-68.8	-28	0	0	0	111.5	D49 C51 S57	D49-N53 WeakPolarHBondContact O-CB 3.39Å; D49-N53 VanDerWaalsContact O-CG 3.23Å; D49-N53 PolarHBondContact O-N 2.72Å; D49-N53 PolarHBondContact O-ND2 3.02Å; D49-N53 PolarHBondContact OD2-ND2 3.21Å; C51-N53 PolarHBondContact O-N 3.36Å; N53-S57 WeakPolarHBondContact O-CB 3.41Å; N53-S57 PolarHBondContact O-N 3.02Å
54	K	84.8	Confident	88.2	Confident	54 Å²	54	84.9 Å²	84.9	24%	0.235	41%	0.407	C	S	.	.	H	α-helix	trans	-69	-43.2	176.2	-168.1	168.5	-174.6	151.2	0	112.6	T14 F16 L19 N50 C51 R52 S57 T58	T14-K54 PolarHBondContact O-NZ 3.23Å; F16-K54 HydrophobicContact CD1-CD 4.34Å; F16-K54 HydrophobicContact CE1-CB 4.17Å; F16-K54 HydrophobicContact CE1-CD 3.8Å; F16-K54 HydrophobicContact CE1-CG 3.68Å; F16-K54 HydrophobicContact CZ-CD 4.23Å; F16-K54 HydrophobicContact CZ-CG 3.9Å; L19-K54 HydrophobicContact CD1-CD 3.67Å; N50-K54 VanDerWaalsContact O-CB 3.28Å; N50-K54 WeakPolarHBondContact O-CB 3.36Å; N50-K54 PolarHBondContact O-N 2.93Å; C51-K54 PolarHBondContact O-N 2.94Å; R52-K54 VanDerWaalsContact C-N 3.3Å; R52-K54 PolarHBondContact O-N 3.03Å; K54-S57 PolarHBondContact O-N 3.2Å; K54-T58 PolarHBondContact O-N 3.08Å; K54-T58 PolarHBondContact O-OG1 3.43Å; K54-T58 VanDerWaalsContact O-OG1 3.09Å
55	W	85.2	Confident	88.4	Confident	181 Å²	181	87.9 Å²	87.9	69%	0.686	43%	0.426	S	S	*	.	H	α-helix	trans	-57.3	-50.1	172.9	-87.2	45.2	0	0	0	110.9	F16 C51 R52 S57 T58 F59	F16-W55 AromaticContact CD1-CD1 3.96Å; F16-W55 AromaticContact CD1-NE1 3.75Å; F16-W55 AromaticContact CE1-CD1 3.32Å; F16-W55 HydrophobicContact CE1-CG 4.46Å; F16-W55 AromaticContact CE1-NE1 3.56Å; C51-W55 PolarHBondContact O-N 2.93Å; R52-W55 PolarHBondContact O-N 2.55Å; W55-S57 VanDerWaalsContact C-N 3.34Å; W55-S57 PolarHBondContact O-N 2.91Å; W55-T58 PolarHBondContact O-N 3.44Å; W55-F59 WeakPolarHBondContact O-CB 3.43Å; W55-F59 PolarHBondContact O-N 3.32Å
56	K	89.8	Confident	88.5	Confident	137 Å²	137	88.6 Å²	88.6	60%	0.596	43%	0.43	S	S	*	.	H	α-helix	trans	-57.7	-44.3	176.7	-172	175.4	-178.6	176.7	0	112.1	R52 F59 I60	R52-K56 WeakPolarHBondContact O-CB 3.39Å; R52-K56 PolarHBondContact O-N 3.09Å; K56-F59 PolarHBondContact O-N 2.93Å; K56-I60 HydrophobicContact CG-CD1 4.2Å; K56-I60 VanDerWaalsContact O-CG1 3.29Å; K56-I60 WeakPolarHBondContact O-CG1 3.29Å; K56-I60 PolarHBondContact O-N 3.42Å
57	S	87.4	Confident	88.7	Confident	52 Å²	52	94.3 Å²	94.3	36%	0.364	45%	0.447	S	S	.	.	H	α-helix	trans	-62.6	-44.5	176.9	-172.3	0	0	0	0	112.4	N53 K54 W55 I60 K61	N53-S57 WeakPolarHBondContact O-CB 3.41Å; N53-S57 PolarHBondContact O-N 3.02Å; K54-S57 PolarHBondContact O-N 3.2Å; W55-S57 VanDerWaalsContact C-N 3.34Å; W55-S57 PolarHBondContact O-N 2.91Å; S57-I60 PolarHBondContact O-N 3.34Å; S57-K61 WeakPolarHBondContact O-CG 3.36Å; S57-K61 PolarHBondContact O-N 2.86Å; S57-K61 VanDerWaalsContact O-N 3.09Å
58	T	85.9	Confident	88.9	Confident	47 Å²	47	98.7 Å²	98.7	29%	0.288	47%	0.473	S	S	.	.	H	α-helix	trans	-65	-42.9	177.5	-60.7	0	0	0	0	111.4	K54 W55 I60 K61 L62	K54-T58 PolarHBondContact O-N 3.08Å; K54-T58 PolarHBondContact O-OG1 3.43Å; K54-T58 VanDerWaalsContact O-OG1 3.09Å; W55-T58 PolarHBondContact O-N 3.44Å; T58-I60 PolarHBondContact O-N 3.33Å; T58-K61 WeakPolarHBondContact O-CB 3.48Å; T58-K61 PolarHBondContact O-N 3.38Å; T58-L62 HydrophobicContact CG2-CD1 4.07Å; T58-L62 HydrophobicContact CG2-CG 4.37Å; T58-L62 WeakPolarHBondContact O-CG 3.41Å; T58-L62 PolarHBondContact O-N 3.29Å
59	F	91.9	Very high	89	Confident	136 Å²	136	100.1 Å²	100.1	60%	0.596	48%	0.477	S	S	*	.	H	α-helix	trans	-58	-47.6	175.6	-178.8	-94.3	0	0	0	111.8	W55 K56 K61 L62 Y63	W55-F59 WeakPolarHBondContact O-CB 3.43Å; W55-F59 PolarHBondContact O-N 3.32Å; K56-F59 PolarHBondContact O-N 2.93Å; F59-K61 VanDerWaalsContact C-N 3.31Å; F59-K61 PolarHBondContact O-N 3.3Å; F59-L62 PolarHBondContact O-N 3.21Å; F59-Y63 WeakPolarHBondContact O-CB 3.48Å; F59-Y63 PolarHBondContact O-N 3.09Å
60	I	91.9	Very high	89.2	Confident	103 Å²	103	105.2 Å²	105.2	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-59.4	-42.5	176.8	-68.8	165.4	0	0	0	111.1	K56 S57 T58 S64	K56-I60 HydrophobicContact CG-CD1 4.2Å; K56-I60 VanDerWaalsContact O-CG1 3.29Å; K56-I60 WeakPolarHBondContact O-CG1 3.29Å; K56-I60 PolarHBondContact O-N 3.42Å; S57-I60 PolarHBondContact O-N 3.34Å; T58-I60 PolarHBondContact O-N 3.33Å; I60-S64 WeakPolarHBondContact O-CB 3.46Å; I60-S64 PolarHBondContact O-N 3.33Å
61	K	87.8	Confident	89.4	Confident	123 Å²	123	105.5 Å²	105.5	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-49.6	176.8	-71.9	172.5	-175.4	176.7	0	111.4	S57 T58 F59 Y63 S64 V65	S57-K61 WeakPolarHBondContact O-CG 3.36Å; S57-K61 PolarHBondContact O-N 2.86Å; S57-K61 VanDerWaalsContact O-N 3.09Å; T58-K61 WeakPolarHBondContact O-CB 3.48Å; T58-K61 PolarHBondContact O-N 3.38Å; F59-K61 VanDerWaalsContact C-N 3.31Å; F59-K61 PolarHBondContact O-N 3.3Å; K61-Y63 VanDerWaalsContact C-N 3.34Å; K61-Y63 PolarHBondContact O-N 3.03Å; K61-S64 PolarHBondContact O-N 3.43Å; K61-S64 PolarHBondContact O-OG 3.39Å; K61-V65 WeakPolarHBondContact O-CG2 3.42Å; K61-V65 PolarHBondContact O-N 3.03Å
62	L	90.1	Very high	89.6	Confident	114 Å²	114	108 Å²	108	60%	0.597	51%	0.514	S	S	*	.	H	α-helix	trans	-59.3	-45.2	178.1	-73.6	174	0	0	0	111.5	T58 F59 S64 V65 L66	T58-L62 HydrophobicContact CG2-CD1 4.07Å; T58-L62 HydrophobicContact CG2-CG 4.37Å; T58-L62 WeakPolarHBondContact O-CG 3.41Å; T58-L62 PolarHBondContact O-N 3.29Å; F59-L62 PolarHBondContact O-N 3.21Å; L62-S64 VanDerWaalsContact C-N 3.3Å; L62-S64 PolarHBondContact O-N 2.85Å; L62-V65 PolarHBondContact O-N 3.23Å; L62-V65 VanDerWaalsContact O-N 3.17Å; L62-L66 WeakPolarHBondContact O-CB 3.35Å; L62-L66 PolarHBondContact O-N 2.93Å
63	Y	93.8	Very high	89.8	Confident	145 Å²	145	105.1 Å²	105.1	57%	0.569	51%	0.513	S	S	*	.	H	α-helix	trans	-61.5	-38.9	177.3	-165.5	-92.8	0	0	0	112.2	F59 K61 L66 R67	F59-Y63 WeakPolarHBondContact O-CB 3.48Å; F59-Y63 PolarHBondContact O-N 3.09Å; K61-Y63 VanDerWaalsContact C-N 3.34Å; K61-Y63 PolarHBondContact O-N 3.03Å; Y63-L66 PolarHBondContact O-N 2.74Å; Y63-R67 WeakPolarHBondContact O-CB 3.29Å; Y63-R67 PolarHBondContact O-N 3.44Å
64	S	90.5	Very high	90	Very high	62 Å²	62	108.7 Å²	108.7	43%	0.434	53%	0.525	S	S	.	.	H	α-helix	trans	-64.4	-40.1	175.2	77.4	0	0	0	0	112.7	I60 K61 L62 R67 V68	I60-S64 WeakPolarHBondContact O-CB 3.46Å; I60-S64 PolarHBondContact O-N 3.33Å; K61-S64 PolarHBondContact O-N 3.43Å; K61-S64 PolarHBondContact O-OG 3.39Å; L62-S64 VanDerWaalsContact C-N 3.3Å; L62-S64 PolarHBondContact O-N 2.85Å; S64-R67 PolarHBondContact O-N 3.44Å; S64-V68 WeakPolarHBondContact O-CG2 3.46Å; S64-V68 PolarHBondContact O-N 3.47Å
65	V	89.2	Confident	90.5	Very high	83 Å²	83	111.8 Å²	111.8	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-67.4	-46.2	176.2	174.2	0	0	0	0	110.2	K61 L62 R67 V68 Q69	K61-V65 WeakPolarHBondContact O-CG2 3.42Å; K61-V65 PolarHBondContact O-N 3.03Å; L62-V65 PolarHBondContact O-N 3.23Å; L62-V65 VanDerWaalsContact O-N 3.17Å; V65-R67 VanDerWaalsContact C-N 3.29Å; V65-R67 PolarHBondContact O-N 3.21Å; V65-V68 PolarHBondContact O-N 2.98Å; V65-V68 VanDerWaalsContact O-N 3.15Å; V65-Q69 HydrophobicContact CG1-CG 4.33Å; V65-Q69 WeakPolarHBondContact O-CG 3.42Å; V65-Q69 PolarHBondContact O-N 3.27Å
66	L	91.5	Very high	90.8	Very high	111 Å²	111	107 Å²	107	58%	0.581	52%	0.523	S	S	*	.	H	α-helix	trans	-57.5	-42.6	176.7	-178.5	63.4	0	0	0	111.6	L62 Y63 V68 Q69 K70	L62-L66 WeakPolarHBondContact O-CB 3.35Å; L62-L66 PolarHBondContact O-N 2.93Å; Y63-L66 PolarHBondContact O-N 2.74Å; L66-V68 PolarHBondContact O-N 3.3Å; L66-Q69 PolarHBondContact O-N 3.05Å; L66-K70 WeakPolarHBondContact O-CB 3.46Å; L66-K70 PolarHBondContact O-N 3.12Å
67	R	92.3	Very high	91	Very high	191 Å²	191	104.1 Å²	104.1	72%	0.721	52%	0.517	S	S	*	.	H	α-helix	trans	-60.9	-43.8	176.4	-175.1	179.8	178.4	-179.2	1.4	112.2	Y63 S64 V65 K70 S71	Y63-R67 WeakPolarHBondContact O-CB 3.29Å; Y63-R67 PolarHBondContact O-N 3.44Å; S64-R67 PolarHBondContact O-N 3.44Å; V65-R67 VanDerWaalsContact C-N 3.29Å; V65-R67 PolarHBondContact O-N 3.21Å; R67-K70 PolarHBondContact O-N 3.38Å; R67-S71 PolarHBondContact O-N 3.37Å; R67-S71 VanDerWaalsContact O-N 3.09Å
68	V	90	Very high	91.3	Very high	92 Å²	92	106.5 Å²	106.5	56%	0.558	53%	0.525	S	S	*	.	H	α-helix	trans	-63.9	-46.7	176.7	173.2	0	0	0	0	110.5	S64 V65 L66 K70 S71 E72	S64-V68 WeakPolarHBondContact O-CG2 3.46Å; S64-V68 PolarHBondContact O-N 3.47Å; V65-V68 PolarHBondContact O-N 2.98Å; V65-V68 VanDerWaalsContact O-N 3.15Å; L66-V68 PolarHBondContact O-N 3.3Å; V68-K70 PolarHBondContact O-N 3.12Å; V68-S71 PolarHBondContact O-N 2.88Å; V68-S71 PolarHBondContact O-OG 3.37Å; V68-E72 PolarHBondContact O-N 3.47Å
69	Q	89.6	Confident	91.6	Very high	110 Å²	110	108.4 Å²	108.4	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-60.7	-43.5	178.1	-68.4	-62.7	-18.6	0	0	111.9	V65 L66 S71 E72 V73	V65-Q69 HydrophobicContact CG1-CG 4.33Å; V65-Q69 WeakPolarHBondContact O-CG 3.42Å; V65-Q69 PolarHBondContact O-N 3.27Å; L66-Q69 PolarHBondContact O-N 3.05Å; Q69-S71 VanDerWaalsContact C-N 3.32Å; Q69-S71 PolarHBondContact O-N 3.45Å; Q69-E72 PolarHBondContact O-N 2.86Å; Q69-E72 VanDerWaalsContact O-N 3.14Å; Q69-V73 WeakPolarHBondContact O-CG2 3.37Å; Q69-V73 PolarHBondContact O-N 3.14Å
70	K	91.9	Very high	91.6	Very high	165 Å²	165	108.5 Å²	108.5	72%	0.717	54%	0.535	S	S	*	.	H	α-helix	trans	-60.8	-39.6	176	-169	173.3	-176.7	175.2	0	112.3	L66 R67 V68 K74	L66-K70 WeakPolarHBondContact O-CB 3.46Å; L66-K70 PolarHBondContact O-N 3.12Å; R67-K70 PolarHBondContact O-N 3.38Å; V68-K70 PolarHBondContact O-N 3.12Å; K70-K74 PolarHBondContact O-N 3.19Å
71	S	90.4	Very high	91.7	Very high	71 Å²	71	106.6 Å²	106.6	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-68.2	-34.7	175.7	70	0	0	0	0	113.1	R67 V68 Q69 K74 R75	R67-S71 PolarHBondContact O-N 3.37Å; R67-S71 VanDerWaalsContact O-N 3.09Å; V68-S71 PolarHBondContact O-N 2.88Å; V68-S71 PolarHBondContact O-OG 3.37Å; Q69-S71 VanDerWaalsContact C-N 3.32Å; Q69-S71 PolarHBondContact O-N 3.45Å; S71-K74 PolarHBondContact O-N 3.19Å; S71-R75 PolarHBondContact O-N 3.44Å
72	E	89.9	Confident	91.9	Very high	73 Å²	73	106.4 Å²	106.4	34%	0.341	54%	0.535	S	S	.	.	H	α-helix	trans	-71.6	-41.4	178.4	-178.2	62.6	-178.2	0	0	111.9	V68 Q69 K74 R75 L76	V68-E72 PolarHBondContact O-N 3.47Å; Q69-E72 PolarHBondContact O-N 2.86Å; Q69-E72 VanDerWaalsContact O-N 3.14Å; E72-K74 VanDerWaalsContact C-N 3.34Å; E72-K74 PolarHBondContact O-N 3.3Å; E72-R75 WeakPolarHBondContact O-CB 3.4Å; E72-R75 PolarHBondContact O-N 3.17Å; E72-R75 IonicContact OE1-CZ 2.84Å; E72-R75 IonicContact OE1-NE 3.44Å; E72-R75 PolarHBondContact OE1-NE 3.38Å; E72-R75 IonicContact OE1-NH2 3.67Å; E72-R75 PolarHBondContact OE1-NH2 3.19Å; E72-R75 IonicContact OE2-CZ 3.17Å; E72-R75 IonicContact OE2-NE 3.66Å; E72-R75 PolarHBondContact OE2-NE 2.93Å; E72-R75 IonicContact OE2-NH2 3.38Å; E72-L76 HydrophobicContact CG-CD1 4.28Å; E72-L76 WeakPolarHBondContact O-CG 3.03Å; E72-L76 PolarHBondContact O-N 3Å
73	V	93	Very high	91.8	Very high	89 Å²	89	104.6 Å²	104.6	54%	0.539	53%	0.529	S	S	.	.	H	α-helix	trans	-56.6	-49.2	171.7	171.5	0	0	0	0	110.2	Q69 R75 L76 T77	Q69-V73 WeakPolarHBondContact O-CG2 3.37Å; Q69-V73 PolarHBondContact O-N 3.14Å; V73-R75 VanDerWaalsContact C-N 3.3Å; V73-R75 PolarHBondContact O-N 3.18Å; V73-L76 PolarHBondContact O-N 3.21Å; V73-L76 VanDerWaalsContact O-N 3.14Å; V73-T77 PolarHBondContact O-N 2.98Å; V73-T77 PolarHBondContact O-OG1 3.01Å
74	K	93.3	Very high	91.8	Very high	143 Å²	143	102.1 Å²	102.1	62%	0.622	52%	0.523	S	S	*	.	H	α-helix	trans	-57.7	-41.9	177.1	-173.9	175.7	-178.3	177.5	0	112.3	K70 S71 E72 T77 N78	K70-K74 PolarHBondContact O-N 3.19Å; S71-K74 PolarHBondContact O-N 3.19Å; E72-K74 VanDerWaalsContact C-N 3.34Å; E72-K74 PolarHBondContact O-N 3.3Å; K74-T77 PolarHBondContact O-N 3.35Å; K74-N78 PolarHBondContact O-N 2.66Å; K74-N78 VanDerWaalsContact O-N 3.09Å; K74-N78 PolarHBondContact O-OD1 2.85Å
75	R	95	Very high	92	Very high	119 Å²	119	101.8 Å²	101.8	45%	0.449	52%	0.524	S	S	.	.	H	α-helix	trans	-62.8	-43.1	177.3	-169.7	-165.6	66.6	70	-1.7	111.6	S71 E72 V73 N78 L79	S71-R75 PolarHBondContact O-N 3.44Å; E72-R75 WeakPolarHBondContact O-CB 3.4Å; E72-R75 PolarHBondContact O-N 3.17Å; E72-R75 IonicContact OE1-CZ 2.84Å; E72-R75 IonicContact OE1-NE 3.44Å; E72-R75 PolarHBondContact OE1-NE 3.38Å; E72-R75 IonicContact OE1-NH2 3.67Å; E72-R75 PolarHBondContact OE1-NH2 3.19Å; E72-R75 IonicContact OE2-CZ 3.17Å; E72-R75 IonicContact OE2-NE 3.66Å; E72-R75 PolarHBondContact OE2-NE 2.93Å; E72-R75 IonicContact OE2-NH2 3.38Å; V73-R75 VanDerWaalsContact C-N 3.3Å; V73-R75 PolarHBondContact O-N 3.18Å; R75-N78 PolarHBondContact O-N 3.48Å; R75-L79 PolarHBondContact O-N 3.17Å
76	L	91	Very high	92.1	Very high	82 Å²	82	103.4 Å²	103.4	43%	0.429	53%	0.528	S	S	.	.	H	α-helix	trans	-67.9	-41.4	178.9	-71.8	172.3	0	0	0	111.9	E72 V73 N78 L79 Q80	E72-L76 HydrophobicContact CG-CD1 4.28Å; E72-L76 WeakPolarHBondContact O-CG 3.03Å; E72-L76 PolarHBondContact O-N 3Å; V73-L76 PolarHBondContact O-N 3.21Å; V73-L76 VanDerWaalsContact O-N 3.14Å; L76-N78 VanDerWaalsContact C-N 3.35Å; L76-N78 PolarHBondContact O-N 2.97Å; L76-L79 PolarHBondContact O-N 2.95Å; L76-Q80 WeakPolarHBondContact O-CB 3.4Å; L76-Q80 PolarHBondContact O-N 2.92Å
77	T	93.8	Very high	92.2	Very high	76 Å²	76	104.3 Å²	104.3	47%	0.466	53%	0.527	S	S	.	.	H	α-helix	trans	-59.6	-44.4	174.3	-53.3	0	0	0	0	111.7	V73 K74 L79 Q80 A81	V73-T77 PolarHBondContact O-N 2.98Å; V73-T77 PolarHBondContact O-OG1 3.01Å; K74-T77 PolarHBondContact O-N 3.35Å; T77-L79 PolarHBondContact O-N 3.22Å; T77-Q80 PolarHBondContact O-N 3.33Å; T77-A81 PolarHBondContact O-N 3.5Å
78	N	93.7	Very high	92.3	Very high	102 Å²	102	99.9 Å²	99.9	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-41.1	176.6	-71.7	-2.7	0	0	0	112.2	K74 R75 L76 A81 H82	K74-N78 PolarHBondContact O-N 2.66Å; K74-N78 VanDerWaalsContact O-N 3.09Å; K74-N78 PolarHBondContact O-OD1 2.85Å; R75-N78 PolarHBondContact O-N 3.48Å; L76-N78 VanDerWaalsContact C-N 3.35Å; L76-N78 PolarHBondContact O-N 2.97Å; N78-A81 PolarHBondContact O-N 3.03Å; N78-H82 PolarHBondContact O-N 3.3Å
79	L	92.1	Very high	92.4	Very high	86 Å²	86	98.3 Å²	98.3	45%	0.45	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-42.3	177.2	-178.6	60.5	0	0	0	111.2	R75 L76 T77 H82 T83	R75-L79 PolarHBondContact O-N 3.17Å; L76-L79 PolarHBondContact O-N 2.95Å; T77-L79 PolarHBondContact O-N 3.22Å; L79-H82 PolarHBondContact O-N 3.09Å; L79-T83 HydrophobicContact CD1-CG2 4.42Å; L79-T83 WeakPolarHBondContact O-CG2 3.29Å; L79-T83 PolarHBondContact O-N 2.87Å; L79-T83 PolarHBondContact O-OG1 2.92Å; L79-T83 VanDerWaalsContact O-OG1 3.1Å
80	Q	93.2	Very high	92.3	Very high	139 Å²	139	96.8 Å²	96.8	65%	0.65	50%	0.504	S	S	*	.	H	α-helix	trans	-59.5	-47.2	175.8	-178.5	-177.9	-14.8	0	0	111.4	L76 T77 H82 T83 Q84	L76-Q80 WeakPolarHBondContact O-CB 3.4Å; L76-Q80 PolarHBondContact O-N 2.92Å; T77-Q80 PolarHBondContact O-N 3.33Å; Q80-H82 VanDerWaalsContact C-N 3.34Å; Q80-H82 PolarHBondContact O-N 3.49Å; Q80-T83 WeakPolarHBondContact CA-OG1 3.31Å; Q80-T83 PolarHBondContact O-N 3.3Å; Q80-T83 PolarHBondContact O-OG1 3.28Å; Q80-Q84 WeakPolarHBondContact O-CB 3.38Å; Q80-Q84 PolarHBondContact O-N 3.15Å
81	A	93.7	Very high	92.4	Very high	62 Å²	62	90.9 Å²	90.9	51%	0.512	48%	0.481	S	S	.	.	H	α-helix	trans	-60.2	-43.1	177.2	0	0	0	0	0	112	T77 N78 Q84 A85	T77-A81 PolarHBondContact O-N 3.5Å; N78-A81 PolarHBondContact O-N 3.03Å; A81-Q84 PolarHBondContact O-N 3.48Å; A81-A85 PolarHBondContact O-N 3.36Å
82	H	91.8	Very high	92.5	Very high	119 Å²	119	92.7 Å²	92.7	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-63.5	-44.5	175.8	179	-83.2	0	0	0	112.2	N78 L79 Q80 Q84 A85 M86	N78-H82 PolarHBondContact O-N 3.3Å; L79-H82 PolarHBondContact O-N 3.09Å; Q80-H82 VanDerWaalsContact C-N 3.34Å; Q80-H82 PolarHBondContact O-N 3.49Å; H82-Q84 VanDerWaalsContact C-N 3.31Å; H82-Q84 PolarHBondContact O-N 2.9Å; H82-A85 PolarHBondContact O-N 2.8Å; H82-M86 WeakPolarHBondContact O-CG 3.16Å; H82-M86 PolarHBondContact O-N 2.87Å
83	T	87.5	Confident	92.4	Very high	76 Å²	76	95.1 Å²	95.1	47%	0.466	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-35.9	177.5	49.2	0	0	0	0	112.5	L79 Q80 M86 F87	L79-T83 HydrophobicContact CD1-CG2 4.42Å; L79-T83 WeakPolarHBondContact O-CG2 3.29Å; L79-T83 PolarHBondContact O-N 2.87Å; L79-T83 PolarHBondContact O-OG1 2.92Å; L79-T83 VanDerWaalsContact O-OG1 3.1Å; Q80-T83 WeakPolarHBondContact CA-OG1 3.31Å; Q80-T83 PolarHBondContact O-N 3.3Å; Q80-T83 PolarHBondContact O-OG1 3.28Å; T83-M86 PolarHBondContact O-N 2.99Å; T83-F87 WeakPolarHBondContact O-CB 3.39Å; T83-F87 PolarHBondContact O-N 3Å
84	Q	94.4	Very high	92.3	Very high	93 Å²	93	98.8 Å²	98.8	44%	0.435	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-47.2	175.7	-176.8	64.2	22.7	0	0	111	Q80 A81 H82 M86 F87 E88	Q80-Q84 WeakPolarHBondContact O-CB 3.38Å; Q80-Q84 PolarHBondContact O-N 3.15Å; A81-Q84 PolarHBondContact O-N 3.48Å; H82-Q84 VanDerWaalsContact C-N 3.31Å; H82-Q84 PolarHBondContact O-N 2.9Å; Q84-M86 VanDerWaalsContact C-N 3.34Å; Q84-M86 PolarHBondContact O-N 2.91Å; Q84-F87 WeakPolarHBondContact O-CB 3.24Å; Q84-F87 PolarHBondContact O-N 2.91Å; Q84-F87 VanDerWaalsContact O-N 3.16Å; Q84-E88 WeakPolarHBondContact CG-OE1 2.97Å; Q84-E88 PolarHBondContact NE2-OE1 3.06Å; Q84-E88 WeakPolarHBondContact O-CG 3.3Å; Q84-E88 PolarHBondContact O-N 3.35Å
85	A	94.4	Very high	92.3	Very high	55 Å²	55	99.6 Å²	99.6	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-60.6	-41.8	177.2	0	0	0	0	0	112.4	A81 H82 F87 E88 A89	A81-A85 PolarHBondContact O-N 3.36Å; H82-A85 PolarHBondContact O-N 2.8Å; A85-F87 VanDerWaalsContact C-N 3.35Å; A85-F87 PolarHBondContact O-N 2.9Å; A85-E88 PolarHBondContact O-N 3.21Å; A85-A89 WeakPolarHBondContact O-CB 3.47Å; A85-A89 PolarHBondContact O-N 2.87Å
86	M	91.5	Very high	92	Very high	118 Å²	118	100.5 Å²	100.5	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-61.7	-41.5	174.8	-74.6	-71.1	-59	0	0	112.3	H82 T83 Q84 E90	H82-M86 WeakPolarHBondContact O-CG 3.16Å; H82-M86 PolarHBondContact O-N 2.87Å; T83-M86 PolarHBondContact O-N 2.99Å; Q84-M86 VanDerWaalsContact C-N 3.34Å; Q84-M86 PolarHBondContact O-N 2.91Å; M86-E90 PolarHBondContact O-N 3.37Å; M86-E90 VanDerWaalsContact O-N 3.13Å
87	F	93.5	Very high	91.9	Very high	130 Å²	130	101.4 Å²	101.4	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-65.8	-45.4	177	176.7	-100.9	0	0	0	111.6	T83 Q84 A85 A89 E90 V91	T83-F87 WeakPolarHBondContact O-CB 3.39Å; T83-F87 PolarHBondContact O-N 3Å; Q84-F87 WeakPolarHBondContact O-CB 3.24Å; Q84-F87 PolarHBondContact O-N 2.91Å; Q84-F87 VanDerWaalsContact O-N 3.16Å; A85-F87 VanDerWaalsContact C-N 3.35Å; A85-F87 PolarHBondContact O-N 2.9Å; F87-A89 PolarHBondContact O-N 3.25Å; F87-E90 PolarHBondContact O-N 3.29Å; F87-V91 HydrophobicContact CD1-CG2 4.16Å; F87-V91 HydrophobicContact CE1-CG2 3.74Å; F87-V91 HydrophobicContact CE2-CG2 4.13Å; F87-V91 HydrophobicContact CZ-CG2 3.73Å; F87-V91 WeakPolarHBondContact O-CG2 3.45Å; F87-V91 PolarHBondContact O-N 3.11Å
88	E	94.7	Very high	91.6	Very high	98 Å²	98	101 Å²	101	46%	0.458	50%	0.495	S	S	.	.	H	α-helix	trans	-61.8	-41.5	177.6	-73.9	172.4	-169.8	0	0	112.3	Q84 A85 V91 Q92	Q84-E88 WeakPolarHBondContact CG-OE1 2.97Å; Q84-E88 PolarHBondContact NE2-OE1 3.06Å; Q84-E88 WeakPolarHBondContact O-CG 3.3Å; Q84-E88 PolarHBondContact O-N 3.35Å; A85-E88 PolarHBondContact O-N 3.21Å; E88-V91 PolarHBondContact O-N 3.49Å; E88-Q92 WeakPolarHBondContact O-CG 3.39Å; E88-Q92 PolarHBondContact O-N 3.24Å
89	A	92.4	Very high	91.4	Very high	58 Å²	58	104.6 Å²	104.6	48%	0.479	50%	0.501	S	S	.	.	H	α-helix	trans	-61.2	-43.7	174.8	0	0	0	0	0	112.1	A85 F87 Q92 K93	A85-A89 WeakPolarHBondContact O-CB 3.47Å; A85-A89 PolarHBondContact O-N 2.87Å; F87-A89 PolarHBondContact O-N 3.25Å; A89-Q92 PolarHBondContact O-N 3.39Å; A89-K93 WeakPolarHBondContact O-CB 3.31Å; A89-K93 PolarHBondContact O-N 2.82Å
90	E	87.5	Confident	91.1	Very high	78 Å²	78	103.5 Å²	103.5	36%	0.364	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-39.2	176.4	179.3	61.8	-163	0	0	111.9	M86 F87 K93 R94	M86-E90 PolarHBondContact O-N 3.37Å; M86-E90 VanDerWaalsContact O-N 3.13Å; F87-E90 PolarHBondContact O-N 3.29Å; E90-K93 PolarHBondContact O-N 3.32Å; E90-R94 WeakPolarHBondContact O-CG 3.32Å; E90-R94 PolarHBondContact O-N 3.24Å; E90-R94 IonicContact OE1-CZ 2.75Å; E90-R94 IonicContact OE1-NE 3.6Å; E90-R94 PolarHBondContact OE1-NE 3.46Å; E90-R94 IonicContact OE1-NH2 2.88Å; E90-R94 PolarHBondContact OE1-NH2 3.4Å; E90-R94 VanDerWaalsContact OE1-NH2 3.13Å
91	V	93.2	Very high	91	Very high	41 Å²	41	102.8 Å²	102.8	25%	0.248	49%	0.492	C	S	.	.	H	α-helix	trans	-62	-44.7	173.8	168.6	0	0	0	0	110.9	F87 E88 R94 R95	F87-V91 HydrophobicContact CD1-CG2 4.16Å; F87-V91 HydrophobicContact CE1-CG2 3.74Å; F87-V91 HydrophobicContact CE2-CG2 4.13Å; F87-V91 HydrophobicContact CZ-CG2 3.73Å; F87-V91 WeakPolarHBondContact O-CG2 3.45Å; F87-V91 PolarHBondContact O-N 3.11Å; E88-V91 PolarHBondContact O-N 3.49Å; V91-R94 PolarHBondContact O-N 2.93Å; V91-R95 WeakPolarHBondContact O-CG 3.33Å; V91-R95 PolarHBondContact O-N 2.69Å
92	Q	91.9	Very high	90.7	Very high	110 Å²	110	104.8 Å²	104.8	51%	0.514	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-43.4	176.3	-74.3	-176.8	3.2	0	0	111.8	E88 A89 R94 R95 R96	E88-Q92 WeakPolarHBondContact O-CG 3.39Å; E88-Q92 PolarHBondContact O-N 3.24Å; A89-Q92 PolarHBondContact O-N 3.39Å; Q92-R94 VanDerWaalsContact C-N 3.35Å; Q92-R94 PolarHBondContact O-N 3.14Å; Q92-R95 WeakPolarHBondContact O-CB 3.24Å; Q92-R95 PolarHBondContact O-N 3.37Å; Q92-R96 PolarHBondContact O-N 2.95Å
93	K	89.7	Confident	90.5	Very high	123 Å²	123	100.2 Å²	100.2	54%	0.535	47%	0.47	S	S	.	.	H	α-helix	trans	-57.7	-46.7	175.6	-174.6	177.6	-179.1	178.4	0	111.6	A89 E90 R95 R96 I97	A89-K93 WeakPolarHBondContact O-CB 3.31Å; A89-K93 PolarHBondContact O-N 2.82Å; E90-K93 PolarHBondContact O-N 3.32Å; K93-R95 PolarHBondContact O-N 2.89Å; K93-R96 PolarHBondContact O-N 2.77Å; K93-I97 HydrophobicContact CG-CD1 4.26Å; K93-I97 WeakPolarHBondContact O-CG1 3.16Å; K93-I97 PolarHBondContact O-N 2.98Å; K93-I97 VanDerWaalsContact O-N 3.11Å
94	R	90.3	Very high	90.5	Very high	167 Å²	167	101.6 Å²	101.6	63%	0.63	48%	0.475	S	S	*	.	H	α-helix	trans	-64.1	-38	176.6	-71.8	177.9	-175.8	-124.8	-2.5	112.8	E90 V91 Q92 R96 I97 E98	E90-R94 WeakPolarHBondContact O-CG 3.32Å; E90-R94 PolarHBondContact O-N 3.24Å; E90-R94 IonicContact OE1-CZ 2.75Å; E90-R94 IonicContact OE1-NE 3.6Å; E90-R94 PolarHBondContact OE1-NE 3.46Å; E90-R94 IonicContact OE1-NH2 2.88Å; E90-R94 PolarHBondContact OE1-NH2 3.4Å; E90-R94 VanDerWaalsContact OE1-NH2 3.13Å; V91-R94 PolarHBondContact O-N 2.93Å; Q92-R94 VanDerWaalsContact C-N 3.35Å; Q92-R94 PolarHBondContact O-N 3.14Å; R94-R96 VanDerWaalsContact C-N 3.34Å; R94-R96 PolarHBondContact O-N 3.37Å; R94-I97 PolarHBondContact O-N 3.18Å; R94-E98 WeakPolarHBondContact O-CB 3.31Å; R94-E98 PolarHBondContact O-N 3.43Å
95	R	92.1	Very high	90.2	Very high	159 Å²	159	101.4 Å²	101.4	60%	0.6	47%	0.473	S	S	*	.	H	α-helix	trans	-62.9	-38.6	174.6	-75.2	175.1	178.8	-179.9	0.6	112.2	V91 Q92 K93 R99	V91-R95 WeakPolarHBondContact O-CG 3.33Å; V91-R95 PolarHBondContact O-N 2.69Å; Q92-R95 WeakPolarHBondContact O-CB 3.24Å; Q92-R95 PolarHBondContact O-N 3.37Å; K93-R95 PolarHBondContact O-N 2.89Å; R95-R99 WeakPolarHBondContact O-CG 3.42Å; R95-R99 PolarHBondContact O-N 3.2Å; R95-R99 VanDerWaalsContact O-N 3.12Å
96	R	89.7	Confident	89.8	Confident	138 Å²	138	107 Å²	107	52%	0.521	48%	0.483	S	S	.	.	H	α-helix	trans	-62.6	-49.6	174.2	-67.5	-179.6	-169.4	167.4	3.1	110.7	Q92 K93 R94 E98 R99 S100 E143	Q92-R96 PolarHBondContact O-N 2.95Å; K93-R96 PolarHBondContact O-N 2.77Å; R94-R96 VanDerWaalsContact C-N 3.34Å; R94-R96 PolarHBondContact O-N 3.37Å; R96-E98 VanDerWaalsContact C-N 3.32Å; R96-E98 PolarHBondContact O-N 2.87Å; R96-R99 PolarHBondContact O-N 3.48Å; R96-S100 PolarHBondContact O-N 2.88Å; R96-S100 VanDerWaalsContact O-N 3.08Å; R96-S100 PolarHBondContact O-OG 3.17Å; R96-E143 IonicContact NH1-OE2 3.22Å
97	I	88.4	Confident	89.5	Confident	101 Å²	101	104.1 Å²	104.1	52%	0.518	47%	0.467	S	S	.	.	H	α-helix	trans	-59.5	-42.6	178.4	-64.7	166.6	0	0	0	111.4	K93 R94 R99 S100 R101	K93-I97 HydrophobicContact CG-CD1 4.26Å; K93-I97 WeakPolarHBondContact O-CG1 3.16Å; K93-I97 PolarHBondContact O-N 2.98Å; K93-I97 VanDerWaalsContact O-N 3.11Å; R94-I97 PolarHBondContact O-N 3.18Å; I97-R99 VanDerWaalsContact C-N 3.34Å; I97-R99 PolarHBondContact O-N 2.95Å; I97-S100 PolarHBondContact O-N 3.04Å; I97-R101 WeakPolarHBondContact O-CB 3.47Å; I97-R101 PolarHBondContact O-N 3.38Å
98	E	88.4	Confident	89.3	Confident	68 Å²	68	101.6 Å²	101.6	32%	0.318	46%	0.459	S	S	.	.	H	α-helix	trans	-66.8	-33.5	179.6	-176.1	57.6	-158.1	0	0	112.6	R94 R96 R101 K102	R94-E98 WeakPolarHBondContact O-CB 3.31Å; R94-E98 PolarHBondContact O-N 3.43Å; R96-E98 VanDerWaalsContact C-N 3.32Å; R96-E98 PolarHBondContact O-N 2.87Å; E98-R101 PolarHBondContact O-N 3.36Å; E98-R101 IonicContact OE1-CZ 3.71Å; E98-R101 IonicContact OE1-NE 3.98Å; E98-R101 PolarHBondContact OE1-NE 3.03Å; E98-R101 IonicContact OE1-NH2 2.9Å; E98-R101 PolarHBondContact OE1-NH2 3.43Å; E98-R101 IonicContact OE2-CZ 3.59Å; E98-R101 IonicContact OE2-NE 3.99Å; E98-R101 PolarHBondContact OE2-NE 2.86Å; E98-R101 IonicContact OE2-NH2 2.8Å; E98-K102 WeakPolarHBondContact O-CG 3.36Å; E98-K102 PolarHBondContact O-N 3.2Å; E98-K102 VanDerWaalsContact OE1-CE 3.23Å; E98-K102 WeakPolarHBondContact OE1-CE 3.38Å
99	R	88.9	Confident	88.9	Confident	178 Å²	178	100.3 Å²	100.3	67%	0.672	46%	0.455	S	S	*	.	H	α-helix	trans	-65	-47	171.8	-69.9	174.6	-161.7	-175.6	2.7	111	R95 R96 I97 R101 K102 S103	R95-R99 WeakPolarHBondContact O-CG 3.42Å; R95-R99 PolarHBondContact O-N 3.2Å; R95-R99 VanDerWaalsContact O-N 3.12Å; R96-R99 PolarHBondContact O-N 3.48Å; I97-R99 VanDerWaalsContact C-N 3.34Å; I97-R99 PolarHBondContact O-N 2.95Å; R99-R101 VanDerWaalsContact C-N 3.31Å; R99-R101 PolarHBondContact O-N 3.46Å; R99-K102 PolarHBondContact O-N 3.09Å; R99-S103 WeakPolarHBondContact O-CB 3.44Å; R99-S103 PolarHBondContact O-N 3.18Å
100	S	86.5	Confident	88.5	Confident	62 Å²	62	100.3 Å²	100.3	43%	0.434	45%	0.446	S	S	.	.	H	α-helix	trans	-61	-40	176.1	-54.7	0	0	0	0	111.8	R96 I97 S103 L104	R96-S100 PolarHBondContact O-N 2.88Å; R96-S100 VanDerWaalsContact O-N 3.08Å; R96-S100 PolarHBondContact O-OG 3.17Å; I97-S100 PolarHBondContact O-N 3.04Å; S100-S103 PolarHBondContact O-N 3.2Å; S100-L104 WeakPolarHBondContact O-CB 3.43Å; S100-L104 PolarHBondContact O-N 3.38Å
101	R	90.4	Very high	88.4	Confident	124 Å²	124	100.6 Å²	100.6	47%	0.468	45%	0.449	S	S	.	.	H	α-helix	trans	-59.6	-50.5	174.5	-171.7	-175.6	80.2	88.4	4.9	111.4	I97 E98 R99 S103 L104 E105	I97-R101 WeakPolarHBondContact O-CB 3.47Å; I97-R101 PolarHBondContact O-N 3.38Å; E98-R101 PolarHBondContact O-N 3.36Å; E98-R101 IonicContact OE1-CZ 3.71Å; E98-R101 IonicContact OE1-NE 3.98Å; E98-R101 PolarHBondContact OE1-NE 3.03Å; E98-R101 IonicContact OE1-NH2 2.9Å; E98-R101 PolarHBondContact OE1-NH2 3.43Å; E98-R101 IonicContact OE2-CZ 3.59Å; E98-R101 IonicContact OE2-NE 3.99Å; E98-R101 PolarHBondContact OE2-NE 2.86Å; E98-R101 IonicContact OE2-NH2 2.8Å; R99-R101 VanDerWaalsContact C-N 3.31Å; R99-R101 PolarHBondContact O-N 3.46Å; R101-S103 VanDerWaalsContact C-N 3.34Å; R101-S103 PolarHBondContact O-N 2.86Å; R101-L104 PolarHBondContact O-N 3.44Å; R101-E105 IonicContact CZ-OE2 3.57Å; R101-E105 IonicContact NH1-OE2 3.06Å; R101-E105 VanDerWaalsContact O-CB 3.31Å; R101-E105 WeakPolarHBondContact O-CB 2.92Å; R101-E105 PolarHBondContact O-N 3.25Å
102	K	88.4	Confident	88.1	Confident	105 Å²	105	105.8 Å²	105.8	46%	0.457	46%	0.464	S	S	.	.	H	α-helix	trans	-63.7	-37.4	178.5	-73.8	-178.8	179.7	-173.2	0	112.5	E98 R99 R106	E98-K102 WeakPolarHBondContact O-CG 3.36Å; E98-K102 PolarHBondContact O-N 3.2Å; E98-K102 VanDerWaalsContact OE1-CE 3.23Å; E98-K102 WeakPolarHBondContact OE1-CE 3.38Å; R99-K102 PolarHBondContact O-N 3.09Å; K102-R106 WeakPolarHBondContact O-CG 3.49Å; K102-R106 PolarHBondContact O-N 3.29Å
103	S	86.8	Confident	87.8	Confident	22 Å²	22	105.4 Å²	105.4	15%	0.154	46%	0.462	C	S	.	.	H	α-helix	trans	-60.8	-51	174.1	-178.5	0	0	0	0	110.5	R99 S100 R101 E105 R106 K107 E136	R99-S103 WeakPolarHBondContact O-CB 3.44Å; R99-S103 PolarHBondContact O-N 3.18Å; S100-S103 PolarHBondContact O-N 3.2Å; R101-S103 VanDerWaalsContact C-N 3.34Å; R101-S103 PolarHBondContact O-N 2.86Å; S103-E105 PolarHBondContact O-N 3.41Å; S103-R106 WeakPolarHBondContact O-CB 3.43Å; S103-R106 PolarHBondContact O-N 3.03Å; S103-K107 PolarHBondContact O-N 3.09Å; S103-E136 PolarHBondContact OG-OE2 2.69Å; S103-E136 VanDerWaalsContact OG-OE2 3.05Å
104	L	87.9	Confident	87.6	Confident	106 Å²	106	100.7 Å²	100.7	56%	0.555	44%	0.444	S	S	*	.	H	α-helix	trans	-64.1	-39.1	178.5	-168.9	64.7	0	0	0	112.5	S100 R101 R106 K107 I108	S100-L104 WeakPolarHBondContact O-CB 3.43Å; S100-L104 PolarHBondContact O-N 3.38Å; R101-L104 PolarHBondContact O-N 3.44Å; L104-R106 VanDerWaalsContact C-N 3.34Å; L104-R106 PolarHBondContact O-N 3.4Å; L104-K107 PolarHBondContact O-N 2.89Å; L104-I108 HydrophobicContact CG-CD1 4.21Å; L104-I108 WeakPolarHBondContact O-CG1 3.44Å; L104-I108 PolarHBondContact O-N 2.82Å
105	E	88.5	Confident	87.2	Confident	88 Å²	88	99.4 Å²	99.4	41%	0.411	45%	0.449	S	S	.	.	H	α-helix	trans	-61.7	-40.4	176	-174.2	166.8	-152.8	0	0	111.9	R101 S103 I108 N109	R101-E105 IonicContact CZ-OE2 3.57Å; R101-E105 IonicContact NH1-OE2 3.06Å; R101-E105 VanDerWaalsContact O-CB 3.31Å; R101-E105 WeakPolarHBondContact O-CB 2.92Å; R101-E105 PolarHBondContact O-N 3.25Å; S103-E105 PolarHBondContact O-N 3.41Å; E105-I108 PolarHBondContact O-N 3.29Å; E105-N109 WeakPolarHBondContact O-CB 3.22Å; E105-N109 PolarHBondContact O-N 2.91Å; E105-N109 PolarHBondContact O-ND2 3.3Å
106	R	85.4	Confident	86.9	Confident	174 Å²	174	98 Å²	98	66%	0.657	45%	0.453	S	S	*	.	H	α-helix	trans	-62.6	-46.6	171.7	-70.3	172.1	-168.7	160.2	-0.9	111.6	K102 S103 L104 I108 N109 M110	K102-R106 WeakPolarHBondContact O-CG 3.49Å; K102-R106 PolarHBondContact O-N 3.29Å; S103-R106 WeakPolarHBondContact O-CB 3.43Å; S103-R106 PolarHBondContact O-N 3.03Å; L104-R106 VanDerWaalsContact C-N 3.34Å; L104-R106 PolarHBondContact O-N 3.4Å; R106-I108 VanDerWaalsContact C-N 3.33Å; R106-I108 PolarHBondContact O-N 3.24Å; R106-N109 PolarHBondContact O-N 2.84Å; R106-N109 VanDerWaalsContact O-N 3.15Å; R106-M110 WeakPolarHBondContact O-CG 3.45Å; R106-M110 PolarHBondContact O-N 3.38Å
107	K	85.4	Confident	86.6	Confident	57 Å²	57	93.4 Å²	93.4	25%	0.248	44%	0.44	C	S	.	.	H	α-helix	trans	-58.7	-44.3	177.8	-67.9	-175.8	-177.2	-164.4	0	111.5	S103 L104 N109 M110 I111 D131	S103-K107 PolarHBondContact O-N 3.09Å; L104-K107 PolarHBondContact O-N 2.89Å; K107-N109 PolarHBondContact O-N 2.82Å; K107-M110 PolarHBondContact O-N 3.13Å; K107-I111 WeakPolarHBondContact O-CG1 3.43Å; K107-I111 PolarHBondContact O-N 2.92Å; K107-D131 VanDerWaalsContact CE-O 3.31Å; K107-D131 WeakPolarHBondContact CE-O 3.4Å; K107-D131 PolarHBondContact NZ-O 3.14Å
108	I	89.1	Confident	86.2	Confident	76 Å²	76	96.6 Å²	96.6	39%	0.39	46%	0.457	S	S	.	.	H	α-helix	trans	-60.8	-44.6	175.6	-70	167.7	0	0	0	111.1	L104 E105 R106 M110 I111 R112	L104-I108 HydrophobicContact CG-CD1 4.21Å; L104-I108 WeakPolarHBondContact O-CG1 3.44Å; L104-I108 PolarHBondContact O-N 2.82Å; E105-I108 PolarHBondContact O-N 3.29Å; R106-I108 VanDerWaalsContact C-N 3.33Å; R106-I108 PolarHBondContact O-N 3.24Å; I108-M110 VanDerWaalsContact C-N 3.33Å; I108-M110 PolarHBondContact O-N 2.67Å; I108-I111 PolarHBondContact O-N 3.14Å; I108-R112 WeakPolarHBondContact O-CG 3.14Å; I108-R112 PolarHBondContact O-N 3.45Å
109	N	85.7	Confident	86.1	Confident	72 Å²	72	96.8 Å²	96.8	39%	0.385	46%	0.461	S	S	.	.	H	α-helix	trans	-66.1	-34.9	179	-73.1	-24.7	0	0	0	112.4	E105 R106 K107 R112 Q113	E105-N109 WeakPolarHBondContact O-CB 3.22Å; E105-N109 PolarHBondContact O-N 2.91Å; E105-N109 PolarHBondContact O-ND2 3.3Å; R106-N109 PolarHBondContact O-N 2.84Å; R106-N109 VanDerWaalsContact O-N 3.15Å; K107-N109 PolarHBondContact O-N 2.82Å; N109-R112 WeakPolarHBondContact O-CB 3.4Å; N109-R112 PolarHBondContact O-N 3.47Å; N109-Q113 WeakPolarHBondContact O-CG 3.38Å; N109-Q113 PolarHBondContact O-N 3.41Å
110	M	84.2	Confident	85.9	Confident	57 Å²	57	93.6 Å²	93.6	28%	0.281	46%	0.461	S	S	.	.	H	α-helix	trans	-66.2	-43.2	173	-67.5	-177.3	74.1	0	0	112	R106 K107 I108 R112 Q113 V114 A129 I130	R106-M110 WeakPolarHBondContact O-CG 3.45Å; R106-M110 PolarHBondContact O-N 3.38Å; K107-M110 PolarHBondContact O-N 3.13Å; I108-M110 VanDerWaalsContact C-N 3.33Å; I108-M110 PolarHBondContact O-N 2.67Å; M110-R112 VanDerWaalsContact C-N 3.29Å; M110-R112 PolarHBondContact O-N 3.49Å; M110-Q113 WeakPolarHBondContact O-CB 3.47Å; M110-Q113 PolarHBondContact O-N 3.09Å; M110-Q113 VanDerWaalsContact O-N 3.09Å; M110-V114 WeakPolarHBondContact O-CG2 3.45Å; M110-V114 PolarHBondContact O-N 3.26Å; M110-A129 VanDerWaalsContact CE-C 3.46Å; M110-A129 HydrophobicContact CE-CB 3.45Å; M110-A129 VanDerWaalsContact CE-CB 3.45Å; M110-A129 WeakPolarHBondContact CE-O 3.41Å; M110-I130 HydrophobicContact CB-CD1 4.09Å; M110-I130 HydrophobicContact CB-CG1 3.79Å; M110-I130 HydrophobicContact CE-CG1 3.89Å; M110-I130 HydrophobicContact SD-CG1 4.22Å
111	I	86	Confident	86	Confident	85 Å²	85	95.6 Å²	95.6	44%	0.436	47%	0.467	S	S	.	.	H	α-helix	trans	-59.7	-42.6	174.1	-66.3	166.3	0	0	0	110.5	K107 I108 Q113 V114 L115 I130	K107-I111 WeakPolarHBondContact O-CG1 3.43Å; K107-I111 PolarHBondContact O-N 2.92Å; I108-I111 PolarHBondContact O-N 3.14Å; I111-Q113 VanDerWaalsContact C-N 3.3Å; I111-Q113 PolarHBondContact O-N 3.18Å; I111-V114 WeakPolarHBondContact O-CB 3.42Å; I111-V114 PolarHBondContact O-N 3.03Å; I111-L115 HydrophobicContact CG2-CD1 4.13Å; I111-L115 WeakPolarHBondContact O-CG 3.09Å; I111-L115 PolarHBondContact O-N 3.31Å; I111-I130 HydrophobicContact CG1-CD1 3.85Å
112	R	86.3	Confident	85.7	Confident	150 Å²	150	91 Å²	91	57%	0.566	45%	0.453	S	S	*	.	H	α-helix	trans	-58.9	-41.1	174.5	-73.7	173.7	176.1	175.8	-4.8	112	I108 N109 M110 L115 L116	I108-R112 WeakPolarHBondContact O-CG 3.14Å; I108-R112 PolarHBondContact O-N 3.45Å; N109-R112 WeakPolarHBondContact O-CB 3.4Å; N109-R112 PolarHBondContact O-N 3.47Å; M110-R112 VanDerWaalsContact C-N 3.29Å; M110-R112 PolarHBondContact O-N 3.49Å; R112-L115 PolarHBondContact O-N 3.15Å; R112-L116 VanDerWaalsContact O-CG 3.26Å; R112-L116 WeakPolarHBondContact O-CG 3.17Å; R112-L116 PolarHBondContact O-N 2.91Å
113	Q	85.4	Confident	85.4	Confident	101 Å²	101	86.7 Å²	86.7	47%	0.472	44%	0.438	S	S	.	.	H	α-helix	trans	-64	-42.1	176	-69.1	-67.4	-2.7	0	0	112.1	N109 M110 I111 L115 L116 V117	N109-Q113 WeakPolarHBondContact O-CG 3.38Å; N109-Q113 PolarHBondContact O-N 3.41Å; M110-Q113 WeakPolarHBondContact O-CB 3.47Å; M110-Q113 PolarHBondContact O-N 3.09Å; M110-Q113 VanDerWaalsContact O-N 3.09Å; I111-Q113 VanDerWaalsContact C-N 3.3Å; I111-Q113 PolarHBondContact O-N 3.18Å; Q113-L115 VanDerWaalsContact C-N 3.29Å; Q113-L115 PolarHBondContact O-N 3.33Å; Q113-L116 PolarHBondContact O-N 3.41Å; Q113-V117 WeakPolarHBondContact O-CG2 3.3Å; Q113-V117 PolarHBondContact O-N 3.49Å
114	V	85.1	Confident	85.4	Confident	24 Å²	24	93.6 Å²	93.6	15%	0.145	46%	0.46	C	S	.	.	H	α-helix	trans	-57.3	-43.7	174.6	176.4	0	0	0	0	111.1	M110 I111 L116 A123 H126 L127 I130	M110-V114 WeakPolarHBondContact O-CG2 3.45Å; M110-V114 PolarHBondContact O-N 3.26Å; I111-V114 WeakPolarHBondContact O-CB 3.42Å; I111-V114 PolarHBondContact O-N 3.03Å; V114-L116 VanDerWaalsContact C-N 3.29Å; V114-L116 PolarHBondContact O-N 3.14Å; V114-A123 HydrophobicContact CG1-CB 4.22Å; V114-H126 HydrophobicContact CG2-CB 3.46Å; V114-H126 VanDerWaalsContact CG2-CB 3.46Å; V114-L127 HydrophobicContact CG1-CD1 3.62Å; V114-L127 HydrophobicContact CG1-CG 4.08Å; V114-L127 HydrophobicContact CG2-CD1 4.46Å; V114-L127 HydrophobicContact CG2-CG 4.1Å; V114-I130 HydrophobicContact CG2-CD1 4.48Å
115	L	82.8	Confident	85.1	Confident	140 Å²	140	95.9 Å²	95.9	73%	0.733	46%	0.462	S	S	*	.	H	α-helix	trans	-72	-19.6	-177.7	-67.5	173.5	0	0	0	114.2	I111 R112 Q113	I111-L115 HydrophobicContact CG2-CD1 4.13Å; I111-L115 WeakPolarHBondContact O-CG 3.09Å; I111-L115 PolarHBondContact O-N 3.31Å; R112-L115 PolarHBondContact O-N 3.15Å; Q113-L115 VanDerWaalsContact C-N 3.29Å; Q113-L115 PolarHBondContact O-N 3.33Å
116	L	86.1	Confident	84.8	Confident	131 Å²	131	94.9 Å²	94.9	69%	0.686	46%	0.457	S	S	*	.	H	α-helix	trans	-95.4	-12.2	-177.9	-71.2	171.6	0	0	0	113.4	R112 Q113 V114	R112-L116 VanDerWaalsContact O-CG 3.26Å; R112-L116 WeakPolarHBondContact O-CG 3.17Å; R112-L116 PolarHBondContact O-N 2.91Å; Q113-L116 PolarHBondContact O-N 3.41Å; V114-L116 VanDerWaalsContact C-N 3.29Å; V114-L116 PolarHBondContact O-N 3.14Å
117	V	82.7	Confident	84.6	Confident	41 Å²	41	91.2 Å²	91.2	25%	0.248	45%	0.45	C	S	.	.			trans	-94	120.9	-175	172.8	0	0	0	0	109.9	Q113 D119 S122	Q113-V117 WeakPolarHBondContact O-CG2 3.3Å; Q113-V117 PolarHBondContact O-N 3.49Å; V117-D119 VanDerWaalsContact C-N 3.32Å; V117-D119 HydrophobicContact CG1-CB 4.04Å; V117-D119 WeakPolarHBondContact CG1-O 3.13Å; V117-S122 VanDerWaalsContact CG1-CB 3.45Å
118	N	79.5	Confident	84.4	Confident	167 Å²	167	94.5 Å²	94.5	89%	0.893	47%	0.47	S	S	*	.			trans	-75.7	-21.6	175.9	-70.7	-17.5	0	0	0	113.1
119	D	87.1	Confident	84	Confident	73 Å²	73	93.7 Å²	93.7	39%	0.39	48%	0.475	S	S	.	.			trans	-80.8	116.3	179.1	174	41.4	0	0	0	111.3	V117 D121 S122 A123 R125	V117-D119 VanDerWaalsContact C-N 3.32Å; V117-D119 HydrophobicContact CG1-CB 4.04Å; V117-D119 WeakPolarHBondContact CG1-O 3.13Å; D119-D121 VanDerWaalsContact C-N 3.27Å; D119-D121 PolarHBondContact O-N 3.49Å; D119-D121 PolarHBondContact OD1-N 2.77Å; D119-S122 PolarHBondContact O-N 2.95Å; D119-S122 WeakPolarHBondContact OD2-CB 3.12Å; D119-S122 PolarHBondContact OD2-N 3.15Å; D119-S122 PolarHBondContact OD2-OG 3.21Å; D119-A123 PolarHBondContact O-N 3Å; D119-R125 IonicContact OD2-NH2 3.66Å
120	V	85.2	Confident	83.6	Confident	110 Å²	110	91.2 Å²	91.2	67%	0.667	46%	0.461	S	S	*	.	H	α-helix	trans	-60.8	-37.4	-176.5	179.6	0	0	0	0	111.4	A123 R124	V120-A123 PolarHBondContact O-N 2.82Å; V120-R124 WeakPolarHBondContact O-CB 3.44Å; V120-R124 PolarHBondContact O-N 3.34Å
121	D	87	Confident	83	Confident	104 Å²	104	93.5 Å²	93.5	56%	0.556	48%	0.475	S	S	*	.	H	α-helix	trans	-69.2	-40.7	-179.9	-72.1	-35.8	0	0	0	111.7	D119 R124 R125	D119-D121 VanDerWaalsContact C-N 3.27Å; D119-D121 PolarHBondContact O-N 3.49Å; D119-D121 PolarHBondContact OD1-N 2.77Å; D121-R124 PolarHBondContact O-N 3.3Å; D121-R125 WeakPolarHBondContact O-CG 3.48Å; D121-R125 PolarHBondContact O-N 2.73Å
122	S	84.9	Confident	82.1	Confident	27 Å²	27	95.8 Å²	95.8	19%	0.189	49%	0.487	C	S	.	.	H	α-helix	trans	-67.1	-40.6	173.7	-67.2	0	0	0	0	112.5	V117 D119 R124 R125 H126	V117-S122 VanDerWaalsContact CG1-CB 3.45Å; D119-S122 PolarHBondContact O-N 2.95Å; D119-S122 WeakPolarHBondContact OD2-CB 3.12Å; D119-S122 PolarHBondContact OD2-N 3.15Å; D119-S122 PolarHBondContact OD2-OG 3.21Å; S122-R124 VanDerWaalsContact C-N 3.3Å; S122-R124 PolarHBondContact O-N 3.36Å; S122-R125 PolarHBondContact O-N 3.04Å; S122-R125 PolarHBondContact OG-NH2 2.9Å; S122-H126 PolarHBondContact O-N 2.83Å; S122-H126 PolarHBondContact O-ND1 3.23Å
123	A	83.3	Confident	80.8	Confident	16 Å²	16	91 Å²	91	13%	0.132	48%	0.477	C	S	.	.	H	α-helix	trans	-60.3	-42	173	0	0	0	0	0	111.3	V114 D119 V120 H126 L127	V114-A123 HydrophobicContact CG1-CB 4.22Å; D119-A123 PolarHBondContact O-N 3Å; V120-A123 PolarHBondContact O-N 2.82Å; A123-H126 PolarHBondContact O-N 2.78Å; A123-L127 PolarHBondContact O-N 3.41Å
124	R	84.9	Confident	79.3	Confident	167 Å²	167	91.1 Å²	91.1	63%	0.63	48%	0.484	S	S	*	.	H	α-helix	trans	-66.1	-43.5	177.8	-171.4	157.1	-178.8	-154.1	-1.3	113	V120 D121 S122 H126 L127 D128	V120-R124 WeakPolarHBondContact O-CB 3.44Å; V120-R124 PolarHBondContact O-N 3.34Å; D121-R124 PolarHBondContact O-N 3.3Å; S122-R124 VanDerWaalsContact C-N 3.3Å; S122-R124 PolarHBondContact O-N 3.36Å; R124-H126 VanDerWaalsContact C-N 3.29Å; R124-H126 PolarHBondContact O-N 2.79Å; R124-L127 WeakPolarHBondContact O-CB 3.45Å; R124-L127 PolarHBondContact O-N 3.21Å; R124-L127 VanDerWaalsContact O-N 3.15Å; R124-D128 PolarHBondContact O-N 3.48Å
125	R	83	Confident	77.7	Confident	154 Å²	154	96.2 Å²	96.2	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-58.2	-40.5	172.5	-74.8	-172.5	-69	-104.4	-0.4	112.4	D119 D121 S122 A129	D119-R125 IonicContact OD2-NH2 3.66Å; D121-R125 WeakPolarHBondContact O-CG 3.48Å; D121-R125 PolarHBondContact O-N 2.73Å; S122-R125 PolarHBondContact O-N 3.04Å; S122-R125 PolarHBondContact OG-NH2 2.9Å; R125-A129 WeakPolarHBondContact O-CB 3.28Å; R125-A129 PolarHBondContact O-N 3.41Å
126	H	81.3	Confident	76.3	Confident	66 Å²	66	95.4 Å²	95.4	31%	0.306	50%	0.503	S	S	.	.	H	α-helix	trans	-67.3	-37.9	176.4	-70.8	149.5	0	0	0	112.5	V114 S122 A123 R124 A129 I130	V114-H126 HydrophobicContact CG2-CB 3.46Å; V114-H126 VanDerWaalsContact CG2-CB 3.46Å; S122-H126 PolarHBondContact O-N 2.83Å; S122-H126 PolarHBondContact O-ND1 3.23Å; A123-H126 PolarHBondContact O-N 2.78Å; R124-H126 VanDerWaalsContact C-N 3.29Å; R124-H126 PolarHBondContact O-N 2.79Å; H126-A129 PolarHBondContact O-N 3.31Å; H126-I130 WeakPolarHBondContact O-CG1 3.4Å; H126-I130 PolarHBondContact O-N 3.07Å
127	L	81	Confident	74.4	Confident	98 Å²	98	94.8 Å²	94.8	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-46.8	173.7	-96.4	141.4	0	0	0	112	V114 A123 R124 A129 I130	V114-L127 HydrophobicContact CG1-CD1 3.62Å; V114-L127 HydrophobicContact CG1-CG 4.08Å; V114-L127 HydrophobicContact CG2-CD1 4.46Å; V114-L127 HydrophobicContact CG2-CG 4.1Å; A123-L127 PolarHBondContact O-N 3.41Å; R124-L127 WeakPolarHBondContact O-CB 3.45Å; R124-L127 PolarHBondContact O-N 3.21Å; R124-L127 VanDerWaalsContact O-N 3.15Å; L127-A129 PolarHBondContact O-N 2.86Å; L127-I130 WeakPolarHBondContact O-CB 3.4Å; L127-I130 PolarHBondContact O-N 3.05Å
128	D	82.7	Confident	72.7	Confident	125 Å²	125	99.1 Å²	99.1	67%	0.668	52%	0.521	S	S	*	.	H	α-helix	trans	-64.6	-25.1	179.2	-68	-21.9	0	0	0	112.3	R124	R124-D128 PolarHBondContact O-N 3.48Å
129	A	79.6	Confident	71.1	Confident	59 Å²	59	99.6 Å²	99.6	49%	0.488	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-13.5	175.2	0	0	0	0	0	113.8	M110 R125 H126 L127 D131	M110-A129 VanDerWaalsContact CE-C 3.46Å; M110-A129 HydrophobicContact CE-CB 3.45Å; M110-A129 VanDerWaalsContact CE-CB 3.45Å; M110-A129 WeakPolarHBondContact CE-O 3.41Å; R125-A129 WeakPolarHBondContact O-CB 3.28Å; R125-A129 PolarHBondContact O-N 3.41Å; H126-A129 PolarHBondContact O-N 3.31Å; L127-A129 PolarHBondContact O-N 2.86Å; A129-D131 PolarHBondContact O-N 3.22Å
130	I	78	Confident	69.1	Low	21 Å²	21	100 Å²	100	11%	0.108	53%	0.527	C	S	.	.	S	Bend	trans	-77.6	95	174.6	-61.5	169.8	0	0	0	107.7	M110 I111 V114 H126 L127 L132	M110-I130 HydrophobicContact CB-CD1 4.09Å; M110-I130 HydrophobicContact CB-CG1 3.79Å; M110-I130 HydrophobicContact CE-CG1 3.89Å; M110-I130 HydrophobicContact SD-CG1 4.22Å; I111-I130 HydrophobicContact CG1-CD1 3.85Å; V114-I130 HydrophobicContact CG2-CD1 4.48Å; H126-I130 WeakPolarHBondContact O-CG1 3.4Å; H126-I130 PolarHBondContact O-N 3.07Å; L127-I130 WeakPolarHBondContact O-CB 3.4Å; L127-I130 PolarHBondContact O-N 3.05Å; I130-L132 HydrophobicContact CG2-CD2 3.75Å; I130-L132 HydrophobicContact CG2-CG 4.01Å; I130-L132 PolarHBondContact O-N 3.15Å
131	D	71.8	Confident	67	Low	105 Å²	105	98.9 Å²	98.9	56%	0.561	52%	0.522	S	S	*	.			trans	-66	105	169	-172.9	11.9	0	0	0	109.9	K107 A129 S133	K107-D131 VanDerWaalsContact CE-O 3.31Å; K107-D131 WeakPolarHBondContact CE-O 3.4Å; K107-D131 PolarHBondContact NZ-O 3.14Å; A129-D131 PolarHBondContact O-N 3.22Å; D131-S133 VanDerWaalsContact C-N 3.25Å; D131-S133 WeakPolarHBondContact OD1-CB 3.43Å; D131-S133 PolarHBondContact OD1-N 2.8Å; D131-S133 PolarHBondContact OD1-OG 3.34Å; D131-S133 VanDerWaalsContact OD1-OG 3.05Å; D131-S133 PolarHBondContact OD2-OG 3.4Å
132	L	66.2	Low	64.8	Low	132 Å²	132	101 Å²	101	69%	0.691	53%	0.534	S	S	*	.			trans	-86.6	8.5	175	-68.1	175.2	0	0	0	112.4	I130 T134	I130-L132 HydrophobicContact CG2-CD2 3.75Å; I130-L132 HydrophobicContact CG2-CG 4.01Å; I130-L132 PolarHBondContact O-N 3.15Å; L132-T134 PolarHBondContact O-N 3.24Å
133	S	58.6	Low	62.3	Low	50 Å²	50	106.5 Å²	106.5	35%	0.35	56%	0.557	S	S	.	*			trans	-50.1	117.6	171.5	68.3	0	0	0	0	109.3	D131 D135	D131-S133 VanDerWaalsContact C-N 3.25Å; D131-S133 WeakPolarHBondContact OD1-CB 3.43Å; D131-S133 PolarHBondContact OD1-N 2.8Å; D131-S133 PolarHBondContact OD1-OG 3.34Å; D131-S133 VanDerWaalsContact OD1-OG 3.05Å; D131-S133 PolarHBondContact OD2-OG 3.4Å; S133-D135 PolarHBondContact O-N 3.15Å
134	T	55.1	Low	59.9	Low	104 Å²	104	116 Å²	116	64%	0.638	59%	0.589	S	S	*	*			trans	-88.2	7.1	-169.1	1.9	0	0	0	0	111.5	L132 E136 I137	L132-T134 PolarHBondContact O-N 3.24Å; T134-E136 PolarHBondContact O-N 3.48Å; T134-E136 VanDerWaalsContact O-N 3.15Å; T134-I137 PolarHBondContact O-N 3.07Å
135	D	51.5	Low	57.4	Low	130 Å²	130	113.1 Å²	113.1	70%	0.695	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-17.5	-168.1	-68.5	-27.9	0	0	0	113.5	S133 I137	S133-D135 PolarHBondContact O-N 3.15Å; D135-I137 VanDerWaalsContact C-N 3.29Å; D135-I137 PolarHBondContact O-N 3.04Å
136	E	52.3	Low	55.1	Low	124 Å²	124	113.1 Å²	113.1	58%	0.579	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-17.8	176.7	-67.6	-163.9	140.6	0	0	113.8	S103 T134	S103-E136 PolarHBondContact OG-OE2 2.69Å; S103-E136 VanDerWaalsContact OG-OE2 3.05Å; T134-E136 PolarHBondContact O-N 3.48Å; T134-E136 VanDerWaalsContact O-N 3.15Å
137	I	47.8	Very low	52.6	Low	117 Å²	117	113.2 Å²	113.2	60%	0.6	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-27.3	-172.2	-60.7	178.7	0	0	0	112.6	T134 D135 Q139 S140	T134-I137 PolarHBondContact O-N 3.07Å; D135-I137 VanDerWaalsContact C-N 3.29Å; D135-I137 PolarHBondContact O-N 3.04Å; I137-Q139 PolarHBondContact O-N 2.88Å; I137-S140 PolarHBondContact O-N 3.46Å
138	N	45	Very low	50	Low	132 Å²	132	113.8 Å²	113.8	71%	0.706	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-11.3	-170.4	-93.2	-13.3	0	0	0	116.1
139	Q	46.8	Very low	47.7	Very low	178 Å²	178	113.2 Å²	113.2	83%	0.832	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-11.4	174.8	-74.9	-177.3	4.3	0	0	113.9	I137	I137-Q139 PolarHBondContact O-N 2.88Å
140	S	45.8	Very low	45.5	Very low	81 Å²	81	116.4 Å²	116.4	57%	0.566	66%	0.658	S	S	*	*	S	Bend	trans	-86.6	-21.5	-175.8	179.8	0	0	0	0	114.3	I137	I137-S140 PolarHBondContact O-N 3.46Å
141	C	40.7	Very low	43.1	Very low	86 Å²	86	124 Å²	124	58%	0.581	69%	0.694	S	S	*	*	S	Bend	trans	-85.6	-18	-170.2	-72	0	0	0	0	114.8
142	N	39.8	Very low	41.1	Very low	150 Å²	150	127 Å²	127	80%	0.802	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-2.6	-173.7	-75.8	4.1	0	0	0	115.5	W144	N142-W144 VanDerWaalsContact C-N 3.31Å; N142-W144 PolarHBondContact O-N 3.34Å
143	E	33.8	Very low	39.4	Very low	141 Å²	141	125 Å²	125	66%	0.659	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	9.2	177.6	-123.8	175.5	-178.1	0	0	113.5	R96 S145	R96-E143 IonicContact NH1-OE2 3.22Å; E143-S145 VanDerWaalsContact C-N 3.25Å; E143-S145 PolarHBondContact O-N 3.42Å; E143-S145 VanDerWaalsContact O-N 3.15Å
144	W	31.3	Very low	37.9	Very low	217 Å²	217	129.5 Å²	129.5	82%	0.822	73%	0.726	S	S	*	*			trans	-90.1	59.1	176.5	-68.2	35.1	0	0	0	110.4	N142	N142-W144 VanDerWaalsContact C-N 3.31Å; N142-W144 PolarHBondContact O-N 3.34Å
145	S	33.2	Very low	36.6	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	73%	0.733	S	S	*	*			trans	-133.4	67.9	163.4	-84.9	0	0	0	0	109.1	E143 G147	E143-S145 VanDerWaalsContact C-N 3.25Å; E143-S145 PolarHBondContact O-N 3.42Å; E143-S145 VanDerWaalsContact O-N 3.15Å; S145-G147 PolarHBondContact O-N 3.05Å
146	V	34	Very low	35.4	Very low	154 Å²	154	129.9 Å²	129.9	93%	0.933	74%	0.735	S	S	*	*			trans	-72.5	82.5	165.6	-177.2	0	0	0	0	107.2
147	G	28.9	Very low	34.1	Very low	67 Å²	67	132.1 Å²	132.1	69%	0.691	75%	0.75	S	S	*	*			trans	-174.3	29	-177.4	0	0	0	0	0	113.9	S145 P149	S145-G147 PolarHBondContact O-N 3.05Å; G147-P149 WeakPolarHBondContact O-CD 3.38Å
148	S	27.1	Very low	33	Very low	110 Å²	110	134.8 Å²	134.8	77%	0.769	76%	0.759	S	S	*	*			trans	-89.5	115	166.9	-156.1	0	0	0	0	108.8	V150	S148-V150 PolarHBondContact O-N 2.77Å
149	P	34.5	Very low	32	Very low	113 Å²	113	133.3 Å²	133.3	73%	0.734	76%	0.759	S	S	*	*			trans	-68.7	122.7	-176.1	26	-29.7	0	0	0	109.8	G147 E151	G147-P149 WeakPolarHBondContact O-CD 3.38Å; P149-E151 PolarHBondContact O-N 3.4Å
150	V	33.4	Very low	30.8	Very low	126 Å²	126	134 Å²	134	76%	0.764	76%	0.763	S	S	*	*			trans	-59.5	106.1	178.9	179	0	0	0	0	109.5	S148 H152	S148-V150 PolarHBondContact O-N 2.77Å; V150-H152 PolarHBondContact O-N 2.99Å; V150-H152 VanDerWaalsContact O-N 3.16Å; V150-H152 PolarHBondContact O-ND1 2.98Å
151	E	27.7	Very low	29.7	Very low	182 Å²	182	136.4 Å²	136.4	85%	0.85	78%	0.777	S	S	*	*			trans	-49.6	119.7	168.5	-74.5	-174	151.9	0	0	109.3	P149 A153	P149-E151 PolarHBondContact O-N 3.4Å; E151-A153 PolarHBondContact O-N 3.06Å
152	H	29.7	Very low	28.8	Very low	167 Å²	167	137.1 Å²	137.1	77%	0.773	79%	0.789	S	S	*	*			trans	-66.8	98.3	175	-69.7	-7.3	0	0	0	108.7	V150 N154	V150-H152 PolarHBondContact O-N 2.99Å; V150-H152 VanDerWaalsContact O-N 3.16Å; V150-H152 PolarHBondContact O-ND1 2.98Å; H152-N154 PolarHBondContact O-N 3.2Å
153	A	29.8	Very low	28.1	Very low	90 Å²	90	136.4 Å²	136.4	74%	0.744	79%	0.79	S	S	*	*			trans	-64	81.1	167	0	0	0	0	0	109.6	E151 T155	E151-A153 PolarHBondContact O-N 3.06Å; A153-T155 PolarHBondContact O-N 2.91Å; A153-T155 VanDerWaalsContact O-N 3.08Å
154	N	27.6	Very low	27.7	Very low	145 Å²	145	139.3 Å²	139.3	78%	0.775	80%	0.801	S	S	*	*			trans	-65.6	100.9	160.9	-74.9	-33.1	0	0	0	106.9	H152 P156	H152-N154 PolarHBondContact O-N 3.2Å; N154-P156 VanDerWaalsContact O-CD 3.27Å; N154-P156 WeakPolarHBondContact O-CD 3.26Å
155	T	27.2	Very low	27.2	Very low	126 Å²	126	139.4 Å²	139.4	77%	0.773	81%	0.807	S	S	*	*			trans	-82.8	110.3	169.5	35.1	0	0	0	0	108	A153 I157	A153-T155 PolarHBondContact O-N 2.91Å; A153-T155 VanDerWaalsContact O-N 3.08Å; T155-I157 PolarHBondContact O-N 3.17Å
156	P	28.1	Very low	26.7	Very low	115 Å²	115	138.1 Å²	138.1	75%	0.747	81%	0.811	S	S	*	*			trans	-77.2	125.8	173	-3.5	23.1	0	0	0	108.1	N154 H158	N154-P156 VanDerWaalsContact O-CD 3.27Å; N154-P156 WeakPolarHBondContact O-CD 3.26Å; P156-H158 PolarHBondContact O-N 2.76Å
157	I	23.9	Very low	26.2	Very low	172 Å²	172	142.8 Å²	142.8	88%	0.882	81%	0.811	S	S	*	*			trans	-67.8	110.4	169.5	-61.1	163.9	0	0	0	106.3	T155	T155-I157 PolarHBondContact O-N 3.17Å
158	H	24.2	Very low	26	Very low	173 Å²	173	147.4 Å²	147.4	80%	0.801	82%	0.82	S	S	*	*			trans	-128.6	127.1	165.6	-121.8	-84.7	0	0	0	111.1	P156	P156-H158 PolarHBondContact O-N 2.76Å
159	S	25.3	Very low	25.9	Very low	100 Å²	100	147.9 Å²	147.9	70%	0.699	82%	0.824	S	S	*	*			trans	-60.9	149.4	178.8	43.4	0	0	0	0	113.1
160	E	21.1	Very low	25.5	Very low	194 Å²	194	146.4 Å²	146.4	91%	0.907	83%	0.829	S	S	*	*			trans	-41.9	130.3	168.6	-70.1	165.7	135.2	0	0	113.1
161	C	22.1	Very low	25	Very low	130 Å²	130	151.5 Å²	151.5	88%	0.878	83%	0.834	S	S	*	*			trans	-155.4	111.7	140.7	-118.7	0	0	0	0	108
162	A	22.2	Very low	24.8	Very low	101 Å²	101	149.7 Å²	149.7	84%	0.835	83%	0.829	S	S	*	*			trans	-80.2	115.4	178.1	0	0	0	0	0	110.4
163	V	26	Very low	24.6	Very low	135 Å²	135	146.6 Å²	146.6	82%	0.818	83%	0.826	S	S	*	*			trans	-148.4	118.6	156.4	-177	0	0	0	0	111.1
164	K	24.1	Very low	24.4	Very low	202 Å²	202	152 Å²	152	88%	0.878	83%	0.833	S	S	*	*			trans	27.8	129.2	152.4	-64.1	-179.3	177.5	177.2	0	122.7
165	K	20.8	Very low	24.5	Very low	220 Å²	220	155.1 Å²	155.1	96%	0.957	84%	0.84	S	S	*	*			trans	-21.2	132	158.5	-67.6	175.1	175.5	176.3	0	117.2
166	G	23.9	Very low	24.4	Very low	79 Å²	79	158 Å²	158	81%	0.814	85%	0.849	S	S	*	*			trans	-158.8	116.2	155.7	0	0	0	0	0	110.3
167	R	22.2	Very low	24.4	Very low	252 Å²	252	156.2 Å²	156.2	95%	0.951	85%	0.851	S	S	*	*			trans	-72.4	132.2	170	-78.7	169.7	157.5	167.7	-8.1	108.8
168	N	25.8	Very low	24.5	Very low	164 Å²	164	159.5 Å²	159.5	88%	0.877	85%	0.852	S	S	*	*				-171	142.1	123	-127.5	-0.3	0	0	0	113.1
169	S	23.8	Very low	24.6	Very low	120 Å²	120	156.1 Å²	156.1	84%	0.839	85%	0.854	S	S	*	*			trans	-66.9	142.7	172.7	-63.1	0	0	0	0	111.9
170	G	26.7	Very low	24.8	Very low	82 Å²	82	156.5 Å²	156.5	85%	0.845	86%	0.857	S	S	*	*			trans	-173.4	118.5	173.1	0	0	0	0	0	112.2
171	R	22.3	Very low	25	Very low	232 Å²	232	152.5 Å²	152.5	88%	0.875	85%	0.851	S	S	*	*			trans	-91.3	160.6	-169.3	-154.5	-169.7	-149.4	160.7	5.7	110.4
172	I	24.8	Very low	25.4	Very low	145 Å²	145	152.9 Å²	152.9	74%	0.744	85%	0.849	S	S	*	*			trans	110.5	124.7	146.4	-62.6	158.3	0	0	0	119.5
173	S	24.9	Very low	25.6	Very low	101 Å²	101	152.7 Å²	152.7	71%	0.706	84%	0.841	S	S	*	*			trans	59.5	106.2	149.8	-80.4	0	0	0	0	123.7
174	K	26.6	Very low	25.6	Very low	203 Å²	203	155.6 Å²	155.6	88%	0.883	85%	0.846	S	S	*	*				22.6	110.2	113.8	-64.9	-177.3	179.1	177.5	0	116.8
175	K	29.3	Very low	25.8	Very low	212 Å²	212	152.6 Å²	152.6	92%	0.922	84%	0.844	S	S	*	*			trans	-139	121.4	146.7	-122.9	175.8	-177.6	177.6	0	109.7
176	L	25.2	Very low	26.2	Very low	187 Å²	187	145.3 Å²	145.3	98%	0.979	83%	0.832	S	S	*	*			trans	-65.6	124.8	174.9	-75.2	129.6	0	0	0	109.7
177	G	28.3	Very low	26.3	Very low	76 Å²	76	146.4 Å²	146.4	78%	0.784	83%	0.833	S	S	*	*			trans	-121.4	123.4	177.8	0	0	0	0	0	111.1
178	R	24.9	Very low	26.6	Very low	241 Å²	241	140.2 Å²	140.2	91%	0.909	82%	0.823	S	S	*	*			trans	-59.6	139.6	-173.2	-168.9	168.2	177.2	157.2	-3.6	113.2	S180	R178-S180 PolarHBondContact O-N 3.33Å
179	A	26	Very low	26.6	Very low	102 Å²	102	143.6 Å²	143.6	84%	0.843	82%	0.823	S	S	*	*			trans	-68.2	114.5	-178.5	0	0	0	0	0	112.3
180	S	29	Very low	26.7	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	83%	0.825	S	S	*	*			trans	-90.8	127.4	170.2	-47.2	0	0	0	0	109.9	R178 V182	R178-S180 PolarHBondContact O-N 3.33Å; S180-V182 PolarHBondContact O-N 3.12Å
181	S	25.5	Very low	26.7	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	82%	0.822	S	S	*	*			trans	-50.2	120.5	173.5	49.2	0	0	0	0	112.7
182	V	30.4	Very low	27.1	Very low	137 Å²	137	143.7 Å²	143.7	83%	0.83	82%	0.817	S	S	*	*			trans	-96.9	106.8	170.2	178.8	0	0	0	0	108.9	S180	S180-V182 PolarHBondContact O-N 3.12Å
183	S	26.9	Very low	27.4	Very low	97 Å²	97	143.3 Å²	143.3	68%	0.678	82%	0.822	S	S	*	*			trans	-64.4	129.8	175.5	-39.3	0	0	0	0	111.1	T185	S183-T185 PolarHBondContact O-N 3.08Å
184	H	26.9	Very low	27.7	Very low	197 Å²	197	146.5 Å²	146.5	91%	0.912	82%	0.823	S	S	*	*			trans	-62.7	110.4	176.2	-75.7	-80.8	0	0	0	112
185	T	28.4	Very low	27.8	Very low	139 Å²	139	145.1 Å²	145.1	85%	0.853	82%	0.82	S	S	*	*			trans	-95.7	117.1	167.6	51.5	0	0	0	0	111.2	S183	S183-T185 PolarHBondContact O-N 3.08Å
186	G	27.7	Very low	27.8	Very low	67 Å²	67	141.7 Å²	141.7	69%	0.691	81%	0.807	S	S	*	*			trans	56.7	80.6	140.7	0	0	0	0	0	118.7	V188	G186-V188 PolarHBondContact O-N 2.98Å
187	A	27.8	Very low	28	Very low	102 Å²	102	140.9 Å²	140.9	84%	0.843	80%	0.803	S	S	*	*			trans	-65.7	99.5	161.6	0	0	0	0	0	110.7	R189	A187-R189 PolarHBondContact O-N 3.04Å; A187-R189 VanDerWaalsContact O-N 3.14Å
188	V	28.3	Very low	28	Very low	122 Å²	122	149.2 Å²	149.2	74%	0.739	81%	0.81	S	S	*	*			trans	-61.3	111.1	171.5	174.6	0	0	0	0	109.5	G186 R190	G186-V188 PolarHBondContact O-N 2.98Å; V188-R190 PolarHBondContact O-N 2.91Å
189	R	24.6	Very low	28.1	Very low	234 Å²	234	143.6 Å²	143.6	88%	0.883	81%	0.807	S	S	*	*			trans	-61.9	96.5	173.6	-69.4	179.6	-174.6	-174.7	2	109.9	A187 S191	A187-R189 PolarHBondContact O-N 3.04Å; A187-R189 VanDerWaalsContact O-N 3.14Å; R189-S191 PolarHBondContact O-N 2.84Å
190	R	25.7	Very low	28.2	Very low	231 Å²	231	143.3 Å²	143.3	87%	0.872	80%	0.804	S	S	*	*			trans	-86.3	100	165.9	-74.6	-174.4	-178.8	-177.4	1.1	109.5	V188 A192	V188-R190 PolarHBondContact O-N 2.91Å; R190-A192 VanDerWaalsContact C-N 3.35Å; R190-A192 PolarHBondContact O-N 3.13Å
191	S	27.3	Very low	28.1	Very low	111 Å²	111	143.7 Å²	143.7	78%	0.776	81%	0.807	S	S	*	*			trans	-62.2	88.2	171.1	-51.2	0	0	0	0	110.3	R189 T193	R189-S191 PolarHBondContact O-N 2.84Å; S191-T193 PolarHBondContact O-N 3.01Å
192	A	29.8	Very low	28.2	Very low	94 Å²	94	144.5 Å²	144.5	78%	0.777	81%	0.807	S	S	*	*			trans	-77.4	102.3	173.7	0	0	0	0	0	109.6	R190 K194	R190-A192 VanDerWaalsContact C-N 3.35Å; R190-A192 PolarHBondContact O-N 3.13Å; A192-K194 PolarHBondContact O-N 3.16Å; A192-K194 VanDerWaalsContact O-N 3.12Å
193	T	31.3	Very low	28	Very low	137 Å²	137	146.3 Å²	146.3	84%	0.84	81%	0.806	S	S	*	*			trans	-58.1	107.6	169.2	44.2	0	0	0	0	110.1	S191 Q195	S191-T193 PolarHBondContact O-N 3.01Å; T193-Q195 PolarHBondContact O-N 3.49Å
194	K	32	Very low	27.9	Very low	169 Å²	169	150.2 Å²	150.2	74%	0.735	81%	0.811	S	S	*	*			trans	-75.9	106.7	177.9	-166.2	-173.1	-177.8	-154.5	0	109	A192 E196	A192-K194 PolarHBondContact O-N 3.16Å; A192-K194 VanDerWaalsContact O-N 3.12Å; K194-E196 HydrophobicContact CD-CG 4.11Å; K194-E196 WeakPolarHBondContact CE-OE1 3.35Å; K194-E196 HydrophobicContact CG-CG 4.11Å; K194-E196 IonicContact NZ-OE1 3.93Å; K194-E196 PolarHBondContact NZ-OE1 2.74Å; K194-E196 PolarHBondContact O-N 3.21Å
195	Q	27.7	Very low	27.7	Very low	174 Å²	174	150.2 Å²	150.2	81%	0.813	81%	0.809	S	S	*	*			trans	-84	96.7	170.4	-159.1	167.6	-0.2	0	0	107.2	T193 L197	T193-Q195 PolarHBondContact O-N 3.49Å; Q195-L197 PolarHBondContact O-N 3.47Å
196	E	30.6	Very low	27.6	Very low	140 Å²	140	150 Å²	150	65%	0.654	80%	0.801	S	S	*	*			trans	-73.9	115.2	178.7	-70.2	-171	156.1	0	0	110.3	K194 R198	K194-E196 HydrophobicContact CD-CG 4.11Å; K194-E196 WeakPolarHBondContact CE-OE1 3.35Å; K194-E196 HydrophobicContact CG-CG 4.11Å; K194-E196 IonicContact NZ-OE1 3.93Å; K194-E196 PolarHBondContact NZ-OE1 2.74Å; K194-E196 PolarHBondContact O-N 3.21Å; E196-R198 PolarHBondContact O-N 2.95Å
197	L	29.7	Very low	27.4	Very low	170 Å²	170	152.8 Å²	152.8	89%	0.89	80%	0.804	S	S	*	*			trans	-62.8	115.5	168.3	-74.2	151.2	0	0	0	108.5	Q195 C199	Q195-L197 PolarHBondContact O-N 3.47Å; L197-C199 PolarHBondContact O-N 2.94Å; L197-C199 VanDerWaalsContact O-N 3.12Å
198	R	27.7	Very low	27.1	Very low	251 Å²	251	158.7 Å²	158.7	95%	0.947	80%	0.804	S	S	*	*			trans	-68.6	100.7	173.7	-76.2	179.4	172	-173.7	-4.7	109.2	E196	E196-R198 PolarHBondContact O-N 2.95Å
199	C	27.3	Very low	26.8	Very low	123 Å²	123	164.6 Å²	164.6	83%	0.831	81%	0.814	S	S	*	*			trans	-71.5	136	155.4	-80.5	0	0	0	0	108.8	L197	L197-C199 PolarHBondContact O-N 2.94Å; L197-C199 VanDerWaalsContact O-N 3.12Å
200	A	28.5	Very low	26.8	Very low	96 Å²	96	158.7 Å²	158.7	79%	0.793	81%	0.808	S	S	*	*			trans	-54.4	147	-179.3	0	0	0	0	0	112.3	V202	A200-V202 PolarHBondContact O-N 2.96Å
201	S	26.2	Very low	26.7	Very low	115 Å²	115	159.3 Å²	159.3	80%	0.804	81%	0.81	S	S	*	*			trans	-41.2	112.6	-171.4	-56.7	0	0	0	0	115.2
202	V	27.8	Very low	26.6	Very low	128 Å²	128	162 Å²	162	78%	0.776	81%	0.811	S	S	*	*			trans	-108	121.6	145	179.1	0	0	0	0	105	A200 K204	A200-V202 PolarHBondContact O-N 2.96Å; V202-K204 PolarHBondContact O-N 3.05Å
203	Q	25.5	Very low	26.3	Very low	175 Å²	175	165.2 Å²	165.2	82%	0.818	82%	0.815	S	S	*	*			trans	-49.4	110.8	-176.4	-132.1	96.1	-15	0	0	109.6	F205	Q203-F205 PolarHBondContact O-N 3.23Å
204	K	26.2	Very low	26.2	Very low	180 Å²	180	166.4 Å²	166.4	78%	0.783	82%	0.815	S	S	*	*			trans	-82.8	100.2	179	-70.6	177.9	179.4	176	0	109	V202 I206	V202-K204 PolarHBondContact O-N 3.05Å; K204-I206 HydrophobicContact CB-CD1 4.46Å; K204-I206 HydrophobicContact CB-CG1 4.21Å; K204-I206 PolarHBondContact O-N 3.48Å
205	F	22.5	Very low	25.9	Very low	197 Å²	197	163 Å²	163	86%	0.864	81%	0.813	S	S	*	*			trans	-79.2	102.7	159.3	-114.8	-94.6	0	0	0	108.1	Q203 V207	Q203-F205 PolarHBondContact O-N 3.23Å; F205-V207 HydrophobicContact CD1-CG2 4.19Å
206	I	24.8	Very low	25.9	Very low	135 Å²	135	160.3 Å²	160.3	69%	0.692	81%	0.813	S	S	*	*			trans	-98.8	98.8	174.4	-61.7	173.4	0	0	0	106.9	K204	K204-I206 HydrophobicContact CB-CD1 4.46Å; K204-I206 HydrophobicContact CB-CG1 4.21Å; K204-I206 PolarHBondContact O-N 3.48Å
207	V	24	Very low	25.9	Very low	124 Å²	124	163 Å²	163	75%	0.752	82%	0.823	S	S	*	*			trans	-94.2	128.8	168.8	-179.1	0	0	0	0	109	F205	F205-V207 HydrophobicContact CD1-CG2 4.19Å
208	R	20.9	Very low	25.8	Very low	226 Å²	226	159.5 Å²	159.5	85%	0.853	81%	0.812	S	S	*	*			trans	-76.6	145.4	-174.6	-79.1	179.5	161	98.7	-5.7	111.2	S210	R208-S210 PolarHBondContact O-N 3.5Å
209	R	23.1	Very low	26.2	Very low	247 Å²	247	153.1 Å²	153.1	93%	0.932	80%	0.804	S	S	*	*			trans	-72.7	113.7	179	-144	178.8	-170	-177.7	-1.1	109.9
210	S	23.8	Very low	26.5	Very low	110 Å²	110	155.2 Å²	155.2	77%	0.769	80%	0.801	S	S	*	*			trans	-73.1	126.7	162.6	-69.6	0	0	0	0	108.8	R208 E212	R208-S210 PolarHBondContact O-N 3.5Å; S210-E212 PolarHBondContact O-N 3.45Å
211	R	23.2	Very low	26.6	Very low	243 Å²	243	156.2 Å²	156.2	92%	0.917	79%	0.793	S	S	*	*			trans	-69.2	109.8	173.1	-91.2	173.2	164.7	164.3	-7.1	107.7
212	E	25	Very low	27.1	Very low	169 Å²	169	153.6 Å²	153.6	79%	0.79	78%	0.775	S	S	*	*			trans	-99.1	124	160.1	-74.6	-179.5	176.5	0	0	108.9	S210 L214	S210-E212 PolarHBondContact O-N 3.45Å; E212-L214 PolarHBondContact O-N 3.19Å
213	N	25	Very low	27.6	Very low	161 Å²	161	150.2 Å²	150.2	86%	0.861	76%	0.761	S	S	*	*			trans	-63.4	96.1	179.3	-73.3	-31.1	0	0	0	109.5	S215	N213-S215 PolarHBondContact O-N 3.36Å
214	L	28.8	Very low	28.5	Very low	161 Å²	161	149.3 Å²	149.3	84%	0.843	76%	0.756	S	S	*	*			trans	-77.5	104.1	167.8	-104.2	76.7	0	0	0	109.4	E212	E212-L214 PolarHBondContact O-N 3.19Å
215	S	26.4	Very low	29.4	Very low	99 Å²	99	150.7 Å²	150.7	69%	0.692	76%	0.756	S	S	*	*			trans	-49.3	135.6	162	177.6	0	0	0	0	110.6	N213 K217	N213-S215 PolarHBondContact O-N 3.36Å; S215-K217 PolarHBondContact O-N 3.43Å
216	S	27.9	Very low	30.6	Very low	117 Å²	117	142.6 Å²	142.6	82%	0.818	72%	0.722	S	S	*	*			trans	-59.7	97.3	-177.8	50.3	0	0	0	0	112.1
217	K	28.8	Very low	31.8	Very low	196 Å²	196	137.5 Å²	137.5	85%	0.852	70%	0.703	S	S	*	*			trans	-126.9	131.3	156.3	-71.9	-172.6	177.9	179.6	0	109.4	S215	S215-K217 PolarHBondContact O-N 3.43Å
218	S	27.8	Very low	33.3	Very low	96 Å²	96	137.4 Å²	137.4	67%	0.671	70%	0.703	S	S	*	*			trans	-58.7	150.9	-166.6	40.5	0	0	0	0	114.7	Q220	S218-Q220 VanDerWaalsContact C-N 3.28Å; S218-Q220 PolarHBondContact O-N 3.47Å
219	P	36.5	Very low	35.5	Very low	118 Å²	118	130 Å²	130	77%	0.766	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	9.8	-160.3	-10.3	27.9	0	0	0	116.2
220	Q	32.8	Very low	38.3	Very low	166 Å²	166	119.8 Å²	119.8	78%	0.776	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-21.8	-169.3	-69.2	-178.2	-5	0	0	113.8	S218	S218-Q220 VanDerWaalsContact C-N 3.28Å; S218-Q220 PolarHBondContact O-N 3.47Å
221	N	30.9	Very low	41.3	Very low	117 Å²	117	114.6 Å²	114.6	63%	0.626	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-13.7	-173.1	-72.9	-5.8	0	0	0	115.4	A223	N221-A223 VanDerWaalsContact C-N 3.34Å; N221-A223 PolarHBondContact O-N 3.19Å
222	S	37.3	Very low	44.2	Very low	61 Å²	61	103.2 Å²	103.2	43%	0.427	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.7	-24.9	-174.5	58.9	0	0	0	0	114	L226	S222-L226 WeakPolarHBondContact O-CD1 3.1Å
223	A	39.2	Very low	46.9	Very low	57 Å²	57	97 Å²	97	47%	0.471	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-34.2	-177.2	0	0	0	0	0	112.7	N221 L226	N221-A223 VanDerWaalsContact C-N 3.34Å; N221-A223 PolarHBondContact O-N 3.19Å; A223-L226 PolarHBondContact O-N 3.11Å
224	Q	43.6	Very low	49.6	Very low	156 Å²	156	89.4 Å²	89.4	73%	0.729	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-69.8	-38.1	-178.8	-82.8	173.2	-33.3	0	0	112.6	L226 G227	Q224-L226 PolarHBondContact O-N 3.02Å; Q224-G227 PolarHBondContact O-N 3.32Å
225	R	44.6	Very low	52.1	Low	208 Å²	208	85.2 Å²	85.2	79%	0.785	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-67.6	-18	178.4	-73.2	-168.4	-176.4	-158	0	114.5	G227 T228	R225-G227 VanDerWaalsContact C-N 3.33Å; R225-T228 PolarHBondContact O-OG1 3.21Å
226	L	49.2	Very low	54.9	Low	27 Å²	27	82 Å²	82	14%	0.141	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-80.7	-14	178.8	-76.6	153	0	0	0	113.1	S222 A223 Q224 T228 I229 R234 N237 V267	S222-L226 WeakPolarHBondContact O-CD1 3.1Å; A223-L226 PolarHBondContact O-N 3.11Å; Q224-L226 PolarHBondContact O-N 3.02Å; L226-T228 VanDerWaalsContact C-N 3.29Å; L226-T228 PolarHBondContact O-N 3.3Å; L226-I229 HydrophobicContact CD2-CD1 3.97Å; L226-R234 WeakPolarHBondContact O-CD 3.27Å; L226-R234 PolarHBondContact O-NH1 3.4Å; L226-N237 HydrophobicContact CD1-CB 4.02Å; L226-V267 HydrophobicContact CD1-CG2 4.06Å
227	G	48.7	Very low	57.7	Low	29 Å²	29	78.5 Å²	78.5	30%	0.299	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-29.1	-179.3	0	0	0	0	0	113.5	Q224 R225	Q224-G227 PolarHBondContact O-N 3.32Å; R225-G227 VanDerWaalsContact C-N 3.33Å
228	T	55.1	Low	60.7	Low	122 Å²	122	70.3 Å²	70.3	75%	0.748	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.6	-176.4	50.4	0	0	0	0	114.2	R225 L226	R225-T228 PolarHBondContact O-OG1 3.21Å; L226-T228 VanDerWaalsContact C-N 3.29Å; L226-T228 PolarHBondContact O-N 3.3Å
229	I	67.7	Low	63.7	Low	69 Å²	69	68.2 Å²	68.2	35%	0.354	37%	0.372	S	S	.	.	S	Bend	trans	-83.4	137	-177.7	-53.6	-179.2	0	0	0	110.3	L226 R231 R234	L226-I229 HydrophobicContact CD2-CD1 3.97Å; I229-R231 PolarHBondContact O-N 2.87Å; I229-R234 HydrophobicContact CB-CG 4.25Å; I229-R234 HydrophobicContact CG2-CB 4.32Å; I229-R234 HydrophobicContact CG2-CG 4.22Å
230	N	83.1	Confident	66.3	Low	34 Å²	34	65.8 Å²	65.8	18%	0.182	36%	0.358	C	S	.	.			trans	-46.7	113.5	171.7	-172.6	-31.4	0	0	0	111.3	L232 N233 R234 F355 P356 L541	N230-L232 PolarHBondContact O-N 3.03Å; N230-L232 VanDerWaalsContact O-N 3.17Å; N230-L232 WeakPolarHBondContact OD1-CB 3.31Å; N230-L232 PolarHBondContact OD1-N 3.39Å; N230-N233 PolarHBondContact O-N 2.86Å; N230-R234 PolarHBondContact O-N 2.95Å; N230-F355 WeakPolarHBondContact CA-O 3.45Å; N230-P356 WeakPolarHBondContact OD1-CD 3.42Å; N230-L541 PolarHBondContact ND2-O 2.93Å
231	R	85.6	Confident	69	Low	1 Å²	1	64.5 Å²	64.5	0%	0.004	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.6	-174.3	-71.1	173.7	72.9	-133.9	13.5	114.3	I229 N233 T283 P351 Q354 F355 V358	I229-R231 PolarHBondContact O-N 2.87Å; R231-N233 VanDerWaalsContact C-N 3.29Å; R231-T283 WeakPolarHBondContact O-CG2 3.06Å; R231-T283 PolarHBondContact O-OG1 3.06Å; R231-P351 VanDerWaalsContact CZ-CG 3.46Å; R231-Q354 VanDerWaalsContact CD-CB 3.47Å; R231-Q354 HydrophobicContact CG-CB 4.23Å; R231-F355 WeakPolarHBondContact CG-O 3.48Å; R231-F355 PolarHBondContact N-O 3.34Å; R231-V358 PolarHBondContact NH1-O 3.01Å
232	L	85.1	Confident	71.8	Confident	3 Å²	3	63 Å²	63	2%	0.016	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-36.3	178.7	-59	-178.7	0	0	0	110.7	N230 T283 P356 I363 F473 L541 Y558	N230-L232 PolarHBondContact O-N 3.03Å; N230-L232 VanDerWaalsContact O-N 3.17Å; N230-L232 WeakPolarHBondContact OD1-CB 3.31Å; N230-L232 PolarHBondContact OD1-N 3.39Å; L232-T283 VanDerWaalsContact O-CB 3.22Å; L232-T283 WeakPolarHBondContact O-CB 3.33Å; L232-T283 VanDerWaalsContact O-CG2 3.29Å; L232-T283 WeakPolarHBondContact O-CG2 3.4Å; L232-T283 PolarHBondContact O-OG1 2.96Å; L232-P356 HydrophobicContact CD1-CG 3.8Å; L232-P356 HydrophobicContact CD2-CG 4.11Å; L232-P356 HydrophobicContact CG-CG 3.64Å; L232-I363 HydrophobicContact CD2-CD1 3.97Å; L232-I363 HydrophobicContact CD2-CG1 3.87Å; L232-I363 HydrophobicContact CD2-CG2 4.29Å; L232-F473 HydrophobicContact CD1-CD2 3.69Å; L232-F473 HydrophobicContact CD1-CE2 4Å; L232-F473 HydrophobicContact CD1-CG 4.49Å; L232-F473 HydrophobicContact CD2-CD2 3.88Å; L232-F473 HydrophobicContact CD2-CE1 4.41Å; L232-F473 HydrophobicContact CD2-CE2 3.69Å; L232-F473 HydrophobicContact CD2-CG 4.32Å; L232-F473 HydrophobicContact CD2-CZ 3.97Å; L232-F473 HydrophobicContact CG-CD2 4.42Å; L232-F473 HydrophobicContact CG-CE2 4.37Å; L232-L541 HydrophobicContact CD1-CB 4.48Å; L232-L541 HydrophobicContact CD1-CD1 4.21Å; L232-L541 HydrophobicContact CD1-CD2 4.35Å; L232-Y558 HydrophobicContact CB-CD1 4.22Å; L232-Y558 HydrophobicContact CD1-CD1 3.64Å; L232-Y558 HydrophobicContact CD1-CE1 3.95Å
233	N	80.2	Confident	74.1	Confident	38 Å²	38	60.2 Å²	60.2	20%	0.203	32%	0.321	C	S	.	.	S	Bend	trans	-116.7	18.1	-176.1	-65.1	-26.7	0	0	0	113.5	N230 R231 P235 L562	N230-N233 PolarHBondContact O-N 2.86Å; R231-N233 VanDerWaalsContact C-N 3.29Å; N233-P235 WeakPolarHBondContact O-CD 3.34Å; N233-L562 HydrophobicContact CB-CD1 4.46Å; N233-L562 HydrophobicContact CB-CD2 3.88Å; N233-L562 WeakPolarHBondContact O-CD1 3.14Å
234	R	82.5	Confident	76.3	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.011	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-74.3	122.4	-174.4	-171.1	170.3	64.6	-167.1	-2.3	111.9	L226 I229 N230 T283 C284	L226-R234 WeakPolarHBondContact O-CD 3.27Å; L226-R234 PolarHBondContact O-NH1 3.4Å; I229-R234 HydrophobicContact CB-CG 4.25Å; I229-R234 HydrophobicContact CG2-CB 4.32Å; I229-R234 HydrophobicContact CG2-CG 4.22Å; N230-R234 PolarHBondContact O-N 2.95Å; R234-T283 PolarHBondContact N-OG1 2.75Å; R234-T283 PolarHBondContact O-OG1 2.73Å; R234-C284 HydrophobicContact CB-CB 4.4Å; R234-C284 HydrophobicContact CG-CB 4.34Å; R234-C284 VanDerWaalsContact CZ-O 3.29Å; R234-C284 PolarHBondContact NE-O 3.41Å; R234-C284 PolarHBondContact NH2-O 3.34Å; R234-C284 WeakPolarHBondContact O-CB 3.29Å; R234-C284 PolarHBondContact O-N 2.98Å
235	P	81.4	Confident	78.1	Confident	73 Å²	73	66.3 Å²	66.3	47%	0.474	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-69.8	155.2	176.6	29.4	-35.3	0	0	0	111.9	N233 C284	N233-P235 WeakPolarHBondContact O-CD 3.34Å; P235-C284 WeakPolarHBondContact O-CB 3.48Å
236	H	84.8	Confident	79.8	Confident	31 Å²	31	62.7 Å²	62.7	14%	0.144	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-80.3	134.3	175.9	-72.1	-91.4	0	0	0	112.2	F238 C265 C268 Q282 T283 C284	H236-F238 HydrophobicContact CB-CD2 3.56Å; H236-F238 HydrophobicContact CB-CE1 4.35Å; H236-F238 HydrophobicContact CB-CE2 3.24Å; H236-F238 HydrophobicContact CB-CG 4.25Å; H236-F238 HydrophobicContact CB-CZ 3.66Å; H236-F238 AromaticContact CG-CE2 3.7Å; H236-F238 AromaticContact CG-CZ 3.72Å; H236-F238 AromaticContact ND1-CZ 3.97Å; H236-F238 PolarHBondContact O-N 3.32Å; H236-C265 HydrophobicContact CB-CB 4.29Å; H236-C265 PolarHBondContact ND1-SG 2.83Å; H236-C265 VanDerWaalsContact ND1-SG 3.36Å; H236-C268 PolarHBondContact CE1-SG 2.82Å; H236-C268 PolarHBondContact ND1-SG 3.06Å; H236-Q282 PolarHBondContact CD2-O 2.95Å; H236-Q282 PolarHBondContact NE2-O 3.42Å; H236-T283 PolarHBondContact NE2-O 2.99Å; H236-C284 HydrophobicContact CB-CB 4.44Å
237	N	87.5	Confident	81.4	Confident	44 Å²	44	64.1 Å²	64.1	24%	0.235	33%	0.334	C	S	.	.			trans	-89.9	82.5	169.5	-172.9	-3.6	0	0	0	110.8	L226 C265 L266	L226-N237 HydrophobicContact CD1-CB 4.02Å; N237-C265 CarbonylContact O-C 3.58Å; N237-C265 VanDerWaalsContact O-CA 3.32Å; N237-C265 WeakPolarHBondContact O-CA 3.31Å; N237-L266 PolarHBondContact O-N 3.43Å
238	F	91.3	Very high	83.1	Confident	23 Å²	23	67 Å²	67	10%	0.101	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	124.9	-177.1	-78.9	-60.8	0	0	0	113.5	H236 Y263 C265 L270 V272 R277 L280	H236-F238 HydrophobicContact CB-CD2 3.56Å; H236-F238 HydrophobicContact CB-CE1 4.35Å; H236-F238 HydrophobicContact CB-CE2 3.24Å; H236-F238 HydrophobicContact CB-CG 4.25Å; H236-F238 HydrophobicContact CB-CZ 3.66Å; H236-F238 AromaticContact CG-CE2 3.7Å; H236-F238 AromaticContact CG-CZ 3.72Å; H236-F238 AromaticContact ND1-CZ 3.97Å; H236-F238 PolarHBondContact O-N 3.32Å; F238-Y263 HydrophobicContact CB-CD1 3.92Å; F238-Y263 HydrophobicContact CB-CG 4.23Å; F238-C265 HydrophobicContact CD1-CB 3.96Å; F238-C265 HydrophobicContact CE1-CB 3.75Å; F238-C265 HydrophobicContact CZ-CB 4.39Å; F238-L270 HydrophobicContact CE1-CD2 4.27Å; F238-L270 HydrophobicContact CZ-CD2 4.17Å; F238-V272 HydrophobicContact CD1-CG2 4.45Å; F238-V272 HydrophobicContact CE1-CG2 3.91Å; F238-V272 HydrophobicContact CZ-CG2 4.02Å; F238-R277 HydrophobicContact CD2-CG 3.92Å; F238-R277 HydrophobicContact CE2-CG 4.17Å; F238-L280 HydrophobicContact CE2-CD2 4.04Å; F238-L280 HydrophobicContact CZ-CD2 3.59Å
239	V	91	Very high	84.6	Confident	53 Å²	53	61.2 Å²	61.2	32%	0.321	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.6	170.1	176.7	0	0	0	0	109.9	K264 L266	V239-K264 PolarHBondContact N-O 3.14Å; V239-K264 PolarHBondContact O-N 3.02Å; V239-L266 HydrophobicContact CB-CD2 4.19Å; V239-L266 HydrophobicContact CB-CG 4.38Å; V239-L266 HydrophobicContact CG2-CD1 3.63Å; V239-L266 HydrophobicContact CG2-CD2 3.87Å; V239-L266 HydrophobicContact CG2-CG 3.65Å
240	S	91.5	Very high	85.3	Confident	66 Å²	66	59 Å²	59	46%	0.462	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.4	176.3	-170.1	0	0	0	0	110.4	S262	S240-S262 CarbonylContact C-O 3.57Å; S240-S262 VanDerWaalsContact CA-O 3.29Å; S240-S262 WeakPolarHBondContact CA-O 3.35Å; S240-S262 PolarHBondContact OG-O 3.38Å
241	R	89.1	Confident	85.2	Confident	139 Å²	139	58.6 Å²	58.6	53%	0.525	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154.5	176	-67.5	-164.5	173.8	-167.6	-0.6	110.7	A261 S262	R241-A261 CarbonylContact O-C 3.59Å; R241-A261 WeakPolarHBondContact O-CA 3.39Å; R241-S262 PolarHBondContact N-O 3.29Å; R241-S262 PolarHBondContact O-N 3.49Å; R241-S262 PolarHBondContact O-OG 2.87Å
242	T	89.4	Confident	85	Confident	87 Å²	87	60.7 Å²	60.7	53%	0.534	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	133.3	168.2	50.6	0	0	0	0	109.8	L244	T242-L244 PolarHBondContact O-N 2.69Å
243	V	85.4	Confident	84.8	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	32%	0.315	C	S	.	.			trans	-74.8	107.4	178.8	176.3	0	0	0	0	110.2	R245 E247 I256 G259 K260 S262	V243-R245 WeakPolarHBondContact CG1-O 3.28Å; V243-E247 HydrophobicContact CG1-CB 4.47Å; V243-I256 HydrophobicContact CB-CG2 4.37Å; V243-I256 HydrophobicContact CG2-CB 4.07Å; V243-I256 HydrophobicContact CG2-CG2 3.58Å; V243-G259 PolarHBondContact O-N 2.84Å; V243-K260 PolarHBondContact N-O 3.18Å; V243-S262 VanDerWaalsContact CG2-OG 3.24Å; V243-S262 WeakPolarHBondContact CG2-OG 3.3Å
244	L	84.8	Confident	85	Confident	133 Å²	133	68.1 Å²	68.1	70%	0.696	34%	0.34	S	S	*	.			trans	-95.6	-8.7	179	-59.6	179.1	0	0	0	113.5	T242 F258	T242-L244 PolarHBondContact O-N 2.69Å; L244-F258 VanDerWaalsContact O-CE2 3.24Å; L244-F258 WeakPolarHBondContact O-CE2 3.22Å
245	R	82.8	Confident	85.1	Confident	207 Å²	207	73.7 Å²	73.7	78%	0.781	36%	0.361	S	S	*	.	S	Bend	trans	-139.7	153	177.3	-158.3	177.6	-178.3	96.3	-0.9	108.7	V243 E247	V243-R245 WeakPolarHBondContact CG1-O 3.28Å; R245-E247 PolarHBondContact O-N 3.04Å
246	M	79.4	Confident	85.4	Confident	133 Å²	133	70.2 Å²	70.2	66%	0.655	34%	0.339	S	S	*	.			trans	-59.2	112.9	178.8	-179.3	159.3	72.5	0	0	110.8	R255	M246-R255 HydrophobicContact CG-CG 4.34Å; M246-R255 VanDerWaalsContact CG-NE 3.25Å; M246-R255 PolarHBondContact SD-NE 2.86Å; M246-R255 PolarHBondContact SD-NH2 2.81Å
247	E	83.5	Confident	85.5	Confident	57 Å²	57	72.4 Å²	72.4	27%	0.266	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	150.1	176.8	-69.7	-177.2	155.3	0	0	109.7	V243 R245 I256 K264 V271	V243-E247 HydrophobicContact CG1-CB 4.47Å; R245-E247 PolarHBondContact O-N 3.04Å; E247-I256 PolarHBondContact O-N 3.21Å; E247-K264 IonicContact OE1-NZ 3.26Å; E247-V271 WeakPolarHBondContact OE2-CG1 3.22Å; E247-V271 WeakPolarHBondContact OE2-CG2 3.41Å
248	L	84.1	Confident	85.6	Confident	89 Å²	89	76.8 Å²	76.8	47%	0.466	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140.3	172.9	-59.4	-179.6	0	0	0	109	S250 R255 L407	L248-S250 PolarHBondContact O-N 3.3Å; L248-R255 HydrophobicContact CD2-CB 4.14Å; L248-L407 HydrophobicContact CD1-CD1 3.95Å
249	C	87	Confident	85.4	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	39%	0.388	C	S	.	.			trans	-70.7	123	173.1	174.5	0	0	0	0	109.6	A251 C252 G253 R254 I256 V271 H273	C249-A251 PolarHBondContact O-N 3.33Å; C249-C252 VanDerWaalsContact SG-SG 3.7Å; C249-G253 WeakPolarHBondContact O-CA 3.26Å; C249-G253 PolarHBondContact O-N 3.42Å; C249-R254 WeakPolarHBondContact CB-O 3.43Å; C249-R254 PolarHBondContact N-O 2.95Å; C249-I256 HydrophobicContact CB-CD1 4.25Å; C249-I256 HydrophobicContact CB-CG1 4.04Å; C249-V271 WeakPolarHBondContact CA-O 3.27Å; C249-H273 WeakPolarHBondContact CB-CE1 3.47Å; C249-H273 WeakPolarHBondContact CB-ND1 3.46Å; C249-H273 PolarHBondContact SG-N 3.38Å; C249-H273 VanDerWaalsContact SG-N 3.37Å; C249-H273 PolarHBondContact SG-ND1 3.32Å
250	S	82.3	Confident	85.2	Confident	24 Å²	24	81.5 Å²	81.5	17%	0.168	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-14.1	-178.1	-54.3	0	0	0	0	114.2	L248 L270 V271 S404	L248-S250 PolarHBondContact O-N 3.3Å; S250-L270 WeakPolarHBondContact OG-CG 3.38Å; S250-V271 PolarHBondContact N-O 2.89Å; S250-V271 PolarHBondContact OG-O 3.23Å; S250-S404 PolarHBondContact O-OG 3.27Å
251	A	81.1	Confident	85.2	Confident	24 Å²	24	80.6 Å²	80.6	20%	0.198	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-42.3	177.9	0	0	0	0	0	112.7	C249 V272 C276 L280 A406	C249-A251 PolarHBondContact O-N 3.33Å; A251-V272 HydrophobicContact CB-CG1 3.94Å; A251-C276 HydrophobicContact CB-CB 3.72Å; A251-L280 HydrophobicContact CB-CD1 3.99Å; A251-A406 WeakPolarHBondContact O-CB 3.31Å
252	C	81.3	Confident	85.3	Confident	45 Å²	45	74.1 Å²	74.1	30%	0.304	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-1.2	-176.8	79.1	0	0	0	0	114	C249 R254 H273	C249-C252 VanDerWaalsContact SG-SG 3.7Å; C252-R254 PolarHBondContact O-N 2.86Å; C252-H273 VanDerWaalsContact SG-CE1 3.53Å; C252-H273 PolarHBondContact SG-ND1 3.3Å; C252-H273 VanDerWaalsContact SG-ND1 3.4Å
253	G	80.5	Confident	85.5	Confident	6 Å²	6	73 Å²	73	6%	0.062	36%	0.358	C	S	.	.			trans	70.2	-16.8	-178.1	0	0	0	0	0	116.2	C249	C249-G253 WeakPolarHBondContact O-CA 3.26Å; C249-G253 PolarHBondContact O-N 3.42Å
254	R	83.8	Confident	85.7	Confident	192 Å²	192	75.5 Å²	75.5	73%	0.725	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-72.8	151	-176.2	-59.7	175.8	-172.1	176.4	1.2	111.7	C249 C252 H273	C249-R254 WeakPolarHBondContact CB-O 3.43Å; C249-R254 PolarHBondContact N-O 2.95Å; C252-R254 PolarHBondContact O-N 2.86Å; R254-H273 PolarHBondContact O-CE1 3.37Å
255	R	86.3	Confident	85.8	Confident	119 Å²	119	69.2 Å²	69.2	45%	0.449	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	135.3	176.5	-169.8	178.5	-168.3	-99.8	-0.8	111.8	M246 L248 H273	M246-R255 HydrophobicContact CG-CG 4.34Å; M246-R255 VanDerWaalsContact CG-NE 3.25Å; M246-R255 PolarHBondContact SD-NE 2.86Å; M246-R255 PolarHBondContact SD-NH2 2.81Å; L248-R255 HydrophobicContact CD2-CB 4.14Å; R255-H273 PolarHBondContact O-NE2 3.26Å
256	I	86.7	Confident	85.9	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	123.4	166.6	-44.7	-180	0	0	0	107.8	V243 E247 C249 V271	V243-I256 HydrophobicContact CB-CG2 4.37Å; V243-I256 HydrophobicContact CG2-CB 4.07Å; V243-I256 HydrophobicContact CG2-CG2 3.58Å; E247-I256 PolarHBondContact O-N 3.21Å; C249-I256 HydrophobicContact CB-CD1 4.25Å; C249-I256 HydrophobicContact CB-CG1 4.04Å; I256-V271 HydrophobicContact CD1-CB 4.39Å; I256-V271 HydrophobicContact CD1-CG1 3.5Å
257	T	86.6	Confident	86	Confident	76 Å²	76	58.2 Å²	58.2	47%	0.466	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-67.5	138.2	-175.9	36.5	0	0	0	0	110.9	G259 K260	T257-G259 PolarHBondContact O-N 2.92Å; T257-K260 WeakPolarHBondContact O-CB 3.45Å; T257-K260 PolarHBondContact O-N 3.08Å; T257-K260 VanDerWaalsContact O-N 3.11Å; T257-K260 WeakPolarHBondContact OG1-CG 3.45Å
258	F	89.2	Confident	85.9	Confident	137 Å²	137	55.7 Å²	55.7	60%	0.601	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	137.8	180	179.3	-88.2	0	0	0	111	L244 K260	L244-F258 VanDerWaalsContact O-CE2 3.24Å; L244-F258 WeakPolarHBondContact O-CE2 3.22Å; F258-K260 PolarHBondContact O-N 3.28Å
259	G	86.9	Confident	85.9	Confident	44 Å²	44	59.9 Å²	59.9	45%	0.454	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-4.7	-178.3	0	0	0	0	0	115.1	V243 T257	V243-G259 PolarHBondContact O-N 2.84Å; T257-G259 PolarHBondContact O-N 2.92Å
260	K	88.6	Confident	85.8	Confident	131 Å²	131	60.7 Å²	60.7	57%	0.57	30%	0.299	S	S	*	.	S	Bend	trans	-82.2	156.7	171.6	-64.7	-55.7	-172.3	178.9	0	111.3	V243 T257 F258	V243-K260 PolarHBondContact N-O 3.18Å; T257-K260 WeakPolarHBondContact O-CB 3.45Å; T257-K260 PolarHBondContact O-N 3.08Å; T257-K260 VanDerWaalsContact O-N 3.11Å; T257-K260 WeakPolarHBondContact OG1-CG 3.45Å; F258-K260 PolarHBondContact O-N 3.28Å
261	A	89.8	Confident	86	Confident	47 Å²	47	60 Å²	60	39%	0.388	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	136.4	173.5	0	0	0	0	0	110.9	R241 P274	R241-A261 CarbonylContact O-C 3.59Å; R241-A261 WeakPolarHBondContact O-CA 3.39Å; A261-P274 HydrophobicContact CB-CG 4.45Å; A261-P274 VanDerWaalsContact O-CD 3.29Å; A261-P274 WeakPolarHBondContact O-CD 3.46Å; A261-P274 WeakPolarHBondContact O-CG 3.45Å
262	S	92.7	Very high	86.4	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	166.8	166.9	65.1	0	0	0	0	109.6	S240 R241 V243	S240-S262 CarbonylContact C-O 3.57Å; S240-S262 VanDerWaalsContact CA-O 3.29Å; S240-S262 WeakPolarHBondContact CA-O 3.35Å; S240-S262 PolarHBondContact OG-O 3.38Å; R241-S262 PolarHBondContact N-O 3.29Å; R241-S262 PolarHBondContact O-N 3.49Å; R241-S262 PolarHBondContact O-OG 2.87Å; V243-S262 VanDerWaalsContact CG2-OG 3.24Å; V243-S262 WeakPolarHBondContact CG2-OG 3.3Å
263	Y	92.3	Very high	86.9	Confident	63 Å²	63	58.6 Å²	58.6	25%	0.247	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.3	163.3	-78	-71.7	0	0	0	109.1	F238 V271 V272 P274 R277	F238-Y263 HydrophobicContact CB-CD1 3.92Å; F238-Y263 HydrophobicContact CB-CG 4.23Å; Y263-V271 CarbonylContact O-C 3.58Å; Y263-V271 VanDerWaalsContact O-CA 3.31Å; Y263-V271 WeakPolarHBondContact O-CA 3.28Å; Y263-V272 PolarHBondContact N-O 2.83Å; Y263-V272 PolarHBondContact O-N 3.16Å; Y263-P274 HydrophobicContact CD2-CB 4.33Å; Y263-P274 HydrophobicContact CE2-CB 4.04Å; Y263-P274 HydrophobicContact CE2-CG 4.49Å; Y263-R277 HydrophobicContact CD2-CB 4.2Å
264	K	90.1	Very high	87.4	Confident	55 Å²	55	61.3 Å²	61.3	24%	0.239	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	125.5	175	-178.2	163.9	-169.7	160.1	0	109.7	V239 E247 L270 V271	V239-K264 PolarHBondContact N-O 3.14Å; V239-K264 PolarHBondContact O-N 3.02Å; E247-K264 IonicContact OE1-NZ 3.26Å; K264-L270 CarbonylContact C-O 3.55Å; K264-L270 WeakPolarHBondContact CA-O 2.87Å; K264-V271 HydrophobicContact CB-CG2 4.23Å; K264-V271 HydrophobicContact CD-CG2 4.01Å; K264-V271 HydrophobicContact CG-CG2 3.95Å
265	C	87.2	Confident	87.6	Confident	1 Å²	1	56 Å²	56	1%	0.007	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	130.1	176.1	-176.8	0	0	0	0	109.5	H236 N237 F238 V267 C268 R269 L270 C284	H236-C265 HydrophobicContact CB-CB 4.29Å; H236-C265 PolarHBondContact ND1-SG 2.83Å; H236-C265 VanDerWaalsContact ND1-SG 3.36Å; N237-C265 CarbonylContact O-C 3.58Å; N237-C265 VanDerWaalsContact O-CA 3.32Å; N237-C265 WeakPolarHBondContact O-CA 3.31Å; F238-C265 HydrophobicContact CD1-CB 3.96Å; F238-C265 HydrophobicContact CE1-CB 3.75Å; F238-C265 HydrophobicContact CZ-CB 4.39Å; C265-V267 VanDerWaalsContact C-N 3.26Å; C265-V267 PolarHBondContact O-N 3.3Å; C265-C268 VanDerWaalsContact SG-SG 3.62Å; C265-R269 WeakPolarHBondContact O-CA 3.32Å; C265-R269 PolarHBondContact O-N 3.42Å; C265-L270 PolarHBondContact N-O 2.93Å; C265-C284 PolarHBondContact SG-SG 2.97Å
266	L	84.8	Confident	87.7	Confident	75 Å²	75	51 Å²	51	39%	0.393	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-26.3	179.7	-65.9	-176.9	0	0	0	113	N237 V239	N237-L266 PolarHBondContact O-N 3.43Å; V239-L266 HydrophobicContact CB-CD2 4.19Å; V239-L266 HydrophobicContact CB-CG 4.38Å; V239-L266 HydrophobicContact CG2-CD1 3.63Å; V239-L266 HydrophobicContact CG2-CD2 3.87Å; V239-L266 HydrophobicContact CG2-CG 3.65Å
267	V	80.7	Confident	87.5	Confident	34 Å²	34	56.1 Å²	56.1	21%	0.206	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-65.1	-174.1	178.1	0	0	0	0	110.7	L226 C265 P286	L226-V267 HydrophobicContact CD1-CG2 4.06Å; C265-V267 VanDerWaalsContact C-N 3.26Å; C265-V267 PolarHBondContact O-N 3.3Å; V267-P286 HydrophobicContact CG1-CG 3.97Å
268	C	81.5	Confident	87.2	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.034	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.4	-178.3	68.9	0	0	0	0	114.8	H236 C265 L270 C284 V285	H236-C268 PolarHBondContact CE1-SG 2.82Å; H236-C268 PolarHBondContact ND1-SG 3.06Å; C265-C268 VanDerWaalsContact SG-SG 3.62Å; C268-L270 PolarHBondContact O-N 3.04Å; C268-L270 VanDerWaalsContact O-N 3.12Å; C268-L270 WeakPolarHBondContact SG-CB 3.34Å; C268-C284 VanDerWaalsContact SG-SG 3.68Å; C268-V285 WeakPolarHBondContact CB-O 3.45Å
269	R	84.7	Confident	86.6	Confident	176 Å²	176	60 Å²	60	66%	0.664	31%	0.313	S	S	*	.			trans	64.4	8.6	-179.7	-53.5	-179.1	177.9	-170.1	-0.7	115.8	C265 V271	C265-R269 WeakPolarHBondContact O-CA 3.32Å; C265-R269 PolarHBondContact O-N 3.42Å; R269-V271 WeakPolarHBondContact O-CG2 3.45Å
270	L	84.2	Confident	86	Confident	18 Å²	18	59.3 Å²	59.3	9%	0.094	30%	0.299	C	S	.	.			trans	-59.9	138.8	175.5	-170.9	152.2	0	0	0	110.7	F238 S250 K264 C265 C268 V272 L280	F238-L270 HydrophobicContact CE1-CD2 4.27Å; F238-L270 HydrophobicContact CZ-CD2 4.17Å; S250-L270 WeakPolarHBondContact OG-CG 3.38Å; K264-L270 CarbonylContact C-O 3.55Å; K264-L270 WeakPolarHBondContact CA-O 2.87Å; C265-L270 PolarHBondContact N-O 2.93Å; C268-L270 PolarHBondContact O-N 3.04Å; C268-L270 VanDerWaalsContact O-N 3.12Å; C268-L270 WeakPolarHBondContact SG-CB 3.34Å; L270-V272 HydrophobicContact CD2-CG1 3.51Å; L270-L280 HydrophobicContact CD1-CD1 4.32Å; L270-L280 HydrophobicContact CD1-CD2 4.33Å; L270-L280 HydrophobicContact CD2-CD1 4.1Å; L270-L280 HydrophobicContact CD2-CD2 3.66Å
271	V	87.7	Confident	85.1	Confident	9 Å²	9	57 Å²	57	6%	0.055	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.3	-177.2	-168.3	0	0	0	0	110.6	E247 C249 S250 I256 Y263 K264 R269	E247-V271 WeakPolarHBondContact OE2-CG1 3.22Å; E247-V271 WeakPolarHBondContact OE2-CG2 3.41Å; C249-V271 WeakPolarHBondContact CA-O 3.27Å; S250-V271 PolarHBondContact N-O 2.89Å; S250-V271 PolarHBondContact OG-O 3.23Å; I256-V271 HydrophobicContact CD1-CB 4.39Å; I256-V271 HydrophobicContact CD1-CG1 3.5Å; Y263-V271 CarbonylContact O-C 3.58Å; Y263-V271 VanDerWaalsContact O-CA 3.31Å; Y263-V271 WeakPolarHBondContact O-CA 3.28Å; K264-V271 HydrophobicContact CB-CG2 4.23Å; K264-V271 HydrophobicContact CD-CG2 4.01Å; K264-V271 HydrophobicContact CG-CG2 3.95Å; R269-V271 WeakPolarHBondContact O-CG2 3.45Å
272	V	89.7	Confident	84.4	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	155.6	177.7	-65.6	0	0	0	0	112.3	F238 A251 Y263 L270 C276 R277 L280	F238-V272 HydrophobicContact CD1-CG2 4.45Å; F238-V272 HydrophobicContact CE1-CG2 3.91Å; F238-V272 HydrophobicContact CZ-CG2 4.02Å; A251-V272 HydrophobicContact CB-CG1 3.94Å; Y263-V272 PolarHBondContact N-O 2.83Å; Y263-V272 PolarHBondContact O-N 3.16Å; L270-V272 HydrophobicContact CD2-CG1 3.51Å; V272-C276 HydrophobicContact CB-CB 4.41Å; V272-R277 HydrophobicContact CG2-CB 4.1Å; V272-L280 HydrophobicContact CG1-CD1 4.23Å; V272-L280 HydrophobicContact CG1-CD2 4.34Å
273	H	92	Very high	83.9	Confident	40 Å²	40	55.7 Å²	55.7	19%	0.185	28%	0.278	C	S	.	.			trans	-63	152.8	165.4	-60.4	108.1	0	0	0	110.6	C249 C252 R254 R255 A275 C276 R277	C249-H273 WeakPolarHBondContact CB-CE1 3.47Å; C249-H273 WeakPolarHBondContact CB-ND1 3.46Å; C249-H273 PolarHBondContact SG-N 3.38Å; C249-H273 VanDerWaalsContact SG-N 3.37Å; C249-H273 PolarHBondContact SG-ND1 3.32Å; C252-H273 VanDerWaalsContact SG-CE1 3.53Å; C252-H273 PolarHBondContact SG-ND1 3.3Å; C252-H273 VanDerWaalsContact SG-ND1 3.4Å; R254-H273 PolarHBondContact O-CE1 3.37Å; R255-H273 PolarHBondContact O-NE2 3.26Å; H273-A275 PolarHBondContact O-N 2.66Å; H273-C276 HydrophobicContact CB-CB 4.14Å; H273-C276 PolarHBondContact O-N 3.23Å; H273-R277 PolarHBondContact O-N 3.41Å
274	P	89.9	Confident	83.4	Confident	63 Å²	63	52.7 Å²	52.7	41%	0.409	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-52.3	-40.6	172.9	-28.6	36.7	0	0	0	113.9	A261 Y263 C276	A261-P274 HydrophobicContact CB-CG 4.45Å; A261-P274 VanDerWaalsContact O-CD 3.29Å; A261-P274 WeakPolarHBondContact O-CD 3.46Å; A261-P274 WeakPolarHBondContact O-CG 3.45Å; Y263-P274 HydrophobicContact CD2-CB 4.33Å; Y263-P274 HydrophobicContact CE2-CB 4.04Å; Y263-P274 HydrophobicContact CE2-CG 4.49Å; P274-C276 VanDerWaalsContact C-N 3.34Å
275	A	88.6	Confident	83	Confident	81 Å²	81	50.1 Å²	50.1	67%	0.669	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-73.7	-22.6	177.8	0	0	0	0	0	113.6	H273	H273-A275 PolarHBondContact O-N 2.66Å
276	C	87.6	Confident	82.4	Confident	14 Å²	14	51 Å²	51	10%	0.095	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-93.6	-7.4	-177.8	-59.1	0	0	0	0	113.2	A251 V272 H273 P274 Q278 L279 L280	A251-C276 HydrophobicContact CB-CB 3.72Å; V272-C276 HydrophobicContact CB-CB 4.41Å; H273-C276 HydrophobicContact CB-CB 4.14Å; H273-C276 PolarHBondContact O-N 3.23Å; P274-C276 VanDerWaalsContact C-N 3.34Å; C276-Q278 VanDerWaalsContact C-N 3.25Å; C276-Q278 PolarHBondContact O-N 3.4Å; C276-L279 PolarHBondContact O-N 2.9Å; C276-L280 PolarHBondContact O-N 2.83Å
277	R	84.1	Confident	81.5	Confident	107 Å²	107	49.3 Å²	49.3	40%	0.404	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-55.8	-41.2	179.2	177.7	-179.9	169.2	177	-1.2	112.3	F238 Y263 V272 H273 L279	F238-R277 HydrophobicContact CD2-CG 3.92Å; F238-R277 HydrophobicContact CE2-CG 4.17Å; Y263-R277 HydrophobicContact CD2-CB 4.2Å; V272-R277 HydrophobicContact CG2-CB 4.1Å; H273-R277 PolarHBondContact O-N 3.41Å; R277-L279 VanDerWaalsContact C-N 3.3Å
278	Q	79.2	Confident	80.5	Confident	171 Å²	171	49.2 Å²	49.2	80%	0.799	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-79.2	-12.1	179.9	-68	174.7	-17.7	0	0	113.3	C276	C276-Q278 VanDerWaalsContact C-N 3.25Å; C276-Q278 PolarHBondContact O-N 3.4Å
279	L	76.1	Confident	79.3	Confident	125 Å²	125	52.6 Å²	52.6	65%	0.654	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-96	-0.6	179.5	-58.3	176.6	0	0	0	112.3	C276 R277 I281	C276-L279 PolarHBondContact O-N 2.9Å; R277-L279 VanDerWaalsContact C-N 3.3Å; L279-I281 PolarHBondContact O-N 3.46Å
280	L	74.2	Confident	77.3	Confident	28 Å²	28	48 Å²	48	15%	0.147	27%	0.268	C	S	.	.			trans	-82.2	107.9	-175.6	-173.3	73.9	0	0	0	110.2	F238 A251 L270 V272 C276 Q282	F238-L280 HydrophobicContact CE2-CD2 4.04Å; F238-L280 HydrophobicContact CZ-CD2 3.59Å; A251-L280 HydrophobicContact CB-CD1 3.99Å; L270-L280 HydrophobicContact CD1-CD1 4.32Å; L270-L280 HydrophobicContact CD1-CD2 4.33Å; L270-L280 HydrophobicContact CD2-CD1 4.1Å; L270-L280 HydrophobicContact CD2-CD2 3.66Å; V272-L280 HydrophobicContact CG1-CD1 4.23Å; V272-L280 HydrophobicContact CG1-CD2 4.34Å; C276-L280 PolarHBondContact O-N 2.83Å; L280-Q282 HydrophobicContact CD1-CB 4.07Å; L280-Q282 HydrophobicContact CD1-CG 4.37Å; L280-Q282 HydrophobicContact CG-CB 4.23Å
281	I	71.2	Confident	75	Confident	82 Å²	82	58 Å²	58	42%	0.421	30%	0.304	S	S	.	.			trans	-81.6	-24.7	177.4	-55	167.7	0	0	0	111.3	L279 T283 A371	L279-I281 PolarHBondContact O-N 3.46Å; I281-T283 PolarHBondContact O-N 3.43Å; I281-A371 HydrophobicContact CB-CB 4.37Å; I281-A371 HydrophobicContact CD1-CB 3.67Å; I281-A371 HydrophobicContact CG2-CB 3.84Å
282	Q	74.1	Confident	72.4	Confident	19 Å²	19	60.6 Å²	60.6	9%	0.089	33%	0.327	C	S	.	.			trans	-63.5	124.2	-177.2	-65.9	-66.5	-27.7	0	0	111	H236 L280 H364 E368	H236-Q282 PolarHBondContact CD2-O 2.95Å; H236-Q282 PolarHBondContact NE2-O 3.42Å; L280-Q282 HydrophobicContact CD1-CB 4.07Å; L280-Q282 HydrophobicContact CD1-CG 4.37Å; L280-Q282 HydrophobicContact CG-CB 4.23Å; Q282-H364 PolarHBondContact OE1-ND1 3.23Å; Q282-E368 PolarHBondContact NE2-OE2 3.36Å
283	T	81.4	Confident	69.4	Low	4 Å²	4	66.3 Å²	66.3	3%	0.025	36%	0.357	C	S	.	.			trans	-67.7	160.8	171.7	-164.2	0	0	0	0	112.2	R231 L232 R234 H236 I281 V285 I363 N367	R231-T283 WeakPolarHBondContact O-CG2 3.06Å; R231-T283 PolarHBondContact O-OG1 3.06Å; L232-T283 VanDerWaalsContact O-CB 3.22Å; L232-T283 WeakPolarHBondContact O-CB 3.33Å; L232-T283 VanDerWaalsContact O-CG2 3.29Å; L232-T283 WeakPolarHBondContact O-CG2 3.4Å; L232-T283 PolarHBondContact O-OG1 2.96Å; R234-T283 PolarHBondContact N-OG1 2.75Å; R234-T283 PolarHBondContact O-OG1 2.73Å; H236-T283 PolarHBondContact NE2-O 2.99Å; I281-T283 PolarHBondContact O-N 3.43Å; T283-V285 HydrophobicContact CG2-CG2 3.45Å; T283-V285 VanDerWaalsContact CG2-CG2 3.45Å; T283-V285 PolarHBondContact O-N 3.22Å; T283-V285 VanDerWaalsContact O-N 3.13Å; T283-I363 HydrophobicContact CG2-CG2 3.73Å; T283-N367 VanDerWaalsContact CG2-ND2 3.34Å; T283-N367 WeakPolarHBondContact CG2-ND2 3.39Å
284	C	82.8	Confident	66.4	Low	0 Å²	0	73.3 Å²	73.3	0%	0	39%	0.388	C	S	.	.			trans	-81.2	95.3	-176	-169.8	0	0	0	0	112.3	R234 P235 H236 C265 C268	R234-C284 HydrophobicContact CB-CB 4.4Å; R234-C284 HydrophobicContact CG-CB 4.34Å; R234-C284 VanDerWaalsContact CZ-O 3.29Å; R234-C284 PolarHBondContact NE-O 3.41Å; R234-C284 PolarHBondContact NH2-O 3.34Å; R234-C284 WeakPolarHBondContact O-CB 3.29Å; R234-C284 PolarHBondContact O-N 2.98Å; P235-C284 WeakPolarHBondContact O-CB 3.48Å; H236-C284 HydrophobicContact CB-CB 4.44Å; C265-C284 PolarHBondContact SG-SG 2.97Å; C268-C284 VanDerWaalsContact SG-SG 3.68Å
285	V	81.6	Confident	63.4	Low	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.4	C	S	.	.			trans	-116	119.9	179.8	-169.9	0	0	0	0	109.7	C268 T283 A360 I363	C268-V285 WeakPolarHBondContact CB-O 3.45Å; T283-V285 HydrophobicContact CG2-CG2 3.45Å; T283-V285 VanDerWaalsContact CG2-CG2 3.45Å; T283-V285 PolarHBondContact O-N 3.22Å; T283-V285 VanDerWaalsContact O-N 3.13Å; V285-A360 HydrophobicContact CG1-CB 3.48Å; V285-A360 VanDerWaalsContact CG1-CB 3.48Å; V285-I363 HydrophobicContact CG1-CD1 3.98Å; V285-I363 HydrophobicContact CG2-CB 4.2Å; V285-I363 HydrophobicContact CG2-CD1 4.15Å; V285-I363 HydrophobicContact CG2-CG2 3.68Å
286	P	73.5	Confident	60.5	Low	20 Å²	20	77 Å²	77	13%	0.13	40%	0.403	C	S	.	.			trans	-74.7	147.6	179.8	-2.3	24.2	0	0	0	108.6	V267 S288	V267-P286 HydrophobicContact CG1-CG 3.97Å; P286-S288 PolarHBondContact O-N 2.99Å
287	P	66.9	Low	57.6	Low	40 Å²	40	85.6 Å²	85.6	26%	0.26	44%	0.442	S	S	.	.			trans	-60	124.1	175.9	22.9	-30.9	0	0	0	110	V289 R400	P287-V289 PolarHBondContact O-N 2.57Å; P287-R400 WeakPolarHBondContact CB-O 3.27Å; P287-R400 VanDerWaalsContact CG-O 3.28Å; P287-R400 WeakPolarHBondContact CG-O 3.48Å
288	S	60.4	Low	55	Low	31 Å²	31	86.6 Å²	86.6	22%	0.217	46%	0.46	C	S	.	.			trans	-75.9	2.9	-174.7	-60.9	0	0	0	0	114.7	P286 P290 L349	P286-S288 PolarHBondContact O-N 2.99Å; S288-P290 VanDerWaalsContact O-CD 3.25Å; S288-P290 WeakPolarHBondContact O-CD 3.37Å; S288-L349 WeakPolarHBondContact CB-O 3.49Å; S288-L349 PolarHBondContact OG-O 3.37Å
289	V	55.4	Low	52.5	Low	76 Å²	76	84 Å²	84	46%	0.461	46%	0.461	S	S	.	.			trans	-68.3	119.4	-168.8	-148.2	0	0	0	0	109.9	P287 R291	P287-V289 PolarHBondContact O-N 2.57Å; V289-R291 PolarHBondContact O-N 3.05Å
290	P	42.4	Very low	50.2	Low	79 Å²	79	88.8 Å²	88.8	51%	0.513	47%	0.47	S	S	.	.			trans	-59.4	139.8	176.1	-19.5	31.1	0	0	0	109.2	S288 A292	S288-P290 VanDerWaalsContact O-CD 3.25Å; S288-P290 WeakPolarHBondContact O-CD 3.37Å; P290-A292 PolarHBondContact O-N 3.43Å
291	R	36.4	Very low	48.2	Very low	228 Å²	228	94.5 Å²	94.5	86%	0.86	50%	0.501	S	S	*	.			trans	-66.9	77	167.3	-166.4	-169.8	-118.5	-142.9	3.3	107.2	V289 N293	V289-R291 PolarHBondContact O-N 3.05Å; R291-N293 VanDerWaalsContact C-N 3.27Å; R291-N293 PolarHBondContact O-N 3.04Å
292	A	32.8	Very low	46.1	Very low	64 Å²	64	98.6 Å²	98.6	53%	0.529	52%	0.523	S	S	.	.			trans	-65	97.9	167.9	0	0	0	0	0	106.2	P290 F294	P290-A292 PolarHBondContact O-N 3.43Å; A292-F294 HydrophobicContact CB-CD2 3.99Å; A292-F294 HydrophobicContact CB-CE2 3.67Å; A292-F294 HydrophobicContact CB-CZ 4.24Å; A292-F294 PolarHBondContact O-N 3.07Å
293	N	26	Very low	44	Very low	120 Å²	120	103.1 Å²	103.1	64%	0.642	55%	0.553	S	S	*	*			trans	-62.6	88.1	160.7	-73	-12.5	0	0	0	105.6	R291 T295	R291-N293 VanDerWaalsContact C-N 3.27Å; R291-N293 PolarHBondContact O-N 3.04Å; N293-T295 PolarHBondContact O-N 3.34Å
294	F	28.9	Very low	41.6	Very low	188 Å²	188	108.3 Å²	108.3	83%	0.825	59%	0.586	S	S	*	*			trans	-68.2	80.9	158.2	-69.5	-80.8	0	0	0	106	A292 P296	A292-F294 HydrophobicContact CB-CD2 3.99Å; A292-F294 HydrophobicContact CB-CE2 3.67Å; A292-F294 HydrophobicContact CB-CZ 4.24Å; A292-F294 PolarHBondContact O-N 3.07Å; F294-P296 WeakPolarHBondContact O-CD 3.26Å
295	T	27.3	Very low	39.1	Very low	109 Å²	109	114.2 Å²	114.2	67%	0.669	62%	0.624	S	S	*	*			trans	-64.3	120.4	155.9	37.9	0	0	0	0	105.7	N293 Q297	N293-T295 PolarHBondContact O-N 3.34Å; T295-Q297 PolarHBondContact O-N 2.79Å
296	P	28.1	Very low	36.7	Very low	112 Å²	112	122.7 Å²	122.7	73%	0.727	66%	0.663	S	S	*	*			trans	-55.8	117.2	174.2	-15.7	27.7	0	0	0	106.9	F294 T298	F294-P296 WeakPolarHBondContact O-CD 3.26Å; P296-T298 VanDerWaalsContact C-N 3.26Å; P296-T298 PolarHBondContact O-N 3.21Å
297	Q	27.4	Very low	34.5	Very low	195 Å²	195	129.5 Å²	129.5	91%	0.911	69%	0.693	S	S	*	*			trans	-63.7	95.3	172.8	-74.5	-179.1	-5	0	0	107.1	T295 S299	T295-Q297 PolarHBondContact O-N 2.79Å; Q297-S299 PolarHBondContact O-N 2.99Å; Q297-S299 VanDerWaalsContact O-N 3.15Å
298	T	28.4	Very low	32.7	Very low	128 Å²	128	134.4 Å²	134.4	79%	0.785	72%	0.722	S	S	*	*			trans	-66.8	108.2	161.4	47.2	0	0	0	0	106.4	P296 R300	P296-T298 VanDerWaalsContact C-N 3.26Å; P296-T298 PolarHBondContact O-N 3.21Å; T298-R300 PolarHBondContact O-N 3.39Å; T298-R300 VanDerWaalsContact O-N 3.16Å
299	S	26.5	Very low	31.1	Very low	116 Å²	116	136.1 Å²	136.1	81%	0.811	73%	0.734	S	S	*	*			trans	-38.4	114.9	165.7	-170.6	0	0	0	0	110.8	Q297	Q297-S299 PolarHBondContact O-N 2.99Å; Q297-S299 VanDerWaalsContact O-N 3.15Å
300	R	28.9	Very low	29.8	Very low	225 Å²	225	136.9 Å²	136.9	85%	0.849	75%	0.748	S	S	*	*			trans	-170.8	127.1	149.8	-104	162.2	-166.2	-161.2	3.1	110.3	T298	T298-R300 PolarHBondContact O-N 3.39Å; T298-R300 VanDerWaalsContact O-N 3.16Å
301	N	31	Very low	29	Very low	149 Å²	149	143.2 Å²	143.2	80%	0.797	76%	0.763	S	S	*	*			trans	77.2	79.1	161.3	-52.9	-15.2	0	0	0	116	P303	N301-P303 WeakPolarHBondContact O-CD 3.39Å
302	L	27.4	Very low	28.6	Very low	168 Å²	168	139.7 Å²	139.7	88%	0.88	76%	0.76	S	S	*	*			trans	-74.6	115.8	154.7	-164.4	76.7	0	0	0	107.7
303	P	31.2	Very low	28.5	Very low	113 Å²	113	142.1 Å²	142.1	73%	0.734	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-73.3	130.3	169.7	-8.5	26.1	0	0	0	108.7	N301	N301-P303 WeakPolarHBondContact O-CD 3.39Å
304	T	30.3	Very low	28.4	Very low	114 Å²	114	144 Å²	144	70%	0.699	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-53.5	134.5	175.9	41.5	0	0	0	0	112	H306	T304-H306 PolarHBondContact O-N 3.49Å
305	P	30.8	Very low	28.4	Very low	123 Å²	123	140.4 Å²	140.4	80%	0.799	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-79	121.3	-177	30.1	-30.4	0	0	0	110.7	H307	P305-H307 PolarHBondContact O-N 3.17Å
306	H	31	Very low	28.7	Very low	179 Å²	179	140 Å²	140	83%	0.829	78%	0.776	S	S	*	*			trans	-72.4	106.9	167.5	-75.9	-88.2	0	0	0	109.7	T304 V308	T304-H306 PolarHBondContact O-N 3.49Å; H306-V308 PolarHBondContact O-N 3.45Å
307	H	27.1	Very low	28.5	Very low	162 Å²	162	141.8 Å²	141.8	75%	0.75	78%	0.779	S	S	*	*			trans	-10.7	114.1	151.4	-169.8	-99.8	0	0	0	116.1	P305	P305-H307 PolarHBondContact O-N 3.17Å
308	V	29.9	Very low	28.7	Very low	143 Å²	143	139.3 Å²	139.3	87%	0.867	78%	0.777	S	S	*	*			trans	-133	96.5	146.5	-166.1	0	0	0	0	107.5	H306	H306-V308 PolarHBondContact O-N 3.45Å
309	S	25.4	Very low	28.4	Very low	68 Å²	68	140.7 Å²	140.7	48%	0.476	77%	0.774	S	S	.	*			trans	-72.3	120.8	172.5	-169.8	0	0	0	0	108.9
310	A	29.7	Very low	28.7	Very low	91 Å²	91	141.3 Å²	141.3	75%	0.752	78%	0.776	S	S	*	*			trans	-120.4	92.5	166	0	0	0	0	0	107.7
311	Y	24.5	Very low	28.5	Very low	212 Å²	212	137.4 Å²	137.4	83%	0.831	77%	0.767	S	S	*	*			trans	-54.2	131.4	165.1	-93.5	-105.5	0	0	0	110.2
312	I	28.7	Very low	28.3	Very low	155 Å²	155	136.2 Å²	136.2	80%	0.795	77%	0.765	S	S	*	*			trans	-128.1	131.2	156	-59.4	180	0	0	0	107.4
313	P	29.5	Very low	28.3	Very low	114 Å²	114	136.7 Å²	136.7	74%	0.74	76%	0.762	S	S	*	*			trans	-84.9	149.3	-160	-1.4	21.6	0	0	0	112.7
314	I	24	Very low	28.2	Very low	159 Å²	159	134.9 Å²	134.9	82%	0.815	77%	0.765	S	S	*	*			trans	-69.2	138.3	167.9	-62.1	164.4	0	0	0	108.8
315	S	30	Very low	28.2	Very low	113 Å²	113	140.7 Å²	140.7	79%	0.79	78%	0.775	S	S	*	*			trans	-140.6	146.5	158.2	-76.6	0	0	0	0	110.8
316	P	33.4	Very low	28.2	Very low	100 Å²	100	137.6 Å²	137.6	65%	0.649	77%	0.766	S	S	*	*			trans	-119.5	171.1	-144.9	38	-22.8	0	0	0	114.5
317	L	24.2	Very low	28.1	Very low	151 Å²	151	136.4 Å²	136.4	79%	0.791	77%	0.766	S	S	*	*			trans	67.7	104.6	148.7	-80.4	146.4	0	0	0	118.5
318	T	30.8	Very low	28.5	Very low	143 Å²	143	134.2 Å²	134.2	88%	0.877	77%	0.766	S	S	*	*				-158.2	108	121.7	-1.6	0	0	0	0	110.2
319	Q	23.1	Very low	28.6	Very low	156 Å²	156	135.4 Å²	135.4	73%	0.729	77%	0.767	S	S	*	*			trans	-82.7	141.6	160.8	-78.1	177.5	-8.7	0	0	108.4
320	P	31.3	Very low	28.9	Very low	129 Å²	129	140 Å²	140	84%	0.838	79%	0.785	S	S	*	*				-120.5	131.5	128.2	1.8	18.5	0	0	0	110.4
321	Q	24.8	Very low	29	Very low	144 Å²	144	141.2 Å²	141.2	67%	0.673	79%	0.785	S	S	*	*			trans	-68.2	150.5	172.4	-58.3	171.9	1.1	0	0	110.2
322	T	27.7	Very low	29.1	Very low	123 Å²	123	136.1 Å²	136.1	76%	0.755	78%	0.78	S	S	*	*				169.6	117.6	114.2	39.4	0	0	0	0	111.9
323	H	26.5	Very low	29.2	Very low	178 Å²	178	134.4 Å²	134.4	82%	0.824	78%	0.779	S	S	*	*			trans	31	122	139.6	-61.7	-77.5	0	0	0	121.7
324	G	29	Very low	29.5	Very low	76 Å²	76	134.6 Å²	134.6	78%	0.784	78%	0.779	S	S	*	*			trans	171.9	80.6	157.5	0	0	0	0	0	112	G326	G324-G326 PolarHBondContact O-N 3.34Å
325	Y	30.7	Very low	30.2	Very low	235 Å²	235	134.4 Å²	134.4	92%	0.922	77%	0.772	S	S	*	*			trans	-56.9	115.9	177.2	-91.7	-104.2	0	0	0	111.6
326	G	31.7	Very low	30.5	Very low	59 Å²	59	131.4 Å²	131.4	61%	0.608	76%	0.755	S	S	*	*			trans	-152.2	99.3	162.9	0	0	0	0	0	107.6	G324 P328	G324-G326 PolarHBondContact O-N 3.34Å; G326-P328 WeakPolarHBondContact O-CD 3.48Å; G326-P328 VanDerWaalsContact O-N 3.11Å
327	D	29.1	Very low	30.6	Very low	154 Å²	154	132.2 Å²	132.2	82%	0.824	75%	0.754	S	S	*	*			trans	-49.1	113	178.5	-86.7	-43.4	0	0	0	110.7	L329	D327-L329 PolarHBondContact O-N 3.42Å; D327-L329 VanDerWaalsContact O-N 3.13Å
328	P	35.7	Very low	31.2	Very low	116 Å²	116	136.5 Å²	136.5	75%	0.753	76%	0.759	S	S	*	*			trans	-72.5	112.5	172.7	-11.2	27.7	0	0	0	107.6	G326 L330	G326-P328 WeakPolarHBondContact O-CD 3.48Å; G326-P328 VanDerWaalsContact O-N 3.11Å; P328-L330 PolarHBondContact O-N 2.88Å
329	L	31.1	Very low	31.8	Very low	167 Å²	167	134.4 Å²	134.4	87%	0.874	74%	0.741	S	S	*	*			trans	-42.5	107.8	167.9	-67.6	166.8	0	0	0	109.6	D327 P331	D327-L329 PolarHBondContact O-N 3.42Å; D327-L329 VanDerWaalsContact O-N 3.13Å; L329-P331 VanDerWaalsContact O-CD 3.29Å; L329-P331 WeakPolarHBondContact O-CD 3.28Å; L329-P331 VanDerWaalsContact O-N 3.1Å
330	L	30.7	Very low	32.9	Very low	166 Å²	166	132.7 Å²	132.7	87%	0.869	73%	0.727	S	S	*	*			trans	-49.6	115.8	174.6	-84.5	147.4	0	0	0	109.1	P328 S332	P328-L330 PolarHBondContact O-N 2.88Å; L330-S332 PolarHBondContact O-N 2.79Å
331	P	31.6	Very low	33.5	Very low	116 Å²	116	131.8 Å²	131.8	75%	0.753	72%	0.724	S	S	*	*			trans	-61.9	126.9	179.8	-19.5	30.5	0	0	0	109.2	L329	L329-P331 VanDerWaalsContact O-CD 3.29Å; L329-P331 WeakPolarHBondContact O-CD 3.28Å; L329-P331 VanDerWaalsContact O-N 3.1Å
332	S	26.8	Very low	34.9	Very low	104 Å²	104	130.8 Å²	130.8	73%	0.727	71%	0.714	S	S	*	*			trans	-47.2	125	176.9	-69.6	0	0	0	0	110.1	L330 T334	L330-S332 PolarHBondContact O-N 2.79Å; S332-T334 PolarHBondContact O-N 3.1Å
333	P	32.1	Very low	36.7	Very low	119 Å²	119	130.6 Å²	130.6	77%	0.773	71%	0.708	S	S	*	*			trans	-68.4	106.8	-175	27	-31.4	0	0	0	107.7	F335	P333-F335 PolarHBondContact O-N 3.27Å
334	T	35.7	Very low	39.3	Very low	118 Å²	118	123.3 Å²	123.3	72%	0.724	68%	0.676	S	S	*	*			trans	-56.3	133.1	176.3	13.1	0	0	0	0	108.3	S332 A336	S332-T334 PolarHBondContact O-N 3.1Å; T334-A336 PolarHBondContact O-N 2.92Å
335	F	38	Very low	42	Very low	155 Å²	155	121.5 Å²	121.5	68%	0.68	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-0.7	-169.2	-160.5	-93.7	0	0	0	116	P333	P333-F335 PolarHBondContact O-N 3.27Å
336	A	36.8	Very low	44.8	Very low	51 Å²	51	110.8 Å²	110.8	42%	0.421	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	-26.4	-176.1	0	0	0	0	0	114.5	T334 R338	T334-A336 PolarHBondContact O-N 2.92Å; A336-R338 PolarHBondContact O-N 3.44Å
337	N	34.7	Very low	47.4	Very low	117 Å²	117	110.7 Å²	110.7	63%	0.626	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-24	-167	-78.1	-1.2	0	0	0	115.2	M339	N337-M339 VanDerWaalsContact C-N 3.32Å; N337-M339 PolarHBondContact O-N 3.31Å
338	R	36.3	Very low	50.1	Low	241 Å²	241	108.7 Å²	108.7	91%	0.909	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-6.9	-167.5	-136.4	-177	-76.5	-152.9	-0.7	115.2	A336	A336-R338 PolarHBondContact O-N 3.44Å
339	M	44.7	Very low	52.5	Low	99 Å²	99	104.7 Å²	104.7	49%	0.488	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.7	-7.7	-173.1	-120.4	172.5	-178.7	0	0	115.6	N337 S341 E394	N337-M339 VanDerWaalsContact C-N 3.32Å; N337-M339 PolarHBondContact O-N 3.31Å; M339-S341 PolarHBondContact O-N 2.9Å; M339-E394 HydrophobicContact CE-CG 4.2Å; M339-E394 WeakPolarHBondContact CE-OE1 3.39Å
340	R	44.8	Very low	55.1	Low	120 Å²	120	97.1 Å²	97.1	45%	0.453	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-5	175.4	-71.8	-163.5	-167.7	-173.8	10.3	114.1	R342 P508	R340-R342 CarbonylContact O-C 3.44Å; R340-R342 PolarHBondContact O-N 3.37Å; R340-P508 PolarHBondContact NH1-O 2.99Å
341	S	44.3	Very low	57.2	Low	110 Å²	110	89.9 Å²	89.9	77%	0.769	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	3.3	178.9	-46.8	0	0	0	0	115.2	M339	M339-S341 PolarHBondContact O-N 2.9Å
342	R	54.9	Low	59.5	Low	122 Å²	122	89.3 Å²	89.3	46%	0.46	48%	0.483	S	S	.	.	S	Bend	trans	-103.6	93.4	161.5	-64.3	-175.1	179.3	-178.5	-3	107.6	R340 L344	R340-R342 CarbonylContact O-C 3.44Å; R340-R342 PolarHBondContact O-N 3.37Å; R342-L344 HydrophobicContact CB-CD1 4.09Å; R342-L344 HydrophobicContact CB-CG 4.01Å; R342-L344 PolarHBondContact O-N 3.41Å
343	N	65.7	Low	62	Low	119 Å²	119	90.5 Å²	90.5	64%	0.636	48%	0.481	S	S	*	.			trans	-59.2	90.3	162.5	-76.4	-45.7	0	0	0	107.9	S345 E426	N343-S345 PolarHBondContact O-N 2.85Å; N343-E426 HydrophobicContact CB-CB 4.31Å; N343-E426 HydrophobicContact CB-CG 4.15Å
344	L	80.5	Confident	64.4	Low	26 Å²	26	86.3 Å²	86.3	14%	0.136	45%	0.451	C	S	.	.	B	Isolated β-bridge	trans	-87.9	95.7	-177	-78.2	148.8	0	0	0	108.1	R342 L346 L349 Y393 L397 E426	R342-L344 HydrophobicContact CB-CD1 4.09Å; R342-L344 HydrophobicContact CB-CG 4.01Å; R342-L344 PolarHBondContact O-N 3.41Å; L344-L346 PolarHBondContact O-N 3.28Å; L344-L349 HydrophobicContact CB-CD1 4.44Å; L344-L349 HydrophobicContact CD2-CD1 4.18Å; L344-L349 HydrophobicContact CD2-CD2 4.25Å; L344-Y393 WeakPolarHBondContact CD1-OH 3.48Å; L344-L397 HydrophobicContact CD1-CD1 4.39Å; L344-L397 HydrophobicContact CD2-CD2 4.39Å; L344-E426 PolarHBondContact O-N 3.14Å
345	S	86.5	Confident	66.7	Low	37 Å²	37	83 Å²	83	26%	0.259	43%	0.427	S	S	.	.			trans	-66.5	125	170.2	-171.5	0	0	0	0	109.9	N343 S347 L348	N343-S345 PolarHBondContact O-N 2.85Å; S345-S347 PolarHBondContact O-N 3.03Å; S345-S347 PolarHBondContact OG-OG 3.46Å; S345-L348 PolarHBondContact O-N 3.4Å; S345-L348 VanDerWaalsContact O-N 3.16Å
346	L	89.6	Confident	69.2	Low	10 Å²	10	75.7 Å²	75.7	5%	0.052	40%	0.395	C	S	.	.	H	α-helix	trans	-58.1	-34.5	-178.7	-177.7	64	0	0	0	112.1	L344 L348 L349 C350 P359 F421 L425 L429 P466 N467	L344-L346 PolarHBondContact O-N 3.28Å; L346-L348 VanDerWaalsContact C-N 3.33Å; L346-L348 PolarHBondContact O-N 3.06Å; L346-L349 PolarHBondContact O-N 3.37Å; L346-C350 PolarHBondContact O-N 3.5Å; L346-C350 PolarHBondContact O-SG 2.89Å; L346-P359 HydrophobicContact CD1-CG 3.46Å; L346-P359 VanDerWaalsContact CD1-CG 3.46Å; L346-F421 HydrophobicContact CD1-CZ 4.2Å; L346-L425 HydrophobicContact CB-CD2 4.31Å; L346-L425 HydrophobicContact CD1-CD1 4.28Å; L346-L425 HydrophobicContact CD1-CD2 4.12Å; L346-L429 HydrophobicContact CD2-CD1 3.59Å; L346-P466 HydrophobicContact CD2-CB 4.11Å; L346-P466 HydrophobicContact CG-CB 4.1Å; L346-N467 HydrophobicContact CD2-CB 4.27Å
347	S	85.7	Confident	71.8	Confident	57 Å²	57	77.2 Å²	77.2	40%	0.399	39%	0.39	S	S	.	.	H	α-helix	trans	-60.2	-39.9	179.3	65.1	0	0	0	0	112.4	S345 L349 C350	S345-S347 PolarHBondContact O-N 3.03Å; S345-S347 PolarHBondContact OG-OG 3.46Å; S347-L349 PolarHBondContact O-N 3.25Å; S347-C350 PolarHBondContact O-N 2.87Å; S347-C350 VanDerWaalsContact O-O 3.12Å
348	L	85.7	Confident	74.5	Confident	113 Å²	113	71.6 Å²	71.6	59%	0.592	36%	0.36	S	S	*	.	H	α-helix	trans	-68	-20.3	179.7	-66.8	172.7	0	0	0	113.4	S345 L346	S345-L348 PolarHBondContact O-N 3.4Å; S345-L348 VanDerWaalsContact O-N 3.16Å; L346-L348 VanDerWaalsContact C-N 3.33Å; L346-L348 PolarHBondContact O-N 3.06Å
349	L	85.8	Confident	77.2	Confident	32 Å²	32	60.3 Å²	60.3	17%	0.168	32%	0.317	C	S	.	.	H	α-helix	trans	-96.1	-12.8	-179.1	-61.6	169	0	0	0	112.8	S288 L344 L346 S347 P359 F421 L425	S288-L349 WeakPolarHBondContact CB-O 3.49Å; S288-L349 PolarHBondContact OG-O 3.37Å; L344-L349 HydrophobicContact CB-CD1 4.44Å; L344-L349 HydrophobicContact CD2-CD1 4.18Å; L344-L349 HydrophobicContact CD2-CD2 4.25Å; L346-L349 PolarHBondContact O-N 3.37Å; S347-L349 PolarHBondContact O-N 3.25Å; L349-P359 HydrophobicContact CB-CB 4.27Å; L349-P359 HydrophobicContact CB-CG 4.32Å; L349-F421 HydrophobicContact CD1-CE2 3.47Å; L349-F421 VanDerWaalsContact CD1-CE2 3.47Å; L349-F421 HydrophobicContact CD1-CZ 3.77Å; L349-L425 HydrophobicContact CD1-CD2 4.42Å
350	C	85.3	Confident	79.3	Confident	7 Å²	7	56 Å²	56	5%	0.047	30%	0.298	C	S	.	.	S	Bend	trans	-94.7	135.8	175.9	-62.6	0	0	0	0	109.2	L346 S347 S352 R357 P359 P466	L346-C350 PolarHBondContact O-N 3.5Å; L346-C350 PolarHBondContact O-SG 2.89Å; S347-C350 PolarHBondContact O-N 2.87Å; S347-C350 VanDerWaalsContact O-O 3.12Å; C350-S352 PolarHBondContact O-N 3.46Å; C350-R357 HydrophobicContact CB-CB 4.16Å; C350-R357 PolarHBondContact SG-O 3.48Å; C350-R357 VanDerWaalsContact SG-O 3.39Å; C350-P359 VanDerWaalsContact SG-CD 3.53Å; C350-P466 HydrophobicContact CB-CB 4.47Å
351	P	76.3	Confident	81.5	Confident	15 Å²	15	50.9 Å²	50.9	10%	0.097	28%	0.279	C	S	.	.			trans	-65.5	119.6	169.2	27.5	-31.7	0	0	0	109.2	R231 D353 Q354	R231-P351 VanDerWaalsContact CZ-CG 3.46Å; P351-D353 WeakPolarHBondContact CB-OD1 3.24Å; P351-D353 PolarHBondContact O-N 3.46Å; P351-Q354 HydrophobicContact CB-CB 4.04Å; P351-Q354 HydrophobicContact CB-CG 4.27Å; P351-Q354 HydrophobicContact CG-CB 3.9Å
352	S	78.5	Confident	83.9	Confident	104 Å²	104	45.6 Å²	45.6	73%	0.727	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.4	178.7	-54.8	0	0	0	0	112.9	C350	C350-S352 PolarHBondContact O-N 3.46Å
353	D	79.7	Confident	85.7	Confident	129 Å²	129	39.8 Å²	39.8	69%	0.69	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99	1.7	-174.4	67	-38.9	0	0	0	113.8	P351	P351-D353 WeakPolarHBondContact CB-OD1 3.24Å; P351-D353 PolarHBondContact O-N 3.46Å
354	Q	82.2	Confident	86.8	Confident	31 Å²	31	34.3 Å²	34.3	15%	0.145	19%	0.191	C	C	.	.	S	Bend	trans	-134.8	147	-176	-61.4	162.6	59.3	0	0	112.8	R231 P351	R231-Q354 VanDerWaalsContact CD-CB 3.47Å; R231-Q354 HydrophobicContact CG-CB 4.23Å; P351-Q354 HydrophobicContact CB-CB 4.04Å; P351-Q354 HydrophobicContact CB-CG 4.27Å; P351-Q354 HydrophobicContact CG-CB 3.9Å
355	F	84.3	Confident	87.5	Confident	49 Å²	49	33 Å²	33	22%	0.215	18%	0.184	C	C	.	.	S	Bend	trans	-106.4	143.1	178.4	-177	-91.8	0	0	0	112.2	N230 R231 H469 L541	N230-F355 WeakPolarHBondContact CA-O 3.45Å; R231-F355 WeakPolarHBondContact CG-O 3.48Å; R231-F355 PolarHBondContact N-O 3.34Å; F355-H469 AromaticContact CD2-CE1 3.78Å; F355-H469 AromaticContact CE2-CE1 3.45Å; F355-H469 VanDerWaalsContact CE2-CE1 3.45Å; F355-H469 WeakPolarHBondContact CE2-CE1 3.45Å; F355-H469 AromaticContact CE2-NE2 3.75Å; F355-L541 VanDerWaalsContact CE1-O 3.24Å; F355-L541 WeakPolarHBondContact CE1-O 3.48Å
356	P	90.6	Very high	87.9	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.172	C	C	.	.	S	Bend	cis	-74.7	155.5	-14.5	31.1	-35.4	0	0	0	111.5	N230 L232 V358 H469 L541	N230-P356 WeakPolarHBondContact OD1-CD 3.42Å; L232-P356 HydrophobicContact CD1-CG 3.8Å; L232-P356 HydrophobicContact CD2-CG 4.11Å; L232-P356 HydrophobicContact CG-CG 3.64Å; P356-V358 HydrophobicContact CB-CG2 4.11Å; P356-V358 HydrophobicContact CG-CG2 4.08Å; P356-V358 PolarHBondContact O-N 2.97Å; P356-H469 HydrophobicContact CB-CB 4.18Å; P356-L541 HydrophobicContact CB-CD2 3.95Å; P356-L541 HydrophobicContact CG-CD2 4.19Å
357	R	91.5	Very high	87.9	Confident	83 Å²	83	31.4 Å²	31.4	31%	0.313	17%	0.173	S	C	.	.			trans	-69.4	66.2	172.9	-64.3	-157.5	-85.7	-174.7	-10.7	112.3	C350 T465 P466 H469 T470	C350-R357 HydrophobicContact CB-CB 4.16Å; C350-R357 PolarHBondContact SG-O 3.48Å; C350-R357 VanDerWaalsContact SG-O 3.39Å; R357-T465 HydrophobicContact CG-CG2 4.48Å; R357-T465 VanDerWaalsContact CZ-CB 3.46Å; R357-T465 VanDerWaalsContact NE-CG2 3.25Å; R357-T465 PolarHBondContact NH2-OG1 3.15Å; R357-P466 HydrophobicContact CB-CG 4.49Å; R357-P466 WeakPolarHBondContact O-CA 3.09Å; R357-H469 PolarHBondContact N-ND1 3.46Å; R357-H469 VanDerWaalsContact N-ND1 3.11Å; R357-T470 PolarHBondContact O-OG1 2.99Å
358	V	92.5	Very high	88.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.			trans	-118.2	134.4	176.3	-175.4	0	0	0	0	109.9	R231 P356 V362 I363 H469 T470 F473	R231-V358 PolarHBondContact NH1-O 3.01Å; P356-V358 HydrophobicContact CB-CG2 4.11Å; P356-V358 HydrophobicContact CG-CG2 4.08Å; P356-V358 PolarHBondContact O-N 2.97Å; V358-V362 HydrophobicContact CG1-CB 3.96Å; V358-V362 HydrophobicContact CG1-CG1 3.98Å; V358-I363 HydrophobicContact CB-CD1 4.17Å; V358-I363 HydrophobicContact CB-CG1 4.13Å; V358-I363 HydrophobicContact CG1-CD1 4.34Å; V358-I363 HydrophobicContact CG1-CG1 3.77Å; V358-H469 HydrophobicContact CG2-CB 3.87Å; V358-T470 HydrophobicContact CG1-CG2 4.46Å; V358-F473 HydrophobicContact CG1-CD1 4.02Å; V358-F473 HydrophobicContact CG2-CB 4.37Å
359	P	92	Very high	88.6	Confident	3 Å²	3	24.1 Å²	24.1	2%	0.019	13%	0.13	C	C	.	.			trans	-61.1	142.7	178.4	-22.6	32.3	0	0	0	112.2	L346 L349 C350 L361 V362 I363 F421 T470	L346-P359 HydrophobicContact CD1-CG 3.46Å; L346-P359 VanDerWaalsContact CD1-CG 3.46Å; L349-P359 HydrophobicContact CB-CB 4.27Å; L349-P359 HydrophobicContact CB-CG 4.32Å; C350-P359 VanDerWaalsContact SG-CD 3.53Å; P359-L361 PolarHBondContact O-N 2.97Å; P359-V362 HydrophobicContact CB-CG2 4.17Å; P359-V362 HydrophobicContact CG-CG2 4.2Å; P359-V362 PolarHBondContact O-N 2.72Å; P359-I363 PolarHBondContact O-N 2.82Å; P359-F421 HydrophobicContact CB-CE1 4.33Å; P359-F421 HydrophobicContact CB-CZ 4.05Å; P359-F421 HydrophobicContact CG-CE1 4.11Å; P359-F421 HydrophobicContact CG-CZ 3.87Å; P359-T470 VanDerWaalsContact CD-OG1 3.27Å; P359-T470 WeakPolarHBondContact CD-OG1 3.25Å
360	A	88.6	Confident	88.9	Confident	9 Å²	9	24.2 Å²	24.2	7%	0.074	13%	0.13	C	C	.	.	H	α-helix	trans	-59	-35.9	-179.9	0	0	0	0	0	113	V285 V362 I363 H364	V285-A360 HydrophobicContact CG1-CB 3.48Å; V285-A360 VanDerWaalsContact CG1-CB 3.48Å; A360-V362 VanDerWaalsContact C-N 3.33Å; A360-V362 PolarHBondContact O-N 3.4Å; A360-I363 PolarHBondContact O-N 3.2Å; A360-H364 WeakPolarHBondContact O-CB 3.36Å; A360-H364 PolarHBondContact O-CD2 3.34Å; A360-H364 PolarHBondContact O-N 3.11Å
361	L	91.9	Very high	89	Confident	12 Å²	12	26 Å²	26	6%	0.063	14%	0.144	C	C	.	.	H	α-helix	trans	-55.8	-48	175.2	-173.8	163.9	0	0	0	111.1	P359 H364 C365 Y393 F396 L418 F421	P359-L361 PolarHBondContact O-N 2.97Å; L361-H364 PolarHBondContact O-N 3.24Å; L361-C365 WeakPolarHBondContact O-CB 3.4Å; L361-C365 PolarHBondContact O-N 3.44Å; L361-C365 PolarHBondContact O-SG 3.21Å; L361-C365 VanDerWaalsContact O-SG 3.34Å; L361-Y393 HydrophobicContact CD1-CD2 4.21Å; L361-Y393 HydrophobicContact CD1-CE2 4.4Å; L361-F396 HydrophobicContact CB-CD1 4.07Å; L361-F396 HydrophobicContact CB-CE1 4.42Å; L361-F396 HydrophobicContact CB-CG 4.3Å; L361-F396 HydrophobicContact CD1-CB 3.67Å; L361-F396 HydrophobicContact CD1-CD1 4.48Å; L361-F396 HydrophobicContact CD1-CD2 4.14Å; L361-F396 HydrophobicContact CD1-CG 3.89Å; L361-F396 HydrophobicContact CG-CB 4.15Å; L361-F396 HydrophobicContact CG-CD1 4.04Å; L361-F396 HydrophobicContact CG-CD2 3.97Å; L361-F396 HydrophobicContact CG-CE1 4.38Å; L361-F396 HydrophobicContact CG-CE2 4.32Å; L361-F396 HydrophobicContact CG-CG 3.82Å; L361-L418 HydrophobicContact CD2-CD1 4.46Å; L361-F421 HydrophobicContact CD1-CB 3.98Å; L361-F421 HydrophobicContact CD1-CD2 3.86Å; L361-F421 HydrophobicContact CD1-CG 3.92Å; L361-F421 HydrophobicContact CD2-CB 3.69Å; L361-F421 HydrophobicContact CD2-CD1 3.96Å; L361-F421 HydrophobicContact CD2-CD2 4.47Å; L361-F421 HydrophobicContact CD2-CG 3.75Å; L361-F421 HydrophobicContact CG-CG 4.41Å
362	V	94.4	Very high	89.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-49.6	-179.3	178.4	0	0	0	0	110.2	V358 P359 A360 H364 C365 V366 L418 F421 T470 F473 I474	V358-V362 HydrophobicContact CG1-CB 3.96Å; V358-V362 HydrophobicContact CG1-CG1 3.98Å; P359-V362 HydrophobicContact CB-CG2 4.17Å; P359-V362 HydrophobicContact CG-CG2 4.2Å; P359-V362 PolarHBondContact O-N 2.72Å; A360-V362 VanDerWaalsContact C-N 3.33Å; A360-V362 PolarHBondContact O-N 3.4Å; V362-H364 PolarHBondContact O-N 3.33Å; V362-C365 PolarHBondContact O-N 3.43Å; V362-V366 HydrophobicContact CG1-CG2 4.24Å; V362-V366 WeakPolarHBondContact O-CB 3.4Å; V362-V366 VanDerWaalsContact O-CG2 3.31Å; V362-V366 WeakPolarHBondContact O-CG2 3.4Å; V362-V366 PolarHBondContact O-N 3.02Å; V362-L418 HydrophobicContact CB-CD1 4.34Å; V362-L418 HydrophobicContact CG1-CD1 4.19Å; V362-L418 HydrophobicContact CG2-CD1 4.08Å; V362-F421 HydrophobicContact CG2-CD1 3.66Å; V362-F421 HydrophobicContact CG2-CE1 3.36Å; V362-F421 HydrophobicContact CG2-CZ 4.43Å; V362-T470 HydrophobicContact CG1-CG2 4.41Å; V362-T470 HydrophobicContact CG2-CG2 4.23Å; V362-F473 HydrophobicContact CG1-CD1 3.92Å; V362-F473 HydrophobicContact CG1-CE1 4.17Å; V362-I474 HydrophobicContact CG1-CD1 4.14Å; V362-I474 HydrophobicContact CG1-CG1 3.95Å
363	I	91.8	Very high	90.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.9	-48.9	-179.9	-57.6	170.1	0	0	0	110.8	L232 T283 V285 V358 P359 A360 N367 F473	L232-I363 HydrophobicContact CD2-CD1 3.97Å; L232-I363 HydrophobicContact CD2-CG1 3.87Å; L232-I363 HydrophobicContact CD2-CG2 4.29Å; T283-I363 HydrophobicContact CG2-CG2 3.73Å; V285-I363 HydrophobicContact CG1-CD1 3.98Å; V285-I363 HydrophobicContact CG2-CB 4.2Å; V285-I363 HydrophobicContact CG2-CD1 4.15Å; V285-I363 HydrophobicContact CG2-CG2 3.68Å; V358-I363 HydrophobicContact CB-CD1 4.17Å; V358-I363 HydrophobicContact CB-CG1 4.13Å; V358-I363 HydrophobicContact CG1-CD1 4.34Å; V358-I363 HydrophobicContact CG1-CG1 3.77Å; P359-I363 PolarHBondContact O-N 2.82Å; A360-I363 PolarHBondContact O-N 3.2Å; I363-N367 VanDerWaalsContact O-CB 3.31Å; I363-N367 WeakPolarHBondContact O-CB 3.47Å; I363-N367 PolarHBondContact O-N 3.04Å; I363-N367 PolarHBondContact O-ND2 3.43Å; I363-N367 PolarHBondContact O-OD1 3.49Å; I363-F473 HydrophobicContact CG1-CE1 4.32Å
364	H	89.7	Confident	91.1	Very high	3 Å²	3	19.6 Å²	19.6	1%	0.014	9%	0.094	C	C	.	.	H	α-helix	trans	-65.8	-43.7	-178.2	-72.1	-53.7	0	0	0	113	Q282 A360 L361 V362 E368 F396 T402 L405	Q282-H364 PolarHBondContact OE1-ND1 3.23Å; A360-H364 WeakPolarHBondContact O-CB 3.36Å; A360-H364 PolarHBondContact O-CD2 3.34Å; A360-H364 PolarHBondContact O-N 3.11Å; L361-H364 PolarHBondContact O-N 3.24Å; V362-H364 PolarHBondContact O-N 3.33Å; H364-E368 VanDerWaalsContact O-CB 3.32Å; H364-E368 WeakPolarHBondContact O-CB 3.42Å; H364-E368 PolarHBondContact O-N 3Å; H364-F396 HydrophobicContact CB-CE1 4.15Å; H364-F396 HydrophobicContact CB-CZ 4.19Å; H364-T402 HydrophobicContact CB-CG2 4.3Å; H364-T402 WeakPolarHBondContact CD2-CG2 3.14Å; H364-T402 VanDerWaalsContact NE2-CG2 3.31Å; H364-T402 WeakPolarHBondContact NE2-CG2 3.4Å; H364-T402 PolarHBondContact NE2-OG1 3.01Å; H364-L405 HydrophobicContact CB-CD1 4.02Å; H364-L405 VanDerWaalsContact O-CD1 3.28Å; H364-L405 WeakPolarHBondContact O-CD1 3.31Å
365	C	94.2	Very high	91.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.3	-45.6	177.8	-73.5	0	0	0	0	111.8	L361 V362 E368 V369 V414 L418	L361-C365 WeakPolarHBondContact O-CB 3.4Å; L361-C365 PolarHBondContact O-N 3.44Å; L361-C365 PolarHBondContact O-SG 3.21Å; L361-C365 VanDerWaalsContact O-SG 3.34Å; V362-C365 PolarHBondContact O-N 3.43Å; C365-E368 PolarHBondContact O-N 3.33Å; C365-V369 VanDerWaalsContact O-CG2 3.3Å; C365-V369 WeakPolarHBondContact O-CG2 3.36Å; C365-V369 PolarHBondContact O-N 3.11Å; C365-V414 HydrophobicContact CB-CG1 3.92Å; C365-L418 HydrophobicContact CB-CB 4.09Å; C365-L418 HydrophobicContact CB-CD1 4.4Å
366	V	95.1	Very high	92.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.6	-49.8	178.2	165.2	0	0	0	0	110.8	V362 E368 V369 M370 L418 F473 H477 F559	V362-V366 HydrophobicContact CG1-CG2 4.24Å; V362-V366 WeakPolarHBondContact O-CB 3.4Å; V362-V366 VanDerWaalsContact O-CG2 3.31Å; V362-V366 WeakPolarHBondContact O-CG2 3.4Å; V362-V366 PolarHBondContact O-N 3.02Å; V366-E368 VanDerWaalsContact C-N 3.27Å; V366-E368 PolarHBondContact O-N 3.45Å; V366-V369 PolarHBondContact O-N 3.39Å; V366-V369 VanDerWaalsContact O-N 3.11Å; V366-M370 HydrophobicContact CG1-CG 4.32Å; V366-M370 WeakPolarHBondContact O-CG 3.31Å; V366-M370 PolarHBondContact O-N 3.36Å; V366-L418 HydrophobicContact CG2-CD2 4.03Å; V366-F473 HydrophobicContact CB-CE1 3.64Å; V366-F473 HydrophobicContact CB-CZ 3.87Å; V366-F473 HydrophobicContact CG1-CE1 3.68Å; V366-F473 HydrophobicContact CG1-CE2 4.29Å; V366-F473 HydrophobicContact CG1-CZ 3.47Å; V366-F473 VanDerWaalsContact CG1-CZ 3.47Å; V366-F473 HydrophobicContact CG2-CD1 4.42Å; V366-F473 HydrophobicContact CG2-CE1 3.8Å; V366-F473 HydrophobicContact CG2-CZ 4.47Å; V366-H477 HydrophobicContact CG1-CB 3.77Å; V366-H477 HydrophobicContact CG2-CB 4.36Å; V366-F559 HydrophobicContact CG1-CD1 4.31Å; V366-F559 HydrophobicContact CG1-CE1 3.65Å
367	N	90.7	Very high	92.4	Very high	12 Å²	12	29.2 Å²	29.2	6%	0.064	14%	0.144	C	C	.	.	H	α-helix	trans	-60.7	-38.4	179.8	-71.6	-5.3	0	0	0	112.2	T283 I363 M370 A371	T283-N367 VanDerWaalsContact CG2-ND2 3.34Å; T283-N367 WeakPolarHBondContact CG2-ND2 3.39Å; I363-N367 VanDerWaalsContact O-CB 3.31Å; I363-N367 WeakPolarHBondContact O-CB 3.47Å; I363-N367 PolarHBondContact O-N 3.04Å; I363-N367 PolarHBondContact O-ND2 3.43Å; I363-N367 PolarHBondContact O-OD1 3.49Å; N367-M370 PolarHBondContact O-N 2.77Å; N367-A371 WeakPolarHBondContact O-CB 3.28Å; N367-A371 PolarHBondContact O-N 2.93Å
368	E	91.3	Very high	92.6	Very high	18 Å²	18	25.2 Å²	25.2	8%	0.084	13%	0.13	C	C	.	.	H	α-helix	trans	-66.2	-42	176.2	-170.3	71.1	-162.9	0	0	112	Q282 H364 C365 V366 A371 R372 L405 I411 V414	Q282-E368 PolarHBondContact NE2-OE2 3.36Å; H364-E368 VanDerWaalsContact O-CB 3.32Å; H364-E368 WeakPolarHBondContact O-CB 3.42Å; H364-E368 PolarHBondContact O-N 3Å; C365-E368 PolarHBondContact O-N 3.33Å; V366-E368 VanDerWaalsContact C-N 3.27Å; V366-E368 PolarHBondContact O-N 3.45Å; E368-A371 PolarHBondContact O-N 2.98Å; E368-R372 WeakPolarHBondContact O-CG 3.44Å; E368-R372 PolarHBondContact O-N 3.23Å; E368-R372 VanDerWaalsContact O-N 3.14Å; E368-R372 VanDerWaalsContact OE1-CD 3.3Å; E368-R372 WeakPolarHBondContact OE1-CD 3.26Å; E368-R372 IonicContact OE1-CZ 3.13Å; E368-R372 IonicContact OE1-NE 2.72Å; E368-R372 PolarHBondContact OE1-NE 3.31Å; E368-R372 IonicContact OE1-NH2 3.45Å; E368-L405 HydrophobicContact CB-CB 4.32Å; E368-L405 HydrophobicContact CB-CD1 3.65Å; E368-L405 HydrophobicContact CG-CB 3.77Å; E368-L405 HydrophobicContact CG-CD1 4.01Å; E368-I411 HydrophobicContact CG-CD1 4.29Å; E368-V414 HydrophobicContact CB-CG1 4.29Å; E368-V414 HydrophobicContact CG-CG1 4.45Å; E368-V414 HydrophobicContact CG-CG2 4.42Å
369	V	94.7	Very high	92.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	I	π-helix	trans	-64.7	-43.6	176.1	175.5	0	0	0	0	111	C365 V366 A371 G373 M374 L379 Y380 I411 V414	C365-V369 VanDerWaalsContact O-CG2 3.3Å; C365-V369 WeakPolarHBondContact O-CG2 3.36Å; C365-V369 PolarHBondContact O-N 3.11Å; V366-V369 PolarHBondContact O-N 3.39Å; V366-V369 VanDerWaalsContact O-N 3.11Å; V369-A371 VanDerWaalsContact C-N 3.3Å; V369-A371 PolarHBondContact O-N 2.7Å; V369-G373 CarbonylContact O-C 3.54Å; V369-G373 WeakPolarHBondContact O-CA 3.44Å; V369-G373 PolarHBondContact O-N 3.04Å; V369-M374 PolarHBondContact O-N 3.4Å; V369-L379 HydrophobicContact CG1-CD1 3.76Å; V369-L379 HydrophobicContact CG1-CD2 4.34Å; V369-Y380 HydrophobicContact CG1-CE2 4.32Å; V369-I411 HydrophobicContact CB-CD1 4.48Å; V369-I411 HydrophobicContact CG2-CD1 3.9Å; V369-I411 HydrophobicContact CG2-CG1 4.21Å; V369-V414 HydrophobicContact CG2-CG1 4.15Å
370	M	91.9	Very high	93.1	Very high	34 Å²	34	25.1 Å²	25.1	17%	0.167	13%	0.129	C	C	.	.	I	π-helix	trans	-63.5	-35.9	175.9	-70.3	-58.7	-68.9	0	0	112.4	V366 N367 M374 H477 A480 F559	V366-M370 HydrophobicContact CG1-CG 4.32Å; V366-M370 WeakPolarHBondContact O-CG 3.31Å; V366-M370 PolarHBondContact O-N 3.36Å; N367-M370 PolarHBondContact O-N 2.77Å; M370-M374 HydrophobicContact CE-CE 4.07Å; M370-M374 HydrophobicContact CE-SD 4.29Å; M370-M374 WeakPolarHBondContact O-CG 3.34Å; M370-M374 HydrophobicContact SD-CE 3.92Å; M370-M374 HydrophobicContact SD-CG 4.35Å; M370-M374 HydrophobicContact SD-SD 3.52Å; M370-H477 WeakPolarHBondContact CG-ND1 3.36Å; M370-H477 PolarHBondContact SD-ND1 3.49Å; M370-A480 HydrophobicContact CE-CB 3.68Å; M370-A480 HydrophobicContact SD-CB 4.06Å; M370-F559 HydrophobicContact CB-CB 4.35Å; M370-F559 HydrophobicContact CB-CD1 4.43Å; M370-F559 HydrophobicContact CE-CB 3.66Å; M370-F559 HydrophobicContact CE-CD1 4.34Å; M370-F559 HydrophobicContact CE-CD2 3.79Å; M370-F559 HydrophobicContact CE-CG 3.68Å; M370-F559 HydrophobicContact CG-CB 4.26Å; M370-F559 HydrophobicContact CG-CD1 3.73Å; M370-F559 HydrophobicContact CG-CE1 4.24Å; M370-F559 HydrophobicContact CG-CG 4.02Å; M370-F559 HydrophobicContact SD-CG 4.49Å
371	A	88	Confident	93.6	Very high	43 Å²	43	30.7 Å²	30.7	36%	0.355	15%	0.148	S	C	.	.	I	π-helix	trans	-71	-45.7	-177.7	0	0	0	0	0	114	I281 N367 E368 V369	I281-A371 HydrophobicContact CB-CB 4.37Å; I281-A371 HydrophobicContact CD1-CB 3.67Å; I281-A371 HydrophobicContact CG2-CB 3.84Å; N367-A371 WeakPolarHBondContact O-CB 3.28Å; N367-A371 PolarHBondContact O-N 2.93Å; E368-A371 PolarHBondContact O-N 2.98Å; V369-A371 VanDerWaalsContact C-N 3.3Å; V369-A371 PolarHBondContact O-N 2.7Å
372	R	91.3	Very high	93.8	Very high	85 Å²	85	32.9 Å²	32.9	32%	0.321	16%	0.162	S	C	.	.	I	π-helix	trans	-128.5	-17.1	-172.5	71.6	180	177.5	92.8	-0.8	115.1	E368 I408 E409 I411	E368-R372 WeakPolarHBondContact O-CG 3.44Å; E368-R372 PolarHBondContact O-N 3.23Å; E368-R372 VanDerWaalsContact O-N 3.14Å; E368-R372 VanDerWaalsContact OE1-CD 3.3Å; E368-R372 WeakPolarHBondContact OE1-CD 3.26Å; E368-R372 IonicContact OE1-CZ 3.13Å; E368-R372 IonicContact OE1-NE 2.72Å; E368-R372 PolarHBondContact OE1-NE 3.31Å; E368-R372 IonicContact OE1-NH2 3.45Å; R372-I408 VanDerWaalsContact CZ-O 3.3Å; R372-I408 PolarHBondContact NH2-O 3.38Å; R372-E409 PolarHBondContact NH1-O 2.92Å; R372-I411 HydrophobicContact CG-CD1 4.01Å; R372-I411 VanDerWaalsContact CZ-CD1 3.43Å
373	G	92.6	Very high	93.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.194	C	C	.	.	I	π-helix	trans	-81.6	-19.2	-177.3	0	0	0	0	0	114.4	V369 K375 T376 L379	V369-G373 CarbonylContact O-C 3.54Å; V369-G373 WeakPolarHBondContact O-CA 3.44Å; V369-G373 PolarHBondContact O-N 3.04Å; G373-K375 PolarHBondContact O-N 2.71Å; G373-T376 VanDerWaalsContact O-CB 3.28Å; G373-T376 WeakPolarHBondContact O-CB 3.45Å; G373-T376 PolarHBondContact O-N 2.86Å; G373-T376 PolarHBondContact O-OG1 3.4Å; G373-L379 WeakPolarHBondContact O-CD1 3.18Å
374	M	92.9	Very high	94	Very high	30 Å²	30	38 Å²	38	15%	0.148	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-7.5	-172.6	-59.9	-56.9	-74.9	0	0	115.1	V369 M370 A480 V481 T484 C487	V369-M374 PolarHBondContact O-N 3.4Å; M370-M374 HydrophobicContact CE-CE 4.07Å; M370-M374 HydrophobicContact CE-SD 4.29Å; M370-M374 WeakPolarHBondContact O-CG 3.34Å; M370-M374 HydrophobicContact SD-CE 3.92Å; M370-M374 HydrophobicContact SD-CG 4.35Å; M370-M374 HydrophobicContact SD-SD 3.52Å; M374-A480 HydrophobicContact CE-CB 4.5Å; M374-V481 HydrophobicContact CE-CG2 4.47Å; M374-V481 HydrophobicContact SD-CG2 4.14Å; M374-T484 HydrophobicContact CE-CG2 4.18Å; M374-T484 WeakPolarHBondContact CE-OG1 3.38Å; M374-T484 VanDerWaalsContact O-CG2 3.31Å; M374-T484 WeakPolarHBondContact O-CG2 3.45Å; M374-C487 PolarHBondContact O-SG 2.98Å; M374-C487 VanDerWaalsContact O-SG 3.37Å
375	K	92.5	Very high	94.3	Very high	173 Å²	173	40.6 Å²	40.6	75%	0.752	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.8	3.7	173.7	-59.7	-178.4	-177.8	179.8	0	112.8	G373 L486	G373-K375 PolarHBondContact O-N 2.71Å; K375-L486 HydrophobicContact CB-CD1 4.41Å; K375-L486 HydrophobicContact CG-CD1 4.1Å
376	T	95.5	Very high	94.4	Very high	41 Å²	41	46.4 Å²	46.4	25%	0.252	25%	0.245	S	C	.	.	S	Bend	trans	-97.4	127.1	-176.3	-54.5	0	0	0	0	110.4	G373 L379 I411 H412 C487	G373-T376 VanDerWaalsContact O-CB 3.28Å; G373-T376 WeakPolarHBondContact O-CB 3.45Å; G373-T376 PolarHBondContact O-N 2.86Å; G373-T376 PolarHBondContact O-OG1 3.4Å; T376-L379 HydrophobicContact CG2-CD2 4.38Å; T376-I411 HydrophobicContact CG2-CG2 3.83Å; T376-H412 WeakPolarHBondContact CG2-NE2 3.45Å; T376-C487 WeakPolarHBondContact O-CA 3.31Å
377	V	96.9	Very high	94.5	Very high	67 Å²	67	53.2 Å²	53.2	41%	0.406	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	138.5	176.5	176.5	0	0	0	0	110.4	L486 Q488	V377-L486 WeakPolarHBondContact CG2-O 3.42Å; V377-Q488 HydrophobicContact CG1-CB 4.21Å; V377-Q488 HydrophobicContact CG1-CG 4.28Å
378	G	96.8	Very high	94.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	30.4	171.4	0	0	0	0	0	114.5	Y380 R381 V382 C487	G378-Y380 PolarHBondContact O-N 2.97Å; G378-R381 PolarHBondContact O-N 3.29Å; G378-R381 VanDerWaalsContact O-N 3.08Å; G378-V382 PolarHBondContact O-N 3.12Å; G378-C487 PolarHBondContact N-O 3.33Å
379	L	97	Very high	95	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	136.5	171.3	-73.6	-176.7	0	0	0	110.8	V369 G373 T376 R381 I411 V481 M489	V369-L379 HydrophobicContact CG1-CD1 3.76Å; V369-L379 HydrophobicContact CG1-CD2 4.34Å; G373-L379 WeakPolarHBondContact O-CD1 3.18Å; T376-L379 HydrophobicContact CG2-CD2 4.38Å; L379-R381 PolarHBondContact O-N 3.19Å; L379-I411 HydrophobicContact CD2-CG1 4.3Å; L379-I411 HydrophobicContact CD2-CG2 4.04Å; L379-V481 HydrophobicContact CB-CG1 4.3Å; L379-V481 HydrophobicContact CD1-CG1 4.16Å; L379-V481 HydrophobicContact CD1-CG2 4.21Å; L379-M489 WeakPolarHBondContact O-CE 3.44Å; L379-M489 WeakPolarHBondContact O-CG 3.37Å
380	Y	98.2	Very high	95	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	-23.8	-174.9	-54.3	-74	0	0	0	117.2	V369 G378 C415 L418 K419 H477 L478 V481 L494 F498	V369-Y380 HydrophobicContact CG1-CE2 4.32Å; G378-Y380 PolarHBondContact O-N 2.97Å; Y380-C415 HydrophobicContact CD1-CB 3.61Å; Y380-C415 HydrophobicContact CE1-CB 3.7Å; Y380-C415 HydrophobicContact CG-CB 4.34Å; Y380-L418 HydrophobicContact CE1-CD2 4.06Å; Y380-K419 HydrophobicContact CD1-CD 4.42Å; Y380-K419 HydrophobicContact CD1-CG 4.25Å; Y380-K419 WeakPolarHBondContact O-CE 3.41Å; Y380-K419 PolarHBondContact O-NZ 3.43Å; Y380-H477 AromaticContact CE2-NE2 3.47Å; Y380-H477 WeakPolarHBondContact CE2-NE2 3.4Å; Y380-H477 AromaticContact CZ-NE2 3.43Å; Y380-H477 PolarHBondContact OH-NE2 3.3Å; Y380-L478 HydrophobicContact CD2-CD2 4.48Å; Y380-L478 HydrophobicContact CE2-CD2 4.34Å; Y380-V481 HydrophobicContact CE2-CG2 4.31Å; Y380-L494 HydrophobicContact CD2-CD2 4.27Å; Y380-F498 AromaticContact CD1-CE2 3.74Å; Y380-F498 HydrophobicContact CD1-CE2 3.74Å; Y380-F498 AromaticContact CD1-CZ 3.41Å; Y380-F498 HydrophobicContact CD1-CZ 3.41Å; Y380-F498 VanDerWaalsContact CD1-CZ 3.41Å; Y380-F498 AromaticContact CD2-CE2 3.81Å; Y380-F498 HydrophobicContact CD2-CE2 3.81Å; Y380-F498 HydrophobicContact CD2-CZ 4.16Å; Y380-F498 HydrophobicContact CE1-CE2 4.37Å; Y380-F498 AromaticContact CE1-CZ 3.76Å; Y380-F498 HydrophobicContact CE1-CZ 3.76Å; Y380-F498 HydrophobicContact CE2-CE2 4.44Å; Y380-F498 HydrophobicContact CE2-CZ 4.46Å; Y380-F498 AromaticContact CG-CE2 3.43Å; Y380-F498 HydrophobicContact CG-CE2 3.43Å; Y380-F498 VanDerWaalsContact CG-CE2 3.43Å; Y380-F498 AromaticContact CG-CZ 3.64Å; Y380-F498 HydrophobicContact CG-CZ 3.64Å
381	R	97.4	Very high	95.1	Very high	126 Å²	126	61.9 Å²	61.9	48%	0.475	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-50.6	172.8	-176.7	-173.5	73.3	-165.3	1.1	111.7	G378 L379 M489	G378-R381 PolarHBondContact O-N 3.29Å; G378-R381 VanDerWaalsContact O-N 3.08Å; L379-R381 PolarHBondContact O-N 3.19Å; R381-M489 HydrophobicContact CB-CE 3.74Å; R381-M489 HydrophobicContact CB-SD 3.61Å; R381-M489 HydrophobicContact CG-SD 4.45Å
382	V	97.3	Very high	95.3	Very high	59 Å²	59	60 Å²	60	36%	0.358	30%	0.298	S	S	.	.	S	Bend	trans	-71.2	131.4	178.3	176.8	0	0	0	0	109.4	G378	G378-V382 PolarHBondContact O-N 3.12Å
383	S	95.1	Very high	95.4	Very high	98 Å²	98	56.8 Å²	56.8	69%	0.685	29%	0.286	S	S	*	.			trans	-85.8	128.7	178.6	-66.7	0	0	0	0	110.6
384	G	95.2	Very high	95.3	Very high	10 Å²	10	59.2 Å²	59.2	10%	0.103	30%	0.297	C	S	.	.			trans	-77.4	174.8	164.9	0	0	0	0	0	111.4	E386 D410	G384-E386 PolarHBondContact O-N 3Å; G384-E386 VanDerWaalsContact O-N 3.11Å; G384-D410 WeakPolarHBondContact CA-OD2 3.33Å
385	S	96.7	Very high	95.1	Very high	57 Å²	57	63.5 Å²	63.5	40%	0.399	32%	0.315	S	S	.	.			trans	-55.5	117.5	176.4	176.6	0	0	0	0	111.4	K387 Q388 V389	S385-K387 PolarHBondContact O-N 2.86Å; S385-Q388 PolarHBondContact O-N 3.24Å; S385-V389 WeakPolarHBondContact O-CG2 3.24Å; S385-V389 PolarHBondContact O-N 3.41Å
386	E	95.5	Very high	94.9	Very high	122 Å²	122	56.4 Å²	56.4	57%	0.57	28%	0.284	S	S	*	.	H	α-helix	trans	-56.7	-38.1	-178.6	-67.7	-163.8	171	0	0	113.1	G384 V389 R390	G384-E386 PolarHBondContact O-N 3Å; G384-E386 VanDerWaalsContact O-N 3.11Å; E386-V389 PolarHBondContact O-N 3.5Å; E386-R390 WeakPolarHBondContact O-CG 3.31Å; E386-R390 PolarHBondContact O-N 3.4Å; E386-R390 IonicContact OE2-CZ 3.96Å; E386-R390 IonicContact OE2-NH1 3.25Å; E386-R390 PolarHBondContact OE2-NH1 3.16Å; E386-R390 IonicContact OE2-NH2 3.26Å
387	K	96.1	Very high	94.4	Very high	143 Å²	143	56 Å²	56	62%	0.622	28%	0.28	S	S	*	.	H	α-helix	trans	-61.1	-48.9	176.8	-177.6	179.8	176.5	-178.6	0	110.3	S385 V389 R390 D391	S385-K387 PolarHBondContact O-N 2.86Å; K387-V389 VanDerWaalsContact C-N 3.33Å; K387-V389 PolarHBondContact O-N 3.04Å; K387-R390 PolarHBondContact O-N 2.9Å; K387-D391 WeakPolarHBondContact O-CB 3.5Å; K387-D391 PolarHBondContact O-N 3.46Å
388	Q	96.5	Very high	93.6	Very high	97 Å²	97	59.8 Å²	59.8	45%	0.453	29%	0.287	S	S	.	.	H	α-helix	trans	-66.3	-35.8	178.7	-65	-179.3	-44.6	0	0	112.2	S385 D391 L392 V413	S385-Q388 PolarHBondContact O-N 3.24Å; Q388-D391 PolarHBondContact O-N 2.95Å; Q388-L392 VanDerWaalsContact O-CB 3.28Å; Q388-L392 WeakPolarHBondContact O-CB 3.49Å; Q388-L392 PolarHBondContact O-N 3.03Å; Q388-V413 HydrophobicContact CB-CG1 3.83Å; Q388-V413 HydrophobicContact CB-CG2 3.8Å
389	V	97.1	Very high	92.3	Very high	14 Å²	14	61.4 Å²	61.4	9%	0.085	30%	0.298	C	S	.	.	H	α-helix	trans	-60.1	-49	173.8	168.7	0	0	0	0	110.4	S385 E386 K387 L392 Y393 V413 L420	S385-V389 WeakPolarHBondContact O-CG2 3.24Å; S385-V389 PolarHBondContact O-N 3.41Å; E386-V389 PolarHBondContact O-N 3.5Å; K387-V389 VanDerWaalsContact C-N 3.33Å; K387-V389 PolarHBondContact O-N 3.04Å; V389-L392 PolarHBondContact O-N 3.13Å; V389-Y393 VanDerWaalsContact O-CB 3.3Å; V389-Y393 WeakPolarHBondContact O-CB 3.39Å; V389-Y393 PolarHBondContact O-N 3.28Å; V389-V413 HydrophobicContact CG2-CB 4.36Å; V389-V413 HydrophobicContact CG2-CG1 4.15Å; V389-L420 HydrophobicContact CG1-CB 4.26Å; V389-L420 HydrophobicContact CG1-CD2 3.94Å
390	R	94.2	Very high	90.9	Very high	71 Å²	71	72 Å²	72	27%	0.268	34%	0.339	S	S	.	.	H	α-helix	trans	-64	-46.3	177.2	-72.6	-164	-71.4	-92.4	7.5	111.5	E386 K387 L392 Y393 E394 L420	E386-R390 WeakPolarHBondContact O-CG 3.31Å; E386-R390 PolarHBondContact O-N 3.4Å; E386-R390 IonicContact OE2-CZ 3.96Å; E386-R390 IonicContact OE2-NH1 3.25Å; E386-R390 PolarHBondContact OE2-NH1 3.16Å; E386-R390 IonicContact OE2-NH2 3.26Å; K387-R390 PolarHBondContact O-N 2.9Å; R390-L392 VanDerWaalsContact C-N 3.29Å; R390-L392 PolarHBondContact O-N 3.38Å; R390-Y393 PolarHBondContact O-N 3.43Å; R390-E394 WeakPolarHBondContact O-CB 3.21Å; R390-E394 VanDerWaalsContact O-CG 3.31Å; R390-E394 WeakPolarHBondContact O-CG 3.41Å; R390-E394 PolarHBondContact O-N 2.92Å; R390-L420 HydrophobicContact CG-CD2 4.28Å
391	D	93.6	Very high	89.4	Confident	64 Å²	64	75.4 Å²	75.4	34%	0.342	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-39.9	178.3	-68.8	-12.9	0	0	0	111.7	K387 Q388 K395	K387-D391 WeakPolarHBondContact O-CB 3.5Å; K387-D391 PolarHBondContact O-N 3.46Å; Q388-D391 PolarHBondContact O-N 2.95Å; D391-K395 WeakPolarHBondContact O-CB 3.07Å; D391-K395 WeakPolarHBondContact O-CD 3.05Å; D391-K395 WeakPolarHBondContact O-CG 3.47Å; D391-K395 PolarHBondContact O-N 3.39Å
392	L	93.7	Very high	88.3	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-67.1	-47.7	176.1	178.6	55.5	0	0	0	111.6	Q388 V389 R390 E394 K395 F396 P403 L405 I408 V413 V414 C417	Q388-L392 VanDerWaalsContact O-CB 3.28Å; Q388-L392 WeakPolarHBondContact O-CB 3.49Å; Q388-L392 PolarHBondContact O-N 3.03Å; V389-L392 PolarHBondContact O-N 3.13Å; R390-L392 VanDerWaalsContact C-N 3.29Å; R390-L392 PolarHBondContact O-N 3.38Å; L392-E394 VanDerWaalsContact C-N 3.34Å; L392-E394 PolarHBondContact O-N 3.38Å; L392-K395 WeakPolarHBondContact O-CB 3.48Å; L392-K395 PolarHBondContact O-N 3.06Å; L392-K395 VanDerWaalsContact O-N 3.17Å; L392-F396 HydrophobicContact CD1-CD2 3.86Å; L392-F396 HydrophobicContact CD1-CE2 3.61Å; L392-F396 HydrophobicContact CD2-CE2 4.28Å; L392-F396 HydrophobicContact CG-CD2 3.98Å; L392-F396 HydrophobicContact CG-CE2 3.83Å; L392-F396 WeakPolarHBondContact O-CD2 3.47Å; L392-F396 PolarHBondContact O-N 2.93Å; L392-P403 HydrophobicContact CD1-CB 4.14Å; L392-P403 HydrophobicContact CD1-CG 3.89Å; L392-L405 HydrophobicContact CD1-CD2 3.82Å; L392-L405 HydrophobicContact CD2-CD2 4Å; L392-L405 HydrophobicContact CG-CD2 4.48Å; L392-I408 HydrophobicContact CB-CD1 4.35Å; L392-I408 HydrophobicContact CD1-CD1 3.42Å; L392-I408 VanDerWaalsContact CD1-CD1 3.42Å; L392-I408 HydrophobicContact CD2-CD1 3.46Å; L392-I408 VanDerWaalsContact CD2-CD1 3.46Å; L392-I408 HydrophobicContact CG-CD1 3.89Å; L392-V413 HydrophobicContact CB-CG1 4.48Å; L392-V413 HydrophobicContact CD2-CG1 4.18Å; L392-V414 HydrophobicContact CD2-CG2 4.42Å; L392-C417 HydrophobicContact CB-CB 4.5Å; L392-C417 HydrophobicContact CD2-CB 3.69Å; L392-C417 HydrophobicContact CG-CB 4.12Å
393	Y	93	Very high	87.4	Confident	16 Å²	16	69 Å²	69	6%	0.063	34%	0.337	C	S	.	.	H	α-helix	trans	-57.7	-47.6	178	176.9	-107.8	0	0	0	111.5	L344 L361 V389 R390 K395 F396 L397 L420 F421 S424	L344-Y393 WeakPolarHBondContact CD1-OH 3.48Å; L361-Y393 HydrophobicContact CD1-CD2 4.21Å; L361-Y393 HydrophobicContact CD1-CE2 4.4Å; V389-Y393 VanDerWaalsContact O-CB 3.3Å; V389-Y393 WeakPolarHBondContact O-CB 3.39Å; V389-Y393 PolarHBondContact O-N 3.28Å; R390-Y393 PolarHBondContact O-N 3.43Å; Y393-K395 VanDerWaalsContact C-N 3.34Å; Y393-K395 PolarHBondContact O-N 2.82Å; Y393-F396 WeakPolarHBondContact O-CB 3.25Å; Y393-F396 PolarHBondContact O-N 3.29Å; Y393-L397 HydrophobicContact CD1-CD1 4.3Å; Y393-L397 HydrophobicContact CE1-CD1 3.59Å; Y393-L397 HydrophobicContact CE1-CG 4.45Å; Y393-L397 HydrophobicContact CE2-CD1 4.2Å; Y393-L397 HydrophobicContact CE2-CG 4.43Å; Y393-L397 PolarHBondContact O-N 2.86Å; Y393-L397 VanDerWaalsContact O-N 3.12Å; Y393-L420 HydrophobicContact CD1-CD2 3.89Å; Y393-L420 HydrophobicContact CD1-CG 4.32Å; Y393-L420 HydrophobicContact CD2-CD2 4.4Å; Y393-L420 HydrophobicContact CD2-CG 4.32Å; Y393-L420 HydrophobicContact CG-CD2 3.79Å; Y393-L420 HydrophobicContact CG-CG 4.17Å; Y393-F421 HydrophobicContact CD2-CB 4.24Å; Y393-F421 HydrophobicContact CE2-CB 3.88Å; Y393-F421 HydrophobicContact CE2-CD2 4.06Å; Y393-S424 VanDerWaalsContact OH-CB 3.32Å; Y393-S424 WeakPolarHBondContact OH-CB 3.41Å; Y393-S424 PolarHBondContact OH-OG 3.47Å
394	E	90.6	Very high	86.6	Confident	51 Å²	51	65.3 Å²	65.3	24%	0.238	31%	0.312	C	S	.	.	H	α-helix	trans	-63.5	-37.6	175.9	-71.8	-166.8	142.2	0	0	112.8	M339 R390 L392 L397 R398	M339-E394 HydrophobicContact CE-CG 4.2Å; M339-E394 WeakPolarHBondContact CE-OE1 3.39Å; R390-E394 WeakPolarHBondContact O-CB 3.21Å; R390-E394 VanDerWaalsContact O-CG 3.31Å; R390-E394 WeakPolarHBondContact O-CG 3.41Å; R390-E394 PolarHBondContact O-N 2.92Å; L392-E394 VanDerWaalsContact C-N 3.34Å; L392-E394 PolarHBondContact O-N 3.38Å; E394-L397 PolarHBondContact O-N 2.82Å; E394-R398 WeakPolarHBondContact O-CB 3.26Å; E394-R398 WeakPolarHBondContact O-CG 3.4Å; E394-R398 PolarHBondContact O-N 3.31Å; E394-R398 IonicContact OE1-CZ 3.73Å; E394-R398 IonicContact OE1-NH1 3.21Å; E394-R398 PolarHBondContact OE1-NH1 3.21Å; E394-R398 IonicContact OE1-NH2 2.95Å; E394-R398 IonicContact OE2-NH1 3.51Å; E394-R398 PolarHBondContact OE2-NH1 2.95Å
395	K	88.3	Confident	86.1	Confident	121 Å²	121	65 Å²	65	53%	0.526	31%	0.308	S	S	.	.	H	α-helix	trans	-60.2	-45.3	172.9	-79.2	166.8	-173.4	170.5	0	110.8	D391 L392 Y393 L397 S399 P403	D391-K395 WeakPolarHBondContact O-CB 3.07Å; D391-K395 WeakPolarHBondContact O-CD 3.05Å; D391-K395 WeakPolarHBondContact O-CG 3.47Å; D391-K395 PolarHBondContact O-N 3.39Å; L392-K395 WeakPolarHBondContact O-CB 3.48Å; L392-K395 PolarHBondContact O-N 3.06Å; L392-K395 VanDerWaalsContact O-N 3.17Å; Y393-K395 VanDerWaalsContact C-N 3.34Å; Y393-K395 PolarHBondContact O-N 2.82Å; K395-L397 VanDerWaalsContact C-N 3.31Å; K395-L397 PolarHBondContact O-N 3.47Å; K395-S399 WeakPolarHBondContact O-CB 3.34Å; K395-S399 PolarHBondContact O-N 3.24Å; K395-S399 PolarHBondContact O-OG 3.5Å; K395-P403 HydrophobicContact CB-CB 4.33Å
396	F	87.9	Confident	85.1	Confident	24 Å²	24	64.5 Å²	64.5	11%	0.105	31%	0.307	C	S	.	.	H	α-helix	trans	-59.5	-40.7	176.2	-86.2	-73.8	0	0	0	112.8	L361 H364 L392 Y393 T402 P403 L405	L361-F396 HydrophobicContact CB-CD1 4.07Å; L361-F396 HydrophobicContact CB-CE1 4.42Å; L361-F396 HydrophobicContact CB-CG 4.3Å; L361-F396 HydrophobicContact CD1-CB 3.67Å; L361-F396 HydrophobicContact CD1-CD1 4.48Å; L361-F396 HydrophobicContact CD1-CD2 4.14Å; L361-F396 HydrophobicContact CD1-CG 3.89Å; L361-F396 HydrophobicContact CG-CB 4.15Å; L361-F396 HydrophobicContact CG-CD1 4.04Å; L361-F396 HydrophobicContact CG-CD2 3.97Å; L361-F396 HydrophobicContact CG-CE1 4.38Å; L361-F396 HydrophobicContact CG-CE2 4.32Å; L361-F396 HydrophobicContact CG-CG 3.82Å; H364-F396 HydrophobicContact CB-CE1 4.15Å; H364-F396 HydrophobicContact CB-CZ 4.19Å; L392-F396 HydrophobicContact CD1-CD2 3.86Å; L392-F396 HydrophobicContact CD1-CE2 3.61Å; L392-F396 HydrophobicContact CD2-CE2 4.28Å; L392-F396 HydrophobicContact CG-CD2 3.98Å; L392-F396 HydrophobicContact CG-CE2 3.83Å; L392-F396 WeakPolarHBondContact O-CD2 3.47Å; L392-F396 PolarHBondContact O-N 2.93Å; Y393-F396 WeakPolarHBondContact O-CB 3.25Å; Y393-F396 PolarHBondContact O-N 3.29Å; F396-T402 HydrophobicContact CE1-CG2 4.13Å; F396-P403 HydrophobicContact CD1-CG 3.74Å; F396-P403 HydrophobicContact CD2-CG 3.76Å; F396-P403 HydrophobicContact CE1-CG 3.63Å; F396-P403 HydrophobicContact CE2-CG 3.65Å; F396-P403 HydrophobicContact CG-CG 3.81Å; F396-P403 HydrophobicContact CZ-CG 3.58Å; F396-L405 HydrophobicContact CE2-CD2 3.91Å; F396-L405 HydrophobicContact CZ-CD1 4.25Å; F396-L405 HydrophobicContact CZ-CD2 3.84Å; F396-L405 HydrophobicContact CZ-CG 4.32Å
397	L	84.9	Confident	84.4	Confident	31 Å²	31	63 Å²	63	16%	0.162	30%	0.302	C	S	.	.	H	α-helix	trans	-78.7	-37	-177.4	-64.4	-172.8	0	0	0	114.2	L344 Y393 E394 K395	L344-L397 HydrophobicContact CD1-CD1 4.39Å; L344-L397 HydrophobicContact CD2-CD2 4.39Å; Y393-L397 HydrophobicContact CD1-CD1 4.3Å; Y393-L397 HydrophobicContact CE1-CD1 3.59Å; Y393-L397 HydrophobicContact CE1-CG 4.45Å; Y393-L397 HydrophobicContact CE2-CD1 4.2Å; Y393-L397 HydrophobicContact CE2-CG 4.43Å; Y393-L397 PolarHBondContact O-N 2.86Å; Y393-L397 VanDerWaalsContact O-N 3.12Å; E394-L397 PolarHBondContact O-N 2.82Å; K395-L397 VanDerWaalsContact C-N 3.31Å; K395-L397 PolarHBondContact O-N 3.47Å
398	R	81.5	Confident	84.1	Confident	147 Å²	147	57.6 Å²	57.6	56%	0.555	28%	0.28	S	S	*	.	H	α-helix	trans	-90.7	-29.5	-174.9	-68.3	-171.8	173.1	106.4	1.9	113.4	E394	E394-R398 WeakPolarHBondContact O-CB 3.26Å; E394-R398 WeakPolarHBondContact O-CG 3.4Å; E394-R398 PolarHBondContact O-N 3.31Å; E394-R398 IonicContact OE1-CZ 3.73Å; E394-R398 IonicContact OE1-NH1 3.21Å; E394-R398 PolarHBondContact OE1-NH1 3.21Å; E394-R398 IonicContact OE1-NH2 2.95Å; E394-R398 IonicContact OE2-NH1 3.51Å; E394-R398 PolarHBondContact OE2-NH1 2.95Å
399	S	69.4	Low	83.8	Confident	34 Å²	34	61.9 Å²	61.9	24%	0.238	30%	0.3	C	S	.	.			trans	-83.4	145.3	-172.5	73.5	0	0	0	0	112.2	K395 S401	K395-S399 WeakPolarHBondContact O-CB 3.34Å; K395-S399 PolarHBondContact O-N 3.24Å; K395-S399 PolarHBondContact O-OG 3.5Å; S399-S401 PolarHBondContact O-N 3.29Å; S399-S401 PolarHBondContact OG-O 2.94Å
400	R	66	Low	83.7	Confident	224 Å²	224	63.8 Å²	63.8	85%	0.845	31%	0.31	S	S	*	.	S	Bend	trans	-80.1	1.8	174.6	-65.6	-174.3	177.5	175.7	-0.8	113.3	P287	P287-R400 WeakPolarHBondContact CB-O 3.27Å; P287-R400 VanDerWaalsContact CG-O 3.28Å; P287-R400 WeakPolarHBondContact CG-O 3.48Å
401	S	67.8	Low	83.8	Confident	70 Å²	70	60.7 Å²	60.7	49%	0.49	30%	0.299	S	S	.	.	S	Bend	trans	-142.6	136.3	-173	57.1	0	0	0	0	109.5	S399	S399-S401 PolarHBondContact O-N 3.29Å; S399-S401 PolarHBondContact OG-O 2.94Å
402	T	73.8	Confident	84	Confident	29 Å²	29	58.8 Å²	58.8	18%	0.178	29%	0.288	C	S	.	.			trans	-51.4	125.7	177	-55.6	0	0	0	0	111.1	H364 F396	H364-T402 HydrophobicContact CB-CG2 4.3Å; H364-T402 WeakPolarHBondContact CD2-CG2 3.14Å; H364-T402 VanDerWaalsContact NE2-CG2 3.31Å; H364-T402 WeakPolarHBondContact NE2-CG2 3.4Å; H364-T402 PolarHBondContact NE2-OG1 3.01Å; F396-T402 HydrophobicContact CE1-CG2 4.13Å
403	P	78.8	Confident	84.2	Confident	21 Å²	21	58.7 Å²	58.7	14%	0.136	29%	0.287	C	S	.	.			trans	-61.6	143.7	175.7	25.6	-33.1	0	0	0	110.5	L392 K395 F396 L405	L392-P403 HydrophobicContact CD1-CB 4.14Å; L392-P403 HydrophobicContact CD1-CG 3.89Å; K395-P403 HydrophobicContact CB-CB 4.33Å; F396-P403 HydrophobicContact CD1-CG 3.74Å; F396-P403 HydrophobicContact CD2-CG 3.76Å; F396-P403 HydrophobicContact CE1-CG 3.63Å; F396-P403 HydrophobicContact CE2-CG 3.65Å; F396-P403 HydrophobicContact CG-CG 3.81Å; F396-P403 HydrophobicContact CZ-CG 3.58Å; P403-L405 PolarHBondContact O-N 3.47Å
404	S	78.1	Confident	84.3	Confident	22 Å²	22	57.9 Å²	57.9	15%	0.154	28%	0.284	C	S	.	.			trans	-72.4	93.7	177.7	-179.4	0	0	0	0	110.1	S250 A406 L407	S250-S404 PolarHBondContact O-OG 3.27Å; S404-A406 PolarHBondContact O-N 2.92Å; S404-L407 WeakPolarHBondContact O-CB 3.5Å; S404-L407 PolarHBondContact O-N 2.85Å
405	L	83.8	Confident	84.7	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-61.6	-24.6	179.2	-63.2	-176.8	0	0	0	113.2	H364 E368 L392 F396 P403 L407 I408 V414	H364-L405 HydrophobicContact CB-CD1 4.02Å; H364-L405 VanDerWaalsContact O-CD1 3.28Å; H364-L405 WeakPolarHBondContact O-CD1 3.31Å; E368-L405 HydrophobicContact CB-CB 4.32Å; E368-L405 HydrophobicContact CB-CD1 3.65Å; E368-L405 HydrophobicContact CG-CB 3.77Å; E368-L405 HydrophobicContact CG-CD1 4.01Å; L392-L405 HydrophobicContact CD1-CD2 3.82Å; L392-L405 HydrophobicContact CD2-CD2 4Å; L392-L405 HydrophobicContact CG-CD2 4.48Å; F396-L405 HydrophobicContact CE2-CD2 3.91Å; F396-L405 HydrophobicContact CZ-CD1 4.25Å; F396-L405 HydrophobicContact CZ-CD2 3.84Å; F396-L405 HydrophobicContact CZ-CG 4.32Å; P403-L405 PolarHBondContact O-N 3.47Å; L405-L407 PolarHBondContact O-N 3.42Å; L405-L407 VanDerWaalsContact O-N 3.15Å; L405-I408 HydrophobicContact CD2-CD1 3.91Å; L405-I408 WeakPolarHBondContact O-CB 3.49Å; L405-I408 PolarHBondContact O-N 3.15Å; L405-V414 HydrophobicContact CD1-CG1 4.47Å
406	A	75.9	Confident	85.2	Confident	45 Å²	45	50.2 Å²	50.2	37%	0.372	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-62	-17.1	172.8	0	0	0	0	0	114.5	A251 S404 I408	A251-A406 WeakPolarHBondContact O-CB 3.31Å; S404-A406 PolarHBondContact O-N 2.92Å; A406-I408 VanDerWaalsContact C-N 3.29Å
407	L	82	Confident	85.6	Confident	90 Å²	90	49.1 Å²	49.1	47%	0.471	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-82.3	-9.2	173.6	-75.5	172.7	0	0	0	113	L248 S404 L405	L248-L407 HydrophobicContact CD1-CD1 3.95Å; S404-L407 WeakPolarHBondContact O-CB 3.5Å; S404-L407 PolarHBondContact O-N 2.85Å; L405-L407 PolarHBondContact O-N 3.42Å; L405-L407 VanDerWaalsContact O-N 3.15Å
408	I	89.2	Confident	86.2	Confident	31 Å²	31	47.7 Å²	47.7	16%	0.159	24%	0.24	C	C	.	.			trans	-100.1	97.7	-175.5	-52.1	-178.8	0	0	0	106.7	R372 L392 L405 A406 V413 V414	R372-I408 VanDerWaalsContact CZ-O 3.3Å; R372-I408 PolarHBondContact NH2-O 3.38Å; L392-I408 HydrophobicContact CB-CD1 4.35Å; L392-I408 HydrophobicContact CD1-CD1 3.42Å; L392-I408 VanDerWaalsContact CD1-CD1 3.42Å; L392-I408 HydrophobicContact CD2-CD1 3.46Å; L392-I408 VanDerWaalsContact CD2-CD1 3.46Å; L392-I408 HydrophobicContact CG-CD1 3.89Å; L405-I408 HydrophobicContact CD2-CD1 3.91Å; L405-I408 WeakPolarHBondContact O-CB 3.49Å; L405-I408 PolarHBondContact O-N 3.15Å; A406-I408 VanDerWaalsContact C-N 3.29Å; I408-V413 HydrophobicContact CG2-CB 3.82Å; I408-V413 HydrophobicContact CG2-CG1 3.78Å; I408-V414 HydrophobicContact CG2-CG2 4.31Å
409	E	89.7	Confident	87	Confident	186 Å²	186	42.2 Å²	42.2	87%	0.869	22%	0.221	S	C	*	.			trans	-61.3	-47.7	-175.9	-63.1	179.6	178.1	0	0	111.2	R372 I411	R372-E409 PolarHBondContact NH1-O 2.92Å; E409-I411 PolarHBondContact O-N 2.81Å
410	D	94.9	Very high	88.3	Confident	54 Å²	54	42.3 Å²	42.3	29%	0.289	22%	0.218	S	C	.	.			trans	-74.3	114.8	179.5	-177.5	9.6	0	0	0	111.9	G384 H412 V413	G384-D410 WeakPolarHBondContact CA-OD2 3.33Å; D410-H412 PolarHBondContact O-N 2.92Å; D410-H412 VanDerWaalsContact OD1-CB 3.26Å; D410-H412 WeakPolarHBondContact OD1-CB 3.32Å; D410-H412 IonicContact OD1-CD2 3.73Å; D410-H412 PolarHBondContact OD1-CD2 3.26Å; D410-H412 IonicContact OD1-CG 3.15Å; D410-H412 PolarHBondContact OD1-N 3.2Å; D410-V413 HydrophobicContact CB-CG2 3.96Å; D410-V413 WeakPolarHBondContact O-CB 3.34Å; D410-V413 PolarHBondContact O-N 3.09Å
411	I	96.5	Very high	89.7	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.036	18%	0.178	C	C	.	.	H	α-helix	trans	-68.8	-25.2	176.2	-166.7	63.1	0	0	0	112.4	E368 V369 R372 T376 L379 E409 V413 V414 C415	E368-I411 HydrophobicContact CG-CD1 4.29Å; V369-I411 HydrophobicContact CB-CD1 4.48Å; V369-I411 HydrophobicContact CG2-CD1 3.9Å; V369-I411 HydrophobicContact CG2-CG1 4.21Å; R372-I411 HydrophobicContact CG-CD1 4.01Å; R372-I411 VanDerWaalsContact CZ-CD1 3.43Å; T376-I411 HydrophobicContact CG2-CG2 3.83Å; L379-I411 HydrophobicContact CD2-CG1 4.3Å; L379-I411 HydrophobicContact CD2-CG2 4.04Å; E409-I411 PolarHBondContact O-N 2.81Å; I411-V413 PolarHBondContact O-N 3.37Å; I411-V414 HydrophobicContact CD1-CB 4.1Å; I411-V414 HydrophobicContact CD1-CG2 4.23Å; I411-V414 WeakPolarHBondContact O-CB 3.3Å; I411-V414 PolarHBondContact O-N 2.89Å; I411-C415 PolarHBondContact O-N 3.22Å; I411-C415 PolarHBondContact O-SG 2.87Å
412	H	97.7	Very high	91	Very high	24 Å²	24	28.5 Å²	28.5	11%	0.111	16%	0.156	C	C	.	.	H	α-helix	trans	-68.1	-23.4	178.1	-57.4	-64.1	0	0	0	111.8	T376 D410 G416	T376-H412 WeakPolarHBondContact CG2-NE2 3.45Å; D410-H412 PolarHBondContact O-N 2.92Å; D410-H412 VanDerWaalsContact OD1-CB 3.26Å; D410-H412 WeakPolarHBondContact OD1-CB 3.32Å; D410-H412 IonicContact OD1-CD2 3.73Å; D410-H412 PolarHBondContact OD1-CD2 3.26Å; D410-H412 IonicContact OD1-CG 3.15Å; D410-H412 PolarHBondContact OD1-N 3.2Å; H412-G416 PolarHBondContact O-N 3.4Å
413	V	97.8	Very high	92	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-42.5	168.4	173.4	0	0	0	0	111.2	Q388 V389 L392 I408 D410 I411 G416 C417	Q388-V413 HydrophobicContact CB-CG1 3.83Å; Q388-V413 HydrophobicContact CB-CG2 3.8Å; V389-V413 HydrophobicContact CG2-CB 4.36Å; V389-V413 HydrophobicContact CG2-CG1 4.15Å; L392-V413 HydrophobicContact CB-CG1 4.48Å; L392-V413 HydrophobicContact CD2-CG1 4.18Å; I408-V413 HydrophobicContact CG2-CB 3.82Å; I408-V413 HydrophobicContact CG2-CG1 3.78Å; D410-V413 HydrophobicContact CB-CG2 3.96Å; D410-V413 WeakPolarHBondContact O-CB 3.34Å; D410-V413 PolarHBondContact O-N 3.09Å; I411-V413 PolarHBondContact O-N 3.37Å; V413-G416 PolarHBondContact O-N 2.75Å; V413-C417 WeakPolarHBondContact O-CB 3.47Å; V413-C417 PolarHBondContact O-N 3.22Å
414	V	96.7	Very high	92.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.9	-44.1	177.2	-176.3	0	0	0	0	110.5	C365 E368 V369 L392 L405 I408 I411 G416 C417 L418	C365-V414 HydrophobicContact CB-CG1 3.92Å; E368-V414 HydrophobicContact CB-CG1 4.29Å; E368-V414 HydrophobicContact CG-CG1 4.45Å; E368-V414 HydrophobicContact CG-CG2 4.42Å; V369-V414 HydrophobicContact CG2-CG1 4.15Å; L392-V414 HydrophobicContact CD2-CG2 4.42Å; L405-V414 HydrophobicContact CD1-CG1 4.47Å; I408-V414 HydrophobicContact CG2-CG2 4.31Å; I411-V414 HydrophobicContact CD1-CB 4.1Å; I411-V414 HydrophobicContact CD1-CG2 4.23Å; I411-V414 WeakPolarHBondContact O-CB 3.3Å; I411-V414 PolarHBondContact O-N 2.89Å; V414-G416 VanDerWaalsContact C-N 3.34Å; V414-G416 PolarHBondContact O-N 3.41Å; V414-C417 PolarHBondContact O-N 3.25Å; V414-L418 PolarHBondContact O-N 3.27Å
415	C	98.3	Very high	93.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.6	-46.3	174.1	-63.2	0	0	0	0	111.5	Y380 I411 C417 L418 K419	Y380-C415 HydrophobicContact CD1-CB 3.61Å; Y380-C415 HydrophobicContact CE1-CB 3.7Å; Y380-C415 HydrophobicContact CG-CB 4.34Å; I411-C415 PolarHBondContact O-N 3.22Å; I411-C415 PolarHBondContact O-SG 2.87Å; C415-C417 PolarHBondContact O-N 3.41Å; C415-L418 PolarHBondContact O-N 3.42Å; C415-K419 WeakPolarHBondContact O-CG 3.32Å; C415-K419 PolarHBondContact O-N 2.95Å
416	G	98.1	Very high	93.7	Very high	11 Å²	11	38.1 Å²	38.1	11%	0.113	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-40.1	176.8	0	0	0	0	0	112.7	H412 V413 V414 K419 L420	H412-G416 PolarHBondContact O-N 3.4Å; V413-G416 PolarHBondContact O-N 2.75Å; V414-G416 VanDerWaalsContact C-N 3.34Å; V414-G416 PolarHBondContact O-N 3.41Å; G416-K419 PolarHBondContact O-N 3.19Å; G416-L420 VanDerWaalsContact O-CB 3.31Å; G416-L420 WeakPolarHBondContact O-CB 3.49Å; G416-L420 PolarHBondContact O-N 3.22Å
417	C	97.1	Very high	94.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-41.3	176.9	-177.7	0	0	0	0	112.1	L392 V413 V414 C415 L420 F421	L392-C417 HydrophobicContact CB-CB 4.5Å; L392-C417 HydrophobicContact CD2-CB 3.69Å; L392-C417 HydrophobicContact CG-CB 4.12Å; V413-C417 WeakPolarHBondContact O-CB 3.47Å; V413-C417 PolarHBondContact O-N 3.22Å; V414-C417 PolarHBondContact O-N 3.25Å; C415-C417 PolarHBondContact O-N 3.41Å; C417-L420 PolarHBondContact O-N 3.39Å; C417-F421 WeakPolarHBondContact O-CB 3.39Å; C417-F421 PolarHBondContact O-N 3.12Å
418	L	97.6	Very high	95.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-62.4	-47.5	174.5	-179.7	59.5	0	0	0	111.2	L361 V362 C365 V366 Y380 V414 C415 L420 F421 L422	L361-L418 HydrophobicContact CD2-CD1 4.46Å; V362-L418 HydrophobicContact CB-CD1 4.34Å; V362-L418 HydrophobicContact CG1-CD1 4.19Å; V362-L418 HydrophobicContact CG2-CD1 4.08Å; C365-L418 HydrophobicContact CB-CB 4.09Å; C365-L418 HydrophobicContact CB-CD1 4.4Å; V366-L418 HydrophobicContact CG2-CD2 4.03Å; Y380-L418 HydrophobicContact CE1-CD2 4.06Å; V414-L418 PolarHBondContact O-N 3.27Å; C415-L418 PolarHBondContact O-N 3.42Å; L418-L420 VanDerWaalsContact C-N 3.33Å; L418-L420 PolarHBondContact O-N 3.22Å; L418-F421 WeakPolarHBondContact O-CB 3.3Å; L418-F421 PolarHBondContact O-N 3.42Å; L418-L422 HydrophobicContact CD1-CD1 4.1Å; L418-L422 HydrophobicContact CD1-CG 4.4Å; L418-L422 HydrophobicContact CG-CD1 4.05Å; L418-L422 WeakPolarHBondContact O-CG 3.31Å; L418-L422 PolarHBondContact O-N 3.3Å
419	K	97.7	Very high	95.6	Very high	33 Å²	33	33.9 Å²	33.9	14%	0.143	16%	0.161	C	C	.	.	H	α-helix	trans	-61.5	-39.8	176.1	-68.7	-171	-59	176.2	0	112.4	Y380 C415 G416 R423 V497 F498 T501	Y380-K419 HydrophobicContact CD1-CD 4.42Å; Y380-K419 HydrophobicContact CD1-CG 4.25Å; Y380-K419 WeakPolarHBondContact O-CE 3.41Å; Y380-K419 PolarHBondContact O-NZ 3.43Å; C415-K419 WeakPolarHBondContact O-CG 3.32Å; C415-K419 PolarHBondContact O-N 2.95Å; G416-K419 PolarHBondContact O-N 3.19Å; K419-R423 WeakPolarHBondContact O-CG 3.49Å; K419-R423 PolarHBondContact O-N 3.05Å; K419-R423 VanDerWaalsContact O-N 3.13Å; K419-R423 PolarHBondContact O-NE 3.13Å; K419-V497 HydrophobicContact CD-CG1 3.72Å; K419-F498 HydrophobicContact CG-CE1 4.32Å; K419-F498 HydrophobicContact CG-CZ 4.34Å; K419-T501 HydrophobicContact CB-CG2 4.48Å
420	L	96	Very high	95.9	Very high	35 Å²	35	25 Å²	25	18%	0.183	12%	0.12	C	C	.	.	H	α-helix	trans	-64.3	-44.1	177.3	179	58.6	0	0	0	110.9	V389 R390 Y393 G416 C417 L418 L422 R423 S424	V389-L420 HydrophobicContact CG1-CB 4.26Å; V389-L420 HydrophobicContact CG1-CD2 3.94Å; R390-L420 HydrophobicContact CG-CD2 4.28Å; Y393-L420 HydrophobicContact CD1-CD2 3.89Å; Y393-L420 HydrophobicContact CD1-CG 4.32Å; Y393-L420 HydrophobicContact CD2-CD2 4.4Å; Y393-L420 HydrophobicContact CD2-CG 4.32Å; Y393-L420 HydrophobicContact CG-CD2 3.79Å; Y393-L420 HydrophobicContact CG-CG 4.17Å; G416-L420 VanDerWaalsContact O-CB 3.31Å; G416-L420 WeakPolarHBondContact O-CB 3.49Å; G416-L420 PolarHBondContact O-N 3.22Å; C417-L420 PolarHBondContact O-N 3.39Å; L418-L420 VanDerWaalsContact C-N 3.33Å; L418-L420 PolarHBondContact O-N 3.22Å; L420-L422 PolarHBondContact O-N 2.8Å; L420-R423 PolarHBondContact O-N 2.93Å; L420-S424 VanDerWaalsContact O-CB 3.27Å; L420-S424 WeakPolarHBondContact O-CB 3.49Å; L420-S424 PolarHBondContact O-N 3.15Å; L420-S424 VanDerWaalsContact O-N 3.08Å; L420-S424 PolarHBondContact O-OG 3.38Å
421	F	95.5	Very high	96	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.009	11%	0.107	C	C	.	.	H	α-helix	trans	-57.1	-50.5	175.6	170.9	-108.5	0	0	0	112.3	L346 L349 P359 L361 V362 Y393 C417 L418 R423 S424 L425	L346-F421 HydrophobicContact CD1-CZ 4.2Å; L349-F421 HydrophobicContact CD1-CE2 3.47Å; L349-F421 VanDerWaalsContact CD1-CE2 3.47Å; L349-F421 HydrophobicContact CD1-CZ 3.77Å; P359-F421 HydrophobicContact CB-CE1 4.33Å; P359-F421 HydrophobicContact CB-CZ 4.05Å; P359-F421 HydrophobicContact CG-CE1 4.11Å; P359-F421 HydrophobicContact CG-CZ 3.87Å; L361-F421 HydrophobicContact CD1-CB 3.98Å; L361-F421 HydrophobicContact CD1-CD2 3.86Å; L361-F421 HydrophobicContact CD1-CG 3.92Å; L361-F421 HydrophobicContact CD2-CB 3.69Å; L361-F421 HydrophobicContact CD2-CD1 3.96Å; L361-F421 HydrophobicContact CD2-CD2 4.47Å; L361-F421 HydrophobicContact CD2-CG 3.75Å; L361-F421 HydrophobicContact CG-CG 4.41Å; V362-F421 HydrophobicContact CG2-CD1 3.66Å; V362-F421 HydrophobicContact CG2-CE1 3.36Å; V362-F421 HydrophobicContact CG2-CZ 4.43Å; Y393-F421 HydrophobicContact CD2-CB 4.24Å; Y393-F421 HydrophobicContact CE2-CB 3.88Å; Y393-F421 HydrophobicContact CE2-CD2 4.06Å; C417-F421 WeakPolarHBondContact O-CB 3.39Å; C417-F421 PolarHBondContact O-N 3.12Å; L418-F421 WeakPolarHBondContact O-CB 3.3Å; L418-F421 PolarHBondContact O-N 3.42Å; F421-R423 VanDerWaalsContact C-N 3.34Å; F421-R423 PolarHBondContact O-N 3.06Å; F421-S424 WeakPolarHBondContact CA-OG 3.44Å; F421-S424 PolarHBondContact O-N 3.46Å; F421-S424 VanDerWaalsContact O-N 3.08Å; F421-S424 PolarHBondContact O-OG 3.46Å; F421-L425 HydrophobicContact CE1-CD2 4.47Å; F421-L425 HydrophobicContact CE2-CD2 3.98Å; F421-L425 HydrophobicContact CZ-CD2 3.83Å; F421-L425 PolarHBondContact O-N 2.86Å
422	L	96.6	Very high	96	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-38.3	-177.4	-65.9	164.5	0	0	0	112.6	L418 L420 S424 L429 I474 F498 T501 L502	L418-L422 HydrophobicContact CD1-CD1 4.1Å; L418-L422 HydrophobicContact CD1-CG 4.4Å; L418-L422 HydrophobicContact CG-CD1 4.05Å; L418-L422 WeakPolarHBondContact O-CG 3.31Å; L418-L422 PolarHBondContact O-N 3.3Å; L420-L422 PolarHBondContact O-N 2.8Å; L422-S424 VanDerWaalsContact C-N 3.26Å; L422-S424 PolarHBondContact O-N 3.01Å; L422-L429 HydrophobicContact CD2-CD2 4.25Å; L422-I474 HydrophobicContact CD1-CD1 3.93Å; L422-I474 HydrophobicContact CD2-CD1 3.63Å; L422-I474 HydrophobicContact CG-CD1 4.4Å; L422-F498 HydrophobicContact CD1-CE1 4.24Å; L422-T501 HydrophobicContact CB-CG2 3.71Å; L422-T501 HydrophobicContact CD1-CG2 4.08Å; L422-L502 HydrophobicContact CD1-CD2 3.77Å; L422-L502 HydrophobicContact CD2-CD2 4.32Å; L422-L502 HydrophobicContact CG-CD2 4.45Å
423	R	94.5	Very high	95.9	Very high	142 Å²	142	30.7 Å²	30.7	54%	0.536	15%	0.146	S	C	.	.	H	α-helix	trans	-74.6	-12.6	175.6	-67.1	-176.6	-57.5	151.6	3.8	114.4	K419 L420 F421 T501	K419-R423 WeakPolarHBondContact O-CG 3.49Å; K419-R423 PolarHBondContact O-N 3.05Å; K419-R423 VanDerWaalsContact O-N 3.13Å; K419-R423 PolarHBondContact O-NE 3.13Å; L420-R423 PolarHBondContact O-N 2.93Å; F421-R423 VanDerWaalsContact C-N 3.34Å; F421-R423 PolarHBondContact O-N 3.06Å; R423-T501 HydrophobicContact CG-CG2 4.06Å
424	S	92.6	Very high	95.9	Very high	17 Å²	17	31.7 Å²	31.7	12%	0.119	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-2.7	-177.9	67.8	0	0	0	0	113.9	Y393 L420 F421 L422	Y393-S424 VanDerWaalsContact OH-CB 3.32Å; Y393-S424 WeakPolarHBondContact OH-CB 3.41Å; Y393-S424 PolarHBondContact OH-OG 3.47Å; L420-S424 VanDerWaalsContact O-CB 3.27Å; L420-S424 WeakPolarHBondContact O-CB 3.49Å; L420-S424 PolarHBondContact O-N 3.15Å; L420-S424 VanDerWaalsContact O-N 3.08Å; L420-S424 PolarHBondContact O-OG 3.38Å; F421-S424 WeakPolarHBondContact CA-OG 3.44Å; F421-S424 PolarHBondContact O-N 3.46Å; F421-S424 VanDerWaalsContact O-N 3.08Å; F421-S424 PolarHBondContact O-OG 3.46Å; L422-S424 VanDerWaalsContact C-N 3.26Å; L422-S424 PolarHBondContact O-N 3.01Å
425	L	92.9	Very high	95.9	Very high	19 Å²	19	32.4 Å²	32.4	10%	0.099	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-64.1	150.4	172.6	-61.9	177	0	0	0	109.7	L346 L349 F421 E427 L429	L346-L425 HydrophobicContact CB-CD2 4.31Å; L346-L425 HydrophobicContact CD1-CD1 4.28Å; L346-L425 HydrophobicContact CD1-CD2 4.12Å; L349-L425 HydrophobicContact CD1-CD2 4.42Å; F421-L425 HydrophobicContact CE1-CD2 4.47Å; F421-L425 HydrophobicContact CE2-CD2 3.98Å; F421-L425 HydrophobicContact CZ-CD2 3.83Å; F421-L425 PolarHBondContact O-N 2.86Å; L425-E427 WeakPolarHBondContact CB-O 3.44Å; L425-E427 PolarHBondContact O-N 3.42Å; L425-L429 HydrophobicContact CD1-CD1 4.43Å
426	E	91.2	Very high	95.8	Very high	100 Å²	100	36.1 Å²	36.1	47%	0.467	18%	0.177	S	C	.	.	S	Bend	trans	-57.6	-36.3	177.9	178	176.6	-175.7	0	0	112.6	N343 L344	N343-E426 HydrophobicContact CB-CB 4.31Å; N343-E426 HydrophobicContact CB-CG 4.15Å; L344-E426 PolarHBondContact O-N 3.14Å
427	E	93.1	Very high	95.8	Very high	66 Å²	66	39.1 Å²	39.1	31%	0.308	19%	0.19	S	C	.	.	S	Bend	trans	-131.7	158.1	171.8	62.7	167	-179	0	0	110	L425 T431 Y432	L425-E427 WeakPolarHBondContact CB-O 3.44Å; L425-E427 PolarHBondContact O-N 3.42Å; E427-T431 WeakPolarHBondContact OE1-CG2 3.48Å; E427-T431 WeakPolarHBondContact OE2-CA 3.46Å; E427-T431 WeakPolarHBondContact OE2-CB 3.36Å; E427-Y432 HydrophobicContact CB-CD2 3.51Å; E427-Y432 HydrophobicContact CB-CE2 3.4Å; E427-Y432 HydrophobicContact CB-CG 4.41Å; E427-Y432 PolarHBondContact OE2-N 3.49Å
428	P	95.7	Very high	95.8	Very high	12 Å²	12	39.1 Å²	39.1	8%	0.078	19%	0.19	C	C	.	.			trans	-56.3	158	176.3	22.8	-34.2	0	0	0	112.1	V430 T431 Y432 V503	P428-V430 HydrophobicContact CB-CG2 4.34Å; P428-V430 HydrophobicContact CG-CG2 4.48Å; P428-V430 PolarHBondContact O-N 2.85Å; P428-V430 VanDerWaalsContact O-N 3.13Å; P428-T431 WeakPolarHBondContact O-CA 3.41Å; P428-T431 PolarHBondContact O-N 3.28Å; P428-Y432 HydrophobicContact CG-CD1 4.23Å; P428-Y432 HydrophobicContact CG-CE1 4.14Å; P428-V503 VanDerWaalsContact CB-O 3.25Å; P428-V503 WeakPolarHBondContact CB-O 3.43Å; P428-V503 WeakPolarHBondContact CG-O 3.24Å
429	L	97.2	Very high	95.8	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-32.3	-177.9	-175.3	62.6	0	0	0	112.1	L346 L422 L425 T431 N467 T470 L471 I474 L502	L346-L429 HydrophobicContact CD2-CD1 3.59Å; L422-L429 HydrophobicContact CD2-CD2 4.25Å; L425-L429 HydrophobicContact CD1-CD1 4.43Å; L429-T431 PolarHBondContact O-N 2.9Å; L429-N467 WeakPolarHBondContact O-CB 3.34Å; L429-N467 PolarHBondContact O-ND2 2.86Å; L429-T470 HydrophobicContact CD1-CG2 3.83Å; L429-T470 HydrophobicContact CD2-CG2 4.16Å; L429-L471 HydrophobicContact CD2-CB 3.9Å; L429-L471 HydrophobicContact CD2-CD1 3.98Å; L429-L471 HydrophobicContact CG-CB 4.23Å; L429-I474 HydrophobicContact CD2-CD1 3.77Å; L429-L502 HydrophobicContact CB-CD2 4.43Å; L429-L502 HydrophobicContact CD2-CD2 3.82Å; L429-L502 PolarHBondContact N-O 2.92Å
430	V	96.9	Very high	95.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	0.7	174.4	-56.2	0	0	0	0	114.2	P428 Q434 R435 F438 L463 L471 L502 V503	P428-V430 HydrophobicContact CB-CG2 4.34Å; P428-V430 HydrophobicContact CG-CG2 4.48Å; P428-V430 PolarHBondContact O-N 2.85Å; P428-V430 VanDerWaalsContact O-N 3.13Å; V430-Q434 WeakPolarHBondContact O-CB 3.42Å; V430-R435 HydrophobicContact CG2-CB 4.09Å; V430-R435 HydrophobicContact CG2-CG 4.34Å; V430-F438 HydrophobicContact CB-CD2 3.89Å; V430-F438 HydrophobicContact CB-CE2 3.84Å; V430-F438 HydrophobicContact CG1-CD2 4.22Å; V430-F438 HydrophobicContact CG1-CE2 4.07Å; V430-L463 VanDerWaalsContact O-CD2 3.27Å; V430-L463 WeakPolarHBondContact O-CD2 3.34Å; V430-L471 HydrophobicContact CG1-CD2 4.4Å; V430-L502 PolarHBondContact N-O 3.3Å; V430-V503 HydrophobicContact CG2-CB 4.43Å; V430-V503 HydrophobicContact CG2-CG1 4.2Å; V430-V503 WeakPolarHBondContact CG2-O 3.41Å
431	T	96.4	Very high	95.8	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	19%	0.19	C	C	.	.			trans	63.8	152.8	-174.4	74.5	0	0	0	0	114.4	E427 P428 L429 L433 Q434 R435 L463 P464 N467	E427-T431 WeakPolarHBondContact OE1-CG2 3.48Å; E427-T431 WeakPolarHBondContact OE2-CA 3.46Å; E427-T431 WeakPolarHBondContact OE2-CB 3.36Å; P428-T431 WeakPolarHBondContact O-CA 3.41Å; P428-T431 PolarHBondContact O-N 3.28Å; L429-T431 PolarHBondContact O-N 2.9Å; T431-L433 VanDerWaalsContact C-N 3.26Å; T431-L433 PolarHBondContact O-N 3.13Å; T431-Q434 WeakPolarHBondContact OG1-CB 2.94Å; T431-Q434 PolarHBondContact OG1-N 3.17Å; T431-Q434 VanDerWaalsContact OG1-N 3.08Å; T431-R435 VanDerWaalsContact O-CB 3.29Å; T431-R435 WeakPolarHBondContact O-CB 3.33Å; T431-R435 PolarHBondContact O-N 3.38Å; T431-L463 HydrophobicContact CG2-CD2 3.99Å; T431-P464 HydrophobicContact CG2-CG 4.08Å; T431-N467 HydrophobicContact CG2-CB 4.41Å; T431-N467 WeakPolarHBondContact CG2-ND2 3.49Å
432	Y	95.9	Very high	95.8	Very high	70 Å²	70	38.2 Å²	38.2	28%	0.275	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-33.7	172	-68.2	-62.5	0	0	0	111.9	E427 P428 P436 Y505 S506 P508	E427-Y432 HydrophobicContact CB-CD2 3.51Å; E427-Y432 HydrophobicContact CB-CE2 3.4Å; E427-Y432 HydrophobicContact CB-CG 4.41Å; E427-Y432 PolarHBondContact OE2-N 3.49Å; P428-Y432 HydrophobicContact CG-CD1 4.23Å; P428-Y432 HydrophobicContact CG-CE1 4.14Å; Y432-P436 VanDerWaalsContact O-CD 3.24Å; Y432-P436 WeakPolarHBondContact O-CD 3.5Å; Y432-Y505 VanDerWaalsContact CE1-O 3.28Å; Y432-Y505 WeakPolarHBondContact CE1-O 3.45Å; Y432-S506 WeakPolarHBondContact CD1-O 3.39Å; Y432-P508 HydrophobicContact CE2-CG 4.37Å; Y432-P508 WeakPolarHBondContact OH-CA 3.31Å; Y432-P508 WeakPolarHBondContact OH-CG 3.44Å
433	L	96	Very high	95.8	Very high	131 Å²	131	44.1 Å²	44.1	69%	0.686	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-45	-178.3	-179.5	62.8	0	0	0	112.7	T431	T431-L433 VanDerWaalsContact C-N 3.26Å; T431-L433 PolarHBondContact O-N 3.13Å
434	Q	97.2	Very high	95.8	Very high	21 Å²	21	40.9 Å²	40.9	10%	0.098	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-15.5	-175.2	-62.6	-58.2	-24.3	0	0	113.8	V430 T431 N437 F438 V459 L463	V430-Q434 WeakPolarHBondContact O-CB 3.42Å; T431-Q434 WeakPolarHBondContact OG1-CB 2.94Å; T431-Q434 PolarHBondContact OG1-N 3.17Å; T431-Q434 VanDerWaalsContact OG1-N 3.08Å; Q434-N437 WeakPolarHBondContact O-CB 3.48Å; Q434-N437 PolarHBondContact O-N 3.08Å; Q434-N437 VanDerWaalsContact O-N 3.15Å; Q434-N437 PolarHBondContact OE1-ND2 3.4Å; Q434-F438 HydrophobicContact CB-CD2 4.34Å; Q434-F438 HydrophobicContact CB-CE2 4.21Å; Q434-F438 WeakPolarHBondContact O-CD2 3.29Å; Q434-F438 PolarHBondContact O-N 3.25Å; Q434-V459 HydrophobicContact CB-CG1 3.75Å; Q434-V459 HydrophobicContact CG-CG1 4.26Å; Q434-L463 HydrophobicContact CB-CD2 3.87Å; Q434-L463 HydrophobicContact CG-CD2 3.85Å; Q434-L463 HydrophobicContact CG-CG 4.4Å
435	R	96.8	Very high	95.8	Very high	15 Å²	15	43.8 Å²	43.8	6%	0.057	22%	0.221	C	C	.	.	H	α-helix	trans	-51.5	-51.1	177.5	-174.8	179.5	-178.4	-81.8	5	114.7	V430 T431 N437 F438 V439 V503 G504 S506 E518	V430-R435 HydrophobicContact CG2-CB 4.09Å; V430-R435 HydrophobicContact CG2-CG 4.34Å; T431-R435 VanDerWaalsContact O-CB 3.29Å; T431-R435 WeakPolarHBondContact O-CB 3.33Å; T431-R435 PolarHBondContact O-N 3.38Å; R435-N437 PolarHBondContact O-N 2.64Å; R435-F438 WeakPolarHBondContact O-CB 3.39Å; R435-F438 PolarHBondContact O-N 2.96Å; R435-F438 VanDerWaalsContact O-N 3.16Å; R435-V439 HydrophobicContact CG-CG2 4.42Å; R435-V439 WeakPolarHBondContact O-CG2 3.43Å; R435-V439 PolarHBondContact O-N 2.71Å; R435-V503 WeakPolarHBondContact CD-O 3.28Å; R435-V503 HydrophobicContact CG-CG1 4.1Å; R435-V503 PolarHBondContact NE-O 2.8Å; R435-G504 PolarHBondContact NE-O 2.8Å; R435-G504 PolarHBondContact NH2-O 3.4Å; R435-S506 PolarHBondContact NH1-OG 3.24Å; R435-E518 IonicContact CZ-OE2 3.93Å; R435-E518 IonicContact NH1-OE2 3.89Å; R435-E518 IonicContact NH2-OE2 3.22Å; R435-E518 PolarHBondContact NH2-OE2 3.19Å
436	P	96.8	Very high	95.7	Very high	78 Å²	78	47.8 Å²	47.8	51%	0.506	25%	0.251	S	S	.	.	H	α-helix	trans	-61.2	-33.7	179.7	23.4	-33.7	0	0	0	112.3	Y432 V439 G440	Y432-P436 VanDerWaalsContact O-CD 3.24Å; Y432-P436 WeakPolarHBondContact O-CD 3.5Å; P436-V439 PolarHBondContact O-N 2.8Å; P436-G440 PolarHBondContact O-N 2.9Å
437	N	97.5	Very high	95.9	Very high	74 Å²	74	49 Å²	49	40%	0.396	27%	0.265	S	S	.	.	H	α-helix	trans	-67	-40.5	176.3	-58.4	-34.8	0	0	0	111.7	Q434 R435 A441 V459	Q434-N437 WeakPolarHBondContact O-CB 3.48Å; Q434-N437 PolarHBondContact O-N 3.08Å; Q434-N437 VanDerWaalsContact O-N 3.15Å; Q434-N437 PolarHBondContact OE1-ND2 3.4Å; R435-N437 PolarHBondContact O-N 2.64Å; N437-A441 WeakPolarHBondContact O-CB 3.23Å; N437-A441 PolarHBondContact O-N 3.13Å; N437-V459 HydrophobicContact CB-CG1 4.33Å; N437-V459 HydrophobicContact CB-CG2 3.47Å; N437-V459 VanDerWaalsContact CB-CG2 3.47Å
438	F	98	Very high	96	Very high	1 Å²	1	49.1 Å²	49.1	0%	0.004	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-46.2	172.5	-81.6	-63	0	0	0	112.2	V430 Q434 R435 A441 S442 V456 V459 L460 L463 V525 L529	V430-F438 HydrophobicContact CB-CD2 3.89Å; V430-F438 HydrophobicContact CB-CE2 3.84Å; V430-F438 HydrophobicContact CG1-CD2 4.22Å; V430-F438 HydrophobicContact CG1-CE2 4.07Å; Q434-F438 HydrophobicContact CB-CD2 4.34Å; Q434-F438 HydrophobicContact CB-CE2 4.21Å; Q434-F438 WeakPolarHBondContact O-CD2 3.29Å; Q434-F438 PolarHBondContact O-N 3.25Å; R435-F438 WeakPolarHBondContact O-CB 3.39Å; R435-F438 PolarHBondContact O-N 2.96Å; R435-F438 VanDerWaalsContact O-N 3.16Å; F438-A441 PolarHBondContact O-N 3.4Å; F438-S442 PolarHBondContact O-N 3.47Å; F438-V456 HydrophobicContact CD1-CG2 4.25Å; F438-V456 HydrophobicContact CE1-CG1 4.16Å; F438-V459 HydrophobicContact CD1-CB 4.48Å; F438-V459 HydrophobicContact CD1-CG1 4.04Å; F438-V459 HydrophobicContact CD2-CG1 3.58Å; F438-V459 HydrophobicContact CE1-CB 4.12Å; F438-V459 HydrophobicContact CE1-CG1 3.75Å; F438-V459 HydrophobicContact CE2-CB 4.44Å; F438-V459 HydrophobicContact CE2-CG1 3.27Å; F438-V459 HydrophobicContact CG-CG1 3.96Å; F438-V459 HydrophobicContact CZ-CB 4.11Å; F438-V459 HydrophobicContact CZ-CG1 3.36Å; F438-L460 HydrophobicContact CE1-CD2 4.29Å; F438-L460 HydrophobicContact CE1-CG 4.3Å; F438-L460 HydrophobicContact CZ-CD2 3.98Å; F438-L460 HydrophobicContact CZ-CG 4.29Å; F438-L463 HydrophobicContact CE2-CD1 4.12Å; F438-L463 HydrophobicContact CE2-CD2 4.34Å; F438-L463 HydrophobicContact CE2-CG 4.39Å; F438-L463 HydrophobicContact CZ-CD1 4Å; F438-V525 HydrophobicContact CB-CG1 3.79Å; F438-V525 HydrophobicContact CB-CG2 4.06Å; F438-V525 HydrophobicContact CD1-CG1 4.33Å; F438-V525 HydrophobicContact CG-CG1 4.2Å; F438-L529 HydrophobicContact CD1-CD2 4.45Å; F438-L529 HydrophobicContact CE1-CD2 3.88Å
439	V	97.5	Very high	95.9	Very high	18 Å²	18	51.2 Å²	51.2	11%	0.109	28%	0.282	C	S	.	.	H	α-helix	trans	-61.4	-50.7	179.5	171.6	0	0	0	0	110.5	R435 P436 A441 S442 E443 P521 V525	R435-V439 HydrophobicContact CG-CG2 4.42Å; R435-V439 WeakPolarHBondContact O-CG2 3.43Å; R435-V439 PolarHBondContact O-N 2.71Å; P436-V439 PolarHBondContact O-N 2.8Å; V439-A441 VanDerWaalsContact C-N 3.28Å; V439-A441 PolarHBondContact O-N 3.48Å; V439-S442 WeakPolarHBondContact O-CA 3.35Å; V439-S442 WeakPolarHBondContact O-CB 3.26Å; V439-S442 PolarHBondContact O-N 3.42Å; V439-S442 PolarHBondContact O-OG 3.02Å; V439-E443 PolarHBondContact O-N 3.46Å; V439-P521 HydrophobicContact CG1-CB 4.03Å; V439-P521 HydrophobicContact CG2-CB 4.38Å; V439-V525 HydrophobicContact CB-CG2 4.4Å; V439-V525 HydrophobicContact CG2-CG2 3.89Å
440	G	96.7	Very high	95.8	Very high	21 Å²	21	55.9 Å²	55.9	22%	0.216	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-36.5	177.5	0	0	0	0	0	113.1	P436 E443 Q444	P436-G440 PolarHBondContact O-N 2.9Å; G440-E443 PolarHBondContact O-N 2.89Å; G440-Q444 WeakPolarHBondContact O-CG 3.47Å; G440-Q444 PolarHBondContact O-N 3.31Å; G440-Q444 VanDerWaalsContact O-N 3.15Å
441	A	97	Very high	95.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.6	-39.1	173.1	0	0	0	0	0	112.3	N437 F438 V439 Q444 Y445 A452 C455 V456 L528	N437-A441 WeakPolarHBondContact O-CB 3.23Å; N437-A441 PolarHBondContact O-N 3.13Å; F438-A441 PolarHBondContact O-N 3.4Å; V439-A441 VanDerWaalsContact C-N 3.28Å; V439-A441 PolarHBondContact O-N 3.48Å; A441-Q444 PolarHBondContact O-N 3.02Å; A441-Y445 PolarHBondContact O-N 3.33Å; A441-A452 WeakPolarHBondContact O-CB 3.38Å; A441-C455 HydrophobicContact CB-CB 3.95Å; A441-V456 HydrophobicContact CB-CG2 3.66Å; A441-L528 HydrophobicContact CB-CD2 4.15Å
442	S	96.5	Very high	95.6	Very high	13 Å²	13	61.3 Å²	61.3	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-67.3	-34.5	177.5	74.8	0	0	0	0	113.4	F438 V439 Y445	F438-S442 PolarHBondContact O-N 3.47Å; V439-S442 WeakPolarHBondContact O-CA 3.35Å; V439-S442 WeakPolarHBondContact O-CB 3.26Å; V439-S442 PolarHBondContact O-N 3.42Å; V439-S442 PolarHBondContact O-OG 3.02Å; S442-Y445 VanDerWaalsContact O-CB 3.25Å; S442-Y445 WeakPolarHBondContact O-CB 3.41Å; S442-Y445 PolarHBondContact O-N 3.22Å
443	E	95.8	Very high	95.6	Very high	125 Å²	125	61 Å²	61	58%	0.584	33%	0.332	S	S	*	.	H	α-helix	trans	-68.5	-38.8	174.8	-69.4	170.2	174.5	0	0	111.4	V439 G440 Y445 S446	V439-E443 PolarHBondContact O-N 3.46Å; G440-E443 PolarHBondContact O-N 2.89Å; E443-Y445 PolarHBondContact O-N 3.17Å; E443-S446 PolarHBondContact O-OG 3.34Å
444	Q	93.5	Very high	95.6	Very high	75 Å²	75	59.5 Å²	59.5	35%	0.35	33%	0.325	S	S	.	.	H	α-helix	trans	-69.9	-17.8	176.5	-71.8	177.6	15	0	0	113.3	G440 A441 S446 T447 N448 A452	G440-Q444 WeakPolarHBondContact O-CG 3.47Å; G440-Q444 PolarHBondContact O-N 3.31Å; G440-Q444 VanDerWaalsContact O-N 3.15Å; A441-Q444 PolarHBondContact O-N 3.02Å; Q444-S446 VanDerWaalsContact C-N 3.25Å; Q444-S446 PolarHBondContact O-N 2.98Å; Q444-T447 PolarHBondContact O-N 3.47Å; Q444-T447 VanDerWaalsContact O-N 3.08Å; Q444-N448 CarbonylContact O-C 3.5Å; Q444-N448 PolarHBondContact O-N 2.93Å; Q444-A452 HydrophobicContact CB-CB 4.38Å
445	Y	94.3	Very high	95.5	Very high	78 Å²	78	60.4 Å²	60.4	31%	0.306	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-34	-175.3	-174.3	-105.5	0	0	0	113.5	A441 S442 E443 P449 A452 Y453 L528 N531	A441-Y445 PolarHBondContact O-N 3.33Å; S442-Y445 VanDerWaalsContact O-CB 3.25Å; S442-Y445 WeakPolarHBondContact O-CB 3.41Å; S442-Y445 PolarHBondContact O-N 3.22Å; E443-Y445 PolarHBondContact O-N 3.17Å; Y445-P449 HydrophobicContact CD2-CB 4.23Å; Y445-P449 HydrophobicContact CE2-CB 4Å; Y445-P449 WeakPolarHBondContact O-CD 3.02Å; Y445-P449 VanDerWaalsContact O-CG 3.29Å; Y445-P449 WeakPolarHBondContact O-CG 3.49Å; Y445-A452 HydrophobicContact CD2-CB 4.06Å; Y445-Y453 HydrophobicContact CE2-CD2 4.48Å; Y445-Y453 HydrophobicContact CE2-CE1 4.23Å; Y445-Y453 AromaticContact CE2-CE2 3.68Å; Y445-Y453 HydrophobicContact CE2-CE2 3.68Å; Y445-Y453 AromaticContact CE2-CZ 3.54Å; Y445-Y453 WeakPolarHBondContact CE2-OH 3.43Å; Y445-Y453 PolarHBondContact OH-OH 3.19Å; Y445-L528 HydrophobicContact CD2-CD1 3.41Å; Y445-L528 VanDerWaalsContact CD2-CD1 3.41Å; Y445-L528 HydrophobicContact CE2-CD1 3.72Å; Y445-L528 HydrophobicContact CG-CD1 4.13Å; Y445-N531 PolarHBondContact OH-ND2 3.21Å
446	S	91.1	Very high	95.6	Very high	103 Å²	103	59.8 Å²	59.8	72%	0.72	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-30.7	178.5	59.1	0	0	0	0	113.3	E443 Q444	E443-S446 PolarHBondContact O-OG 3.34Å; Q444-S446 VanDerWaalsContact C-N 3.25Å; Q444-S446 PolarHBondContact O-N 2.98Å
447	T	94.4	Very high	95.5	Very high	125 Å²	125	58.3 Å²	58.3	77%	0.767	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-41.1	-174.1	-53.6	0	0	0	0	111.9	Q444	Q444-T447 PolarHBondContact O-N 3.47Å; Q444-T447 VanDerWaalsContact O-N 3.08Å
448	N	94.4	Very high	95.5	Very high	69 Å²	69	59.2 Å²	59.2	37%	0.369	32%	0.324	S	S	.	.			trans	-142.6	82.1	179.9	-169.7	-22.7	0	0	0	110.5	Q444 T450 K451 A452	Q444-N448 CarbonylContact O-C 3.5Å; Q444-N448 PolarHBondContact O-N 2.93Å; N448-T450 VanDerWaalsContact C-N 3.29Å; N448-T450 PolarHBondContact O-N 2.94Å; N448-T450 PolarHBondContact OD1-N 2.78Å; N448-K451 HydrophobicContact CB-CB 4.13Å; N448-K451 VanDerWaalsContact CG-CB 3.46Å; N448-K451 PolarHBondContact O-N 3.5Å; N448-K451 WeakPolarHBondContact OD1-CB 3.15Å; N448-K451 PolarHBondContact OD1-N 2.89Å; N448-A452 PolarHBondContact O-N 3.42Å
449	P	94	Very high	95.5	Very high	56 Å²	56	59.3 Å²	59.3	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-52.3	-44.3	177.9	-25.2	29.1	0	0	0	113.2	Y445 K451 A452 Y453	Y445-P449 HydrophobicContact CD2-CB 4.23Å; Y445-P449 HydrophobicContact CE2-CB 4Å; Y445-P449 WeakPolarHBondContact O-CD 3.02Å; Y445-P449 VanDerWaalsContact O-CG 3.29Å; Y445-P449 WeakPolarHBondContact O-CG 3.49Å; P449-K451 PolarHBondContact O-N 3.04Å; P449-A452 WeakPolarHBondContact O-CB 3.32Å; P449-A452 PolarHBondContact O-N 2.89Å; P449-Y453 HydrophobicContact CB-CD2 4.42Å; P449-Y453 HydrophobicContact CB-CE2 4.12Å; P449-Y453 WeakPolarHBondContact O-CD2 3.26Å; P449-Y453 PolarHBondContact O-N 3.36Å
450	T	94.5	Very high	95.5	Very high	98 Å²	98	58.4 Å²	58.4	60%	0.601	32%	0.319	S	S	*	.	H	α-helix	trans	-59.6	-49.7	-177.9	-49.3	0	0	0	0	111.5	N448 A452 Y453 D454	N448-T450 VanDerWaalsContact C-N 3.29Å; N448-T450 PolarHBondContact O-N 2.94Å; N448-T450 PolarHBondContact OD1-N 2.78Å; T450-A452 VanDerWaalsContact C-N 3.33Å; T450-A452 PolarHBondContact O-N 3.4Å; T450-Y453 WeakPolarHBondContact O-CB 3.45Å; T450-Y453 PolarHBondContact O-N 3.08Å; T450-D454 PolarHBondContact O-N 3.42Å
451	K	94.5	Very high	95.4	Very high	116 Å²	116	63.7 Å²	63.7	50%	0.504	34%	0.336	S	S	.	.	H	α-helix	trans	-64.1	-38.1	177.1	-174.5	179.5	178.7	-179.4	0	112.2	N448 P449 Y453 D454 C455	N448-K451 HydrophobicContact CB-CB 4.13Å; N448-K451 VanDerWaalsContact CG-CB 3.46Å; N448-K451 PolarHBondContact O-N 3.5Å; N448-K451 WeakPolarHBondContact OD1-CB 3.15Å; N448-K451 PolarHBondContact OD1-N 2.89Å; P449-K451 PolarHBondContact O-N 3.04Å; K451-Y453 VanDerWaalsContact C-N 3.34Å; K451-D454 PolarHBondContact O-N 3Å; K451-C455 VanDerWaalsContact O-CB 3.3Å; K451-C455 WeakPolarHBondContact O-CB 3.33Å; K451-C455 PolarHBondContact O-N 2.97Å
452	A	96.2	Very high	95.4	Very high	0 Å²	0	68 Å²	68	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-41.8	175.6	0	0	0	0	0	111.7	A441 Q444 Y445 N448 P449 T450 C455 V456 L528	A441-A452 WeakPolarHBondContact O-CB 3.38Å; Q444-A452 HydrophobicContact CB-CB 4.38Å; Y445-A452 HydrophobicContact CD2-CB 4.06Å; N448-A452 PolarHBondContact O-N 3.42Å; P449-A452 WeakPolarHBondContact O-CB 3.32Å; P449-A452 PolarHBondContact O-N 2.89Å; T450-A452 VanDerWaalsContact C-N 3.33Å; T450-A452 PolarHBondContact O-N 3.4Å; A452-C455 PolarHBondContact O-N 3.41Å; A452-V456 WeakPolarHBondContact O-CG2 3.43Å; A452-V456 PolarHBondContact O-N 2.91Å; A452-L528 HydrophobicContact CB-CD2 4.4Å
453	Y	95.4	Very high	95.4	Very high	63 Å²	63	67.4 Å²	67.4	25%	0.247	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-50.6	174.1	-75.3	-62.3	0	0	0	111.9	Y445 P449 T450 K451 C455 V456 L457 L528 N531 I532	Y445-Y453 HydrophobicContact CE2-CD2 4.48Å; Y445-Y453 HydrophobicContact CE2-CE1 4.23Å; Y445-Y453 AromaticContact CE2-CE2 3.68Å; Y445-Y453 HydrophobicContact CE2-CE2 3.68Å; Y445-Y453 AromaticContact CE2-CZ 3.54Å; Y445-Y453 WeakPolarHBondContact CE2-OH 3.43Å; Y445-Y453 PolarHBondContact OH-OH 3.19Å; P449-Y453 HydrophobicContact CB-CD2 4.42Å; P449-Y453 HydrophobicContact CB-CE2 4.12Å; P449-Y453 WeakPolarHBondContact O-CD2 3.26Å; P449-Y453 PolarHBondContact O-N 3.36Å; T450-Y453 WeakPolarHBondContact O-CB 3.45Å; T450-Y453 PolarHBondContact O-N 3.08Å; K451-Y453 VanDerWaalsContact C-N 3.34Å; Y453-C455 VanDerWaalsContact C-N 3.28Å; Y453-C455 PolarHBondContact O-N 3.16Å; Y453-V456 PolarHBondContact O-N 3.39Å; Y453-L457 WeakPolarHBondContact O-CG 3.11Å; Y453-L457 PolarHBondContact O-N 3.18Å; Y453-L528 HydrophobicContact CD1-CD1 4.17Å; Y453-L528 HydrophobicContact CE1-CD1 4.01Å; Y453-N531 HydrophobicContact CE1-CB 3.64Å; Y453-N531 VanDerWaalsContact OH-CB 3.24Å; Y453-N531 WeakPolarHBondContact OH-CB 3.32Å; Y453-N531 PolarHBondContact OH-ND2 2.68Å; Y453-I532 HydrophobicContact CD1-CD1 3.88Å; Y453-I532 HydrophobicContact CE1-CD1 4.41Å
454	D	95.5	Very high	95.5	Very high	100 Å²	100	64.4 Å²	64.4	54%	0.535	35%	0.346	S	S	.	.	H	α-helix	trans	-58.9	-41.7	179.1	-69.3	-29.1	0	0	0	111.7	T450 K451 L457 N458	T450-D454 PolarHBondContact O-N 3.42Å; K451-D454 PolarHBondContact O-N 3Å; D454-L457 PolarHBondContact O-N 3.06Å; D454-N458 PolarHBondContact O-N 3.08Å
455	C	96.2	Very high	95.5	Very high	41 Å²	41	62.3 Å²	62.3	28%	0.277	34%	0.338	S	S	.	.	H	α-helix	trans	-60.6	-50.6	175.5	-170.5	0	0	0	0	111.2	A441 K451 A452 Y453 L457 N458 V459	A441-C455 HydrophobicContact CB-CB 3.95Å; K451-C455 VanDerWaalsContact O-CB 3.3Å; K451-C455 WeakPolarHBondContact O-CB 3.33Å; K451-C455 PolarHBondContact O-N 2.97Å; A452-C455 PolarHBondContact O-N 3.41Å; Y453-C455 VanDerWaalsContact C-N 3.28Å; Y453-C455 PolarHBondContact O-N 3.16Å; C455-L457 VanDerWaalsContact C-N 3.33Å; C455-L457 PolarHBondContact O-N 2.81Å; C455-N458 WeakPolarHBondContact O-CB 3.17Å; C455-N458 PolarHBondContact O-N 3.28Å; C455-N458 VanDerWaalsContact O-N 3.15Å; C455-V459 VanDerWaalsContact O-CG2 3.26Å; C455-V459 WeakPolarHBondContact O-CG2 3.27Å; C455-V459 PolarHBondContact O-N 3.31Å
456	V	97.3	Very high	95.5	Very high	1 Å²	1	59 Å²	59	1%	0.006	33%	0.327	C	S	.	.	H	α-helix	trans	-61.2	-40.2	178.7	165.1	0	0	0	0	112.4	F438 A441 A452 Y453 N458 V459 L460 L528 L529 I532	F438-V456 HydrophobicContact CD1-CG2 4.25Å; F438-V456 HydrophobicContact CE1-CG1 4.16Å; A441-V456 HydrophobicContact CB-CG2 3.66Å; A452-V456 WeakPolarHBondContact O-CG2 3.43Å; A452-V456 PolarHBondContact O-N 2.91Å; Y453-V456 PolarHBondContact O-N 3.39Å; V456-N458 VanDerWaalsContact C-N 3.33Å; V456-N458 PolarHBondContact O-N 3.21Å; V456-V459 PolarHBondContact O-N 2.59Å; V456-L460 HydrophobicContact CG1-CD1 3.96Å; V456-L460 HydrophobicContact CG1-CG 4.27Å; V456-L460 WeakPolarHBondContact O-CB 3.41Å; V456-L460 VanDerWaalsContact O-CG 3.3Å; V456-L460 WeakPolarHBondContact O-CG 3.38Å; V456-L460 PolarHBondContact O-N 3.18Å; V456-L528 HydrophobicContact CG2-CD2 3.35Å; V456-L528 HydrophobicContact CG2-CG 3.81Å; V456-L529 HydrophobicContact CG1-CD2 4.02Å; V456-I532 HydrophobicContact CB-CD1 4.34Å; V456-I532 HydrophobicContact CG1-CD1 3.67Å; V456-I532 HydrophobicContact CG1-CG1 3.9Å
457	L	96.5	Very high	95.8	Very high	48 Å²	48	54.6 Å²	54.6	25%	0.251	30%	0.295	S	S	.	.	H	α-helix	trans	-61.9	-41.8	175.8	-68.7	176.3	0	0	0	111.6	Y453 D454 C455 K461 I532 V536	Y453-L457 WeakPolarHBondContact O-CG 3.11Å; Y453-L457 PolarHBondContact O-N 3.18Å; D454-L457 PolarHBondContact O-N 3.06Å; C455-L457 VanDerWaalsContact C-N 3.33Å; C455-L457 PolarHBondContact O-N 2.81Å; L457-K461 WeakPolarHBondContact O-CG 3.3Å; L457-K461 PolarHBondContact O-N 3.36Å; L457-K461 VanDerWaalsContact O-N 3.12Å; L457-I532 HydrophobicContact CD2-CD1 4.24Å; L457-I532 HydrophobicContact CD2-CG2 4.27Å; L457-V536 HydrophobicContact CD2-CB 4.4Å; L457-V536 HydrophobicContact CD2-CG1 3.65Å; L457-V536 HydrophobicContact CD2-CG2 3.97Å
458	N	96.9	Very high	96	Very high	92 Å²	92	50.7 Å²	50.7	49%	0.492	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-45	175	-174.3	47.4	0	0	0	111.7	D454 C455 V456 L460 K461 N462	D454-N458 PolarHBondContact O-N 3.08Å; C455-N458 WeakPolarHBondContact O-CB 3.17Å; C455-N458 PolarHBondContact O-N 3.28Å; C455-N458 VanDerWaalsContact O-N 3.15Å; V456-N458 VanDerWaalsContact C-N 3.33Å; V456-N458 PolarHBondContact O-N 3.21Å; N458-L460 PolarHBondContact O-N 3.33Å; N458-K461 WeakPolarHBondContact O-CB 3.48Å; N458-K461 PolarHBondContact O-N 3.27Å; N458-N462 PolarHBondContact O-N 3.29Å; N458-N462 PolarHBondContact O-ND2 3.33Å; N458-N462 PolarHBondContact OD1-ND2 2.79Å
459	V	97.5	Very high	96	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.018	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-43.7	177.7	179.6	0	0	0	0	111.3	Q434 N437 F438 C455 V456 K461 N462 L463	Q434-V459 HydrophobicContact CB-CG1 3.75Å; Q434-V459 HydrophobicContact CG-CG1 4.26Å; N437-V459 HydrophobicContact CB-CG1 4.33Å; N437-V459 HydrophobicContact CB-CG2 3.47Å; N437-V459 VanDerWaalsContact CB-CG2 3.47Å; F438-V459 HydrophobicContact CD1-CB 4.48Å; F438-V459 HydrophobicContact CD1-CG1 4.04Å; F438-V459 HydrophobicContact CD2-CG1 3.58Å; F438-V459 HydrophobicContact CE1-CB 4.12Å; F438-V459 HydrophobicContact CE1-CG1 3.75Å; F438-V459 HydrophobicContact CE2-CB 4.44Å; F438-V459 HydrophobicContact CE2-CG1 3.27Å; F438-V459 HydrophobicContact CG-CG1 3.96Å; F438-V459 HydrophobicContact CZ-CB 4.11Å; F438-V459 HydrophobicContact CZ-CG1 3.36Å; C455-V459 VanDerWaalsContact O-CG2 3.26Å; C455-V459 WeakPolarHBondContact O-CG2 3.27Å; C455-V459 PolarHBondContact O-N 3.31Å; V456-V459 PolarHBondContact O-N 2.59Å; V459-K461 VanDerWaalsContact C-N 3.31Å; V459-K461 PolarHBondContact O-N 3.07Å; V459-N462 PolarHBondContact O-N 2.87Å; V459-N462 VanDerWaalsContact O-N 3.13Å; V459-L463 PolarHBondContact O-N 2.87Å
460	L	97.2	Very high	96.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.5	-41.9	175.7	-75.6	171.4	0	0	0	111.8	F438 V456 N458 N462 L463 R468 L471 L529 I532 Y537 F540	F438-L460 HydrophobicContact CE1-CD2 4.29Å; F438-L460 HydrophobicContact CE1-CG 4.3Å; F438-L460 HydrophobicContact CZ-CD2 3.98Å; F438-L460 HydrophobicContact CZ-CG 4.29Å; V456-L460 HydrophobicContact CG1-CD1 3.96Å; V456-L460 HydrophobicContact CG1-CG 4.27Å; V456-L460 WeakPolarHBondContact O-CB 3.41Å; V456-L460 VanDerWaalsContact O-CG 3.3Å; V456-L460 WeakPolarHBondContact O-CG 3.38Å; V456-L460 PolarHBondContact O-N 3.18Å; N458-L460 PolarHBondContact O-N 3.33Å; L460-N462 VanDerWaalsContact C-N 3.33Å; L460-L463 HydrophobicContact CD2-CD1 4.12Å; L460-L463 PolarHBondContact O-N 3.02Å; L460-R468 WeakPolarHBondContact O-CD 3.34Å; L460-R468 WeakPolarHBondContact O-CG 3.49Å; L460-L471 HydrophobicContact CD2-CD2 3.7Å; L460-L529 HydrophobicContact CD1-CD2 4.48Å; L460-L529 HydrophobicContact CD2-CD2 4.21Å; L460-I532 HydrophobicContact CD1-CG2 4.42Å; L460-Y537 HydrophobicContact CD1-CE1 4.14Å; L460-Y537 HydrophobicContact CD2-CE1 4.47Å; L460-F540 HydrophobicContact CB-CE2 3.97Å; L460-F540 HydrophobicContact CB-CZ 4.2Å; L460-F540 HydrophobicContact CD1-CE2 4.49Å
461	K	95.5	Very high	96.4	Very high	132 Å²	132	40.6 Å²	40.6	57%	0.574	21%	0.205	S	C	*	.	H	α-helix	trans	-63.3	-38.5	175.7	-71	171.2	-177.1	179.7	0	112.1	L457 N458 V459 R468 F540	L457-K461 WeakPolarHBondContact O-CG 3.3Å; L457-K461 PolarHBondContact O-N 3.36Å; L457-K461 VanDerWaalsContact O-N 3.12Å; N458-K461 WeakPolarHBondContact O-CB 3.48Å; N458-K461 PolarHBondContact O-N 3.27Å; V459-K461 VanDerWaalsContact C-N 3.31Å; V459-K461 PolarHBondContact O-N 3.07Å; K461-R468 PolarHBondContact O-NH1 3.23Å; K461-F540 HydrophobicContact CG-CE1 4.16Å; K461-F540 HydrophobicContact CG-CZ 3.99Å
462	N	96.7	Very high	96.5	Very high	89 Å²	89	35 Å²	35	48%	0.476	18%	0.181	S	C	.	.	H	α-helix	trans	-81.6	-10.1	-177.6	-67.7	-34.8	0	0	0	114.6	N458 V459 L460	N458-N462 PolarHBondContact O-N 3.29Å; N458-N462 PolarHBondContact O-ND2 3.33Å; N458-N462 PolarHBondContact OD1-ND2 2.79Å; V459-N462 PolarHBondContact O-N 2.87Å; V459-N462 VanDerWaalsContact O-N 3.13Å; L460-N462 VanDerWaalsContact C-N 3.33Å
463	L	97.1	Very high	96.5	Very high	2 Å²	2	35 Å²	35	1%	0.01	18%	0.181	C	C	.	.	S	Bend	trans	-60.8	142	171.6	-80.1	172.2	0	0	0	110.9	V430 T431 Q434 F438 V459 L460 T465 N467 R468 L471	V430-L463 VanDerWaalsContact O-CD2 3.27Å; V430-L463 WeakPolarHBondContact O-CD2 3.34Å; T431-L463 HydrophobicContact CG2-CD2 3.99Å; Q434-L463 HydrophobicContact CB-CD2 3.87Å; Q434-L463 HydrophobicContact CG-CD2 3.85Å; Q434-L463 HydrophobicContact CG-CG 4.4Å; F438-L463 HydrophobicContact CE2-CD1 4.12Å; F438-L463 HydrophobicContact CE2-CD2 4.34Å; F438-L463 HydrophobicContact CE2-CG 4.39Å; F438-L463 HydrophobicContact CZ-CD1 4Å; V459-L463 PolarHBondContact O-N 2.87Å; L460-L463 HydrophobicContact CD2-CD1 4.12Å; L460-L463 PolarHBondContact O-N 3.02Å; L463-T465 PolarHBondContact O-N 2.84Å; L463-N467 HydrophobicContact CD2-CB 4.44Å; L463-R468 HydrophobicContact CB-CB 3.94Å; L463-R468 PolarHBondContact O-NH1 2.8Å; L463-L471 HydrophobicContact CD1-CD2 3.72Å
464	P	96.3	Very high	96.7	Very high	61 Å²	61	32 Å²	32	40%	0.396	17%	0.169	S	C	.	.			trans	-51.6	139.4	169.4	-24.4	33.1	0	0	0	110.4	T431 P466 N467 R468	T431-P464 HydrophobicContact CG2-CG 4.08Å; P464-P466 VanDerWaalsContact C-CD 3.43Å; P464-P466 VanDerWaalsContact C-N 3.35Å; P464-N467 HydrophobicContact CB-CB 4.48Å; P464-N467 WeakPolarHBondContact O-CA 3.44Å; P464-N467 WeakPolarHBondContact O-CB 3.46Å; P464-N467 PolarHBondContact O-N 3.27Å; P464-R468 PolarHBondContact O-N 3.36Å
465	T	94.4	Very high	96.8	Very high	31 Å²	31	27.3 Å²	27.3	19%	0.19	14%	0.144	C	C	.	.	H	α-helix	trans	-54	-40.8	-172.7	-47.7	0	0	0	0	114.6	R357 L463 N467 R468 H469	R357-T465 HydrophobicContact CG-CG2 4.48Å; R357-T465 VanDerWaalsContact CZ-CB 3.46Å; R357-T465 VanDerWaalsContact NE-CG2 3.25Å; R357-T465 PolarHBondContact NH2-OG1 3.15Å; L463-T465 PolarHBondContact O-N 2.84Å; T465-N467 VanDerWaalsContact C-N 3.3Å; T465-N467 PolarHBondContact O-N 2.93Å; T465-R468 PolarHBondContact O-N 3.02Å; T465-H469 WeakPolarHBondContact CG2-CE1 3.47Å; T465-H469 WeakPolarHBondContact CG2-ND1 3.4Å; T465-H469 WeakPolarHBondContact CG2-NE2 3.22Å; T465-H469 WeakPolarHBondContact O-CB 3.47Å; T465-H469 VanDerWaalsContact O-CG 3.25Å; T465-H469 PolarHBondContact O-N 3.16Å
466	P	94.9	Very high	96.9	Very high	9 Å²	9	26 Å²	26	6%	0.058	13%	0.134	C	C	.	.	H	α-helix	trans	-58.6	-42.5	174.7	-23.7	35.9	0	0	0	112.6	L346 C350 R357 P464 T470	L346-P466 HydrophobicContact CD2-CB 4.11Å; L346-P466 HydrophobicContact CG-CB 4.1Å; C350-P466 HydrophobicContact CB-CB 4.47Å; R357-P466 HydrophobicContact CB-CG 4.49Å; R357-P466 WeakPolarHBondContact O-CA 3.09Å; P464-P466 VanDerWaalsContact C-CD 3.43Å; P464-P466 VanDerWaalsContact C-N 3.35Å; P466-T470 WeakPolarHBondContact O-CB 3.41Å; P466-T470 PolarHBondContact O-N 3.19Å; P466-T470 PolarHBondContact O-OG1 3.33Å
467	N	97.1	Very high	96.9	Very high	10 Å²	10	26 Å²	26	5%	0.053	13%	0.134	C	C	.	.	H	α-helix	trans	-66.8	-49.1	177.9	-62.7	66.5	0	0	0	110.9	L346 L429 T431 L463 P464 T465 T470 L471	L346-N467 HydrophobicContact CD2-CB 4.27Å; L429-N467 WeakPolarHBondContact O-CB 3.34Å; L429-N467 PolarHBondContact O-ND2 2.86Å; T431-N467 HydrophobicContact CG2-CB 4.41Å; T431-N467 WeakPolarHBondContact CG2-ND2 3.49Å; L463-N467 HydrophobicContact CD2-CB 4.44Å; P464-N467 HydrophobicContact CB-CB 4.48Å; P464-N467 WeakPolarHBondContact O-CA 3.44Å; P464-N467 WeakPolarHBondContact O-CB 3.46Å; P464-N467 PolarHBondContact O-N 3.27Å; T465-N467 VanDerWaalsContact C-N 3.3Å; T465-N467 PolarHBondContact O-N 2.93Å; N467-T470 PolarHBondContact O-N 2.8Å; N467-L471 WeakPolarHBondContact O-CB 3.2Å; N467-L471 PolarHBondContact O-N 3.03Å
468	R	97.3	Very high	97	Very high	44 Å²	44	23.7 Å²	23.7	17%	0.166	12%	0.122	C	C	.	.	H	α-helix	trans	-59.1	-49.6	179.8	-173.7	176.1	65.1	-116.8	11.6	112.4	L460 K461 L463 P464 T465 S472 F540	L460-R468 WeakPolarHBondContact O-CD 3.34Å; L460-R468 WeakPolarHBondContact O-CG 3.49Å; K461-R468 PolarHBondContact O-NH1 3.23Å; L463-R468 HydrophobicContact CB-CB 3.94Å; L463-R468 PolarHBondContact O-NH1 2.8Å; P464-R468 PolarHBondContact O-N 3.36Å; T465-R468 PolarHBondContact O-N 3.02Å; R468-S472 VanDerWaalsContact O-CB 3.31Å; R468-S472 WeakPolarHBondContact O-CB 3.46Å; R468-S472 PolarHBondContact O-N 3.35Å; R468-S472 PolarHBondContact O-OG 2.85Å; R468-F540 HydrophobicContact CG-CB 4.42Å; R468-F540 HydrophobicContact CG-CD1 4.25Å; R468-F540 HydrophobicContact CG-CD2 4.18Å; R468-F540 HydrophobicContact CG-CG 4.05Å
469	H	96	Very high	97	Very high	10 Å²	10	20 Å²	20	5%	0.046	10%	0.101	C	C	.	.	H	α-helix	trans	-65.9	-44.7	179.1	-66.3	170.5	0	0	0	111.6	F355 P356 R357 V358 T465 S472 F473 F540 L541	F355-H469 AromaticContact CD2-CE1 3.78Å; F355-H469 AromaticContact CE2-CE1 3.45Å; F355-H469 VanDerWaalsContact CE2-CE1 3.45Å; F355-H469 WeakPolarHBondContact CE2-CE1 3.45Å; F355-H469 AromaticContact CE2-NE2 3.75Å; P356-H469 HydrophobicContact CB-CB 4.18Å; R357-H469 PolarHBondContact N-ND1 3.46Å; R357-H469 VanDerWaalsContact N-ND1 3.11Å; V358-H469 HydrophobicContact CG2-CB 3.87Å; T465-H469 WeakPolarHBondContact CG2-CE1 3.47Å; T465-H469 WeakPolarHBondContact CG2-ND1 3.4Å; T465-H469 WeakPolarHBondContact CG2-NE2 3.22Å; T465-H469 WeakPolarHBondContact O-CB 3.47Å; T465-H469 VanDerWaalsContact O-CG 3.25Å; T465-H469 PolarHBondContact O-N 3.16Å; H469-S472 PolarHBondContact O-N 2.94Å; H469-F473 WeakPolarHBondContact O-CB 3.3Å; H469-F473 PolarHBondContact O-N 3.08Å; H469-F540 PolarHBondContact CD2-O 3.48Å; H469-F540 PolarHBondContact NE2-O 3.19Å; H469-L541 HydrophobicContact CB-CD2 4.17Å
470	T	97.1	Very high	97	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.1	-42.6	-179.9	-59.5	0	0	0	0	111.2	R357 V358 P359 V362 L429 P466 N467 F473 I474	R357-T470 PolarHBondContact O-OG1 2.99Å; V358-T470 HydrophobicContact CG1-CG2 4.46Å; P359-T470 VanDerWaalsContact CD-OG1 3.27Å; P359-T470 WeakPolarHBondContact CD-OG1 3.25Å; V362-T470 HydrophobicContact CG1-CG2 4.41Å; V362-T470 HydrophobicContact CG2-CG2 4.23Å; L429-T470 HydrophobicContact CD1-CG2 3.83Å; L429-T470 HydrophobicContact CD2-CG2 4.16Å; P466-T470 WeakPolarHBondContact O-CB 3.41Å; P466-T470 PolarHBondContact O-N 3.19Å; P466-T470 PolarHBondContact O-OG1 3.33Å; N467-T470 PolarHBondContact O-N 2.8Å; T470-F473 PolarHBondContact O-N 3.22Å; T470-I474 HydrophobicContact CG2-CD1 3.82Å; T470-I474 WeakPolarHBondContact O-CB 3.44Å; T470-I474 WeakPolarHBondContact O-CD1 3.43Å; T470-I474 VanDerWaalsContact O-CG1 3.26Å; T470-I474 WeakPolarHBondContact O-CG1 3.38Å; T470-I474 PolarHBondContact O-N 3.13Å
471	L	98.2	Very high	97	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63	-47.4	175.7	-179.8	62.8	0	0	0	111	L429 V430 L460 L463 N467 F473 I474 M475 L502	L429-L471 HydrophobicContact CD2-CB 3.9Å; L429-L471 HydrophobicContact CD2-CD1 3.98Å; L429-L471 HydrophobicContact CG-CB 4.23Å; V430-L471 HydrophobicContact CG1-CD2 4.4Å; L460-L471 HydrophobicContact CD2-CD2 3.7Å; L463-L471 HydrophobicContact CD1-CD2 3.72Å; N467-L471 WeakPolarHBondContact O-CB 3.2Å; N467-L471 PolarHBondContact O-N 3.03Å; L471-F473 VanDerWaalsContact C-N 3.32Å; L471-F473 PolarHBondContact O-N 2.84Å; L471-I474 PolarHBondContact O-N 2.92Å; L471-M475 HydrophobicContact CD1-CG 4.04Å; L471-M475 HydrophobicContact CD1-SD 4.45Å; L471-M475 HydrophobicContact CG-CG 4.27Å; L471-M475 WeakPolarHBondContact O-CB 3.42Å; L471-M475 WeakPolarHBondContact O-CG 3.43Å; L471-M475 PolarHBondContact O-N 3.36Å; L471-L502 HydrophobicContact CD1-CD1 4.3Å
472	S	97.6	Very high	97.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.6	-44.2	179.7	-57.8	0	0	0	0	111.8	R468 H469 M475 L476 F540	R468-S472 VanDerWaalsContact O-CB 3.31Å; R468-S472 WeakPolarHBondContact O-CB 3.46Å; R468-S472 PolarHBondContact O-N 3.35Å; R468-S472 PolarHBondContact O-OG 2.85Å; H469-S472 PolarHBondContact O-N 2.94Å; S472-M475 PolarHBondContact O-N 3.35Å; S472-L476 WeakPolarHBondContact O-CG 3.36Å; S472-L476 PolarHBondContact O-N 3.16Å; S472-F540 WeakPolarHBondContact OG-CD2 3.45Å
473	F	97	Very high	97.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.4	-41	177.8	-178.7	-114.7	0	0	0	112.2	L232 V358 V362 I363 V366 H469 T470 L471 H477 L541 F559	L232-F473 HydrophobicContact CD1-CD2 3.69Å; L232-F473 HydrophobicContact CD1-CE2 4Å; L232-F473 HydrophobicContact CD1-CG 4.49Å; L232-F473 HydrophobicContact CD2-CD2 3.88Å; L232-F473 HydrophobicContact CD2-CE1 4.41Å; L232-F473 HydrophobicContact CD2-CE2 3.69Å; L232-F473 HydrophobicContact CD2-CG 4.32Å; L232-F473 HydrophobicContact CD2-CZ 3.97Å; L232-F473 HydrophobicContact CG-CD2 4.42Å; L232-F473 HydrophobicContact CG-CE2 4.37Å; V358-F473 HydrophobicContact CG1-CD1 4.02Å; V358-F473 HydrophobicContact CG2-CB 4.37Å; V362-F473 HydrophobicContact CG1-CD1 3.92Å; V362-F473 HydrophobicContact CG1-CE1 4.17Å; I363-F473 HydrophobicContact CG1-CE1 4.32Å; V366-F473 HydrophobicContact CB-CE1 3.64Å; V366-F473 HydrophobicContact CB-CZ 3.87Å; V366-F473 HydrophobicContact CG1-CE1 3.68Å; V366-F473 HydrophobicContact CG1-CE2 4.29Å; V366-F473 HydrophobicContact CG1-CZ 3.47Å; V366-F473 VanDerWaalsContact CG1-CZ 3.47Å; V366-F473 HydrophobicContact CG2-CD1 4.42Å; V366-F473 HydrophobicContact CG2-CE1 3.8Å; V366-F473 HydrophobicContact CG2-CZ 4.47Å; H469-F473 WeakPolarHBondContact O-CB 3.3Å; H469-F473 PolarHBondContact O-N 3.08Å; T470-F473 PolarHBondContact O-N 3.22Å; L471-F473 VanDerWaalsContact C-N 3.32Å; L471-F473 PolarHBondContact O-N 2.84Å; F473-H477 PolarHBondContact O-N 3.06Å; F473-L541 HydrophobicContact CB-CD1 4.03Å; F473-L541 HydrophobicContact CB-CD2 4.39Å; F473-L541 HydrophobicContact CD2-CD1 4.39Å; F473-F559 HydrophobicContact CD2-CE1 4.47Å; F473-F559 AromaticContact CE2-CE1 3.66Å; F473-F559 HydrophobicContact CE2-CE1 3.66Å; F473-F559 HydrophobicContact CE2-CZ 4.21Å; F473-F559 HydrophobicContact CZ-CE1 4.07Å
474	I	98.3	Very high	97	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.6	-43	174.9	-71.5	167.1	0	0	0	110.9	V362 L422 L429 T470 L471 H477 L478 L502	V362-I474 HydrophobicContact CG1-CD1 4.14Å; V362-I474 HydrophobicContact CG1-CG1 3.95Å; L422-I474 HydrophobicContact CD1-CD1 3.93Å; L422-I474 HydrophobicContact CD2-CD1 3.63Å; L422-I474 HydrophobicContact CG-CD1 4.4Å; L429-I474 HydrophobicContact CD2-CD1 3.77Å; T470-I474 HydrophobicContact CG2-CD1 3.82Å; T470-I474 WeakPolarHBondContact O-CB 3.44Å; T470-I474 WeakPolarHBondContact O-CD1 3.43Å; T470-I474 VanDerWaalsContact O-CG1 3.26Å; T470-I474 WeakPolarHBondContact O-CG1 3.38Å; T470-I474 PolarHBondContact O-N 3.13Å; L471-I474 PolarHBondContact O-N 2.92Å; I474-H477 WeakPolarHBondContact O-CB 3.27Å; I474-H477 PolarHBondContact O-N 3.01Å; I474-L478 HydrophobicContact CG2-CD1 3.91Å; I474-L478 HydrophobicContact CG2-CG 4.06Å; I474-L478 VanDerWaalsContact O-CG 3.31Å; I474-L478 WeakPolarHBondContact O-CG 3.46Å; I474-L478 PolarHBondContact O-N 3.15Å; I474-L502 HydrophobicContact CD1-CD2 4.35Å; I474-L502 HydrophobicContact CG2-CD1 3.98Å; I474-L502 HydrophobicContact CG2-CD2 4.27Å
475	M	98.5	Very high	97	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.6	-45.7	-180	-73.2	-54.6	-55.1	0	0	111.7	L471 S472 H477 L478 K479 L526 L529 F530 Y537	L471-M475 HydrophobicContact CD1-CG 4.04Å; L471-M475 HydrophobicContact CD1-SD 4.45Å; L471-M475 HydrophobicContact CG-CG 4.27Å; L471-M475 WeakPolarHBondContact O-CB 3.42Å; L471-M475 WeakPolarHBondContact O-CG 3.43Å; L471-M475 PolarHBondContact O-N 3.36Å; S472-M475 PolarHBondContact O-N 3.35Å; M475-H477 VanDerWaalsContact C-N 3.27Å; M475-H477 PolarHBondContact O-N 2.95Å; M475-L478 PolarHBondContact O-N 3.44Å; M475-K479 WeakPolarHBondContact O-CB 3.39Å; M475-K479 VanDerWaalsContact O-CG 3.27Å; M475-K479 WeakPolarHBondContact O-CG 3.45Å; M475-K479 PolarHBondContact O-N 3.28Å; M475-L526 HydrophobicContact CE-CD1 4.16Å; M475-L526 HydrophobicContact SD-CD1 3.7Å; M475-L529 HydrophobicContact CE-CB 3.6Å; M475-L529 HydrophobicContact SD-CB 4.04Å; M475-L529 HydrophobicContact SD-CD1 4.35Å; M475-F530 HydrophobicContact CE-CD1 4.32Å; M475-F530 HydrophobicContact CE-CG 4.29Å; M475-Y537 HydrophobicContact CB-CD1 4.21Å; M475-Y537 HydrophobicContact CB-CD2 4.09Å; M475-Y537 HydrophobicContact CB-CE1 3.9Å; M475-Y537 HydrophobicContact CB-CE2 3.76Å; M475-Y537 HydrophobicContact CB-CG 4.29Å; M475-Y537 HydrophobicContact CG-CE1 3.95Å; M475-Y537 HydrophobicContact CG-CE2 4.34Å
476	L	97.6	Very high	97	Very high	13 Å²	13	24.8 Å²	24.8	7%	0.068	13%	0.134	C	C	.	.	H	α-helix	trans	-57.1	-41.9	174.3	-72.2	172.5	0	0	0	112.1	S472 K479 A480 D534 L541 Y558 F559	S472-L476 WeakPolarHBondContact O-CG 3.36Å; S472-L476 PolarHBondContact O-N 3.16Å; L476-K479 PolarHBondContact O-N 2.95Å; L476-A480 PolarHBondContact O-N 3.01Å; L476-D534 HydrophobicContact CD2-CB 4Å; L476-L541 HydrophobicContact CD1-CD1 3.62Å; L476-Y558 HydrophobicContact CD1-CD2 3.93Å; L476-Y558 HydrophobicContact CD1-CE2 3.76Å; L476-F559 HydrophobicContact CB-CE2 4.22Å; L476-F559 HydrophobicContact CB-CZ 4.16Å
477	H	97.4	Very high	97	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-47.9	175.2	171.2	63.6	0	0	0	112.4	V366 M370 Y380 F473 I474 M475 K479 A480 V481 F559	V366-H477 HydrophobicContact CG1-CB 3.77Å; V366-H477 HydrophobicContact CG2-CB 4.36Å; M370-H477 WeakPolarHBondContact CG-ND1 3.36Å; M370-H477 PolarHBondContact SD-ND1 3.49Å; Y380-H477 AromaticContact CE2-NE2 3.47Å; Y380-H477 WeakPolarHBondContact CE2-NE2 3.4Å; Y380-H477 AromaticContact CZ-NE2 3.43Å; Y380-H477 PolarHBondContact OH-NE2 3.3Å; F473-H477 PolarHBondContact O-N 3.06Å; I474-H477 WeakPolarHBondContact O-CB 3.27Å; I474-H477 PolarHBondContact O-N 3.01Å; M475-H477 VanDerWaalsContact C-N 3.27Å; M475-H477 PolarHBondContact O-N 2.95Å; H477-K479 VanDerWaalsContact C-N 3.29Å; H477-K479 PolarHBondContact O-N 3.37Å; H477-A480 WeakPolarHBondContact O-CB 3.38Å; H477-A480 PolarHBondContact O-N 2.79Å; H477-A480 VanDerWaalsContact O-N 3.14Å; H477-V481 WeakPolarHBondContact O-CG2 3.48Å; H477-V481 PolarHBondContact O-N 2.72Å; H477-F559 HydrophobicContact CB-CE1 4.41Å; H477-F559 HydrophobicContact CB-CZ 4.06Å
478	L	98.4	Very high	97	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-35.8	178.9	-66	-175.7	0	0	0	112.2	Y380 I474 M475 V481 S482 L494 F498 L502 F530	Y380-L478 HydrophobicContact CD2-CD2 4.48Å; Y380-L478 HydrophobicContact CE2-CD2 4.34Å; I474-L478 HydrophobicContact CG2-CD1 3.91Å; I474-L478 HydrophobicContact CG2-CG 4.06Å; I474-L478 VanDerWaalsContact O-CG 3.31Å; I474-L478 WeakPolarHBondContact O-CG 3.46Å; I474-L478 PolarHBondContact O-N 3.15Å; M475-L478 PolarHBondContact O-N 3.44Å; L478-V481 PolarHBondContact O-N 3.44Å; L478-S482 PolarHBondContact O-N 2.73Å; L478-L494 HydrophobicContact CB-CD1 4.43Å; L478-L494 HydrophobicContact CD2-CD2 4.45Å; L478-L494 WeakPolarHBondContact O-CD1 3.29Å; L478-F498 HydrophobicContact CD1-CB 4.14Å; L478-F498 HydrophobicContact CD1-CD1 4.16Å; L478-F498 HydrophobicContact CD1-CD2 3.82Å; L478-F498 HydrophobicContact CD1-CE2 4.19Å; L478-F498 HydrophobicContact CD1-CG 3.79Å; L478-F498 HydrophobicContact CD2-CD2 3.74Å; L478-F498 HydrophobicContact CD2-CE1 4.35Å; L478-F498 HydrophobicContact CD2-CE2 3.3Å; L478-F498 HydrophobicContact CD2-CG 4.41Å; L478-F498 HydrophobicContact CD2-CZ 3.64Å; L478-F498 HydrophobicContact CG-CD2 4.45Å; L478-F498 HydrophobicContact CG-CE2 4.39Å; L478-L502 HydrophobicContact CD1-CD1 4.17Å; L478-F530 HydrophobicContact CB-CE1 4.06Å; L478-F530 HydrophobicContact CB-CZ 3.93Å
479	K	98	Very high	97	Very high	16 Å²	16	27.5 Å²	27.5	7%	0.07	15%	0.147	C	C	.	.	H	α-helix	trans	-66	-38	173.1	-69.6	-172.8	73.6	154.3	0	112.2	M475 L476 H477 V481 S482 K483 F530 I532 D534 Y537	M475-K479 WeakPolarHBondContact O-CB 3.39Å; M475-K479 VanDerWaalsContact O-CG 3.27Å; M475-K479 WeakPolarHBondContact O-CG 3.45Å; M475-K479 PolarHBondContact O-N 3.28Å; L476-K479 PolarHBondContact O-N 2.95Å; H477-K479 VanDerWaalsContact C-N 3.29Å; H477-K479 PolarHBondContact O-N 3.37Å; K479-V481 VanDerWaalsContact C-N 3.35Å; K479-S482 PolarHBondContact O-N 2.96Å; K479-S482 PolarHBondContact O-OG 3.15Å; K479-K483 WeakPolarHBondContact O-CB 3.39Å; K479-K483 VanDerWaalsContact O-CG 3.22Å; K479-K483 WeakPolarHBondContact O-CG 3.18Å; K479-K483 PolarHBondContact O-N 3.48Å; K479-F530 WeakPolarHBondContact CE-O 3.44Å; K479-F530 HydrophobicContact CG-CD1 3.71Å; K479-F530 HydrophobicContact CG-CE1 3.93Å; K479-F530 PolarHBondContact NZ-O 3.3Å; K479-I532 PolarHBondContact NZ-O 3.33Å; K479-D534 WeakPolarHBondContact CD-OD1 3.48Å; K479-D534 WeakPolarHBondContact CE-OD1 3.41Å; K479-D534 IonicContact NZ-OD1 3.59Å; K479-D534 PolarHBondContact NZ-OD1 3.26Å; K479-Y537 HydrophobicContact CD-CE2 4.48Å
480	A	96.5	Very high	97.1	Very high	23 Å²	23	28.4 Å²	28.4	19%	0.19	16%	0.16	C	C	.	.	H	α-helix	trans	-64.4	-40.7	173.2	0	0	0	0	0	111.9	M370 M374 L476 H477 T484	M370-A480 HydrophobicContact CE-CB 3.68Å; M370-A480 HydrophobicContact SD-CB 4.06Å; M374-A480 HydrophobicContact CE-CB 4.5Å; L476-A480 PolarHBondContact O-N 3.01Å; H477-A480 WeakPolarHBondContact O-CB 3.38Å; H477-A480 PolarHBondContact O-N 2.79Å; H477-A480 VanDerWaalsContact O-N 3.14Å; A480-T484 PolarHBondContact O-N 2.95Å; A480-T484 PolarHBondContact O-OG1 2.86Å
481	V	97.2	Very high	97.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-42.2	175	175	0	0	0	0	111.5	M374 L379 Y380 H477 L478 K479 K483 T484 C487 M489 L494	M374-V481 HydrophobicContact CE-CG2 4.47Å; M374-V481 HydrophobicContact SD-CG2 4.14Å; L379-V481 HydrophobicContact CB-CG1 4.3Å; L379-V481 HydrophobicContact CD1-CG1 4.16Å; L379-V481 HydrophobicContact CD1-CG2 4.21Å; Y380-V481 HydrophobicContact CE2-CG2 4.31Å; H477-V481 WeakPolarHBondContact O-CG2 3.48Å; H477-V481 PolarHBondContact O-N 2.72Å; L478-V481 PolarHBondContact O-N 3.44Å; K479-V481 VanDerWaalsContact C-N 3.35Å; V481-K483 VanDerWaalsContact C-N 3.35Å; V481-K483 PolarHBondContact O-N 3.06Å; V481-T484 PolarHBondContact O-N 3.49Å; V481-C487 HydrophobicContact CG1-CB 4.2Å; V481-M489 HydrophobicContact CG1-CB 4.17Å; V481-L494 HydrophobicContact CB-CD1 4.36Å; V481-L494 HydrophobicContact CG1-CD1 4.19Å; V481-L494 HydrophobicContact CG1-CD2 4.43Å
482	S	97.6	Very high	97.1	Very high	20 Å²	20	35.3 Å²	35.3	14%	0.14	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-37.1	179.8	73.9	0	0	0	0	113.1	L478 K479 T484 M489	L478-S482 PolarHBondContact O-N 2.73Å; K479-S482 PolarHBondContact O-N 2.96Å; K479-S482 PolarHBondContact O-OG 3.15Å; S482-T484 VanDerWaalsContact C-N 3.26Å; S482-T484 PolarHBondContact O-N 3.31Å; S482-M489 WeakPolarHBondContact CA-O 3.48Å
483	K	96.2	Very high	97.1	Very high	125 Å²	125	38.1 Å²	38.1	54%	0.543	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-9.4	177.1	-68.1	171	-175.5	177.8	0	113.6	K479 V481 P485 D534	K479-K483 WeakPolarHBondContact O-CB 3.39Å; K479-K483 VanDerWaalsContact O-CG 3.22Å; K479-K483 WeakPolarHBondContact O-CG 3.18Å; K479-K483 PolarHBondContact O-N 3.48Å; V481-K483 VanDerWaalsContact C-N 3.35Å; V481-K483 PolarHBondContact O-N 3.06Å; K483-P485 VanDerWaalsContact O-CD 3.31Å; K483-P485 WeakPolarHBondContact O-CD 3.45Å; K483-D534 IonicContact NZ-OD1 3.41Å; K483-D534 IonicContact NZ-OD2 2.82Å; K483-D534 PolarHBondContact NZ-OD2 3.34Å
484	T	96.4	Very high	97.1	Very high	33 Å²	33	38.1 Å²	38.1	20%	0.202	21%	0.207	C	C	.	.			trans	-95	107.6	-177.1	-61.5	0	0	0	0	111.3	M374 A480 V481 S482 L486 C487	M374-T484 HydrophobicContact CE-CG2 4.18Å; M374-T484 WeakPolarHBondContact CE-OG1 3.38Å; M374-T484 VanDerWaalsContact O-CG2 3.31Å; M374-T484 WeakPolarHBondContact O-CG2 3.45Å; A480-T484 PolarHBondContact O-N 2.95Å; A480-T484 PolarHBondContact O-OG1 2.86Å; V481-T484 PolarHBondContact O-N 3.49Å; S482-T484 VanDerWaalsContact C-N 3.26Å; S482-T484 PolarHBondContact O-N 3.31Å; T484-L486 VanDerWaalsContact C-N 3.3Å; T484-L486 HydrophobicContact CG2-CB 4.45Å; T484-L486 PolarHBondContact O-N 3.39Å; T484-C487 WeakPolarHBondContact O-CB 3.45Å; T484-C487 PolarHBondContact O-N 3.42Å
485	P	94.8	Very high	97.2	Very high	112 Å²	112	38.1 Å²	38.1	73%	0.727	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-62.6	-34.8	-171.9	-24.7	35.9	0	0	0	113.7	K483 C487 Q488	K483-P485 VanDerWaalsContact O-CD 3.31Å; K483-P485 WeakPolarHBondContact O-CD 3.45Å; P485-C487 PolarHBondContact O-N 2.98Å; P485-Q488 PolarHBondContact O-N 2.71Å
486	L	95.6	Very high	97.1	Very high	104 Å²	104	43 Å²	43	55%	0.545	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-61.9	-26.8	178.7	-63.8	179.6	0	0	0	112.9	K375 V377 T484 Q488	K375-L486 HydrophobicContact CB-CD1 4.41Å; K375-L486 HydrophobicContact CG-CD1 4.1Å; V377-L486 WeakPolarHBondContact CG2-O 3.42Å; T484-L486 VanDerWaalsContact C-N 3.3Å; T484-L486 HydrophobicContact CG2-CB 4.45Å; T484-L486 PolarHBondContact O-N 3.39Å; L486-Q488 VanDerWaalsContact C-N 3.31Å
487	C	94.7	Very high	97.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-72.9	-25.4	177.2	-66.7	0	0	0	0	112.4	M374 T376 G378 V481 T484 P485 M489	M374-C487 PolarHBondContact O-SG 2.98Å; M374-C487 VanDerWaalsContact O-SG 3.37Å; T376-C487 WeakPolarHBondContact O-CA 3.31Å; G378-C487 PolarHBondContact N-O 3.33Å; V481-C487 HydrophobicContact CG1-CB 4.2Å; T484-C487 WeakPolarHBondContact O-CB 3.45Å; T484-C487 PolarHBondContact O-N 3.42Å; P485-C487 PolarHBondContact O-N 2.98Å; C487-M489 HydrophobicContact CB-CB 4.46Å; C487-M489 WeakPolarHBondContact O-CG 3.49Å; C487-M489 PolarHBondContact O-N 3.01Å; C487-M489 VanDerWaalsContact O-N 3.15Å
488	Q	97.1	Very high	97.2	Very high	118 Å²	118	43.7 Å²	43.7	55%	0.551	23%	0.233	S	C	*	.			trans	50.9	32.7	-174.7	-55.7	-176.2	-4.4	0	0	113.6	V377 P485 L486	V377-Q488 HydrophobicContact CG1-CB 4.21Å; V377-Q488 HydrophobicContact CG1-CG 4.28Å; P485-Q488 PolarHBondContact O-N 2.71Å; L486-Q488 VanDerWaalsContact C-N 3.31Å
489	M	97.2	Very high	97.2	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	23%	0.233	C	C	.	.			trans	-123.7	69.3	-176.8	-74.7	-61.7	-57.8	0	0	109.8	L379 R381 V481 S482 C487 N493 L494 V497	L379-M489 WeakPolarHBondContact O-CE 3.44Å; L379-M489 WeakPolarHBondContact O-CG 3.37Å; R381-M489 HydrophobicContact CB-CE 3.74Å; R381-M489 HydrophobicContact CB-SD 3.61Å; R381-M489 HydrophobicContact CG-SD 4.45Å; V481-M489 HydrophobicContact CG1-CB 4.17Å; S482-M489 WeakPolarHBondContact CA-O 3.48Å; C487-M489 HydrophobicContact CB-CB 4.46Å; C487-M489 WeakPolarHBondContact O-CG 3.49Å; C487-M489 PolarHBondContact O-N 3.01Å; C487-M489 VanDerWaalsContact O-N 3.15Å; M489-N493 HydrophobicContact CE-CB 3.7Å; M489-N493 HydrophobicContact SD-CB 4.07Å; M489-L494 HydrophobicContact CB-CD2 4.17Å; M489-L494 HydrophobicContact CB-CG 4.25Å; M489-L494 HydrophobicContact CE-CD2 3.74Å; M489-L494 HydrophobicContact CE-CG 4.19Å; M489-L494 VanDerWaalsContact O-CD1 3.31Å; M489-L494 WeakPolarHBondContact O-CD1 3.12Å; M489-L494 WeakPolarHBondContact O-CG 3.37Å; M489-V497 HydrophobicContact CE-CG2 4.44Å
490	G	97	Very high	97.1	Very high	30 Å²	30	44.5 Å²	44.5	31%	0.309	24%	0.24	S	C	.	.			trans	-62.3	171.5	173.8	0	0	0	0	0	113	E492 N493 L494	G490-E492 VanDerWaalsContact C-N 3.29Å; G490-E492 PolarHBondContact O-N 3.49Å; G490-N493 PolarHBondContact O-N 3.11Å; G490-L494 PolarHBondContact O-N 3.36Å
491	E	98.1	Very high	97.1	Very high	70 Å²	70	43.9 Å²	43.9	33%	0.327	23%	0.234	S	C	.	.	H	α-helix	trans	-57.1	-39.6	-172.9	-58.3	-176.4	169.2	0	0	112.7	N493 L494 A495 F530	E491-N493 PolarHBondContact O-N 3.25Å; E491-L494 PolarHBondContact O-N 3.3Å; E491-A495 VanDerWaalsContact O-CB 3.26Å; E491-A495 WeakPolarHBondContact O-CB 3.25Å; E491-A495 PolarHBondContact O-N 3.15Å; E491-F530 HydrophobicContact CB-CB 4.45Å; E491-F530 HydrophobicContact CB-CD1 4.14Å; E491-F530 HydrophobicContact CB-CD2 3.95Å; E491-F530 HydrophobicContact CB-CE1 4.41Å; E491-F530 HydrophobicContact CB-CE2 4.21Å; E491-F530 HydrophobicContact CB-CG 3.94Å; E491-F530 HydrophobicContact CB-CZ 4.44Å; E491-F530 HydrophobicContact CG-CB 4.36Å; E491-F530 HydrophobicContact CG-CD1 3.64Å; E491-F530 HydrophobicContact CG-CD2 4.37Å; E491-F530 HydrophobicContact CG-CE1 3.96Å; E491-F530 HydrophobicContact CG-CG 3.89Å; E491-F530 HydrophobicContact CG-CZ 4.45Å
492	E	97.2	Very high	97.1	Very high	74 Å²	74	43.9 Å²	43.9	35%	0.346	23%	0.234	S	C	.	.	H	α-helix	trans	-61.9	-39.8	176.4	-178.5	61.2	-154.3	0	0	112.7	G490 K496 R527	G490-E492 VanDerWaalsContact C-N 3.29Å; G490-E492 PolarHBondContact O-N 3.49Å; E492-K496 WeakPolarHBondContact O-CG 3.38Å; E492-K496 PolarHBondContact O-N 3.06Å; E492-K496 VanDerWaalsContact OE1-CE 3.26Å; E492-K496 WeakPolarHBondContact OE1-CE 3.35Å; E492-K496 IonicContact OE1-NZ 3.75Å; E492-R527 VanDerWaalsContact OE2-CD 3.23Å; E492-R527 WeakPolarHBondContact OE2-CD 3.5Å; E492-R527 IonicContact OE2-CZ 3.98Å; E492-R527 IonicContact OE2-NE 2.82Å; E492-R527 IonicContact OE2-NH1 3.94Å; E492-R527 PolarHBondContact OE2-NH1 3.15Å
493	N	97.8	Very high	97.1	Very high	60 Å²	60	42.9 Å²	42.9	32%	0.321	23%	0.227	S	C	.	.	H	α-helix	trans	-74.5	-38.4	178.5	-72.1	-25.2	0	0	0	111.4	M489 G490 E491 A495 K496 V497	M489-N493 HydrophobicContact CE-CB 3.7Å; M489-N493 HydrophobicContact SD-CB 4.07Å; G490-N493 PolarHBondContact O-N 3.11Å; E491-N493 PolarHBondContact O-N 3.25Å; N493-A495 VanDerWaalsContact C-N 3.33Å; N493-K496 PolarHBondContact O-N 3.47Å; N493-V497 PolarHBondContact O-N 2.88Å
494	L	98.6	Very high	97.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.3	-34.8	174.9	-69.8	173.7	0	0	0	111.4	Y380 L478 V481 M489 G490 E491 K496 V497 F498 F530	Y380-L494 HydrophobicContact CD2-CD2 4.27Å; L478-L494 HydrophobicContact CB-CD1 4.43Å; L478-L494 HydrophobicContact CD2-CD2 4.45Å; L478-L494 WeakPolarHBondContact O-CD1 3.29Å; V481-L494 HydrophobicContact CB-CD1 4.36Å; V481-L494 HydrophobicContact CG1-CD1 4.19Å; V481-L494 HydrophobicContact CG1-CD2 4.43Å; M489-L494 HydrophobicContact CB-CD2 4.17Å; M489-L494 HydrophobicContact CB-CG 4.25Å; M489-L494 HydrophobicContact CE-CD2 3.74Å; M489-L494 HydrophobicContact CE-CG 4.19Å; M489-L494 VanDerWaalsContact O-CD1 3.31Å; M489-L494 WeakPolarHBondContact O-CD1 3.12Å; M489-L494 WeakPolarHBondContact O-CG 3.37Å; G490-L494 PolarHBondContact O-N 3.36Å; E491-L494 PolarHBondContact O-N 3.3Å; L494-K496 VanDerWaalsContact C-N 3.33Å; L494-K496 PolarHBondContact O-N 2.78Å; L494-V497 PolarHBondContact O-N 3.49Å; L494-V497 VanDerWaalsContact O-N 3.15Å; L494-F498 HydrophobicContact CD2-CD2 4.29Å; L494-F498 HydrophobicContact CD2-CE2 4.25Å; L494-F498 WeakPolarHBondContact O-CB 3.34Å; L494-F498 PolarHBondContact O-N 3Å; L494-F530 HydrophobicContact CB-CE2 4.06Å; L494-F530 HydrophobicContact CB-CZ 3.79Å; L494-F530 HydrophobicContact CD1-CE1 4.44Å; L494-F530 HydrophobicContact CD1-CZ 3.89Å
495	A	98.4	Very high	97	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.3	-45.4	175.3	0	0	0	0	0	111.7	E491 N493 V497 G499 Q523 L526 R527	E491-A495 VanDerWaalsContact O-CB 3.26Å; E491-A495 WeakPolarHBondContact O-CB 3.25Å; E491-A495 PolarHBondContact O-N 3.15Å; N493-A495 VanDerWaalsContact C-N 3.33Å; A495-V497 VanDerWaalsContact C-N 3.31Å; A495-V497 PolarHBondContact O-N 3.12Å; A495-G499 WeakPolarHBondContact O-CA 3.27Å; A495-G499 PolarHBondContact O-N 2.88Å; A495-Q523 HydrophobicContact CB-CB 4.44Å; A495-L526 HydrophobicContact CB-CD2 4.49Å; A495-R527 HydrophobicContact CB-CG 3.7Å
496	K	98	Very high	96.8	Very high	102 Å²	102	36 Å²	36	44%	0.443	19%	0.191	S	C	.	.	H	α-helix	trans	-61.2	-35.9	176.4	-69.3	170.3	-174.9	171.3	0	113.3	E492 N493 L494	E492-K496 WeakPolarHBondContact O-CG 3.38Å; E492-K496 PolarHBondContact O-N 3.06Å; E492-K496 VanDerWaalsContact OE1-CE 3.26Å; E492-K496 WeakPolarHBondContact OE1-CE 3.35Å; E492-K496 IonicContact OE1-NZ 3.75Å; N493-K496 PolarHBondContact O-N 3.47Å; L494-K496 VanDerWaalsContact C-N 3.33Å; L494-K496 PolarHBondContact O-N 2.78Å
497	V	98	Very high	96.5	Very high	29 Å²	29	33 Å²	33	18%	0.176	18%	0.178	C	C	.	.	H	α-helix	trans	-82.5	-45.8	-178.7	177.6	0	0	0	0	111.8	K419 M489 N493 L494 A495 T501	K419-V497 HydrophobicContact CD-CG1 3.72Å; M489-V497 HydrophobicContact CE-CG2 4.44Å; N493-V497 PolarHBondContact O-N 2.88Å; L494-V497 PolarHBondContact O-N 3.49Å; L494-V497 VanDerWaalsContact O-N 3.15Å; A495-V497 VanDerWaalsContact C-N 3.31Å; A495-V497 PolarHBondContact O-N 3.12Å; V497-T501 PolarHBondContact O-OG1 3.29Å
498	F	98.4	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-94.7	-15	-170.5	-81.2	-81.3	0	0	0	114.1	Y380 K419 L422 L478 L494 T501 L502 L526	Y380-F498 AromaticContact CD1-CE2 3.74Å; Y380-F498 HydrophobicContact CD1-CE2 3.74Å; Y380-F498 AromaticContact CD1-CZ 3.41Å; Y380-F498 HydrophobicContact CD1-CZ 3.41Å; Y380-F498 VanDerWaalsContact CD1-CZ 3.41Å; Y380-F498 AromaticContact CD2-CE2 3.81Å; Y380-F498 HydrophobicContact CD2-CE2 3.81Å; Y380-F498 HydrophobicContact CD2-CZ 4.16Å; Y380-F498 HydrophobicContact CE1-CE2 4.37Å; Y380-F498 AromaticContact CE1-CZ 3.76Å; Y380-F498 HydrophobicContact CE1-CZ 3.76Å; Y380-F498 HydrophobicContact CE2-CE2 4.44Å; Y380-F498 HydrophobicContact CE2-CZ 4.46Å; Y380-F498 AromaticContact CG-CE2 3.43Å; Y380-F498 HydrophobicContact CG-CE2 3.43Å; Y380-F498 VanDerWaalsContact CG-CE2 3.43Å; Y380-F498 AromaticContact CG-CZ 3.64Å; Y380-F498 HydrophobicContact CG-CZ 3.64Å; K419-F498 HydrophobicContact CG-CE1 4.32Å; K419-F498 HydrophobicContact CG-CZ 4.34Å; L422-F498 HydrophobicContact CD1-CE1 4.24Å; L478-F498 HydrophobicContact CD1-CB 4.14Å; L478-F498 HydrophobicContact CD1-CD1 4.16Å; L478-F498 HydrophobicContact CD1-CD2 3.82Å; L478-F498 HydrophobicContact CD1-CE2 4.19Å; L478-F498 HydrophobicContact CD1-CG 3.79Å; L478-F498 HydrophobicContact CD2-CD2 3.74Å; L478-F498 HydrophobicContact CD2-CE1 4.35Å; L478-F498 HydrophobicContact CD2-CE2 3.3Å; L478-F498 HydrophobicContact CD2-CG 4.41Å; L478-F498 HydrophobicContact CD2-CZ 3.64Å; L478-F498 HydrophobicContact CG-CD2 4.45Å; L478-F498 HydrophobicContact CG-CE2 4.39Å; L494-F498 HydrophobicContact CD2-CD2 4.29Å; L494-F498 HydrophobicContact CD2-CE2 4.25Å; L494-F498 WeakPolarHBondContact O-CB 3.34Å; L494-F498 PolarHBondContact O-N 3Å; F498-T501 HydrophobicContact CD1-CG2 3.97Å; F498-T501 HydrophobicContact CE1-CG2 4.31Å; F498-T501 CarbonylContact O-C 3.59Å; F498-T501 PolarHBondContact O-N 3.2Å; F498-T501 VanDerWaalsContact O-N 3.09Å; F498-L502 HydrophobicContact CB-CD1 4.09Å; F498-L502 HydrophobicContact CB-CG 4.2Å; F498-L502 HydrophobicContact CD1-CD1 4.1Å; F498-L502 HydrophobicContact CD1-CD2 4.21Å; F498-L502 HydrophobicContact CD1-CG 3.92Å; F498-L502 HydrophobicContact CG-CD1 4.45Å; F498-L502 WeakPolarHBondContact O-CB 3.31Å; F498-L502 PolarHBondContact O-N 2.95Å; F498-L526 HydrophobicContact CB-CD2 3.27Å
499	G	97.9	Very high	95.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-54.4	-61.1	174	0	0	0	0	0	110.8	A495 T501 V503 G504 Q522 L526	A495-G499 WeakPolarHBondContact O-CA 3.27Å; A495-G499 PolarHBondContact O-N 2.88Å; G499-T501 PolarHBondContact O-N 3.35Å; G499-V503 WeakPolarHBondContact O-CA 3.46Å; G499-V503 WeakPolarHBondContact O-CB 3.35Å; G499-V503 PolarHBondContact O-N 2.59Å; G499-G504 PolarHBondContact O-N 3.44Å; G499-Q522 WeakPolarHBondContact CA-O 3.42Å; G499-L526 VanDerWaalsContact N-CD2 3.3Å
500	P	95.9	Very high	95.1	Very high	33 Å²	33	39.8 Å²	39.8	21%	0.214	22%	0.219	C	C	.	.	I	π-helix	trans	-63.1	-23.6	175.4	-20.2	30.4	0	0	0	114	G504	P500-G504 WeakPolarHBondContact O-CA 3.41Å
501	T	96.8	Very high	94.9	Very high	9 Å²	9	45.5 Å²	45.5	6%	0.055	24%	0.238	C	C	.	.	I	π-helix	trans	-83.4	-35.9	-175.8	-59.5	0	0	0	0	113.3	K419 L422 R423 V497 F498 G499	K419-T501 HydrophobicContact CB-CG2 4.48Å; L422-T501 HydrophobicContact CB-CG2 3.71Å; L422-T501 HydrophobicContact CD1-CG2 4.08Å; R423-T501 HydrophobicContact CG-CG2 4.06Å; V497-T501 PolarHBondContact O-OG1 3.29Å; F498-T501 HydrophobicContact CD1-CG2 3.97Å; F498-T501 HydrophobicContact CE1-CG2 4.31Å; F498-T501 CarbonylContact O-C 3.59Å; F498-T501 PolarHBondContact O-N 3.2Å; F498-T501 VanDerWaalsContact O-N 3.09Å; G499-T501 PolarHBondContact O-N 3.35Å
502	L	98	Very high	94.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.	I	π-helix	trans	-103.1	-44.3	-176.5	-60.2	-178.6	0	0	0	112	L422 L429 V430 L471 I474 L478 F498 L526	L422-L502 HydrophobicContact CD1-CD2 3.77Å; L422-L502 HydrophobicContact CD2-CD2 4.32Å; L422-L502 HydrophobicContact CG-CD2 4.45Å; L429-L502 HydrophobicContact CB-CD2 4.43Å; L429-L502 HydrophobicContact CD2-CD2 3.82Å; L429-L502 PolarHBondContact N-O 2.92Å; V430-L502 PolarHBondContact N-O 3.3Å; L471-L502 HydrophobicContact CD1-CD1 4.3Å; I474-L502 HydrophobicContact CD1-CD2 4.35Å; I474-L502 HydrophobicContact CG2-CD1 3.98Å; I474-L502 HydrophobicContact CG2-CD2 4.27Å; L478-L502 HydrophobicContact CD1-CD1 4.17Å; F498-L502 HydrophobicContact CB-CD1 4.09Å; F498-L502 HydrophobicContact CB-CG 4.2Å; F498-L502 HydrophobicContact CD1-CD1 4.1Å; F498-L502 HydrophobicContact CD1-CD2 4.21Å; F498-L502 HydrophobicContact CD1-CG 3.92Å; F498-L502 HydrophobicContact CG-CD1 4.45Å; F498-L502 WeakPolarHBondContact O-CB 3.31Å; F498-L502 PolarHBondContact O-N 2.95Å; L502-L526 HydrophobicContact CD1-CD1 4.12Å
503	V	97.8	Very high	94.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.274	C	S	.	.	I	π-helix	trans	-80.6	-37.8	-178.2	-171.7	0	0	0	0	110.4	P428 V430 R435 G499 Q522 V525	P428-V503 VanDerWaalsContact CB-O 3.25Å; P428-V503 WeakPolarHBondContact CB-O 3.43Å; P428-V503 WeakPolarHBondContact CG-O 3.24Å; V430-V503 HydrophobicContact CG2-CB 4.43Å; V430-V503 HydrophobicContact CG2-CG1 4.2Å; V430-V503 WeakPolarHBondContact CG2-O 3.41Å; R435-V503 WeakPolarHBondContact CD-O 3.28Å; R435-V503 HydrophobicContact CG-CG1 4.1Å; R435-V503 PolarHBondContact NE-O 2.8Å; G499-V503 WeakPolarHBondContact O-CA 3.46Å; G499-V503 WeakPolarHBondContact O-CB 3.35Å; G499-V503 PolarHBondContact O-N 2.59Å; V503-Q522 HydrophobicContact CB-CB 4.26Å; V503-Q522 HydrophobicContact CB-CG 4.14Å; V503-Q522 HydrophobicContact CG1-CB 4.5Å; V503-Q522 HydrophobicContact CG1-CG 4.15Å; V503-V525 HydrophobicContact CG1-CB 4.39Å; V503-V525 HydrophobicContact CG1-CG1 4.24Å; V503-V525 HydrophobicContact CG1-CG2 4.45Å; V503-V525 HydrophobicContact CG2-CB 4Å; V503-V525 HydrophobicContact CG2-CG1 3.62Å
504	G	94.6	Very high	94	Very high	8 Å²	8	51.1 Å²	51.1	8%	0.082	27%	0.272	C	S	.	.			trans	60.3	-167.4	179.7	0	0	0	0	0	113.7	R435 G499 P500 Q522	R435-G504 PolarHBondContact NE-O 2.8Å; R435-G504 PolarHBondContact NH2-O 3.4Å; G499-G504 PolarHBondContact O-N 3.44Å; P500-G504 WeakPolarHBondContact O-CA 3.41Å; G504-Q522 VanDerWaalsContact C-NE2 3.34Å; G504-Q522 WeakPolarHBondContact O-CG 3.43Å; G504-Q522 PolarHBondContact O-NE2 3.15Å
505	Y	94.3	Very high	93.6	Very high	60 Å²	60	52 Å²	52	24%	0.235	28%	0.279	C	S	.	.			trans	-97.3	166.7	-177.8	-57.5	-81.2	0	0	0	111.2	Y432 C507 P510 A515 E518	Y432-Y505 VanDerWaalsContact CE1-O 3.28Å; Y432-Y505 WeakPolarHBondContact CE1-O 3.45Å; Y505-C507 PolarHBondContact O-N 2.88Å; Y505-P510 HydrophobicContact CD1-CB 4.15Å; Y505-P510 HydrophobicContact CD1-CG 4.04Å; Y505-P510 HydrophobicContact CD2-CG 3.76Å; Y505-P510 HydrophobicContact CE2-CG 4.31Å; Y505-P510 HydrophobicContact CG-CB 3.99Å; Y505-P510 HydrophobicContact CG-CG 3.6Å; Y505-A515 HydrophobicContact CD1-CB 4.25Å; Y505-A515 HydrophobicContact CE1-CB 3.68Å; Y505-E518 VanDerWaalsContact CA-OE2 3.27Å; Y505-E518 WeakPolarHBondContact CA-OE2 3.49Å; Y505-E518 HydrophobicContact CD1-CB 4.39Å
506	S	91.1	Very high	93.4	Very high	57 Å²	57	57.2 Å²	57.2	40%	0.399	31%	0.306	S	S	.	.	S	Bend	trans	-67.7	-18.3	179	-51.6	0	0	0	0	113.8	Y432 R435 E518	Y432-S506 WeakPolarHBondContact CD1-O 3.39Å; R435-S506 PolarHBondContact NH1-OG 3.24Å; S506-E518 WeakPolarHBondContact CB-OE1 3.33Å; S506-E518 PolarHBondContact N-OE2 3.45Å; S506-E518 PolarHBondContact OG-OE1 2.83Å; S506-E518 PolarHBondContact OG-OE2 3.08Å
507	C	89.4	Confident	93.3	Very high	41 Å²	41	56 Å²	56	28%	0.277	31%	0.31	S	S	.	.	S	Bend	trans	-143.7	163.8	177.9	64	0	0	0	0	111.5	Y505 E509	Y505-C507 PolarHBondContact O-N 2.88Å; C507-E509 VanDerWaalsContact C-N 3.34Å; C507-E509 PolarHBondContact O-N 3.4Å
508	P	85.5	Confident	93.2	Very high	71 Å²	71	55.7 Å²	55.7	46%	0.461	31%	0.307	S	S	.	.	S	Bend	trans	-61.8	-37.6	-177.9	-24.3	33.2	0	0	0	114.3	R340 Y432 P510	R340-P508 PolarHBondContact NH1-O 2.99Å; Y432-P508 HydrophobicContact CE2-CG 4.37Å; Y432-P508 WeakPolarHBondContact OH-CA 3.31Å; Y432-P508 WeakPolarHBondContact OH-CG 3.44Å; P508-P510 WeakPolarHBondContact O-CD 3.33Å
509	E	86.6	Confident	93	Very high	157 Å²	157	57.8 Å²	57.8	73%	0.734	32%	0.32	S	S	*	.	S	Bend	trans	-119.4	77.1	-178.8	-68.1	-174.3	-179	0	0	110.1	C507	C507-E509 VanDerWaalsContact C-N 3.34Å; C507-E509 PolarHBondContact O-N 3.4Å
510	P	88.3	Confident	93	Very high	34 Å²	34	62.3 Å²	62.3	22%	0.221	34%	0.34	C	S	.	.			trans	-69	138.8	177.7	31.2	-36.7	0	0	0	110.2	Y505 P508 A515	Y505-P510 HydrophobicContact CD1-CB 4.15Å; Y505-P510 HydrophobicContact CD1-CG 4.04Å; Y505-P510 HydrophobicContact CD2-CG 3.76Å; Y505-P510 HydrophobicContact CE2-CG 4.31Å; Y505-P510 HydrophobicContact CG-CB 3.99Å; Y505-P510 HydrophobicContact CG-CG 3.6Å; P508-P510 WeakPolarHBondContact O-CD 3.33Å; P510-A515 HydrophobicContact CB-CB 4.45Å; P510-A515 HydrophobicContact CG-CB 4.48Å
511	Q	91.2	Very high	93	Very high	150 Å²	150	62.3 Å²	62.3	70%	0.701	34%	0.339	S	S	*	.			trans	-66.1	157.9	168.5	-63.7	-178.3	0.4	0	0	110.4	M513 Q514 A515	Q511-M513 VanDerWaalsContact C-N 3.31Å; Q511-M513 PolarHBondContact O-N 3.13Å; Q511-Q514 WeakPolarHBondContact O-CB 3.39Å; Q511-Q514 PolarHBondContact O-N 3.41Å; Q511-Q514 VanDerWaalsContact O-N 3.14Å; Q511-A515 PolarHBondContact O-N 2.98Å
512	V	92.5	Very high	93.1	Very high	117 Å²	117	61.9 Å²	61.9	71%	0.709	34%	0.337	S	S	*	.	H	α-helix	trans	-54.3	-46.6	-177	178.2	0	0	0	0	111.9	Q514 A515 I516	V512-Q514 PolarHBondContact O-N 3.14Å; V512-A515 PolarHBondContact O-N 3.35Å; V512-I516 HydrophobicContact CG1-CD1 3.98Å; V512-I516 WeakPolarHBondContact O-CG1 3.27Å; V512-I516 PolarHBondContact O-N 3.07Å
513	M	91.8	Very high	93.1	Very high	149 Å²	149	63.1 Å²	63.1	73%	0.734	34%	0.343	S	S	*	.	H	α-helix	trans	-65.2	-39.4	-178.5	-161	65.6	171.9	0	0	112.3	Q511 I516 S517	Q511-M513 VanDerWaalsContact C-N 3.31Å; Q511-M513 PolarHBondContact O-N 3.13Å; M513-I516 PolarHBondContact O-N 3.46Å; M513-S517 PolarHBondContact O-N 3.23Å; M513-S517 PolarHBondContact O-OG 2.82Å
514	Q	90.8	Very high	93.1	Very high	56 Å²	56	64.9 Å²	64.9	26%	0.262	35%	0.352	S	S	.	.	H	α-helix	trans	-66	-40.1	175.1	-175.4	179.2	5.5	0	0	111.6	Q511 V512 I516 S517 E518	Q511-Q514 WeakPolarHBondContact O-CB 3.39Å; Q511-Q514 PolarHBondContact O-N 3.41Å; Q511-Q514 VanDerWaalsContact O-N 3.14Å; V512-Q514 PolarHBondContact O-N 3.14Å; Q514-I516 VanDerWaalsContact C-N 3.28Å; Q514-I516 PolarHBondContact O-N 3.26Å; Q514-S517 WeakPolarHBondContact CA-OG 3.5Å; Q514-S517 PolarHBondContact O-N 2.9Å; Q514-S517 PolarHBondContact O-OG 3.31Å; Q514-S517 VanDerWaalsContact O-OG 3.13Å; Q514-E518 HydrophobicContact CG-CG 4.18Å; Q514-E518 VanDerWaalsContact CG-OE1 3.23Å; Q514-E518 WeakPolarHBondContact CG-OE1 3.29Å; Q514-E518 PolarHBondContact NE2-OE1 3.27Å; Q514-E518 VanDerWaalsContact O-CB 3.31Å; Q514-E518 WeakPolarHBondContact O-CB 3.33Å; Q514-E518 VanDerWaalsContact O-CG 3.29Å; Q514-E518 WeakPolarHBondContact O-CG 3.23Å; Q514-E518 PolarHBondContact O-N 3.48Å
515	A	91.3	Very high	93.2	Very high	20 Å²	20	64.6 Å²	64.6	17%	0.165	35%	0.349	C	S	.	.	H	α-helix	trans	-62.7	-37.9	176.9	0	0	0	0	0	111.7	Y505 P510 Q511 V512 T519	Y505-A515 HydrophobicContact CD1-CB 4.25Å; Y505-A515 HydrophobicContact CE1-CB 3.68Å; P510-A515 HydrophobicContact CB-CB 4.45Å; P510-A515 HydrophobicContact CG-CB 4.48Å; Q511-A515 PolarHBondContact O-N 2.98Å; V512-A515 PolarHBondContact O-N 3.35Å; A515-T519 PolarHBondContact O-N 3.18Å; A515-T519 PolarHBondContact O-OG1 2.88Å
516	I	93.4	Very high	93.4	Very high	109 Å²	109	61.8 Å²	61.8	56%	0.559	34%	0.337	S	S	*	.	H	α-helix	trans	-68.4	-50	176.5	-66	165.7	0	0	0	110.6	V512 M513 Q514 E518 T519	V512-I516 HydrophobicContact CG1-CD1 3.98Å; V512-I516 WeakPolarHBondContact O-CG1 3.27Å; V512-I516 PolarHBondContact O-N 3.07Å; M513-I516 PolarHBondContact O-N 3.46Å; Q514-I516 VanDerWaalsContact C-N 3.28Å; Q514-I516 PolarHBondContact O-N 3.26Å; I516-E518 VanDerWaalsContact C-N 3.34Å; I516-E518 PolarHBondContact O-N 3.28Å; I516-T519 WeakPolarHBondContact O-CB 3.5Å; I516-T519 PolarHBondContact O-N 3.37Å
517	S	94.7	Very high	93.7	Very high	76 Å²	76	63.2 Å²	63.2	53%	0.531	33%	0.334	S	S	.	.	H	α-helix	trans	-65.4	-35.9	-176.8	63.9	0	0	0	0	112.9	M513 Q514 T519 P521	M513-S517 PolarHBondContact O-N 3.23Å; M513-S517 PolarHBondContact O-OG 2.82Å; Q514-S517 WeakPolarHBondContact CA-OG 3.5Å; Q514-S517 PolarHBondContact O-N 2.9Å; Q514-S517 PolarHBondContact O-OG 3.31Å; Q514-S517 VanDerWaalsContact O-OG 3.13Å; S517-T519 VanDerWaalsContact C-N 3.34Å; S517-T519 PolarHBondContact O-N 2.75Å; S517-P521 VanDerWaalsContact O-CD 3.27Å; S517-P521 WeakPolarHBondContact O-CD 3.23Å
518	E	96	Very high	94.1	Very high	22 Å²	22	61.4 Å²	61.4	10%	0.103	32%	0.322	C	S	.	.	H	α-helix	trans	-80.5	-12.2	-179.1	-68.1	-175.4	-173.2	0	0	114	R435 Y505 S506 Q514 I516 K520 P521 Q522	R435-E518 IonicContact CZ-OE2 3.93Å; R435-E518 IonicContact NH1-OE2 3.89Å; R435-E518 IonicContact NH2-OE2 3.22Å; R435-E518 PolarHBondContact NH2-OE2 3.19Å; Y505-E518 VanDerWaalsContact CA-OE2 3.27Å; Y505-E518 WeakPolarHBondContact CA-OE2 3.49Å; Y505-E518 HydrophobicContact CD1-CB 4.39Å; S506-E518 WeakPolarHBondContact CB-OE1 3.33Å; S506-E518 PolarHBondContact N-OE2 3.45Å; S506-E518 PolarHBondContact OG-OE1 2.83Å; S506-E518 PolarHBondContact OG-OE2 3.08Å; Q514-E518 HydrophobicContact CG-CG 4.18Å; Q514-E518 VanDerWaalsContact CG-OE1 3.23Å; Q514-E518 WeakPolarHBondContact CG-OE1 3.29Å; Q514-E518 PolarHBondContact NE2-OE1 3.27Å; Q514-E518 VanDerWaalsContact O-CB 3.31Å; Q514-E518 WeakPolarHBondContact O-CB 3.33Å; Q514-E518 VanDerWaalsContact O-CG 3.29Å; Q514-E518 WeakPolarHBondContact O-CG 3.23Å; Q514-E518 PolarHBondContact O-N 3.48Å; I516-E518 VanDerWaalsContact C-N 3.34Å; I516-E518 PolarHBondContact O-N 3.28Å; E518-K520 VanDerWaalsContact C-N 3.3Å; E518-K520 PolarHBondContact O-N 3.22Å; E518-P521 WeakPolarHBondContact O-CD 3.37Å; E518-Q522 WeakPolarHBondContact O-CB 3.29Å; E518-Q522 VanDerWaalsContact O-CD 3.28Å; E518-Q522 WeakPolarHBondContact O-CG 3.31Å; E518-Q522 PolarHBondContact O-N 3.16Å
519	T	96	Very high	94.7	Very high	44 Å²	44	58.1 Å²	58.1	27%	0.27	30%	0.3	S	S	.	.	H	α-helix	trans	-61.1	-39.3	-178.3	-70.2	0	0	0	0	111.9	A515 I516 S517 Q523	A515-T519 PolarHBondContact O-N 3.18Å; A515-T519 PolarHBondContact O-OG1 2.88Å; I516-T519 WeakPolarHBondContact O-CB 3.5Å; I516-T519 PolarHBondContact O-N 3.37Å; S517-T519 VanDerWaalsContact C-N 3.34Å; S517-T519 PolarHBondContact O-N 2.75Å; T519-Q523 VanDerWaalsContact CG2-NE2 3.29Å; T519-Q523 VanDerWaalsContact O-CG 3.3Å; T519-Q523 WeakPolarHBondContact O-CG 3.34Å; T519-Q523 PolarHBondContact O-N 3.39Å
520	K	96.1	Very high	95.3	Very high	96 Å²	96	50.7 Å²	50.7	42%	0.417	27%	0.266	S	S	.	.	H	α-helix	trans	-70.5	-51.2	-179.5	179.2	59	176.8	152	0	112	E518 Q522 Q523 D524	E518-K520 VanDerWaalsContact C-N 3.3Å; E518-K520 PolarHBondContact O-N 3.22Å; K520-Q522 VanDerWaalsContact C-N 3.29Å; K520-Q522 PolarHBondContact O-N 2.99Å; K520-Q523 WeakPolarHBondContact O-CB 3.47Å; K520-Q523 PolarHBondContact O-N 2.92Å; K520-D524 WeakPolarHBondContact CE-OD1 3.16Å; K520-D524 WeakPolarHBondContact CE-OD2 3.38Å; K520-D524 IonicContact NZ-OD1 3.98Å; K520-D524 PolarHBondContact NZ-OD1 3.48Å; K520-D524 IonicContact NZ-OD2 3.41Å; K520-D524 VanDerWaalsContact O-CG 3.24Å; K520-D524 PolarHBondContact O-N 3.2Å
521	P	97	Very high	95.6	Very high	32 Å²	32	52.1 Å²	52.1	21%	0.208	27%	0.271	C	S	.	.	H	α-helix	trans	-52.5	-41.6	171.4	-29.7	34.5	0	0	0	114.3	V439 S517 E518 Q523 D524 V525	V439-P521 HydrophobicContact CG1-CB 4.03Å; V439-P521 HydrophobicContact CG2-CB 4.38Å; S517-P521 VanDerWaalsContact O-CD 3.27Å; S517-P521 WeakPolarHBondContact O-CD 3.23Å; E518-P521 WeakPolarHBondContact O-CD 3.37Å; P521-Q523 VanDerWaalsContact C-N 3.31Å; P521-Q523 PolarHBondContact O-N 3.13Å; P521-D524 PolarHBondContact O-N 3.37Å; P521-V525 WeakPolarHBondContact O-CG2 3.31Å; P521-V525 PolarHBondContact O-N 2.93Å
522	Q	97.7	Very high	95.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.7	-39.7	177.1	-72.5	162.2	4.1	0	0	112.9	G499 V503 G504 E518 K520 L526	G499-Q522 WeakPolarHBondContact CA-O 3.42Å; V503-Q522 HydrophobicContact CB-CB 4.26Å; V503-Q522 HydrophobicContact CB-CG 4.14Å; V503-Q522 HydrophobicContact CG1-CB 4.5Å; V503-Q522 HydrophobicContact CG1-CG 4.15Å; G504-Q522 VanDerWaalsContact C-NE2 3.34Å; G504-Q522 WeakPolarHBondContact O-CG 3.43Å; G504-Q522 PolarHBondContact O-NE2 3.15Å; E518-Q522 WeakPolarHBondContact O-CB 3.29Å; E518-Q522 VanDerWaalsContact O-CD 3.28Å; E518-Q522 WeakPolarHBondContact O-CG 3.31Å; E518-Q522 PolarHBondContact O-N 3.16Å; K520-Q522 VanDerWaalsContact C-N 3.29Å; K520-Q522 PolarHBondContact O-N 2.99Å; Q522-L526 PolarHBondContact O-N 3.32Å
523	Q	98	Very high	96	Very high	27 Å²	27	42.6 Å²	42.6	13%	0.126	23%	0.226	C	C	.	.	H	α-helix	trans	-69.5	-40.7	176.3	-66.5	169.6	21.2	0	0	110.8	A495 T519 K520 P521 L526 R527	A495-Q523 HydrophobicContact CB-CB 4.44Å; T519-Q523 VanDerWaalsContact CG2-NE2 3.29Å; T519-Q523 VanDerWaalsContact O-CG 3.3Å; T519-Q523 WeakPolarHBondContact O-CG 3.34Å; T519-Q523 PolarHBondContact O-N 3.39Å; K520-Q523 WeakPolarHBondContact O-CB 3.47Å; K520-Q523 PolarHBondContact O-N 2.92Å; P521-Q523 VanDerWaalsContact C-N 3.31Å; P521-Q523 PolarHBondContact O-N 3.13Å; Q523-L526 PolarHBondContact O-N 3.05Å; Q523-L526 VanDerWaalsContact O-N 3.16Å; Q523-R527 WeakPolarHBondContact O-CG 3.34Å; Q523-R527 PolarHBondContact O-N 2.88Å
524	D	97.9	Very high	96.1	Very high	37 Å²	37	37.9 Å²	37.9	20%	0.198	20%	0.204	C	C	.	.	H	α-helix	trans	-66.7	-41.5	-178	-63.3	-14.3	0	0	0	111.8	K520 P521 L526 R527 L528	K520-D524 WeakPolarHBondContact CE-OD1 3.16Å; K520-D524 WeakPolarHBondContact CE-OD2 3.38Å; K520-D524 IonicContact NZ-OD1 3.98Å; K520-D524 PolarHBondContact NZ-OD1 3.48Å; K520-D524 IonicContact NZ-OD2 3.41Å; K520-D524 VanDerWaalsContact O-CG 3.24Å; K520-D524 PolarHBondContact O-N 3.2Å; P521-D524 PolarHBondContact O-N 3.37Å; D524-L526 VanDerWaalsContact C-N 3.31Å; D524-L526 PolarHBondContact O-N 3.38Å; D524-R527 PolarHBondContact O-N 3.27Å; D524-R527 IonicContact OD1-CZ 3.8Å; D524-R527 VanDerWaalsContact OD1-CZ 3.25Å; D524-R527 IonicContact OD1-NE 2.77Å; D524-R527 PolarHBondContact OD1-NE 3.05Å; D524-R527 IonicContact OD1-NH2 3.77Å; D524-R527 PolarHBondContact OD1-NH2 3.42Å; D524-L528 PolarHBondContact O-N 3.4Å
525	V	98.3	Very high	96.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-54.9	-47.6	168.9	169	0	0	0	0	111.1	F438 V439 V503 P521 R527 L528 L529	F438-V525 HydrophobicContact CB-CG1 3.79Å; F438-V525 HydrophobicContact CB-CG2 4.06Å; F438-V525 HydrophobicContact CD1-CG1 4.33Å; F438-V525 HydrophobicContact CG-CG1 4.2Å; V439-V525 HydrophobicContact CB-CG2 4.4Å; V439-V525 HydrophobicContact CG2-CG2 3.89Å; V503-V525 HydrophobicContact CG1-CB 4.39Å; V503-V525 HydrophobicContact CG1-CG1 4.24Å; V503-V525 HydrophobicContact CG1-CG2 4.45Å; V503-V525 HydrophobicContact CG2-CB 4Å; V503-V525 HydrophobicContact CG2-CG1 3.62Å; P521-V525 WeakPolarHBondContact O-CG2 3.31Å; P521-V525 PolarHBondContact O-N 2.93Å; V525-R527 VanDerWaalsContact C-N 3.34Å; V525-R527 PolarHBondContact O-N 2.86Å; V525-L528 WeakPolarHBondContact O-CB 3.38Å; V525-L528 PolarHBondContact O-N 2.99Å; V525-L529 HydrophobicContact CG1-CD1 4.24Å; V525-L529 WeakPolarHBondContact O-CG 3.49Å; V525-L529 PolarHBondContact O-N 3.05Å
526	L	98.2	Very high	96.3	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.8	-34.4	-177.4	-172.6	57.5	0	0	0	112.3	M475 A495 F498 G499 L502 Q522 Q523 D524 L529 F530	M475-L526 HydrophobicContact CE-CD1 4.16Å; M475-L526 HydrophobicContact SD-CD1 3.7Å; A495-L526 HydrophobicContact CB-CD2 4.49Å; F498-L526 HydrophobicContact CB-CD2 3.27Å; G499-L526 VanDerWaalsContact N-CD2 3.3Å; L502-L526 HydrophobicContact CD1-CD1 4.12Å; Q522-L526 PolarHBondContact O-N 3.32Å; Q523-L526 PolarHBondContact O-N 3.05Å; Q523-L526 VanDerWaalsContact O-N 3.16Å; D524-L526 VanDerWaalsContact C-N 3.31Å; D524-L526 PolarHBondContact O-N 3.38Å; L526-L529 HydrophobicContact CD1-CB 4.41Å; L526-L529 HydrophobicContact CD1-CD1 4.18Å; L526-L529 PolarHBondContact O-N 2.77Å; L526-F530 HydrophobicContact CD1-CE2 4.44Å; L526-F530 HydrophobicContact CD2-CE2 4.5Å; L526-F530 HydrophobicContact CG-CD2 4.26Å; L526-F530 HydrophobicContact CG-CE2 4.02Å; L526-F530 WeakPolarHBondContact O-CD2 3.35Å; L526-F530 PolarHBondContact O-N 2.88Å
527	R	97.9	Very high	96.5	Very high	87 Å²	87	33.8 Å²	33.8	33%	0.328	18%	0.183	S	C	.	.	H	α-helix	trans	-63.5	-40.7	171.6	-68.7	-173.4	-61.2	159.2	13.3	111.7	E492 A495 Q523 D524 V525 L529 F530 N531	E492-R527 VanDerWaalsContact OE2-CD 3.23Å; E492-R527 WeakPolarHBondContact OE2-CD 3.5Å; E492-R527 IonicContact OE2-CZ 3.98Å; E492-R527 IonicContact OE2-NE 2.82Å; E492-R527 IonicContact OE2-NH1 3.94Å; E492-R527 PolarHBondContact OE2-NH1 3.15Å; A495-R527 HydrophobicContact CB-CG 3.7Å; Q523-R527 WeakPolarHBondContact O-CG 3.34Å; Q523-R527 PolarHBondContact O-N 2.88Å; D524-R527 PolarHBondContact O-N 3.27Å; D524-R527 IonicContact OD1-CZ 3.8Å; D524-R527 VanDerWaalsContact OD1-CZ 3.25Å; D524-R527 IonicContact OD1-NE 2.77Å; D524-R527 PolarHBondContact OD1-NE 3.05Å; D524-R527 IonicContact OD1-NH2 3.77Å; D524-R527 PolarHBondContact OD1-NH2 3.42Å; V525-R527 VanDerWaalsContact C-N 3.34Å; V525-R527 PolarHBondContact O-N 2.86Å; R527-L529 VanDerWaalsContact C-N 3.34Å; R527-L529 PolarHBondContact O-N 3.47Å; R527-F530 WeakPolarHBondContact O-CB 3.14Å; R527-F530 PolarHBondContact O-N 3.42Å; R527-N531 PolarHBondContact O-N 3.33Å
528	L	97.4	Very high	96.4	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-63.6	-40.5	173.6	-178.7	53.7	0	0	0	111.9	A441 Y445 A452 Y453 V456 D524 V525 F530 N531	A441-L528 HydrophobicContact CB-CD2 4.15Å; Y445-L528 HydrophobicContact CD2-CD1 3.41Å; Y445-L528 VanDerWaalsContact CD2-CD1 3.41Å; Y445-L528 HydrophobicContact CE2-CD1 3.72Å; Y445-L528 HydrophobicContact CG-CD1 4.13Å; A452-L528 HydrophobicContact CB-CD2 4.4Å; Y453-L528 HydrophobicContact CD1-CD1 4.17Å; Y453-L528 HydrophobicContact CE1-CD1 4.01Å; V456-L528 HydrophobicContact CG2-CD2 3.35Å; V456-L528 HydrophobicContact CG2-CG 3.81Å; D524-L528 PolarHBondContact O-N 3.4Å; V525-L528 WeakPolarHBondContact O-CB 3.38Å; V525-L528 PolarHBondContact O-N 2.99Å; L528-F530 VanDerWaalsContact C-N 3.32Å; L528-F530 PolarHBondContact O-N 3Å; L528-N531 PolarHBondContact O-N 3.43Å; L528-N531 VanDerWaalsContact O-N 3.15Å
529	L	98.3	Very high	96.2	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-36.9	173.5	-69.1	172.9	0	0	0	112.1	F438 V456 L460 M475 V525 L526 R527 N531 I532 Y537	F438-L529 HydrophobicContact CD1-CD2 4.45Å; F438-L529 HydrophobicContact CE1-CD2 3.88Å; V456-L529 HydrophobicContact CG1-CD2 4.02Å; L460-L529 HydrophobicContact CD1-CD2 4.48Å; L460-L529 HydrophobicContact CD2-CD2 4.21Å; M475-L529 HydrophobicContact CE-CB 3.6Å; M475-L529 HydrophobicContact SD-CB 4.04Å; M475-L529 HydrophobicContact SD-CD1 4.35Å; V525-L529 HydrophobicContact CG1-CD1 4.24Å; V525-L529 WeakPolarHBondContact O-CG 3.49Å; V525-L529 PolarHBondContact O-N 3.05Å; L526-L529 HydrophobicContact CD1-CB 4.41Å; L526-L529 HydrophobicContact CD1-CD1 4.18Å; L526-L529 PolarHBondContact O-N 2.77Å; R527-L529 VanDerWaalsContact C-N 3.34Å; R527-L529 PolarHBondContact O-N 3.47Å; L529-N531 PolarHBondContact O-N 2.96Å; L529-I532 WeakPolarHBondContact O-CB 3.39Å; L529-I532 PolarHBondContact O-N 3.47Å; L529-I532 VanDerWaalsContact O-N 3.14Å; L529-Y537 PolarHBondContact O-OH 3.47Å
530	F	97.9	Very high	96.1	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.009	18%	0.178	C	C	.	.	H	α-helix	trans	-58.8	-33.3	173.9	-88.3	-69.9	0	0	0	112.8	M475 L478 K479 E491 L494 L526 R527 L528 I532	M475-F530 HydrophobicContact CE-CD1 4.32Å; M475-F530 HydrophobicContact CE-CG 4.29Å; L478-F530 HydrophobicContact CB-CE1 4.06Å; L478-F530 HydrophobicContact CB-CZ 3.93Å; K479-F530 WeakPolarHBondContact CE-O 3.44Å; K479-F530 HydrophobicContact CG-CD1 3.71Å; K479-F530 HydrophobicContact CG-CE1 3.93Å; K479-F530 PolarHBondContact NZ-O 3.3Å; E491-F530 HydrophobicContact CB-CB 4.45Å; E491-F530 HydrophobicContact CB-CD1 4.14Å; E491-F530 HydrophobicContact CB-CD2 3.95Å; E491-F530 HydrophobicContact CB-CE1 4.41Å; E491-F530 HydrophobicContact CB-CE2 4.21Å; E491-F530 HydrophobicContact CB-CG 3.94Å; E491-F530 HydrophobicContact CB-CZ 4.44Å; E491-F530 HydrophobicContact CG-CB 4.36Å; E491-F530 HydrophobicContact CG-CD1 3.64Å; E491-F530 HydrophobicContact CG-CD2 4.37Å; E491-F530 HydrophobicContact CG-CE1 3.96Å; E491-F530 HydrophobicContact CG-CG 3.89Å; E491-F530 HydrophobicContact CG-CZ 4.45Å; L494-F530 HydrophobicContact CB-CE2 4.06Å; L494-F530 HydrophobicContact CB-CZ 3.79Å; L494-F530 HydrophobicContact CD1-CE1 4.44Å; L494-F530 HydrophobicContact CD1-CZ 3.89Å; L526-F530 HydrophobicContact CD1-CE2 4.44Å; L526-F530 HydrophobicContact CD2-CE2 4.5Å; L526-F530 HydrophobicContact CG-CD2 4.26Å; L526-F530 HydrophobicContact CG-CE2 4.02Å; L526-F530 WeakPolarHBondContact O-CD2 3.35Å; L526-F530 PolarHBondContact O-N 2.88Å; R527-F530 WeakPolarHBondContact O-CB 3.14Å; R527-F530 PolarHBondContact O-N 3.42Å; L528-F530 VanDerWaalsContact C-N 3.32Å; L528-F530 PolarHBondContact O-N 3Å; F530-I532 VanDerWaalsContact C-N 3.29Å; F530-I532 PolarHBondContact O-N 3.06Å
531	N	95.4	Very high	95.9	Very high	64 Å²	64	28.3 Å²	28.3	34%	0.342	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-11.4	179.4	-66.4	-19.3	0	0	0	114.3	Y445 Y453 R527 L528 L529	Y445-N531 PolarHBondContact OH-ND2 3.21Å; Y453-N531 HydrophobicContact CE1-CB 3.64Å; Y453-N531 VanDerWaalsContact OH-CB 3.24Å; Y453-N531 WeakPolarHBondContact OH-CB 3.32Å; Y453-N531 PolarHBondContact OH-ND2 2.68Å; R527-N531 PolarHBondContact O-N 3.33Å; L528-N531 PolarHBondContact O-N 3.43Å; L528-N531 VanDerWaalsContact O-N 3.15Å; L529-N531 PolarHBondContact O-N 2.96Å
532	I	96.1	Very high	95.1	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.026	16%	0.16	C	C	.	.	S	Bend	trans	-69	135.2	174.7	-58.2	-62.6	0	0	0	109.9	Y453 V456 L457 L460 K479 L529 F530 V536 Y537	Y453-I532 HydrophobicContact CD1-CD1 3.88Å; Y453-I532 HydrophobicContact CE1-CD1 4.41Å; V456-I532 HydrophobicContact CB-CD1 4.34Å; V456-I532 HydrophobicContact CG1-CD1 3.67Å; V456-I532 HydrophobicContact CG1-CG1 3.9Å; L457-I532 HydrophobicContact CD2-CD1 4.24Å; L457-I532 HydrophobicContact CD2-CG2 4.27Å; L460-I532 HydrophobicContact CD1-CG2 4.42Å; K479-I532 PolarHBondContact NZ-O 3.33Å; L529-I532 WeakPolarHBondContact O-CB 3.39Å; L529-I532 PolarHBondContact O-N 3.47Å; L529-I532 VanDerWaalsContact O-N 3.14Å; F530-I532 VanDerWaalsContact C-N 3.29Å; F530-I532 PolarHBondContact O-N 3.06Å; I532-V536 HydrophobicContact CG2-CB 3.77Å; I532-V536 HydrophobicContact CG2-CG1 3.88Å; I532-V536 HydrophobicContact CG2-CG2 4.16Å; I532-Y537 HydrophobicContact CB-CE2 3.79Å; I532-Y537 HydrophobicContact CG2-CD2 4.41Å; I532-Y537 HydrophobicContact CG2-CE1 4.39Å; I532-Y537 HydrophobicContact CG2-CE2 3.86Å
533	S	95	Very high	93.3	Very high	62 Å²	62	32.6 Å²	32.6	43%	0.434	18%	0.182	S	C	.	.			trans	-59.8	143.3	-179	180	0	0	0	0	112.3	D535 V536	S533-D535 PolarHBondContact O-N 3.44Å; S533-D535 PolarHBondContact OG-N 3.15Å; S533-V536 WeakPolarHBondContact O-CB 3.39Å; S533-V536 PolarHBondContact O-N 2.97Å
534	D	93.8	Very high	91.1	Very high	50 Å²	50	41.4 Å²	41.4	27%	0.267	21%	0.214	S	C	.	.	H	α-helix	trans	-59.3	-29.4	177	-62.2	2.2	0	0	0	110.9	L476 K479 K483 V536 Y537 S538	L476-D534 HydrophobicContact CD2-CB 4Å; K479-D534 WeakPolarHBondContact CD-OD1 3.48Å; K479-D534 WeakPolarHBondContact CE-OD1 3.41Å; K479-D534 IonicContact NZ-OD1 3.59Å; K479-D534 PolarHBondContact NZ-OD1 3.26Å; K483-D534 IonicContact NZ-OD1 3.41Å; K483-D534 IonicContact NZ-OD2 2.82Å; K483-D534 PolarHBondContact NZ-OD2 3.34Å; D534-V536 VanDerWaalsContact C-N 3.34Å; D534-V536 PolarHBondContact O-N 2.92Å; D534-Y537 PolarHBondContact O-N 3.23Å; D534-S538 VanDerWaalsContact O-CB 3.28Å; D534-S538 WeakPolarHBondContact O-CB 3.39Å; D534-S538 PolarHBondContact O-N 2.92Å; D534-S538 PolarHBondContact O-OG 3.4Å
535	D	93.3	Very high	88.3	Confident	64 Å²	64	45.2 Å²	45.2	34%	0.342	23%	0.234	S	C	.	.	H	α-helix	trans	-65	-35.5	177.6	-68.9	-25	0	0	0	112	S533 S538 S539 R555	S533-D535 PolarHBondContact O-N 3.44Å; S533-D535 PolarHBondContact OG-N 3.15Å; D535-S538 PolarHBondContact O-N 2.91Å; D535-S539 WeakPolarHBondContact O-CB 3.49Å; D535-S539 PolarHBondContact O-N 3.37Å; D535-R555 IonicContact OD1-CZ 2.8Å; D535-R555 IonicContact OD1-NE 3.33Å; D535-R555 IonicContact OD1-NH1 2.67Å; D535-R555 PolarHBondContact OD1-NH1 3.18Å; D535-R555 VanDerWaalsContact OD1-NH1 3.15Å; D535-R555 IonicContact OD1-NH2 2.74Å; D535-R555 PolarHBondContact OD1-NH2 3.37Å; D535-R555 IonicContact OD2-CZ 3.05Å; D535-R555 IonicContact OD2-NH1 3.65Å; D535-R555 PolarHBondContact OD2-NH1 3.4Å; D535-R555 IonicContact OD2-NH2 2.71Å; D535-R555 PolarHBondContact OD2-NH2 3.32Å
536	V	94.5	Very high	85.3	Confident	35 Å²	35	50.8 Å²	50.8	21%	0.212	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-49.8	177.5	174.3	0	0	0	0	110	L457 I532 S533 D534 S538 S539 F540	L457-V536 HydrophobicContact CD2-CB 4.4Å; L457-V536 HydrophobicContact CD2-CG1 3.65Å; L457-V536 HydrophobicContact CD2-CG2 3.97Å; I532-V536 HydrophobicContact CG2-CB 3.77Å; I532-V536 HydrophobicContact CG2-CG1 3.88Å; I532-V536 HydrophobicContact CG2-CG2 4.16Å; S533-V536 WeakPolarHBondContact O-CB 3.39Å; S533-V536 PolarHBondContact O-N 2.97Å; D534-V536 VanDerWaalsContact C-N 3.34Å; D534-V536 PolarHBondContact O-N 2.92Å; V536-S538 VanDerWaalsContact C-N 3.28Å; V536-S538 PolarHBondContact O-N 3.06Å; V536-S539 PolarHBondContact O-N 3.3Å; V536-S539 PolarHBondContact O-OG 3.47Å; V536-F540 HydrophobicContact CG1-CD2 4.39Å; V536-F540 HydrophobicContact CG1-CE2 3.74Å; V536-F540 HydrophobicContact CG1-CZ 4.34Å; V536-F540 WeakPolarHBondContact O-CD2 3.49Å; V536-F540 PolarHBondContact O-N 3.46Å
537	Y	96.1	Very high	82	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-38.3	177	-65.2	-55.4	0	0	0	112.1	L460 M475 K479 L529 I532 D534 S539 F540 L541	L460-Y537 HydrophobicContact CD1-CE1 4.14Å; L460-Y537 HydrophobicContact CD2-CE1 4.47Å; M475-Y537 HydrophobicContact CB-CD1 4.21Å; M475-Y537 HydrophobicContact CB-CD2 4.09Å; M475-Y537 HydrophobicContact CB-CE1 3.9Å; M475-Y537 HydrophobicContact CB-CE2 3.76Å; M475-Y537 HydrophobicContact CB-CG 4.29Å; M475-Y537 HydrophobicContact CG-CE1 3.95Å; M475-Y537 HydrophobicContact CG-CE2 4.34Å; K479-Y537 HydrophobicContact CD-CE2 4.48Å; L529-Y537 PolarHBondContact O-OH 3.47Å; I532-Y537 HydrophobicContact CB-CE2 3.79Å; I532-Y537 HydrophobicContact CG2-CD2 4.41Å; I532-Y537 HydrophobicContact CG2-CE1 4.39Å; I532-Y537 HydrophobicContact CG2-CE2 3.86Å; D534-Y537 PolarHBondContact O-N 3.23Å; Y537-S539 VanDerWaalsContact C-N 3.34Å; Y537-F540 PolarHBondContact O-N 3.28Å; Y537-L541 WeakPolarHBondContact O-CG 3.18Å; Y537-L541 PolarHBondContact O-N 3.06Å
538	S	92.9	Very high	78.9	Confident	21 Å²	21	57.9 Å²	57.9	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-65.5	-36.7	176.7	-60.1	0	0	0	0	112	D534 D535 V536 F540 L541 S542 Y558	D534-S538 VanDerWaalsContact O-CB 3.28Å; D534-S538 WeakPolarHBondContact O-CB 3.39Å; D534-S538 PolarHBondContact O-N 2.92Å; D534-S538 PolarHBondContact O-OG 3.4Å; D535-S538 PolarHBondContact O-N 2.91Å; V536-S538 VanDerWaalsContact C-N 3.28Å; V536-S538 PolarHBondContact O-N 3.06Å; S538-F540 VanDerWaalsContact C-N 3.27Å; S538-F540 PolarHBondContact O-N 3.02Å; S538-L541 CarbonylContact O-C 3.38Å; S538-L541 WeakPolarHBondContact O-CA 3.45Å; S538-L541 PolarHBondContact O-N 3.23Å; S538-S542 VanDerWaalsContact O-CB 3.31Å; S538-S542 WeakPolarHBondContact O-CB 3.44Å; S538-S542 PolarHBondContact O-N 3.4Å; S538-S542 PolarHBondContact O-OG 2.96Å; S538-Y558 WeakPolarHBondContact CA-OH 3.15Å; S538-Y558 PolarHBondContact O-OH 3.09Å
539	S	93.2	Very high	75.7	Confident	73 Å²	73	66.4 Å²	66.4	51%	0.51	36%	0.361	S	S	.	.	H	α-helix	trans	-63.8	-30.6	175.2	77.6	0	0	0	0	112.8	D535 V536 Y537 L541	D535-S539 WeakPolarHBondContact O-CB 3.49Å; D535-S539 PolarHBondContact O-N 3.37Å; V536-S539 PolarHBondContact O-N 3.3Å; V536-S539 PolarHBondContact O-OG 3.47Å; Y537-S539 VanDerWaalsContact C-N 3.34Å; S539-L541 PolarHBondContact O-N 2.99Å
540	F	93.3	Very high	72.6	Confident	28 Å²	28	75 Å²	75	12%	0.123	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-10.3	172.6	-63.3	-47.2	0	0	0	113.5	L460 K461 R468 H469 S472 V536 Y537 S538	L460-F540 HydrophobicContact CB-CE2 3.97Å; L460-F540 HydrophobicContact CB-CZ 4.2Å; L460-F540 HydrophobicContact CD1-CE2 4.49Å; K461-F540 HydrophobicContact CG-CE1 4.16Å; K461-F540 HydrophobicContact CG-CZ 3.99Å; R468-F540 HydrophobicContact CG-CB 4.42Å; R468-F540 HydrophobicContact CG-CD1 4.25Å; R468-F540 HydrophobicContact CG-CD2 4.18Å; R468-F540 HydrophobicContact CG-CG 4.05Å; H469-F540 PolarHBondContact CD2-O 3.48Å; H469-F540 PolarHBondContact NE2-O 3.19Å; S472-F540 WeakPolarHBondContact OG-CD2 3.45Å; V536-F540 HydrophobicContact CG1-CD2 4.39Å; V536-F540 HydrophobicContact CG1-CE2 3.74Å; V536-F540 HydrophobicContact CG1-CZ 4.34Å; V536-F540 WeakPolarHBondContact O-CD2 3.49Å; V536-F540 PolarHBondContact O-N 3.46Å; Y537-F540 PolarHBondContact O-N 3.28Å; S538-F540 VanDerWaalsContact C-N 3.27Å; S538-F540 PolarHBondContact O-N 3.02Å
541	L	91.4	Very high	69.4	Low	0 Å²	0	82.6 Å²	82.6	0%	0	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-1.5	-177.3	-62.6	177	0	0	0	113.3	N230 L232 F355 P356 H469 F473 L476 Y537 S538 S539 Y558	N230-L541 PolarHBondContact ND2-O 2.93Å; L232-L541 HydrophobicContact CD1-CB 4.48Å; L232-L541 HydrophobicContact CD1-CD1 4.21Å; L232-L541 HydrophobicContact CD1-CD2 4.35Å; F355-L541 VanDerWaalsContact CE1-O 3.24Å; F355-L541 WeakPolarHBondContact CE1-O 3.48Å; P356-L541 HydrophobicContact CB-CD2 3.95Å; P356-L541 HydrophobicContact CG-CD2 4.19Å; H469-L541 HydrophobicContact CB-CD2 4.17Å; F473-L541 HydrophobicContact CB-CD1 4.03Å; F473-L541 HydrophobicContact CB-CD2 4.39Å; F473-L541 HydrophobicContact CD2-CD1 4.39Å; L476-L541 HydrophobicContact CD1-CD1 3.62Å; Y537-L541 WeakPolarHBondContact O-CG 3.18Å; Y537-L541 PolarHBondContact O-N 3.06Å; S538-L541 CarbonylContact O-C 3.38Å; S538-L541 WeakPolarHBondContact O-CA 3.45Å; S538-L541 PolarHBondContact O-N 3.23Å; S539-L541 PolarHBondContact O-N 2.99Å; L541-Y558 HydrophobicContact CB-CE1 3.95Å; L541-Y558 HydrophobicContact CD1-CE1 4.46Å
542	S	80.6	Confident	66.3	Low	36 Å²	36	88.2 Å²	88.2	25%	0.252	47%	0.472	S	S	.	.	S	Bend	trans	-120.9	123.1	176.3	-55.2	0	0	0	0	107.1	S538 Y558	S538-S542 VanDerWaalsContact O-CB 3.31Å; S538-S542 WeakPolarHBondContact O-CB 3.44Å; S538-S542 PolarHBondContact O-N 3.4Å; S538-S542 PolarHBondContact O-OG 2.96Å; S542-Y558 PolarHBondContact OG-OH 3.15Å
543	D	60.3	Low	63.1	Low	86 Å²	86	95.6 Å²	95.6	46%	0.46	51%	0.506	S	S	.	.			trans	78.8	125.5	171.7	-87.7	-45	0	0	0	122.2	N546	D543-N546 VanDerWaalsContact OD1-CB 3.26Å; D543-N546 WeakPolarHBondContact OD1-CB 3.26Å; D543-N546 VanDerWaalsContact OD1-CG 3.29Å; D543-N546 PolarHBondContact OD1-N 3.03Å; D543-N546 PolarHBondContact OD1-ND2 3.45Å; D543-N546 PolarHBondContact OD2-ND2 3.43Å
544	W	50.6	Low	60.2	Low	213 Å²	213	98.1 Å²	98.1	81%	0.807	52%	0.521	S	S	*	.	S	Bend	trans	-123.3	-14.7	142.6	159.4	-89.7	0	0	0	111.7
545	D	39.2	Very low	57.8	Low	116 Å²	116	104.5 Å²	104.5	62%	0.62	54%	0.542	S	S	*	.	S	Bend	trans	-139.1	6.2	-166.6	-92.6	-25	0	0	0	118	T547	D545-T547 VanDerWaalsContact C-N 3.27Å; D545-T547 PolarHBondContact O-N 3.25Å
546	N	35.2	Very low	55.3	Low	119 Å²	119	104.6 Å²	104.6	64%	0.636	55%	0.545	S	S	*	.			trans	-84.2	71.6	168.2	-60.3	-43.5	0	0	0	111.2	D543 S548	D543-N546 VanDerWaalsContact OD1-CB 3.26Å; D543-N546 WeakPolarHBondContact OD1-CB 3.26Å; D543-N546 VanDerWaalsContact OD1-CG 3.29Å; D543-N546 PolarHBondContact OD1-N 3.03Å; D543-N546 PolarHBondContact OD1-ND2 3.45Å; D543-N546 PolarHBondContact OD2-ND2 3.43Å; N546-S548 PolarHBondContact O-N 3.19Å
547	T	29.2	Very low	53.2	Low	139 Å²	139	107.1 Å²	107.1	85%	0.853	56%	0.56	S	S	*	*			trans	-76	74.3	149.3	42	0	0	0	0	107.5	D545	D545-T547 VanDerWaalsContact C-N 3.27Å; D545-T547 PolarHBondContact O-N 3.25Å
548	S	32.5	Very low	51.5	Low	97 Å²	97	107.7 Å²	107.7	68%	0.678	56%	0.563	S	S	*	*			trans	-149.5	111.4	167.1	-45.7	0	0	0	0	106.9	N546	N546-S548 PolarHBondContact O-N 3.19Å
549	E	31.6	Very low	50.1	Low	183 Å²	183	109.3 Å²	109.3	86%	0.855	57%	0.567	S	S	*	*			trans	-55	151.8	178.9	-63.6	171.8	152.3	0	0	111.7
550	E	32.8	Very low	47.8	Very low	182 Å²	182	109.9 Å²	109.9	85%	0.85	57%	0.568	S	S	*	*			trans	62.8	87.9	162.8	-61.9	-176.7	168.6	0	0	117.9
551	N	31.4	Very low	45.1	Very low	161 Å²	161	111.6 Å²	111.6	86%	0.861	58%	0.583	S	S	*	*			trans	-149.2	98.5	147.2	-85.8	-50.4	0	0	0	110.3	E553	N551-E553 PolarHBondContact O-N 2.91Å; N551-E553 VanDerWaalsContact O-N 3.09Å
552	N	28.7	Very low	42.6	Very low	183 Å²	183	115.7 Å²	115.7	98%	0.979	60%	0.604	S	S	*	*			trans	-80.5	61.6	172.3	-87.8	-29.8	0	0	0	111.3
553	E	29.8	Very low	40.4	Very low	159 Å²	159	118.2 Å²	118.2	74%	0.743	62%	0.619	S	S	*	*			trans	-94.6	145.2	164.6	-113.8	-161.2	148.4	0	0	110.5	N551 R555	N551-E553 PolarHBondContact O-N 2.91Å; N551-E553 VanDerWaalsContact O-N 3.09Å; E553-R555 PolarHBondContact O-N 3.24Å
554	P	34.4	Very low	38.9	Very low	116 Å²	116	119.8 Å²	119.8	75%	0.753	63%	0.632	S	S	*	*			trans	-70.3	113	-164	26.4	-30.4	0	0	0	112
555	R	43.5	Very low	38	Very low	183 Å²	183	117.1 Å²	117.1	69%	0.691	63%	0.633	S	S	*	*			trans	24.2	103.8	151.9	-70	177.2	175.2	-161.5	-13.8	115.2	D535 E553 T557	D535-R555 IonicContact OD1-CZ 2.8Å; D535-R555 IonicContact OD1-NE 3.33Å; D535-R555 IonicContact OD1-NH1 2.67Å; D535-R555 PolarHBondContact OD1-NH1 3.18Å; D535-R555 VanDerWaalsContact OD1-NH1 3.15Å; D535-R555 IonicContact OD1-NH2 2.74Å; D535-R555 PolarHBondContact OD1-NH2 3.37Å; D535-R555 IonicContact OD2-CZ 3.05Å; D535-R555 IonicContact OD2-NH1 3.65Å; D535-R555 PolarHBondContact OD2-NH1 3.4Å; D535-R555 IonicContact OD2-NH2 2.71Å; D535-R555 PolarHBondContact OD2-NH2 3.32Å; E553-R555 PolarHBondContact O-N 3.24Å; R555-T557 PolarHBondContact O-N 3.34Å; R555-T557 VanDerWaalsContact O-N 3.09Å
556	T	39.9	Very low	37.4	Very low	66 Å²	66	119.1 Å²	119.1	41%	0.405	64%	0.64	S	S	.	*			trans	-26.4	104.2	176.4	55.9	0	0	0	0	114.6	Y558	T556-Y558 WeakPolarHBondContact O-CD2 3.43Å; T556-Y558 PolarHBondContact O-N 3Å; T556-Y558 VanDerWaalsContact O-N 3.13Å; T556-Y558 VanDerWaalsContact OG1-CE2 3.26Å; T556-Y558 WeakPolarHBondContact OG1-CE2 3.44Å; T556-Y558 PolarHBondContact OG1-OH 3.29Å
557	T	51	Low	37.1	Very low	89 Å²	89	121.2 Å²	121.2	55%	0.546	65%	0.652	S	S	.	*			trans	-80	94.4	168.5	60.8	0	0	0	0	109.5	R555 F559 T560	R555-T557 PolarHBondContact O-N 3.34Å; R555-T557 VanDerWaalsContact O-N 3.09Å; T557-F559 PolarHBondContact O-N 3.05Å; T557-F559 VanDerWaalsContact O-N 3.14Å; T557-T560 WeakPolarHBondContact CB-OG1 3.33Å; T557-T560 WeakPolarHBondContact OG1-CB 3.37Å; T557-T560 PolarHBondContact OG1-OG1 2.89Å
558	Y	60.7	Low	37	Very low	12 Å²	12	119.4 Å²	119.4	5%	0.047	65%	0.645	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.4	-15.9	-179.2	-59.6	-79.8	0	0	0	114.6	L232 L476 S538 L541 S542 T556	L232-Y558 HydrophobicContact CB-CD1 4.22Å; L232-Y558 HydrophobicContact CD1-CD1 3.64Å; L232-Y558 HydrophobicContact CD1-CE1 3.95Å; L476-Y558 HydrophobicContact CD1-CD2 3.93Å; L476-Y558 HydrophobicContact CD1-CE2 3.76Å; S538-Y558 WeakPolarHBondContact CA-OH 3.15Å; S538-Y558 PolarHBondContact O-OH 3.09Å; L541-Y558 HydrophobicContact CB-CE1 3.95Å; L541-Y558 HydrophobicContact CD1-CE1 4.46Å; S542-Y558 PolarHBondContact OG-OH 3.15Å; T556-Y558 WeakPolarHBondContact O-CD2 3.43Å; T556-Y558 PolarHBondContact O-N 3Å; T556-Y558 VanDerWaalsContact O-N 3.13Å; T556-Y558 VanDerWaalsContact OG1-CE2 3.26Å; T556-Y558 WeakPolarHBondContact OG1-CE2 3.44Å; T556-Y558 PolarHBondContact OG1-OH 3.29Å
559	F	63.4	Low	36.6	Very low	55 Å²	55	120.2 Å²	120.2	24%	0.241	65%	0.651	C	S	.	*	T	Hydrogen-bonded Turn	trans	-119.6	3.8	-168.6	-50.5	-62.2	0	0	0	114.1	V366 M370 F473 L476 H477 T557	V366-F559 HydrophobicContact CG1-CD1 4.31Å; V366-F559 HydrophobicContact CG1-CE1 3.65Å; M370-F559 HydrophobicContact CB-CB 4.35Å; M370-F559 HydrophobicContact CB-CD1 4.43Å; M370-F559 HydrophobicContact CE-CB 3.66Å; M370-F559 HydrophobicContact CE-CD1 4.34Å; M370-F559 HydrophobicContact CE-CD2 3.79Å; M370-F559 HydrophobicContact CE-CG 3.68Å; M370-F559 HydrophobicContact CG-CB 4.26Å; M370-F559 HydrophobicContact CG-CD1 3.73Å; M370-F559 HydrophobicContact CG-CE1 4.24Å; M370-F559 HydrophobicContact CG-CG 4.02Å; M370-F559 HydrophobicContact SD-CG 4.49Å; F473-F559 HydrophobicContact CD2-CE1 4.47Å; F473-F559 AromaticContact CE2-CE1 3.66Å; F473-F559 HydrophobicContact CE2-CE1 3.66Å; F473-F559 HydrophobicContact CE2-CZ 4.21Å; F473-F559 HydrophobicContact CZ-CE1 4.07Å; L476-F559 HydrophobicContact CB-CE2 4.22Å; L476-F559 HydrophobicContact CB-CZ 4.16Å; H477-F559 HydrophobicContact CB-CE1 4.41Å; H477-F559 HydrophobicContact CB-CZ 4.06Å; T557-F559 PolarHBondContact O-N 3.05Å; T557-F559 VanDerWaalsContact O-N 3.14Å
560	T	44.8	Very low	36.3	Very low	85 Å²	85	120.9 Å²	120.9	52%	0.521	65%	0.654	S	S	.	*	S	Bend	trans	-84.6	149.1	178.4	-38.7	0	0	0	0	110.8	T557 L562	T557-T560 WeakPolarHBondContact CB-OG1 3.33Å; T557-T560 WeakPolarHBondContact OG1-CB 3.37Å; T557-T560 PolarHBondContact OG1-OG1 2.89Å; T560-L562 PolarHBondContact O-N 3.46Å
561	S	36.8	Very low	36	Very low	64 Å²	64	120 Å²	120	45%	0.448	65%	0.654	S	S	.	*			trans	-62.6	122.4	176	-73.3	0	0	0	0	110.6	T563	S561-T563 PolarHBondContact O-N 3.37Å
562	L	37.3	Very low	35.6	Very low	85 Å²	85	118.4 Å²	118.4	45%	0.445	65%	0.65	S	S	.	*			trans	-75.7	50.7	-178.7	-61.3	163.8	0	0	0	112.9	N233 T560	N233-L562 HydrophobicContact CB-CD1 4.46Å; N233-L562 HydrophobicContact CB-CD2 3.88Å; N233-L562 WeakPolarHBondContact O-CD1 3.14Å; T560-L562 PolarHBondContact O-N 3.46Å
563	T	36.1	Very low	35.6	Very low	90 Å²	90	115.7 Å²	115.7	55%	0.552	64%	0.642	S	S	*	*			trans	-91.6	102.9	164.7	52.5	0	0	0	0	107.2	S561 D565	S561-T563 PolarHBondContact O-N 3.37Å; T563-D565 PolarHBondContact O-N 3.3Å
564	T	28.8	Very low	35.4	Very low	119 Å²	119	115.8 Å²	115.8	73%	0.73	65%	0.648	S	S	*	*			trans	-58.6	101.4	171.2	29.5	0	0	0	0	109.8	M566	T564-M566 HydrophobicContact CG2-CE 4.14Å
565	D	30.7	Very low	34.8	Very low	156 Å²	156	115 Å²	115	83%	0.834	65%	0.646	S	S	*	*			trans	-84.6	100.3	155.9	-76.2	-28	0	0	0	106.6	T563 N567	T563-D565 PolarHBondContact O-N 3.3Å; D565-N567 PolarHBondContact O-N 3.37Å
566	M	27.4	Very low	34	Very low	158 Å²	158	117.4 Å²	117.4	78%	0.778	66%	0.656	S	S	*	*			trans	-81.5	101.1	172.1	-76.5	-78.3	162.8	0	0	107.6	T564	T564-M566 HydrophobicContact CG2-CE 4.14Å
567	N	29.2	Very low	33.3	Very low	163 Å²	163	120.4 Å²	120.4	87%	0.872	67%	0.67	S	S	*	*			trans	-168.4	100	159.8	-98.3	-7.7	0	0	0	110.9	D565	D565-N567 PolarHBondContact O-N 3.37Å
568	S	25.5	Very low	32.1	Very low	102 Å²	102	123.9 Å²	123.9	71%	0.713	69%	0.685	S	S	*	*			trans	-159.7	74.4	159.8	37.9	0	0	0	0	109.1
569	S	25.9	Very low	30.5	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	72%	0.715	S	S	*	*			trans	-153.6	106.5	157.6	-39.1	0	0	0	0	108.1	L571	S569-L571 PolarHBondContact O-N 3.42Å
570	E	24.1	Very low	28.8	Very low	197 Å²	197	134.6 Å²	134.6	92%	0.921	75%	0.746	S	S	*	*			trans	-56.9	114.2	175.2	-70.7	168.1	137.4	0	0	110.1
571	L	26.2	Very low	27.9	Very low	163 Å²	163	137.6 Å²	137.6	85%	0.853	76%	0.758	S	S	*	*			trans	-112.8	113.6	161.3	-74.9	170.7	0	0	0	107.6	S569	S569-L571 PolarHBondContact O-N 3.42Å
572	T	24	Very low	27.5	Very low	127 Å²	127	141.7 Å²	141.7	78%	0.779	78%	0.776	S	S	*	*			trans	-54.6	128.6	-177.5	41.8	0	0	0	0	111.2	N574	T572-N574 PolarHBondContact O-N 2.91Å
573	P	28.7	Very low	27	Very low	126 Å²	126	142.6 Å²	142.6	82%	0.818	79%	0.789	S	S	*	*			trans	-79.9	110.5	-174.4	28.5	-29.5	0	0	0	110.3	S575	P573-S575 PolarHBondContact O-N 3.42Å
574	N	25.5	Very low	26.6	Very low	161 Å²	161	146.1 Å²	146.1	86%	0.861	80%	0.804	S	S	*	*			trans	-59.2	120.4	167.1	-96.6	-23.6	0	0	0	110.1	T572 Y576	T572-N574 PolarHBondContact O-N 2.91Å; N574-Y576 PolarHBondContact O-N 2.96Å
575	S	22.5	Very low	26.5	Very low	101 Å²	101	151.5 Å²	151.5	71%	0.706	81%	0.811	S	S	*	*			trans	-31.2	115.3	163.2	179.2	0	0	0	0	112.6	P573	P573-S575 PolarHBondContact O-N 3.42Å
576	Y	26.6	Very low	26.1	Very low	232 Å²	232	151.9 Å²	151.9	91%	0.91	81%	0.812	S	S	*	*			trans	-144.8	105.2	143.4	-102	-78.6	0	0	0	109.4	N574 N578	N574-Y576 PolarHBondContact O-N 2.96Å; Y576-N578 PolarHBondContact O-N 2.59Å
577	N	23.8	Very low	26.1	Very low	130 Å²	130	149.5 Å²	149.5	70%	0.695	81%	0.81	S	S	*	*			trans	-33.3	124.4	159.4	-106.9	-25.4	0	0	0	112.3
578	N	27	Very low	25.8	Very low	162 Å²	162	149.7 Å²	149.7	87%	0.866	81%	0.811	S	S	*	*			trans	-153.1	104	132.9	-119.4	-20.7	0	0	0	110.6	Y576 N580	Y576-N578 PolarHBondContact O-N 2.59Å; N578-N580 PolarHBondContact O-N 2.83Å
579	N	25.5	Very low	26	Very low	126 Å²	126	152.2 Å²	152.2	67%	0.674	82%	0.815	S	S	*	*			trans	-52.1	122.5	164.7	-76.3	-33.2	0	0	0	109.7
580	N	29	Very low	26	Very low	165 Å²	165	150.2 Å²	150.2	88%	0.882	81%	0.812	S	S	*	*			trans	-148.3	99.4	145.6	-105	-25	0	0	0	109.4	N578 N582	N578-N580 PolarHBondContact O-N 2.83Å; N580-N582 PolarHBondContact O-N 3.24Å
581	N	26	Very low	26	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	81%	0.81	S	S	*	*			trans	-53.5	121.2	165.3	-73.5	-32	0	0	0	109.5
582	N	28.3	Very low	26	Very low	151 Å²	151	142.8 Å²	142.8	81%	0.807	81%	0.809	S	S	*	*			trans	-149.7	91.2	145.9	-112.4	-17.5	0	0	0	109.3	N580 N584	N580-N582 PolarHBondContact O-N 3.24Å; N582-N584 PolarHBondContact O-N 2.95Å
583	S	25.5	Very low	26.2	Very low	104 Å²	104	143 Å²	143	73%	0.727	81%	0.81	S	S	*	*			trans	-51.6	117.6	160	47.3	0	0	0	0	110.4
584	N	28.6	Very low	26	Very low	163 Å²	163	148.9 Å²	148.9	87%	0.872	82%	0.816	S	S	*	*			trans	-139	111.4	152.8	-92.6	-32.2	0	0	0	109	N582	N582-N584 PolarHBondContact O-N 2.95Å
585	R	25.7	Very low	26.2	Very low	233 Å²	233	150.8 Å²	150.8	88%	0.879	82%	0.817	S	S	*	*			trans	-71.3	152.9	179.2	-69	174.9	168.3	169.6	-4.3	111.1
586	L	23.6	Very low	26.4	Very low	164 Å²	164	149.6 Å²	149.6	86%	0.859	82%	0.821	S	S	*	*			trans	58.1	120.4	143.7	-109.4	72.8	0	0	0	119.2
587	C	26.3	Very low	26.3	Very low	108 Å²	108	148.5 Å²	148.5	73%	0.73	82%	0.821	S	S	*	*				-170.2	114.9	104.8	50.8	0	0	0	0	111.1
588	D	22.8	Very low	26.4	Very low	166 Å²	166	150 Å²	150	89%	0.888	83%	0.829	S	S	*	*			trans	-57.6	128.7	156.8	-86.7	-46	0	0	0	109.8
589	I	30.1	Very low	26.4	Very low	156 Å²	156	147.3 Å²	147.3	80%	0.8	82%	0.82	S	S	*	*			trans	-132.9	111	161.1	-62	-178.7	0	0	0	107.8
590	G	26.3	Very low	26.5	Very low	72 Å²	72	149.1 Å²	149.1	74%	0.742	83%	0.829	S	S	*	*			trans	-62.6	162.8	-174.8	0	0	0	0	0	115.8
591	G	23	Very low	26.4	Very low	85 Å²	85	148.9 Å²	148.9	88%	0.876	83%	0.827	S	S	*	*			trans	-65.8	146.8	-177.9	0	0	0	0	0	114.7
592	S	27	Very low	26.3	Very low	118 Å²	118	150.1 Å²	150.1	83%	0.825	83%	0.833	S	S	*	*			trans	-114.3	108.8	166.7	-161.4	0	0	0	0	108.7
593	T	28.7	Very low	26.1	Very low	132 Å²	132	148.6 Å²	148.6	81%	0.81	83%	0.834	S	S	*	*			trans	-60.4	123	171.8	32.9	0	0	0	0	110.9	K595	T593-K595 PolarHBondContact O-N 3.31Å
594	R	24.6	Very low	26.5	Very low	250 Å²	250	148.6 Å²	148.6	94%	0.943	83%	0.834	S	S	*	*			trans	-81.7	109.3	173.2	-79.9	-176.2	176.5	-166.9	-1.5	109.9
595	K	28.4	Very low	26.5	Very low	200 Å²	200	151.1 Å²	151.1	87%	0.87	84%	0.838	S	S	*	*			trans	-64.7	136.1	169.7	-73.2	-178.6	175.9	179.4	0	110.9	T593	T593-K595 PolarHBondContact O-N 3.31Å
596	G	27	Very low	26.9	Very low	77 Å²	77	151.6 Å²	151.6	79%	0.794	84%	0.839	S	S	*	*			trans	-68.2	139.4	-177.9	0	0	0	0	0	113.6
597	F	25.9	Very low	27.3	Very low	209 Å²	209	150.7 Å²	150.7	92%	0.917	84%	0.836	S	S	*	*			trans	-94.6	105.5	168.2	-111.4	-102.5	0	0	0	107.7
598	L	24.3	Very low	27.5	Very low	162 Å²	162	154.4 Å²	154.4	85%	0.848	84%	0.844	S	S	*	*			trans	-100.1	118	164.1	-82.8	167.5	0	0	0	108
599	P	27.7	Very low	28.1	Very low	105 Å²	105	152.3 Å²	152.3	68%	0.682	84%	0.843	S	S	*	*			trans	-85.5	110.1	172.5	30.2	-26.9	0	0	0	110.3	L601	P599-L601 PolarHBondContact O-N 3.47Å
600	N	28.4	Very low	28.9	Very low	163 Å²	163	153.9 Å²	153.9	87%	0.872	87%	0.868	S	S	*	*			trans	-69.1	108.8	166	-80.4	-21.4	0	0	0	109.5
601	L	26	Very low	29	Very low	160 Å²	160	158 Å²	158	84%	0.838	87%	0.874	S	S	*	*			trans	-114.7	70.6	172	-89	167.3	0	0	0	109.4	P599	P599-L601 PolarHBondContact O-N 3.47Å
602	L	23.9	Very low	29.3	Very low	175 Å²	175	161.8 Å²	161.8	92%	0.916	87%	0.874	S	S	*	*			trans	-153.1	77.1	166.1	-75.7	-178.6	0	0	0	109.6
603	S	25.3	Very low	29.5	Very low	119 Å²	119	164.3 Å²	164.3	83%	0.832	88%	0.877	S	S	*	*			trans	-162.8	98.7	163.6	59.8	0	0	0	0	109.9
604	S	32.2	Very low	29.5	Very low	104 Å²	104	166.2 Å²	166.2	73%	0.727	88%	0.881	S	S	*	*			trans	176.5	70.5	146.3	-172.1	0	0	0	0	109.7
605	F	29.6	Very low	29.8	Very low	215 Å²	215	160.9 Å²	160.9	94%	0.943	88%	0.877	S	S	*	*			trans	-134.5	87.4	156.4	-92.4	-75.5	0	0	0	106.1
606	R	34.8	Very low	29.9	Very low	243 Å²	243	158.3 Å²	158.3	92%	0.917	88%	0.877	S	S	*	*			trans	-170.5	75.8	162.8	-111.2	177	-176.4	-161.1	0.1	107.7
607	D	31.2	Very low	30.1	Very low	146 Å²	146	164.1 Å²	164.1	78%	0.781	88%	0.883	S	S	*	*			trans	-107.1	145.8	159.9	-80.9	-39.7	0	0	0	108
608	M	30	Very low	30.5	Very low	185 Å²	185	160.7 Å²	160.7	91%	0.911	88%	0.881	S	S	*	*			trans	83.5	84.8	163.4	-64.5	155.4	64.5	0	0	118
609	S	36.2	Very low	31	Very low	123 Å²	123	160.6 Å²	160.6	86%	0.86	88%	0.883	S	S	*	*			trans	-155.3	82.5	135.9	64.4	0	0	0	0	109.4
610	S	46.5	Very low	31.3	Very low	189 Å²	189	165.6 Å²	165.6	100%	1.322	90%	0.902	S	S	*	*			trans	-95.2	0	140	61.2	0	0	0	0	106.4

Retrieved 610 of 610 residues in 544.7 ms (Link to these results)

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