A0A6D2XIP1_PANTR Loading...

NOL4L isoform 3

AlphaFold DB , UniProt , Accession A0A6D2XIP1, Species PANTR (Pan troglodytes, Chimpanzee), Gene NOL4L, Length 680 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	46	Very low	33.6	Very low	236 Å²	236	156.5 Å²	156.5	100%	1.163	87%	0.866	S	S	*	*				0	91.1	0	-70.8	-60.7	-166.9	0	0	110.5
2	P	34.1	Very low	33.5	Very low	131 Å²	131	164.1 Å²	164.1	85%	0.851	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-86.3	162.3	164.8	-3.2	24	0	0	0	111.4
3	K	28.6	Very low	33.4	Very low	199 Å²	199	166.2 Å²	166.2	87%	0.865	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-93.3	158.5	-178.4	-72.3	174.1	179.2	175.9	0	111.5
4	P	36.6	Very low	33.7	Very low	128 Å²	128	170.3 Å²	170.3	83%	0.831	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-71.8	145.9	-174.1	29	-36.2	0	0	0	113.5
5	T	33.2	Very low	34.2	Very low	142 Å²	142	171.4 Å²	171.4	87%	0.871	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-76.5	146.5	175	-47.8	0	0	0	0	111.4
6	L	33.2	Very low	35.2	Very low	167 Å²	167	173.9 Å²	173.9	87%	0.874	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-61.6	138.5	-176.1	-70.8	163.2	0	0	0	113.6	L8	L6-L8 PolarHBondContact O-N 3.27Å
7	L	33.9	Very low	36.4	Very low	176 Å²	176	166.8 Å²	166.8	92%	0.921	84%	0.838	S	S	*	*			trans	-74.5	103.9	166.6	-70.6	172.5	0	0	0	110	R9	L7-R9 PolarHBondContact O-N 2.88Å
8	L	33.3	Very low	37.8	Very low	173 Å²	173	160.3 Å²	160.3	91%	0.906	81%	0.81	S	S	*	*			trans	-80.6	107.5	168.8	-155.4	74.3	0	0	0	109.5	L6 G10	L6-L8 PolarHBondContact O-N 3.27Å; L8-G10 VanDerWaalsContact C-N 3.31Å; L8-G10 PolarHBondContact O-N 3.32Å
9	R	34.6	Very low	38.9	Very low	239 Å²	239	152 Å²	152	90%	0.902	77%	0.768	S	S	*	*			trans	-73.2	79.4	-176.8	-172.9	-177.8	-175.5	-120.7	7.4	111	L7 G11	L7-R9 PolarHBondContact O-N 2.88Å; R9-G11 PolarHBondContact O-N 3.4Å
10	G	29	Very low	40	Very low	60 Å²	60	148.1 Å²	148.1	62%	0.619	75%	0.749	S	S	*	*			trans	-59.1	103	172.1	0	0	0	0	0	111.1	L8 W12	L8-G10 VanDerWaalsContact C-N 3.31Å; L8-G10 PolarHBondContact O-N 3.32Å; G10-W12 PolarHBondContact O-N 2.98Å
11	G	27.4	Very low	42	Very low	70 Å²	70	143.3 Å²	143.3	72%	0.722	73%	0.73	S	S	*	*			trans	-74	109.5	173.3	0	0	0	0	0	109.7	R9 E13	R9-G11 PolarHBondContact O-N 3.4Å; G11-E13 PolarHBondContact O-N 3.3Å
12	W	31.8	Very low	43.8	Very low	248 Å²	248	136.8 Å²	136.8	94%	0.939	70%	0.696	S	S	*	*			trans	-73.4	95.5	168.9	-67.7	65.1	0	0	0	107.2	G10 R14	G10-W12 PolarHBondContact O-N 2.98Å; W12-R14 PolarHBondContact O-N 3.14Å
13	E	32.4	Very low	46.2	Very low	191 Å²	191	133.1 Å²	133.1	89%	0.893	67%	0.669	S	S	*	*			trans	-65.1	105.4	176	-165.9	164.5	-174.7	0	0	108.3	G11 E15	G11-E13 PolarHBondContact O-N 3.3Å; E13-E15 PolarHBondContact O-N 3.03Å; E13-E15 VanDerWaalsContact O-N 3.08Å
14	R	38.2	Very low	49	Very low	224 Å²	224	123.7 Å²	123.7	85%	0.845	63%	0.628	S	S	*	*			trans	-65.2	110.1	178.9	179.3	-171.7	-61.9	170.5	1.1	107.4	W12 R16	W12-R14 PolarHBondContact O-N 3.14Å; R14-R16 PolarHBondContact O-N 3.37Å; R14-R16 VanDerWaalsContact O-N 3.11Å
15	E	40.8	Very low	51.6	Low	187 Å²	187	122 Å²	122	87%	0.874	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-46.4	123.1	168.3	-72.6	-165.8	120.6	0	0	108.7	E13 S17	E13-E15 PolarHBondContact O-N 3.03Å; E13-E15 VanDerWaalsContact O-N 3.08Å; E15-S17 PolarHBondContact O-N 3Å
16	R	50.7	Low	54.3	Low	211 Å²	211	120.5 Å²	120.5	80%	0.796	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-62.3	133.2	178.2	-69.6	-171.7	-177.5	-161.2	2.5	108.1	R14 D20	R14-R16 PolarHBondContact O-N 3.37Å; R14-R16 VanDerWaalsContact O-N 3.11Å; R16-D20 HydrophobicContact CB-CB 4.29Å
17	S	55.8	Low	57.2	Low	53 Å²	53	112.8 Å²	112.8	37%	0.371	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-59.6	145.8	174.2	-173.5	0	0	0	0	108.8	E15 G19 D20	E15-S17 PolarHBondContact O-N 3Å; S17-G19 PolarHBondContact O-N 2.93Å; S17-G19 VanDerWaalsContact O-N 3.09Å; S17-D20 PolarHBondContact N-OD2 2.79Å; S17-D20 WeakPolarHBondContact O-CB 3.36Å; S17-D20 PolarHBondContact O-N 3.04Å
18	P	60.7	Low	60	Low	51 Å²	51	108.1 Å²	108.1	33%	0.331	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-49.4	-35.7	170.8	-29.9	37.2	0	0	0	112.7	D20 S21 F130 Y134	P18-D20 VanDerWaalsContact C-N 3.27Å; P18-D20 PolarHBondContact O-N 2.89Å; P18-S21 VanDerWaalsContact O-CB 3.23Å; P18-S21 WeakPolarHBondContact O-CB 3.37Å; P18-S21 PolarHBondContact O-N 3.37Å; P18-S21 PolarHBondContact O-OG 3.48Å; P18-F130 VanDerWaalsContact C-CE1 3.45Å; P18-F130 HydrophobicContact CB-CE1 4.04Å; P18-F130 VanDerWaalsContact O-CE1 3.3Å; P18-F130 WeakPolarHBondContact O-CE1 3.32Å; P18-Y134 HydrophobicContact CB-CD1 3.79Å; P18-Y134 HydrophobicContact CB-CD2 4.09Å; P18-Y134 HydrophobicContact CB-CE1 3.75Å; P18-Y134 HydrophobicContact CB-CE2 4.05Å; P18-Y134 HydrophobicContact CB-CG 3.98Å; P18-Y134 HydrophobicContact CG-CD1 3.93Å; P18-Y134 HydrophobicContact CG-CE1 3.65Å
19	G	58.5	Low	62.9	Low	2 Å²	2	103 Å²	103	2%	0.021	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-66.1	-12.2	173.4	0	0	0	0	0	117.1	S17 G24 D131	S17-G19 PolarHBondContact O-N 2.93Å; S17-G19 VanDerWaalsContact O-N 3.09Å; G19-G24 CarbonylContact O-C 3.5Å; G19-D131 PolarHBondContact N-OD1 2.95Å; G19-D131 VanDerWaalsContact N-OD1 3.17Å
20	D	61.5	Low	65.8	Low	73 Å²	73	93 Å²	93	39%	0.39	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-86.1	-8.7	172.4	-65.8	-40	0	0	0	112.7	R16 S17 P18	R16-D20 HydrophobicContact CB-CB 4.29Å; S17-D20 PolarHBondContact N-OD2 2.79Å; S17-D20 WeakPolarHBondContact O-CB 3.36Å; S17-D20 PolarHBondContact O-N 3.04Å; P18-D20 VanDerWaalsContact C-N 3.27Å; P18-D20 PolarHBondContact O-N 2.89Å
21	S	81.1	Confident	69	Low	48 Å²	48	90.1 Å²	90.1	34%	0.336	42%	0.424	S	S	.	.	S	Bend	trans	-60.4	156.4	172.6	67	0	0	0	0	111.9	P18 L23 G24 R25	P18-S21 VanDerWaalsContact O-CB 3.23Å; P18-S21 WeakPolarHBondContact O-CB 3.37Å; P18-S21 PolarHBondContact O-N 3.37Å; P18-S21 PolarHBondContact O-OG 3.48Å; S21-L23 VanDerWaalsContact C-N 3.25Å; S21-L23 PolarHBondContact O-N 3.13Å; S21-G24 WeakPolarHBondContact O-CA 3.32Å; S21-G24 PolarHBondContact O-N 3.38Å; S21-G24 PolarHBondContact OG-N 3.18Å; S21-R25 WeakPolarHBondContact O-CG 3.39Å; S21-R25 PolarHBondContact O-N 3.12Å
22	E	84.4	Confident	72.1	Confident	99 Å²	99	90 Å²	90	46%	0.463	41%	0.406	S	S	.	.	H	α-helix	trans	-50.3	-48.3	176.4	-167.7	54.7	-133.3	0	0	112	R25 Q26	E22-R25 IonicContact OE1-CZ 2.98Å; E22-R25 IonicContact OE1-NH2 3.18Å; E22-R25 PolarHBondContact OE1-NH2 3.32Å; E22-R25 IonicContact OE2-CZ 3.99Å; E22-R25 IonicContact OE2-NH1 3.79Å; E22-R25 PolarHBondContact OE2-NH1 3.08Å; E22-R25 IonicContact OE2-NH2 3.98Å; E22-R25 PolarHBondContact OE2-NH2 3.44Å; E22-Q26 VanDerWaalsContact O-CG 3.3Å; E22-Q26 WeakPolarHBondContact O-CG 3.34Å; E22-Q26 PolarHBondContact O-N 3.3Å; E22-Q26 VanDerWaalsContact O-N 3.15Å; E22-Q26 PolarHBondContact OE1-NE2 3.41Å
23	L	84.7	Confident	75.1	Confident	55 Å²	55	86.4 Å²	86.4	29%	0.288	39%	0.393	S	S	.	.	H	α-helix	trans	-62	-42.7	174.8	179.8	61.2	0	0	0	112.6	S21 Q26 F27 F130 S178	S21-L23 VanDerWaalsContact C-N 3.25Å; S21-L23 PolarHBondContact O-N 3.13Å; L23-Q26 PolarHBondContact O-N 2.94Å; L23-F27 WeakPolarHBondContact O-CB 3.37Å; L23-F27 PolarHBondContact O-N 2.95Å; L23-F130 HydrophobicContact CG-CE2 4.14Å; L23-S178 WeakPolarHBondContact CD2-O 3.41Å
24	G	87	Confident	78.1	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-59.5	-47.9	178.4	0	0	0	0	0	113.1	G19 S21 R28	G19-G24 CarbonylContact O-C 3.5Å; S21-G24 WeakPolarHBondContact O-CA 3.32Å; S21-G24 PolarHBondContact O-N 3.38Å; S21-G24 PolarHBondContact OG-N 3.18Å; G24-R28 VanDerWaalsContact O-CB 3.28Å; G24-R28 WeakPolarHBondContact O-CB 3.49Å; G24-R28 PolarHBondContact O-N 3.25Å
25	R	90.9	Very high	80.8	Confident	94 Å²	94	69.3 Å²	69.3	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-62.7	-52.2	176.8	-54.5	-166.6	-36.4	-81.7	-6.2	111.3	S21 E22 F27 R28 D29	S21-R25 WeakPolarHBondContact O-CG 3.39Å; S21-R25 PolarHBondContact O-N 3.12Å; E22-R25 IonicContact OE1-CZ 2.98Å; E22-R25 IonicContact OE1-NH2 3.18Å; E22-R25 PolarHBondContact OE1-NH2 3.32Å; E22-R25 IonicContact OE2-CZ 3.99Å; E22-R25 IonicContact OE2-NH1 3.79Å; E22-R25 PolarHBondContact OE2-NH1 3.08Å; E22-R25 IonicContact OE2-NH2 3.98Å; E22-R25 PolarHBondContact OE2-NH2 3.44Å; R25-F27 VanDerWaalsContact C-N 3.3Å; R25-F27 PolarHBondContact O-N 3.29Å; R25-R28 PolarHBondContact O-N 2.88Å; R25-D29 WeakPolarHBondContact O-CB 3.46Å; R25-D29 PolarHBondContact O-N 3.11Å
26	Q	91.4	Very high	83.2	Confident	109 Å²	109	60.6 Å²	60.6	51%	0.509	29%	0.286	S	S	.	.	H	α-helix	trans	-59.9	-39.3	-178.5	-68.1	178.6	20.7	0	0	112.6	E22 L23 W30	E22-Q26 VanDerWaalsContact O-CG 3.3Å; E22-Q26 WeakPolarHBondContact O-CG 3.34Å; E22-Q26 PolarHBondContact O-N 3.3Å; E22-Q26 VanDerWaalsContact O-N 3.15Å; E22-Q26 PolarHBondContact OE1-NE2 3.41Å; L23-Q26 PolarHBondContact O-N 2.94Å; Q26-W30 PolarHBondContact O-N 3.39Å; Q26-W30 VanDerWaalsContact O-N 3.15Å
27	F	94.1	Very high	84.9	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-68.5	-46.1	175.9	-177.5	-89.5	0	0	0	112.4	L23 R25 D29 W30 C31 F129 F130 I133 A171 R174 F175	L23-F27 WeakPolarHBondContact O-CB 3.37Å; L23-F27 PolarHBondContact O-N 2.95Å; R25-F27 VanDerWaalsContact C-N 3.3Å; R25-F27 PolarHBondContact O-N 3.29Å; F27-D29 PolarHBondContact O-N 2.98Å; F27-W30 HydrophobicContact CE2-CE3 4.36Å; F27-W30 HydrophobicContact CE2-CZ3 4.24Å; F27-W30 HydrophobicContact CZ-CZ3 4.48Å; F27-W30 PolarHBondContact O-N 3.08Å; F27-C31 WeakPolarHBondContact CE1-SG 3.28Å; F27-C31 PolarHBondContact O-N 2.74Å; F27-F129 HydrophobicContact CE1-CB 4.18Å; F27-F130 HydrophobicContact CB-CD2 3.95Å; F27-F130 HydrophobicContact CD1-CB 3.89Å; F27-F130 AromaticContact CD1-CD2 3.79Å; F27-F130 HydrophobicContact CD1-CD2 3.79Å; F27-F130 HydrophobicContact CD1-CG 4.35Å; F27-F130 HydrophobicContact CE1-CB 4.34Å; F27-F130 AromaticContact CG-CD2 4Å; F27-F130 HydrophobicContact CG-CD2 4Å; F27-I133 HydrophobicContact CE1-CD1 4.16Å; F27-I133 HydrophobicContact CZ-CD1 3.76Å; F27-A171 WeakPolarHBondContact CE2-O 3.38Å; F27-A171 HydrophobicContact CZ-CB 4.15Å; F27-A171 WeakPolarHBondContact CZ-O 3.36Å; F27-R174 HydrophobicContact CE2-CB 4.25Å; F27-R174 HydrophobicContact CE2-CG 4.47Å; F27-F175 HydrophobicContact CD2-CB 4.34Å; F27-F175 HydrophobicContact CE2-CB 3.69Å; F27-F175 HydrophobicContact CZ-CB 3.99Å
28	R	93.1	Very high	86.3	Confident	77 Å²	77	57.3 Å²	57.3	29%	0.291	29%	0.289	S	S	.	.	H	α-helix	trans	-61.5	-43.8	178.2	-176.2	178.8	64.2	-145.4	-2.1	111.6	G24 R25 W30 C31 L32	G24-R28 VanDerWaalsContact O-CB 3.28Å; G24-R28 WeakPolarHBondContact O-CB 3.49Å; G24-R28 PolarHBondContact O-N 3.25Å; R25-R28 PolarHBondContact O-N 2.88Å; R28-W30 VanDerWaalsContact C-N 3.32Å; R28-W30 PolarHBondContact O-N 2.91Å; R28-C31 PolarHBondContact O-N 3.17Å; R28-L32 HydrophobicContact CG-CD1 4.39Å; R28-L32 PolarHBondContact O-N 2.88Å
29	D	93.9	Very high	87.4	Confident	65 Å²	65	55.8 Å²	55.8	35%	0.348	28%	0.281	S	S	.	.	H	α-helix	trans	-65.9	-35.6	178.7	-65.9	-2.8	0	0	0	111.7	R25 F27 R33	R25-D29 WeakPolarHBondContact O-CB 3.46Å; R25-D29 PolarHBondContact O-N 3.11Å; F27-D29 PolarHBondContact O-N 2.98Å; D29-R33 VanDerWaalsContact C-NH2 3.33Å; D29-R33 VanDerWaalsContact CB-NH2 3.33Å; D29-R33 WeakPolarHBondContact O-CG 3.26Å; D29-R33 PolarHBondContact O-N 3.43Å; D29-R33 VanDerWaalsContact O-N 3.08Å; D29-R33 PolarHBondContact O-NE 3.32Å
30	W	94.7	Very high	88.6	Confident	30 Å²	30	64.3 Å²	64.3	11%	0.114	32%	0.317	C	S	.	.	H	α-helix	trans	-65.3	-47.6	169.7	171.8	75.1	0	0	0	111.9	Q26 F27 R28 L32 R33 T34 Y35 E170 A171 R174	Q26-W30 PolarHBondContact O-N 3.39Å; Q26-W30 VanDerWaalsContact O-N 3.15Å; F27-W30 HydrophobicContact CE2-CE3 4.36Å; F27-W30 HydrophobicContact CE2-CZ3 4.24Å; F27-W30 HydrophobicContact CZ-CZ3 4.48Å; F27-W30 PolarHBondContact O-N 3.08Å; R28-W30 VanDerWaalsContact C-N 3.32Å; R28-W30 PolarHBondContact O-N 2.91Å; W30-L32 VanDerWaalsContact C-N 3.27Å; W30-L32 PolarHBondContact O-N 3.02Å; W30-R33 PolarHBondContact O-N 3.12Å; W30-R33 VanDerWaalsContact O-N 3.11Å; W30-T34 HydrophobicContact CZ2-CG2 4.14Å; W30-T34 PolarHBondContact NE1-OG1 3.39Å; W30-T34 VanDerWaalsContact NE1-OG1 3.14Å; W30-T34 PolarHBondContact O-N 3.38Å; W30-T34 PolarHBondContact O-OG1 2.89Å; W30-Y35 AromaticContact CH2-CE2 3.72Å; W30-Y35 HydrophobicContact CH2-CE2 3.72Å; W30-Y35 AromaticContact CH2-CZ 3.93Å; W30-Y35 WeakPolarHBondContact CH2-OH 3.32Å; W30-Y35 HydrophobicContact CZ2-CE2 4.44Å; W30-Y35 AromaticContact CZ3-CE2 3.89Å; W30-Y35 HydrophobicContact CZ3-CE2 3.89Å; W30-E170 HydrophobicContact CH2-CG 4.22Å; W30-A171 HydrophobicContact CZ3-CB 4.25Å; W30-R174 VanDerWaalsContact CD2-CD 3.47Å; W30-R174 VanDerWaalsContact CE2-NH1 3.34Å; W30-R174 HydrophobicContact CH2-CB 4.47Å; W30-R174 HydrophobicContact CZ3-CB 4.38Å; W30-R174 VanDerWaalsContact CZ3-CD 3.42Å
31	C	95.3	Very high	89.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.9	-38.3	176.5	-81.6	0	0	0	0	112.5	F27 R28 Y35 V126 F129	F27-C31 WeakPolarHBondContact CE1-SG 3.28Å; F27-C31 PolarHBondContact O-N 2.74Å; R28-C31 PolarHBondContact O-N 3.17Å; C31-Y35 HydrophobicContact CB-CD2 4.28Å; C31-Y35 WeakPolarHBondContact O-CA 3.34Å; C31-Y35 VanDerWaalsContact O-CB 3.31Å; C31-Y35 WeakPolarHBondContact O-CB 3.45Å; C31-Y35 PolarHBondContact O-N 3.16Å; C31-V126 HydrophobicContact CB-CG1 4.14Å; C31-V126 WeakPolarHBondContact O-CG1 3.42Å; C31-F129 HydrophobicContact CB-CD2 4.47Å
32	L	94.3	Very high	90.3	Very high	66 Å²	66	69.3 Å²	69.3	35%	0.346	34%	0.335	S	S	.	.	H	α-helix	trans	-67	-42.4	174.1	-79.4	170.8	0	0	0	112.5	R28 W30 G36 E127	R28-L32 HydrophobicContact CG-CD1 4.39Å; R28-L32 PolarHBondContact O-N 2.88Å; W30-L32 VanDerWaalsContact C-N 3.27Å; W30-L32 PolarHBondContact O-N 3.02Å; L32-G36 VanDerWaalsContact O-CA 3.27Å; L32-G36 WeakPolarHBondContact O-CA 3.47Å; L32-G36 PolarHBondContact O-N 3.43Å; L32-E127 HydrophobicContact CD2-CG 4.04Å
33	R	93.9	Very high	90.8	Very high	173 Å²	173	64.8 Å²	64.8	65%	0.653	31%	0.313	S	S	*	.	H	α-helix	trans	-65.7	-35	175.8	-74.4	179.1	-71.6	-110.7	-0.6	113.2	D29 W30	D29-R33 VanDerWaalsContact C-NH2 3.33Å; D29-R33 VanDerWaalsContact CB-NH2 3.33Å; D29-R33 WeakPolarHBondContact O-CG 3.26Å; D29-R33 PolarHBondContact O-N 3.43Å; D29-R33 VanDerWaalsContact O-N 3.08Å; D29-R33 PolarHBondContact O-NE 3.32Å; W30-R33 PolarHBondContact O-N 3.12Å; W30-R33 VanDerWaalsContact O-N 3.11Å
34	T	94.4	Very high	91.2	Very high	47 Å²	47	62.1 Å²	62.1	29%	0.288	30%	0.3	S	S	.	.	H	α-helix	trans	-94.3	-28.7	-175.4	-59.3	0	0	0	0	113.8	W30 A39	W30-T34 HydrophobicContact CZ2-CG2 4.14Å; W30-T34 PolarHBondContact NE1-OG1 3.39Å; W30-T34 VanDerWaalsContact NE1-OG1 3.14Å; W30-T34 PolarHBondContact O-N 3.38Å; W30-T34 PolarHBondContact O-OG1 2.89Å; T34-A39 WeakPolarHBondContact O-CB 3.46Å
35	Y	95.2	Very high	91.6	Very high	10 Å²	10	62.2 Å²	62.2	4%	0.039	30%	0.3	C	S	.	.	H	α-helix	trans	-130.6	6.8	-172.8	-49.4	-58	0	0	0	115	W30 C31 T41 T43 F129 P168 E170 A171	W30-Y35 AromaticContact CH2-CE2 3.72Å; W30-Y35 HydrophobicContact CH2-CE2 3.72Å; W30-Y35 AromaticContact CH2-CZ 3.93Å; W30-Y35 WeakPolarHBondContact CH2-OH 3.32Å; W30-Y35 HydrophobicContact CZ2-CE2 4.44Å; W30-Y35 AromaticContact CZ3-CE2 3.89Å; W30-Y35 HydrophobicContact CZ3-CE2 3.89Å; C31-Y35 HydrophobicContact CB-CD2 4.28Å; C31-Y35 WeakPolarHBondContact O-CA 3.34Å; C31-Y35 VanDerWaalsContact O-CB 3.31Å; C31-Y35 WeakPolarHBondContact O-CB 3.45Å; C31-Y35 PolarHBondContact O-N 3.16Å; Y35-T41 HydrophobicContact CD1-CG2 4.44Å; Y35-T43 HydrophobicContact CD1-CG2 4.05Å; Y35-T43 HydrophobicContact CG-CG2 4.02Å; Y35-T43 PolarHBondContact O-OG1 3.43Å; Y35-F129 HydrophobicContact CD2-CD2 4.39Å; Y35-F129 AromaticContact CD2-CE2 3.97Å; Y35-F129 HydrophobicContact CD2-CE2 3.97Å; Y35-F129 HydrophobicContact CE2-CE2 4.48Å; Y35-P168 HydrophobicContact CD1-CG 4.12Å; Y35-P168 HydrophobicContact CD2-CG 4.39Å; Y35-P168 HydrophobicContact CE1-CB 4.16Å; Y35-P168 HydrophobicContact CE1-CG 3.81Å; Y35-P168 HydrophobicContact CE2-CB 4.5Å; Y35-P168 HydrophobicContact CE2-CG 4.08Å; Y35-P168 HydrophobicContact CG-CG 4.41Å; Y35-E170 WeakPolarHBondContact OH-CB 3.26Å; Y35-E170 PolarHBondContact OH-OE2 2.84Å; Y35-A171 HydrophobicContact CE2-CB 4.07Å
36	G	91.3	Very high	91.8	Very high	4 Å²	4	64.2 Å²	64.2	4%	0.041	31%	0.308	C	S	.	.	S	Bend	trans	-67.7	-178.4	176.8	0	0	0	0	0	114.4	L32 S38 A39	L32-G36 VanDerWaalsContact O-CA 3.27Å; L32-G36 WeakPolarHBondContact O-CA 3.47Å; L32-G36 PolarHBondContact O-N 3.43Å; G36-S38 VanDerWaalsContact C-N 3.25Å; G36-S38 PolarHBondContact O-N 2.96Å; G36-S38 VanDerWaalsContact O-N 3.17Å; G36-A39 VanDerWaalsContact O-CB 3.31Å; G36-A39 WeakPolarHBondContact O-CB 3.42Å; G36-A39 PolarHBondContact O-N 2.83Å
37	D	86.1	Confident	91.8	Very high	78 Å²	78	62.3 Å²	62.3	42%	0.417	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.2	-171.6	-83.4	-57.4	0	0	0	114.9	A39 T45 S47 K48 R51	D37-A39 VanDerWaalsContact C-N 3.32Å; D37-T45 HydrophobicContact CB-CG2 4.42Å; D37-T45 PolarHBondContact OD1-OG1 3.18Å; D37-T45 WeakPolarHBondContact OD2-CB 3.28Å; D37-T45 WeakPolarHBondContact OD2-CG2 3.16Å; D37-T45 PolarHBondContact OD2-OG1 2.65Å; D37-S47 WeakPolarHBondContact OD2-CB 3.49Å; D37-K48 WeakPolarHBondContact OD1-CE 3.4Å; D37-R51 IonicContact OD1-NH2 3.91Å
38	S	85.4	Confident	91.7	Very high	116 Å²	116	63.5 Å²	63.5	81%	0.811	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-18.4	171.7	56.1	0	0	0	0	113.5	G36	G36-S38 VanDerWaalsContact C-N 3.25Å; G36-S38 PolarHBondContact O-N 2.96Å; G36-S38 VanDerWaalsContact O-N 3.17Å
39	A	84.5	Confident	91.7	Very high	19 Å²	19	61.8 Å²	61.8	16%	0.157	31%	0.305	C	S	.	.	S	Bend	trans	-84.5	125.9	-176.4	0	0	0	0	0	111.1	T34 G36 D37 T41	T34-A39 WeakPolarHBondContact O-CB 3.46Å; G36-A39 VanDerWaalsContact O-CB 3.31Å; G36-A39 WeakPolarHBondContact O-CB 3.42Å; G36-A39 PolarHBondContact O-N 2.83Å; D37-A39 VanDerWaalsContact C-N 3.32Å; A39-T41 HydrophobicContact CB-CG2 3.94Å; A39-T41 PolarHBondContact O-N 3.34Å
40	K	84.2	Confident	91.6	Very high	182 Å²	182	63.2 Å²	63.2	79%	0.791	31%	0.31	S	S	*	.			trans	-72.9	66.9	176.7	-66	-167.3	175.4	-166.6	0	112
41	T	88.1	Confident	91.4	Very high	59 Å²	59	67.1 Å²	67.1	36%	0.362	33%	0.325	S	S	.	.	S	Bend	trans	-131	166.8	-173.9	72.3	0	0	0	0	111.5	Y35 A39 T43	Y35-T41 HydrophobicContact CD1-CG2 4.44Å; A39-T41 HydrophobicContact CB-CG2 3.94Å; A39-T41 PolarHBondContact O-N 3.34Å; T41-T43 VanDerWaalsContact C-N 3.31Å; T41-T43 PolarHBondContact O-N 3.31Å; T41-T43 PolarHBondContact OG1-OG1 3.38Å
42	K	88.9	Confident	91.3	Very high	167 Å²	167	67.1 Å²	67.1	73%	0.726	33%	0.325	S	S	*	.	S	Bend	trans	-86.1	6	-178.2	68	-179.3	178.5	-176.8	0	114.5	F166	K42-F166 WeakPolarHBondContact O-CD1 3.46Å
43	T	94.4	Very high	91.1	Very high	3 Å²	3	64.1 Å²	64.1	2%	0.018	31%	0.309	C	S	.	.			trans	-75.4	166.4	-177.5	56.9	0	0	0	0	112.1	Y35 T41 K48 V126 F129 P168	Y35-T43 HydrophobicContact CD1-CG2 4.05Å; Y35-T43 HydrophobicContact CG-CG2 4.02Å; Y35-T43 PolarHBondContact O-OG1 3.43Å; T41-T43 VanDerWaalsContact C-N 3.31Å; T41-T43 PolarHBondContact O-N 3.31Å; T41-T43 PolarHBondContact OG1-OG1 3.38Å; T43-K48 PolarHBondContact O-NZ 2.88Å; T43-V126 HydrophobicContact CG2-CG2 4.25Å; T43-F129 HydrophobicContact CG2-CE2 4.39Å; T43-F129 HydrophobicContact CG2-CZ 4.16Å; T43-P168 HydrophobicContact CG2-CG 3.67Å
44	V	94.9	Very high	90.8	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-119.7	112	178.7	-173.9	0	0	0	0	108.8	K48 Y49 I52 V123 V125 V126 F166	V44-K48 HydrophobicContact CG1-CB 4.04Å; V44-K48 HydrophobicContact CG1-CG 4.32Å; V44-Y49 HydrophobicContact CG1-CD2 4.43Å; V44-I52 HydrophobicContact CG1-CD1 3.9Å; V44-I52 HydrophobicContact CG2-CD1 4.41Å; V44-V123 HydrophobicContact CB-CG1 3.84Å; V44-V123 HydrophobicContact CG1-CG1 3.98Å; V44-V123 HydrophobicContact CG2-CG1 3.74Å; V44-V125 CarbonylContact O-C 3.5Å; V44-V125 VanDerWaalsContact O-CA 3.3Å; V44-V125 WeakPolarHBondContact O-CA 3.35Å; V44-V126 WeakPolarHBondContact O-CG2 3.5Å; V44-V126 PolarHBondContact O-N 3.49Å; V44-F166 HydrophobicContact CG2-CB 4.27Å; V44-F166 HydrophobicContact CG2-CD2 4.23Å; V44-F166 HydrophobicContact CG2-CG 4.13Å
45	T	95.4	Very high	90.6	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.012	29%	0.292	C	S	.	.			trans	-75.3	167.5	169.1	55.7	0	0	0	0	110.5	D37 S47 K48 Y49 V126 E127	D37-T45 HydrophobicContact CB-CG2 4.42Å; D37-T45 PolarHBondContact OD1-OG1 3.18Å; D37-T45 WeakPolarHBondContact OD2-CB 3.28Å; D37-T45 WeakPolarHBondContact OD2-CG2 3.16Å; D37-T45 PolarHBondContact OD2-OG1 2.65Å; T45-S47 VanDerWaalsContact C-N 3.27Å; T45-S47 PolarHBondContact O-N 3.14Å; T45-K48 CarbonylContact O-C 3.57Å; T45-K48 PolarHBondContact O-N 2.67Å; T45-K48 VanDerWaalsContact OG1-CB 3.29Å; T45-K48 WeakPolarHBondContact OG1-CB 3.21Å; T45-K48 PolarHBondContact OG1-N 2.98Å; T45-K48 VanDerWaalsContact OG1-N 3.14Å; T45-Y49 WeakPolarHBondContact O-CB 3.33Å; T45-Y49 PolarHBondContact O-N 2.77Å; T45-V126 HydrophobicContact CG2-CG2 4.44Å; T45-E127 VanDerWaalsContact CA-OE2 3.28Å; T45-E127 WeakPolarHBondContact CA-OE2 3.46Å
46	R	93.4	Very high	90.3	Very high	136 Å²	136	60.7 Å²	60.7	51%	0.513	30%	0.301	S	S	.	.	H	α-helix	trans	-57.4	-41.3	173.8	-171.6	168.4	-75.1	-89.8	-2.5	111.4	K48 Y49 Q50 V125 E127 D128	R46-K48 VanDerWaalsContact C-N 3.32Å; R46-K48 PolarHBondContact O-N 2.9Å; R46-Y49 PolarHBondContact O-N 2.85Å; R46-Q50 WeakPolarHBondContact O-CB 3.32Å; R46-Q50 PolarHBondContact O-N 3.05Å; R46-V125 HydrophobicContact CB-CG1 4.06Å; R46-E127 HydrophobicContact CB-CG 4.34Å; R46-E127 WeakPolarHBondContact CB-OE1 3.3Å; R46-E127 PolarHBondContact N-OE1 3.31Å; R46-E127 PolarHBondContact N-OE2 2.92Å; R46-D128 IonicContact CZ-OD1 3.7Å; R46-D128 IonicContact NE-OD1 3.58Å; R46-D128 IonicContact NH2-OD1 2.97Å; R46-D128 PolarHBondContact NH2-OD1 2.93Å; R46-D128 IonicContact NH2-OD2 2.65Å; R46-D128 PolarHBondContact NH2-OD2 3.36Å
47	S	91.9	Very high	89.9	Confident	68 Å²	68	66 Å²	66	48%	0.476	32%	0.324	S	S	.	.	H	α-helix	trans	-65.6	-28.5	174.6	-51.1	0	0	0	0	114.1	D37 T45 R51	D37-S47 WeakPolarHBondContact OD2-CB 3.49Å; T45-S47 VanDerWaalsContact C-N 3.27Å; T45-S47 PolarHBondContact O-N 3.14Å; S47-R51 WeakPolarHBondContact O-CG 3.28Å; S47-R51 PolarHBondContact O-NE 2.92Å
48	K	92	Very high	89.2	Confident	31 Å²	31	65.3 Å²	65.3	14%	0.135	34%	0.336	C	S	.	.	H	α-helix	trans	-84.8	-39.3	175.3	-163.6	-179.1	-51.1	173.1	0	111.1	D37 T43 V44 T45 R46 R51 I52 F76	D37-K48 WeakPolarHBondContact OD1-CE 3.4Å; T43-K48 PolarHBondContact O-NZ 2.88Å; V44-K48 HydrophobicContact CG1-CB 4.04Å; V44-K48 HydrophobicContact CG1-CG 4.32Å; T45-K48 CarbonylContact O-C 3.57Å; T45-K48 PolarHBondContact O-N 2.67Å; T45-K48 VanDerWaalsContact OG1-CB 3.29Å; T45-K48 WeakPolarHBondContact OG1-CB 3.21Å; T45-K48 PolarHBondContact OG1-N 2.98Å; T45-K48 VanDerWaalsContact OG1-N 3.14Å; R46-K48 VanDerWaalsContact C-N 3.32Å; R46-K48 PolarHBondContact O-N 2.9Å; K48-R51 PolarHBondContact O-N 3.42Å; K48-I52 VanDerWaalsContact O-CG1 3.31Å; K48-I52 WeakPolarHBondContact O-CG1 3.29Å; K48-I52 PolarHBondContact O-N 2.95Å; K48-F76 HydrophobicContact CG-CE2 4.31Å
49	Y	93.3	Very high	87.8	Confident	42 Å²	42	61.9 Å²	61.9	17%	0.165	32%	0.318	C	S	.	.	H	α-helix	trans	-58.5	-48.4	175	-175.1	-83.5	0	0	0	111.4	V44 T45 R46 R51 I52 A53 Q97 V98 V99 V123 V125	V44-Y49 HydrophobicContact CG1-CD2 4.43Å; T45-Y49 WeakPolarHBondContact O-CB 3.33Å; T45-Y49 PolarHBondContact O-N 2.77Å; R46-Y49 PolarHBondContact O-N 2.85Å; Y49-R51 PolarHBondContact O-N 2.9Å; Y49-I52 WeakPolarHBondContact O-CB 3.47Å; Y49-I52 PolarHBondContact O-N 3.34Å; Y49-I52 VanDerWaalsContact O-N 3.12Å; Y49-A53 WeakPolarHBondContact O-CB 3.29Å; Y49-A53 PolarHBondContact O-N 3.49Å; Y49-Q97 PolarHBondContact OH-O 2.92Å; Y49-V98 VanDerWaalsContact OH-CA 3.28Å; Y49-V98 WeakPolarHBondContact OH-CA 3.37Å; Y49-V99 HydrophobicContact CD1-CG2 4.5Å; Y49-V99 HydrophobicContact CD2-CB 4.44Å; Y49-V99 HydrophobicContact CD2-CG2 4.39Å; Y49-V99 HydrophobicContact CE1-CG2 3.95Å; Y49-V99 HydrophobicContact CE2-CB 3.77Å; Y49-V99 HydrophobicContact CE2-CG2 3.86Å; Y49-V99 PolarHBondContact OH-N 2.98Å; Y49-V123 HydrophobicContact CD2-CB 4.37Å; Y49-V123 HydrophobicContact CD2-CG1 4.05Å; Y49-V123 HydrophobicContact CE2-CB 4.2Å; Y49-V123 HydrophobicContact CE2-CG1 4.38Å; Y49-V125 HydrophobicContact CD2-CG2 3.37Å; Y49-V125 HydrophobicContact CE2-CG2 3.89Å; Y49-V125 HydrophobicContact CG-CG2 3.77Å
50	Q	91.8	Very high	86.1	Confident	95 Å²	95	64.9 Å²	64.9	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-59.9	-43.2	177.6	179.8	56.3	28.1	0	0	111.8	R46 I52 A53 E54	R46-Q50 WeakPolarHBondContact O-CB 3.32Å; R46-Q50 PolarHBondContact O-N 3.05Å; Q50-I52 PolarHBondContact O-N 3.3Å; Q50-A53 WeakPolarHBondContact O-CB 3.44Å; Q50-A53 PolarHBondContact O-N 3.44Å; Q50-A53 VanDerWaalsContact O-N 3.17Å; Q50-E54 WeakPolarHBondContact CG-OE1 3.44Å; Q50-E54 PolarHBondContact NE2-OE1 3.06Å; Q50-E54 WeakPolarHBondContact O-CG 3.36Å; Q50-E54 PolarHBondContact O-N 3.48Å
51	R	90.9	Very high	83.9	Confident	112 Å²	112	59.3 Å²	59.3	42%	0.423	35%	0.345	S	S	.	.	H	α-helix	trans	-65.6	-33	174.3	-72.2	-177.9	-71.1	162.2	-5	113.6	D37 S47 K48 Y49 V55 F76	D37-R51 IonicContact OD1-NH2 3.91Å; S47-R51 WeakPolarHBondContact O-CG 3.28Å; S47-R51 PolarHBondContact O-NE 2.92Å; K48-R51 PolarHBondContact O-N 3.42Å; Y49-R51 PolarHBondContact O-N 2.9Å; R51-V55 WeakPolarHBondContact O-CB 3.31Å; R51-V55 VanDerWaalsContact O-CG2 3.26Å; R51-V55 WeakPolarHBondContact O-CG2 3.09Å; R51-V55 PolarHBondContact O-N 2.78Å; R51-V55 VanDerWaalsContact O-N 3.13Å; R51-F76 HydrophobicContact CB-CE1 3.77Å; R51-F76 HydrophobicContact CB-CZ 3.83Å
52	I	91.9	Very high	82	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-66.2	-45.1	171.2	-63.1	163.2	0	0	0	109.7	V44 K48 Y49 Q50 E54 V55 L56 F76 W79 V80 F85 V99	V44-I52 HydrophobicContact CG1-CD1 3.9Å; V44-I52 HydrophobicContact CG2-CD1 4.41Å; K48-I52 VanDerWaalsContact O-CG1 3.31Å; K48-I52 WeakPolarHBondContact O-CG1 3.29Å; K48-I52 PolarHBondContact O-N 2.95Å; Y49-I52 WeakPolarHBondContact O-CB 3.47Å; Y49-I52 PolarHBondContact O-N 3.34Å; Y49-I52 VanDerWaalsContact O-N 3.12Å; Q50-I52 PolarHBondContact O-N 3.3Å; I52-E54 PolarHBondContact O-N 3.2Å; I52-V55 PolarHBondContact O-N 3.44Å; I52-L56 HydrophobicContact CG2-CD1 3.79Å; I52-L56 HydrophobicContact CG2-CG 4.46Å; I52-L56 VanDerWaalsContact O-CG 3.26Å; I52-L56 WeakPolarHBondContact O-CG 3.09Å; I52-L56 PolarHBondContact O-N 3.26Å; I52-L56 VanDerWaalsContact O-N 3.12Å; I52-F76 HydrophobicContact CG1-CZ 3.9Å; I52-W79 HydrophobicContact CD1-CH2 4.32Å; I52-W79 HydrophobicContact CD1-CZ3 3.97Å; I52-W79 HydrophobicContact CG1-CZ3 4.21Å; I52-V80 HydrophobicContact CG1-CG2 4.05Å; I52-V80 HydrophobicContact CG2-CG1 4.15Å; I52-V80 HydrophobicContact CG2-CG2 4.42Å; I52-F85 HydrophobicContact CD1-CE1 4.32Å; I52-F85 HydrophobicContact CD1-CE2 4.42Å; I52-F85 HydrophobicContact CD1-CZ 4.1Å; I52-F85 HydrophobicContact CG2-CB 4.12Å; I52-F85 HydrophobicContact CG2-CD1 4.27Å; I52-F85 HydrophobicContact CG2-CD2 4.22Å; I52-F85 HydrophobicContact CG2-CG 3.99Å; I52-V99 HydrophobicContact CG2-CG1 3.81Å
53	A	90.2	Very high	79.7	Confident	3 Å²	3	59.3 Å²	59.3	3%	0.025	37%	0.374	C	S	.	.	H	α-helix	trans	-59.1	-44.8	178	0	0	0	0	0	112.5	Y49 Q50 L56 Q57 Q97 V99	Y49-A53 WeakPolarHBondContact O-CB 3.29Å; Y49-A53 PolarHBondContact O-N 3.49Å; Q50-A53 WeakPolarHBondContact O-CB 3.44Å; Q50-A53 PolarHBondContact O-N 3.44Å; Q50-A53 VanDerWaalsContact O-N 3.17Å; A53-L56 PolarHBondContact O-N 2.94Å; A53-Q57 WeakPolarHBondContact O-CG 3.44Å; A53-Q57 PolarHBondContact O-N 2.94Å; A53-Q97 VanDerWaalsContact CB-NE2 3.34Å; A53-V99 HydrophobicContact CB-CG2 4.31Å
54	E	89.4	Confident	77.5	Confident	91 Å²	91	64.7 Å²	64.7	43%	0.425	42%	0.419	S	S	.	.	H	α-helix	trans	-63.5	-45.8	176.2	-72.8	160	-177	0	0	112.6	Q50 I52 L56 Q57 G58	Q50-E54 WeakPolarHBondContact CG-OE1 3.44Å; Q50-E54 PolarHBondContact NE2-OE1 3.06Å; Q50-E54 WeakPolarHBondContact O-CG 3.36Å; Q50-E54 PolarHBondContact O-N 3.48Å; I52-E54 PolarHBondContact O-N 3.2Å; E54-L56 PolarHBondContact O-N 2.94Å; E54-Q57 PolarHBondContact O-N 3.49Å; E54-G58 PolarHBondContact O-N 2.74Å
55	V	89.4	Confident	74.7	Confident	25 Å²	25	68.5 Å²	68.5	15%	0.152	46%	0.458	C	S	.	.	H	α-helix	trans	-61.9	-31.2	177.9	166	0	0	0	0	112.1	R51 I52 F76 Q77 V80	R51-V55 WeakPolarHBondContact O-CB 3.31Å; R51-V55 VanDerWaalsContact O-CG2 3.26Å; R51-V55 WeakPolarHBondContact O-CG2 3.09Å; R51-V55 PolarHBondContact O-N 2.78Å; R51-V55 VanDerWaalsContact O-N 3.13Å; I52-V55 PolarHBondContact O-N 3.44Å; V55-F76 HydrophobicContact CG2-CD1 4.21Å; V55-F76 HydrophobicContact CG2-CE1 4.08Å; V55-Q77 HydrophobicContact CG1-CB 4.37Å; V55-Q77 HydrophobicContact CG1-CG 3.9Å; V55-Q77 HydrophobicContact CG2-CG 3.85Å; V55-V80 HydrophobicContact CB-CG1 4.46Å; V55-V80 HydrophobicContact CG1-CB 4.03Å; V55-V80 HydrophobicContact CG1-CG1 3.8Å; V55-V80 HydrophobicContact CG1-CG2 4.39Å
56	L	88	Confident	72.4	Confident	42 Å²	42	74.7 Å²	74.7	22%	0.22	50%	0.501	C	S	.	.	H	α-helix	trans	-83.7	-31.9	177.3	-64.2	168.8	0	0	0	112.9	I52 A53 E54 V80 F85 L87 V99	I52-L56 HydrophobicContact CG2-CD1 3.79Å; I52-L56 HydrophobicContact CG2-CG 4.46Å; I52-L56 VanDerWaalsContact O-CG 3.26Å; I52-L56 WeakPolarHBondContact O-CG 3.09Å; I52-L56 PolarHBondContact O-N 3.26Å; I52-L56 VanDerWaalsContact O-N 3.12Å; A53-L56 PolarHBondContact O-N 2.94Å; E54-L56 PolarHBondContact O-N 2.94Å; L56-V80 HydrophobicContact CD2-CG1 3.92Å; L56-V80 HydrophobicContact CG-CG1 4.09Å; L56-F85 HydrophobicContact CD1-CB 3.8Å; L56-F85 HydrophobicContact CD2-CB 4.45Å; L56-F85 VanDerWaalsContact CD2-O 3.32Å; L56-F85 WeakPolarHBondContact CD2-O 3.43Å; L56-L87 HydrophobicContact CB-CD1 3.7Å; L56-L87 HydrophobicContact CB-CD2 3.78Å; L56-L87 HydrophobicContact CB-CG 3.6Å; L56-L87 HydrophobicContact CD1-CD2 3.58Å; L56-L87 HydrophobicContact CD1-CG 4.01Å; L56-L87 HydrophobicContact CG-CD2 4.34Å; L56-L87 HydrophobicContact CG-CG 4.44Å; L56-V99 HydrophobicContact CD1-CG1 4.31Å
57	Q	83.6	Confident	69.8	Low	115 Å²	115	71 Å²	71	54%	0.537	51%	0.505	S	S	.	.	H	α-helix	trans	-67.4	-49.8	171.5	-76.4	172.3	-6.2	0	0	111.6	A53 E54 G59 L87 Q97	A53-Q57 WeakPolarHBondContact O-CG 3.44Å; A53-Q57 PolarHBondContact O-N 2.94Å; E54-Q57 PolarHBondContact O-N 3.49Å; Q57-G59 PolarHBondContact O-N 3.43Å; Q57-G59 VanDerWaalsContact O-N 3.14Å; Q57-L87 HydrophobicContact CG-CD1 3.99Å; Q57-Q97 VanDerWaalsContact NE2-CD 3.34Å
58	G	71.3	Confident	67.5	Low	64 Å²	64	74.6 Å²	74.6	66%	0.66	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-72.8	1.2	-179	0	0	0	0	0	114.8	E54 G60	E54-G58 PolarHBondContact O-N 2.74Å; G58-G60 VanDerWaalsContact C-N 3.29Å; G58-G60 PolarHBondContact O-N 2.9Å
59	G	56.3	Low	65.2	Low	43 Å²	43	75.4 Å²	75.4	44%	0.443	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-77.6	-4.2	-175.6	0	0	0	0	0	115.9	Q57	Q57-G59 PolarHBondContact O-N 3.43Å; Q57-G59 VanDerWaalsContact O-N 3.14Å
60	G	48.2	Very low	63.2	Low	82 Å²	82	77.2 Å²	77.2	85%	0.845	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-99.4	3.1	-170.8	0	0	0	0	0	117	G58	G58-G60 VanDerWaalsContact C-N 3.29Å; G58-G60 PolarHBondContact O-N 2.9Å
61	G	39.4	Very low	61.3	Low	65 Å²	65	75.6 Å²	75.6	67%	0.67	57%	0.572	S	S	*	*			trans	-118	117.1	-172.6	0	0	0	0	0	114.4	G63	G61-G63 PolarHBondContact O-N 2.75Å
62	T	48	Very low	59.7	Low	154 Å²	154	78.6 Å²	78.6	95%	0.945	59%	0.591	S	S	*	*			trans	-75.4	106.8	157.1	47.7	0	0	0	0	108.9
63	G	39.1	Very low	58.5	Low	72 Å²	72	84.6 Å²	84.6	74%	0.742	62%	0.617	S	S	*	*			trans	-173.2	143.2	179.1	0	0	0	0	0	112.5	G61	G61-G63 PolarHBondContact O-N 2.75Å
64	A	48	Very low	58.1	Low	116 Å²	116	86.3 Å²	86.3	96%	0.959	64%	0.635	S	S	*	*			trans	-76.4	143.7	178.5	0	0	0	0	0	111.6
65	G	37.5	Very low	57.9	Low	80 Å²	80	90.1 Å²	90.1	83%	0.825	65%	0.65	S	S	*	*			trans	-164.9	113.9	174.4	0	0	0	0	0	110.6
66	S	45.9	Very low	57.9	Low	132 Å²	132	91.2 Å²	91.2	92%	0.923	65%	0.653	S	S	*	*			trans	-79.5	144.6	-176	42.7	0	0	0	0	112.4
67	G	39.7	Very low	57.9	Low	58 Å²	58	92.7 Å²	92.7	60%	0.598	66%	0.659	S	S	*	*			trans	-177.8	118.6	176.8	0	0	0	0	0	113.1	A69	G67-A69 PolarHBondContact O-N 2.97Å
68	P	43.3	Very low	58.2	Low	144 Å²	144	94.3 Å²	94.3	94%	0.935	66%	0.664	S	S	*	*	S	Bend	trans	-80.5	77.4	-170.5	32.4	-36.1	0	0	0	112.9
69	A	44.5	Very low	59.2	Low	48 Å²	48	95.2 Å²	95.2	40%	0.397	65%	0.648	S	S	.	*			trans	-157.7	37.5	174.1	0	0	0	0	0	113.5	G67 K73	G67-A69 PolarHBondContact O-N 2.97Å; A69-K73 HydrophobicContact CB-CD 4.25Å; A69-K73 WeakPolarHBondContact O-CD 3.46Å; A69-K73 WeakPolarHBondContact O-CG 3.23Å
70	A	51	Low	60.9	Low	81 Å²	81	93.2 Å²	93.2	67%	0.669	63%	0.627	S	S	*	*	H	α-helix	trans	-72.2	-42.9	-163.6	0	0	0	0	0	115.4	E72 K73 G74	A70-E72 PolarHBondContact O-N 3.27Å; A70-K73 PolarHBondContact O-N 2.66Å; A70-G74 PolarHBondContact O-N 3.09Å
71	G	51.5	Low	62.9	Low	61 Å²	61	96.2 Å²	96.2	63%	0.629	61%	0.613	S	S	*	*	H	α-helix	trans	-60.4	-48.6	-163.1	0	0	0	0	0	115.6
72	E	58.3	Low	65.3	Low	174 Å²	174	96.8 Å²	96.8	81%	0.813	61%	0.606	S	S	*	*	H	α-helix	trans	-80.4	-34.7	-178.2	-161.6	176.1	-152.2	0	0	112.3	A70 G74 K75 F76	A70-E72 PolarHBondContact O-N 3.27Å; E72-G74 VanDerWaalsContact C-N 3.3Å; E72-G74 PolarHBondContact O-N 3.17Å; E72-K75 PolarHBondContact O-N 2.97Å; E72-F76 PolarHBondContact O-N 3.18Å; E72-F76 VanDerWaalsContact O-N 3.16Å
73	K	66.8	Low	67.3	Low	127 Å²	127	94.1 Å²	94.1	55%	0.552	58%	0.582	S	S	*	*	H	α-helix	trans	-59.7	-40.3	175	-68.3	-176	-176.7	-179.3	0	111.5	A69 A70 F76 Q77	A69-K73 HydrophobicContact CB-CD 4.25Å; A69-K73 WeakPolarHBondContact O-CD 3.46Å; A69-K73 WeakPolarHBondContact O-CG 3.23Å; A70-K73 PolarHBondContact O-N 2.66Å; K73-F76 PolarHBondContact O-N 3.31Å; K73-Q77 WeakPolarHBondContact O-CB 3.44Å; K73-Q77 WeakPolarHBondContact O-CG 3.3Å; K73-Q77 PolarHBondContact O-N 2.83Å
74	G	80.8	Confident	69.7	Low	38 Å²	38	92 Å²	92	39%	0.392	56%	0.559	S	S	.	*	H	α-helix	trans	-58.4	-49.5	176.6	0	0	0	0	0	113.1	A70 E72 F76 Q77 F78	A70-G74 PolarHBondContact O-N 3.09Å; E72-G74 VanDerWaalsContact C-N 3.3Å; E72-G74 PolarHBondContact O-N 3.17Å; G74-F76 VanDerWaalsContact C-N 3.35Å; G74-F76 PolarHBondContact O-N 2.86Å; G74-Q77 PolarHBondContact O-N 3.2Å; G74-F78 WeakPolarHBondContact O-CB 3.28Å; G74-F78 PolarHBondContact O-N 2.95Å
75	K	86	Confident	71.9	Confident	172 Å²	172	86.9 Å²	86.9	75%	0.748	52%	0.515	S	S	*	.	H	α-helix	trans	-61.8	-40.2	178.6	-67.5	-178	178.8	-178.5	0	112.1	E72 W79	E72-K75 PolarHBondContact O-N 2.97Å; K75-W79 PolarHBondContact O-N 3.2Å
76	F	88.4	Confident	74.4	Confident	47 Å²	47	90.3 Å²	90.3	21%	0.206	50%	0.504	C	S	.	.	H	α-helix	trans	-67.3	-45.8	175.3	-177.7	-101.6	0	0	0	112.7	K48 R51 I52 V55 E72 K73 G74 F78 W79 V80	K48-F76 HydrophobicContact CG-CE2 4.31Å; R51-F76 HydrophobicContact CB-CE1 3.77Å; R51-F76 HydrophobicContact CB-CZ 3.83Å; I52-F76 HydrophobicContact CG1-CZ 3.9Å; V55-F76 HydrophobicContact CG2-CD1 4.21Å; V55-F76 HydrophobicContact CG2-CE1 4.08Å; E72-F76 PolarHBondContact O-N 3.18Å; E72-F76 VanDerWaalsContact O-N 3.16Å; K73-F76 PolarHBondContact O-N 3.31Å; G74-F76 VanDerWaalsContact C-N 3.35Å; G74-F76 PolarHBondContact O-N 2.86Å; F76-F78 VanDerWaalsContact C-N 3.33Å; F76-F78 PolarHBondContact O-N 3.45Å; F76-W79 HydrophobicContact CD2-CE3 4.44Å; F76-W79 HydrophobicContact CE2-CE3 4.22Å; F76-W79 HydrophobicContact CE2-CZ3 4.24Å; F76-W79 PolarHBondContact O-N 3.14Å; F76-V80 HydrophobicContact CD1-CG2 4.27Å; F76-V80 HydrophobicContact CE1-CG2 3.9Å; F76-V80 HydrophobicContact CZ-CG2 4.05Å; F76-V80 WeakPolarHBondContact O-CG2 3.4Å; F76-V80 PolarHBondContact O-N 3.29Å
77	Q	88.9	Confident	76.4	Confident	73 Å²	73	86.7 Å²	86.7	34%	0.341	47%	0.474	S	S	.	.	H	α-helix	trans	-62.6	-38.8	176.7	-73.4	-172.2	19.4	0	0	112.5	V55 K73 G74 V80 R81	V55-Q77 HydrophobicContact CG1-CB 4.37Å; V55-Q77 HydrophobicContact CG1-CG 3.9Å; V55-Q77 HydrophobicContact CG2-CG 3.85Å; K73-Q77 WeakPolarHBondContact O-CB 3.44Å; K73-Q77 WeakPolarHBondContact O-CG 3.3Å; K73-Q77 PolarHBondContact O-N 2.83Å; G74-Q77 PolarHBondContact O-N 3.2Å; Q77-V80 PolarHBondContact O-N 3.45Å; Q77-R81 PolarHBondContact O-N 2.97Å; Q77-R81 VanDerWaalsContact OE1-NH1 3.14Å
78	F	90.2	Very high	78.3	Confident	150 Å²	150	85.1 Å²	85.1	66%	0.658	46%	0.457	S	S	*	.	H	α-helix	trans	-61.8	-45.1	173.3	-179	-94.7	0	0	0	111.1	G74 F76 V80 R81 S82	G74-F78 WeakPolarHBondContact O-CB 3.28Å; G74-F78 PolarHBondContact O-N 2.95Å; F76-F78 VanDerWaalsContact C-N 3.33Å; F76-F78 PolarHBondContact O-N 3.45Å; F78-V80 PolarHBondContact O-N 3.31Å; F78-R81 PolarHBondContact O-N 2.91Å; F78-S82 WeakPolarHBondContact O-CB 3.27Å; F78-S82 PolarHBondContact O-N 3.22Å
79	W	91.7	Very high	79.1	Confident	83 Å²	83	83.7 Å²	83.7	31%	0.314	45%	0.451	S	S	.	.	H	α-helix	trans	-60.3	-42	174.6	177.6	86.1	0	0	0	112.5	I52 K75 F76 S82 K83 F85	I52-W79 HydrophobicContact CD1-CH2 4.32Å; I52-W79 HydrophobicContact CD1-CZ3 3.97Å; I52-W79 HydrophobicContact CG1-CZ3 4.21Å; K75-W79 PolarHBondContact O-N 3.2Å; F76-W79 HydrophobicContact CD2-CE3 4.44Å; F76-W79 HydrophobicContact CE2-CE3 4.22Å; F76-W79 HydrophobicContact CE2-CZ3 4.24Å; F76-W79 PolarHBondContact O-N 3.14Å; W79-S82 PolarHBondContact O-N 3.3Å; W79-K83 HydrophobicContact CD2-CG 4.38Å; W79-K83 HydrophobicContact CZ2-CG 4.4Å; W79-K83 WeakPolarHBondContact O-CB 3.48Å; W79-K83 WeakPolarHBondContact O-CG 3.47Å; W79-K83 PolarHBondContact O-N 2.97Å; W79-F85 HydrophobicContact CE3-CE2 4.07Å; W79-F85 AromaticContact CH2-CE2 3.67Å; W79-F85 HydrophobicContact CH2-CE2 3.67Å; W79-F85 AromaticContact CH2-CZ 3.59Å; W79-F85 HydrophobicContact CH2-CZ 3.59Å; W79-F85 HydrophobicContact CZ2-CE2 4.24Å; W79-F85 HydrophobicContact CZ2-CZ 4.22Å; W79-F85 AromaticContact CZ3-CE2 3.58Å; W79-F85 HydrophobicContact CZ3-CE2 3.58Å; W79-F85 AromaticContact CZ3-CZ 3.92Å; W79-F85 HydrophobicContact CZ3-CZ 3.92Å
80	V	92.4	Very high	79.3	Confident	0 Å²	0	84.3 Å²	84.3	0%	0	46%	0.461	C	S	.	.	H	α-helix	trans	-62.1	-47.2	176.4	172.7	0	0	0	0	111.5	I52 V55 L56 F76 Q77 F78 G84 F85	I52-V80 HydrophobicContact CG1-CG2 4.05Å; I52-V80 HydrophobicContact CG2-CG1 4.15Å; I52-V80 HydrophobicContact CG2-CG2 4.42Å; V55-V80 HydrophobicContact CB-CG1 4.46Å; V55-V80 HydrophobicContact CG1-CB 4.03Å; V55-V80 HydrophobicContact CG1-CG1 3.8Å; V55-V80 HydrophobicContact CG1-CG2 4.39Å; L56-V80 HydrophobicContact CD2-CG1 3.92Å; L56-V80 HydrophobicContact CG-CG1 4.09Å; F76-V80 HydrophobicContact CD1-CG2 4.27Å; F76-V80 HydrophobicContact CE1-CG2 3.9Å; F76-V80 HydrophobicContact CZ-CG2 4.05Å; F76-V80 WeakPolarHBondContact O-CG2 3.4Å; F76-V80 PolarHBondContact O-N 3.29Å; Q77-V80 PolarHBondContact O-N 3.45Å; F78-V80 PolarHBondContact O-N 3.31Å; V80-G84 PolarHBondContact O-N 2.84Å; V80-F85 HydrophobicContact CB-CD2 4.37Å; V80-F85 HydrophobicContact CG1-CB 4.36Å; V80-F85 HydrophobicContact CG1-CD2 4.06Å; V80-F85 WeakPolarHBondContact O-CD2 3.4Å; V80-F85 PolarHBondContact O-N 3.17Å
81	R	88.6	Confident	79	Confident	145 Å²	145	92.2 Å²	92.2	55%	0.547	47%	0.474	S	S	.	.	H	α-helix	trans	-66.3	-43.4	177.4	-72.5	-179.6	169.3	109.1	-3.4	112	Q77 F78 K83 G84	Q77-R81 PolarHBondContact O-N 2.97Å; Q77-R81 VanDerWaalsContact OE1-NH1 3.14Å; F78-R81 PolarHBondContact O-N 2.91Å; R81-K83 VanDerWaalsContact C-N 3.35Å; R81-K83 PolarHBondContact O-N 3.4Å; R81-G84 WeakPolarHBondContact O-CA 3.42Å; R81-G84 PolarHBondContact O-N 3.11Å
82	S	91.1	Very high	78.5	Confident	77 Å²	77	94.3 Å²	94.3	54%	0.538	47%	0.467	S	S	.	.	H	α-helix	trans	-63.3	-34.6	178.2	174.5	0	0	0	0	113.3	F78 W79 G84	F78-S82 WeakPolarHBondContact O-CB 3.27Å; F78-S82 PolarHBondContact O-N 3.22Å; W79-S82 PolarHBondContact O-N 3.3Å; S82-G84 PolarHBondContact O-N 3.24Å
83	K	89.8	Confident	77.9	Confident	99 Å²	99	92.1 Å²	92.1	43%	0.43	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.3	171.3	-65.4	-57.2	174.7	-158	0	113.8	W79 R81 F85 V101 P102	W79-K83 HydrophobicContact CD2-CG 4.38Å; W79-K83 HydrophobicContact CZ2-CG 4.4Å; W79-K83 WeakPolarHBondContact O-CB 3.48Å; W79-K83 WeakPolarHBondContact O-CG 3.47Å; W79-K83 PolarHBondContact O-N 2.97Å; R81-K83 VanDerWaalsContact C-N 3.35Å; R81-K83 PolarHBondContact O-N 3.4Å; K83-F85 HydrophobicContact CB-CD2 3.7Å; K83-F85 HydrophobicContact CB-CE2 3.47Å; K83-F85 VanDerWaalsContact CB-CE2 3.47Å; K83-F85 HydrophobicContact CB-CZ 4.21Å; K83-F85 HydrophobicContact CG-CE2 4.07Å; K83-F85 PolarHBondContact O-N 2.69Å; K83-V101 WeakPolarHBondContact O-CG2 3.44Å; K83-P102 WeakPolarHBondContact O-CD 3.3Å; K83-P102 WeakPolarHBondContact O-CG 3.02Å
84	G	90.3	Very high	76.9	Confident	26 Å²	26	94.8 Å²	94.8	27%	0.268	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	29.8	174.9	0	0	0	0	0	113.7	V80 R81 S82 P102	V80-G84 PolarHBondContact O-N 2.84Å; R81-G84 WeakPolarHBondContact O-CA 3.42Å; R81-G84 PolarHBondContact O-N 3.11Å; S82-G84 PolarHBondContact O-N 3.24Å; G84-P102 WeakPolarHBondContact O-CD 3.31Å
85	F	92.8	Very high	75.4	Confident	9 Å²	9	100.5 Å²	100.5	4%	0.039	50%	0.498	C	S	.	.			trans	-56.5	144.8	178.6	-69.1	-84.3	0	0	0	110.8	I52 L56 W79 V80 K83 V99 Y100 V101 V123 F166	I52-F85 HydrophobicContact CD1-CE1 4.32Å; I52-F85 HydrophobicContact CD1-CE2 4.42Å; I52-F85 HydrophobicContact CD1-CZ 4.1Å; I52-F85 HydrophobicContact CG2-CB 4.12Å; I52-F85 HydrophobicContact CG2-CD1 4.27Å; I52-F85 HydrophobicContact CG2-CD2 4.22Å; I52-F85 HydrophobicContact CG2-CG 3.99Å; L56-F85 HydrophobicContact CD1-CB 3.8Å; L56-F85 HydrophobicContact CD2-CB 4.45Å; L56-F85 VanDerWaalsContact CD2-O 3.32Å; L56-F85 WeakPolarHBondContact CD2-O 3.43Å; W79-F85 HydrophobicContact CE3-CE2 4.07Å; W79-F85 AromaticContact CH2-CE2 3.67Å; W79-F85 HydrophobicContact CH2-CE2 3.67Å; W79-F85 AromaticContact CH2-CZ 3.59Å; W79-F85 HydrophobicContact CH2-CZ 3.59Å; W79-F85 HydrophobicContact CZ2-CE2 4.24Å; W79-F85 HydrophobicContact CZ2-CZ 4.22Å; W79-F85 AromaticContact CZ3-CE2 3.58Å; W79-F85 HydrophobicContact CZ3-CE2 3.58Å; W79-F85 AromaticContact CZ3-CZ 3.92Å; W79-F85 HydrophobicContact CZ3-CZ 3.92Å; V80-F85 HydrophobicContact CB-CD2 4.37Å; V80-F85 HydrophobicContact CG1-CB 4.36Å; V80-F85 HydrophobicContact CG1-CD2 4.06Å; V80-F85 WeakPolarHBondContact O-CD2 3.4Å; V80-F85 PolarHBondContact O-N 3.17Å; K83-F85 HydrophobicContact CB-CD2 3.7Å; K83-F85 HydrophobicContact CB-CE2 3.47Å; K83-F85 VanDerWaalsContact CB-CE2 3.47Å; K83-F85 HydrophobicContact CB-CZ 4.21Å; K83-F85 HydrophobicContact CG-CE2 4.07Å; K83-F85 PolarHBondContact O-N 2.69Å; F85-V99 HydrophobicContact CB-CG1 4.24Å; F85-V99 HydrophobicContact CD1-CG1 3.8Å; F85-V99 HydrophobicContact CG-CG1 4.39Å; F85-Y100 CarbonylContact C-O 3.59Å; F85-Y100 VanDerWaalsContact CA-O 3.28Å; F85-Y100 WeakPolarHBondContact CA-O 3.43Å; F85-V101 HydrophobicContact CD1-CB 3.87Å; F85-V101 HydrophobicContact CD1-CG2 4.01Å; F85-V101 HydrophobicContact CE1-CB 3.99Å; F85-V101 HydrophobicContact CE1-CG2 4.01Å; F85-V123 HydrophobicContact CD1-CG2 3.83Å; F85-V123 HydrophobicContact CE1-CG2 3.61Å; F85-F166 AromaticContact CE1-CE2 3.6Å; F85-F166 HydrophobicContact CE1-CE2 3.6Å; F85-F166 HydrophobicContact CE1-CZ 4.09Å; F85-F166 AromaticContact CZ-CE2 3.83Å; F85-F166 HydrophobicContact CZ-CE2 3.83Å; F85-F166 AromaticContact CZ-CZ 3.85Å; F85-F166 HydrophobicContact CZ-CZ 3.85Å
86	R	90.3	Very high	74	Confident	153 Å²	153	95.4 Å²	95.4	58%	0.577	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	147.8	-179.7	-61.7	-175	-178.5	-174.3	-1.6	110.6	Y100	R86-Y100 PolarHBondContact N-O 3.31Å; R86-Y100 PolarHBondContact O-N 3.28Å
87	L	89.4	Confident	73.4	Confident	56 Å²	56	96.5 Å²	96.5	29%	0.293	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	128.6	168.6	-57	-179.8	0	0	0	109	L56 Q57 Q97 V99	L56-L87 HydrophobicContact CB-CD1 3.7Å; L56-L87 HydrophobicContact CB-CD2 3.78Å; L56-L87 HydrophobicContact CB-CG 3.6Å; L56-L87 HydrophobicContact CD1-CD2 3.58Å; L56-L87 HydrophobicContact CD1-CG 4.01Å; L56-L87 HydrophobicContact CG-CD2 4.34Å; L56-L87 HydrophobicContact CG-CG 4.44Å; Q57-L87 HydrophobicContact CG-CD1 3.99Å; L87-Q97 HydrophobicContact CB-CG 4.45Å; L87-Q97 HydrophobicContact CD1-CG 4.42Å; L87-Q97 HydrophobicContact CD2-CG 3.94Å; L87-Q97 VanDerWaalsContact CD2-NE2 3.28Å; L87-Q97 HydrophobicContact CG-CG 4.48Å; L87-V99 HydrophobicContact CD2-CG2 4.01Å
88	G	77.6	Confident	73.3	Confident	24 Å²	24	95 Å²	95	25%	0.247	50%	0.495	C	S	.	.			trans	-74	125	168.7	0	0	0	0	0	109.9	G90 V98	G88-G90 VanDerWaalsContact C-N 3.32Å; G88-G90 PolarHBondContact O-N 2.93Å; G88-V98 PolarHBondContact N-O 2.99Å
89	S	61.1	Low	73.4	Confident	115 Å²	115	87.8 Å²	87.8	80%	0.804	46%	0.464	S	S	*	.			trans	-71.3	90.8	168.7	-174.5	0	0	0	0	109.2	R91	S89-R91 PolarHBondContact O-N 2.91Å
90	G	49.2	Very low	73.5	Confident	60 Å²	60	87 Å²	87	62%	0.619	46%	0.461	S	S	*	.			trans	-68.5	114.1	177.5	0	0	0	0	0	110.6	G88 E92	G88-G90 VanDerWaalsContact C-N 3.32Å; G88-G90 PolarHBondContact O-N 2.93Å; G90-E92 PolarHBondContact O-N 2.94Å
91	R	43.3	Very low	73.5	Confident	247 Å²	247	87.3 Å²	87.3	93%	0.932	46%	0.463	S	S	*	.	S	Bend	trans	-79.1	14.9	177	-58.2	-172.7	-176	-171.1	2.1	113.6	S89	S89-R91 PolarHBondContact O-N 2.91Å
92	E	41.7	Very low	73.6	Confident	106 Å²	106	82.3 Å²	82.3	50%	0.495	45%	0.45	S	S	.	.	S	Bend	trans	-137.6	115.4	-176.5	-121.3	-59.1	139.4	0	0	108.3	G90 K94	G90-E92 PolarHBondContact O-N 2.94Å; E92-K94 PolarHBondContact O-N 2.81Å
93	P	46.5	Very low	73.3	Confident	128 Å²	128	80.9 Å²	80.9	83%	0.831	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	2.4	-170.4	29.8	-36.4	0	0	0	114.5
94	K	45.7	Very low	72.7	Confident	183 Å²	183	85.4 Å²	85.4	80%	0.796	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-18.1	-178	-69	172	-179.7	167.3	0	114.8	E92	E92-K94 PolarHBondContact O-N 2.81Å
95	M	48.3	Very low	71.3	Confident	158 Å²	158	86.8 Å²	86.8	78%	0.778	46%	0.461	S	S	*	.	S	Bend	trans	-100	119.2	172.6	-71.7	-165	176.6	0	0	109.9
96	G	57.4	Low	69.3	Low	64 Å²	64	90.6 Å²	90.6	66%	0.66	50%	0.502	S	S	*	.			trans	-59.4	159.5	179.8	0	0	0	0	0	113	V98	G96-V98 WeakPolarHBondContact O-CG2 3.27Å; G96-V98 PolarHBondContact O-N 3.4Å; G96-V98 VanDerWaalsContact O-N 3.08Å
97	Q	74.4	Confident	67.2	Low	70 Å²	70	88.3 Å²	88.3	33%	0.327	51%	0.51	S	S	.	.			trans	-49.4	112.8	-171	-172.9	175.9	-82.5	0	0	113.3	Y49 A53 Q57 L87	Y49-Q97 PolarHBondContact OH-O 2.92Å; A53-Q97 VanDerWaalsContact CB-NE2 3.34Å; Q57-Q97 VanDerWaalsContact NE2-CD 3.34Å; L87-Q97 HydrophobicContact CB-CG 4.45Å; L87-Q97 HydrophobicContact CD1-CG 4.42Å; L87-Q97 HydrophobicContact CD2-CG 3.94Å; L87-Q97 VanDerWaalsContact CD2-NE2 3.28Å; L87-Q97 HydrophobicContact CG-CG 4.48Å
98	V	87.1	Confident	64.8	Low	41 Å²	41	89.2 Å²	89.2	25%	0.248	53%	0.533	C	S	.	.			trans	-87.5	123	-176.5	-173.8	0	0	0	0	110.5	Y49 G88 G96 Y100 R122	Y49-V98 VanDerWaalsContact OH-CA 3.28Å; Y49-V98 WeakPolarHBondContact OH-CA 3.37Å; G88-V98 PolarHBondContact N-O 2.99Å; G96-V98 WeakPolarHBondContact O-CG2 3.27Å; G96-V98 PolarHBondContact O-N 3.4Å; G96-V98 VanDerWaalsContact O-N 3.08Å; V98-Y100 HydrophobicContact CB-CD2 4.47Å; V98-Y100 HydrophobicContact CB-CE2 3.75Å; V98-Y100 HydrophobicContact CG1-CD2 4.03Å; V98-Y100 HydrophobicContact CG1-CE2 3.38Å; V98-R122 HydrophobicContact CG1-CG 4.05Å
99	V	92.3	Very high	63	Low	0 Å²	0	92.2 Å²	92.2	0%	0	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.3	131.8	174.7	-175.8	0	0	0	0	109.9	Y49 I52 A53 L56 F85 L87 V123	Y49-V99 HydrophobicContact CD1-CG2 4.5Å; Y49-V99 HydrophobicContact CD2-CB 4.44Å; Y49-V99 HydrophobicContact CD2-CG2 4.39Å; Y49-V99 HydrophobicContact CE1-CG2 3.95Å; Y49-V99 HydrophobicContact CE2-CB 3.77Å; Y49-V99 HydrophobicContact CE2-CG2 3.86Å; Y49-V99 PolarHBondContact OH-N 2.98Å; I52-V99 HydrophobicContact CG2-CG1 3.81Å; A53-V99 HydrophobicContact CB-CG2 4.31Å; L56-V99 HydrophobicContact CD1-CG1 4.31Å; F85-V99 HydrophobicContact CB-CG1 4.24Å; F85-V99 HydrophobicContact CD1-CG1 3.8Å; F85-V99 HydrophobicContact CG-CG1 4.39Å; L87-V99 HydrophobicContact CD2-CG2 4.01Å; V99-V123 HydrophobicContact CB-CB 4.37Å; V99-V123 HydrophobicContact CB-CG2 4.17Å; V99-V123 HydrophobicContact CG1-CB 4.47Å; V99-V123 HydrophobicContact CG1-CG2 3.79Å; V99-V123 PolarHBondContact O-N 3.07Å
100	Y	93.5	Very high	62	Low	66 Å²	66	94.7 Å²	94.7	26%	0.259	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.4	155.3	176.4	-68.2	-102.5	0	0	0	110.7	F85 R86 V98 L120 K121 R122	F85-Y100 CarbonylContact C-O 3.59Å; F85-Y100 VanDerWaalsContact CA-O 3.28Å; F85-Y100 WeakPolarHBondContact CA-O 3.43Å; R86-Y100 PolarHBondContact N-O 3.31Å; R86-Y100 PolarHBondContact O-N 3.28Å; V98-Y100 HydrophobicContact CB-CD2 4.47Å; V98-Y100 HydrophobicContact CB-CE2 3.75Å; V98-Y100 HydrophobicContact CG1-CD2 4.03Å; V98-Y100 HydrophobicContact CG1-CE2 3.38Å; Y100-L120 HydrophobicContact CD1-CB 4.18Å; Y100-K121 CarbonylContact C-O 3.54Å; Y100-K121 VanDerWaalsContact CA-O 3.29Å; Y100-K121 WeakPolarHBondContact CA-O 3.26Å; Y100-R122 HydrophobicContact CD1-CG 4.12Å; Y100-R122 HydrophobicContact CE1-CG 3.59Å
101	V	93.4	Very high	61.8	Low	7 Å²	7	95.4 Å²	95.4	4%	0.042	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.1	138.2	171.4	71.9	0	0	0	0	110.1	K83 F85 V103 K121 V123 A165 F166	K83-V101 WeakPolarHBondContact O-CG2 3.44Å; F85-V101 HydrophobicContact CD1-CB 3.87Å; F85-V101 HydrophobicContact CD1-CG2 4.01Å; F85-V101 HydrophobicContact CE1-CB 3.99Å; F85-V101 HydrophobicContact CE1-CG2 4.01Å; V101-V103 HydrophobicContact CG1-CG2 4.07Å; V101-K121 PolarHBondContact N-O 2.85Å; V101-K121 PolarHBondContact O-N 3.38Å; V101-V123 HydrophobicContact CB-CG2 4.42Å; V101-A165 HydrophobicContact CG1-CB 3.34Å; V101-F166 HydrophobicContact CB-CE2 4.12Å; V101-F166 HydrophobicContact CG1-CD2 4.49Å; V101-F166 HydrophobicContact CG1-CE2 3.82Å; V101-F166 HydrophobicContact CG2-CE2 4.16Å; V101-F166 HydrophobicContact CG2-CZ 4.35Å
102	P	90.6	Very high	61.8	Low	40 Å²	40	92 Å²	92	26%	0.26	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.1	135.7	170.8	27.3	-34.7	0	0	0	111	K83 G84 I118 L120	K83-P102 WeakPolarHBondContact O-CD 3.3Å; K83-P102 WeakPolarHBondContact O-CG 3.02Å; G84-P102 WeakPolarHBondContact O-CD 3.31Å; P102-I118 HydrophobicContact CB-CG2 3.45Å; P102-I118 VanDerWaalsContact CB-CG2 3.45Å; P102-L120 HydrophobicContact CB-CD2 4.26Å
103	V	85.7	Confident	61.6	Low	47 Å²	47	92.3 Å²	92.3	29%	0.285	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.6	113.4	177.3	-178	0	0	0	0	107.9	V101 T105 S119 K121	V101-V103 HydrophobicContact CG1-CG2 4.07Å; V103-T105 PolarHBondContact O-N 2.99Å; V103-S119 PolarHBondContact N-O 2.96Å; V103-S119 PolarHBondContact O-N 3.28Å; V103-S119 PolarHBondContact O-OG 3.22Å; V103-K121 HydrophobicContact CB-CD 4.23Å; V103-K121 HydrophobicContact CB-CG 4.37Å; V103-K121 HydrophobicContact CG1-CD 4.47Å; V103-K121 HydrophobicContact CG2-CB 4.21Å; V103-K121 HydrophobicContact CG2-CD 3.98Å; V103-K121 HydrophobicContact CG2-CG 4.02Å
104	K	77.1	Confident	61.5	Low	194 Å²	194	94 Å²	94	84%	0.843	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-63.5	106.3	176.3	-173.3	171.9	-176.9	175.2	0	109.2
105	T	59.7	Low	61.6	Low	55 Å²	55	90 Å²	90	34%	0.337	57%	0.569	S	S	.	*			trans	-75.9	129.2	172.8	20.5	0	0	0	0	109	V103 S107 G117	V103-T105 PolarHBondContact O-N 2.99Å; T105-S107 PolarHBondContact O-N 2.81Å; T105-G117 PolarHBondContact OG1-O 2.79Å; T105-G117 VanDerWaalsContact OG1-O 3.08Å
106	G	51.6	Low	61.7	Low	88 Å²	88	91 Å²	91	91%	0.907	57%	0.572	S	S	*	*	S	Bend	trans	-74.9	33.4	-179.5	0	0	0	0	0	114.4
107	S	46.7	Very low	61.5	Low	106 Å²	106	89.8 Å²	89.8	74%	0.741	56%	0.559	S	S	*	*			trans	-113.3	98.4	179.1	-61.6	0	0	0	0	106.9	T105	T105-S107 PolarHBondContact O-N 2.81Å
108	G	37.3	Very low	61.2	Low	75 Å²	75	91.3 Å²	91.3	77%	0.773	57%	0.568	S	S	*	*			trans	174.2	45.1	-168.5	0	0	0	0	0	111.7
109	A	41	Very low	61	Low	87 Å²	87	91 Å²	91	72%	0.719	57%	0.568	S	S	*	*			trans	-78.8	159.6	143.8	0	0	0	0	0	107.2
110	D	40.3	Very low	60.8	Low	167 Å²	167	95 Å²	95	89%	0.893	59%	0.589	S	S	*	*	S	Bend	trans	64.7	118.3	-170.1	-50.1	-33.7	0	0	0	113.3
111	G	44.7	Very low	60.8	Low	75 Å²	75	93.3 Å²	93.3	77%	0.773	58%	0.583	S	S	*	*			trans	-101	-174.6	-176	0	0	0	0	0	113.8
112	L	41.8	Very low	60.9	Low	176 Å²	176	96.9 Å²	96.9	92%	0.921	60%	0.596	S	S	*	*			trans	81.7	51.5	170.2	-152.4	79.8	0	0	0	117.8
113	S	38.9	Very low	61.1	Low	111 Å²	111	95.3 Å²	95.3	78%	0.776	59%	0.586	S	S	*	*	S	Bend	trans	-175.3	130.2	133.9	26.5	0	0	0	0	113
114	E	43.6	Very low	61.6	Low	165 Å²	165	93.1 Å²	93.1	77%	0.771	57%	0.572	S	S	*	*			trans	53.4	161.2	166.3	-77.9	-61.1	91.5	0	0	119.8	E116	E114-E116 PolarHBondContact O-N 2.97Å
115	P	49.1	Very low	62.5	Low	97 Å²	97	84.3 Å²	84.3	63%	0.63	53%	0.534	S	S	*	.	S	Bend	trans	-82.7	44	-173.6	34.6	-36.4	0	0	0	113.5	G117	P115-G117 VanDerWaalsContact C-N 3.26Å; P115-G117 PolarHBondContact O-N 2.9Å
116	E	48.7	Very low	64.2	Low	181 Å²	181	81.7 Å²	81.7	85%	0.846	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-0.7	-167.6	-158.1	138	-140	0	0	114.4	E114 I118	E114-E116 PolarHBondContact O-N 2.97Å; E116-I118 VanDerWaalsContact C-N 3.34Å; E116-I118 PolarHBondContact O-N 3.31Å
117	G	54.8	Low	66.3	Low	38 Å²	38	79.1 Å²	79.1	39%	0.392	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	13	-177.9	0	0	0	0	0	117.4	T105 P115	T105-G117 PolarHBondContact OG1-O 2.79Å; T105-G117 VanDerWaalsContact OG1-O 3.08Å; P115-G117 VanDerWaalsContact C-N 3.26Å; P115-G117 PolarHBondContact O-N 2.9Å
118	I	66.7	Low	68.6	Low	101 Å²	101	76.4 Å²	76.4	52%	0.518	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	88.4	-172.9	-50.4	179.8	0	0	0	111.7	P102 E116	P102-I118 HydrophobicContact CB-CG2 3.45Å; P102-I118 VanDerWaalsContact CB-CG2 3.45Å; E116-I118 VanDerWaalsContact C-N 3.34Å; E116-I118 PolarHBondContact O-N 3.31Å
119	S	82.9	Confident	71.4	Confident	34 Å²	34	72.8 Å²	72.8	24%	0.238	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	136.9	172.2	73.9	0	0	0	0	112	V103	V103-S119 PolarHBondContact N-O 2.96Å; V103-S119 PolarHBondContact O-N 3.28Å; V103-S119 PolarHBondContact O-OG 3.22Å
120	L	89.7	Confident	73.9	Confident	84 Å²	84	68.9 Å²	68.9	44%	0.44	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	123.8	172.1	-74	170.4	0	0	0	110	Y100 P102	Y100-L120 HydrophobicContact CD1-CB 4.18Å; P102-L120 HydrophobicContact CB-CD2 4.26Å
121	K	93.4	Very high	76.4	Confident	31 Å²	31	63.5 Å²	63.5	14%	0.135	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	145	179.3	-59.9	-167.8	-177.5	-178.7	0	111.3	Y100 V101 V103 A161 E162 A165	Y100-K121 CarbonylContact C-O 3.54Å; Y100-K121 VanDerWaalsContact CA-O 3.29Å; Y100-K121 WeakPolarHBondContact CA-O 3.26Å; V101-K121 PolarHBondContact N-O 2.85Å; V101-K121 PolarHBondContact O-N 3.38Å; V103-K121 HydrophobicContact CB-CD 4.23Å; V103-K121 HydrophobicContact CB-CG 4.37Å; V103-K121 HydrophobicContact CG1-CD 4.47Å; V103-K121 HydrophobicContact CG2-CB 4.21Å; V103-K121 HydrophobicContact CG2-CD 3.98Å; V103-K121 HydrophobicContact CG2-CG 4.02Å; K121-A161 PolarHBondContact NZ-O 3.37Å; K121-E162 VanDerWaalsContact CD-O 3.3Å; K121-E162 WeakPolarHBondContact CD-O 3.43Å; K121-E162 WeakPolarHBondContact CE-O 3.49Å; K121-A165 HydrophobicContact CB-CB 4.08Å
122	R	94.5	Very high	78.8	Confident	82 Å²	82	60.7 Å²	60.7	31%	0.309	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	137.3	177.3	-66.8	-164.6	-64.6	-96.9	12.5	110	V98 Y100 A124 T163 Y164 A165	V98-R122 HydrophobicContact CG1-CG 4.05Å; Y100-R122 HydrophobicContact CD1-CG 4.12Å; Y100-R122 HydrophobicContact CE1-CG 3.59Å; R122-A124 PolarHBondContact O-N 3.15Å; R122-T163 VanDerWaalsContact CZ-CG2 3.42Å; R122-T163 PolarHBondContact N-O 3.28Å; R122-T163 VanDerWaalsContact NH2-CG2 3.27Å; R122-Y164 HydrophobicContact CB-CD1 3.84Å; R122-Y164 HydrophobicContact CB-CE1 3.95Å; R122-Y164 PolarHBondContact NH2-OH 3.06Å; R122-Y164 CarbonylContact O-C 3.57Å; R122-Y164 WeakPolarHBondContact O-CA 3.49Å; R122-A165 PolarHBondContact O-N 3.15Å
123	V	95.3	Very high	81.3	Confident	8 Å²	8	52.3 Å²	52.3	5%	0.048	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	117.5	172.4	176.8	0	0	0	0	108.6	V44 Y49 F85 V99 V101 F166	V44-V123 HydrophobicContact CB-CG1 3.84Å; V44-V123 HydrophobicContact CG1-CG1 3.98Å; V44-V123 HydrophobicContact CG2-CG1 3.74Å; Y49-V123 HydrophobicContact CD2-CB 4.37Å; Y49-V123 HydrophobicContact CD2-CG1 4.05Å; Y49-V123 HydrophobicContact CE2-CB 4.2Å; Y49-V123 HydrophobicContact CE2-CG1 4.38Å; F85-V123 HydrophobicContact CD1-CG2 3.83Å; F85-V123 HydrophobicContact CE1-CG2 3.61Å; V99-V123 HydrophobicContact CB-CB 4.37Å; V99-V123 HydrophobicContact CB-CG2 4.17Å; V99-V123 HydrophobicContact CG1-CB 4.47Å; V99-V123 HydrophobicContact CG1-CG2 3.79Å; V99-V123 PolarHBondContact O-N 3.07Å; V101-V123 HydrophobicContact CB-CG2 4.42Å; V123-F166 HydrophobicContact CG1-CD2 4.1Å; V123-F166 HydrophobicContact CG2-CD2 4.26Å; V123-F166 HydrophobicContact CG2-CE2 4.3Å
124	A	96.1	Very high	83.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-77.4	135.7	172.7	0	0	0	0	0	110.8	R122 F129 I132 Y164 A165 L167	R122-A124 PolarHBondContact O-N 3.15Å; A124-F129 HydrophobicContact CB-CD1 4.14Å; A124-F129 HydrophobicContact CB-CE1 3.74Å; A124-I132 HydrophobicContact CB-CD1 3.93Å; A124-Y164 HydrophobicContact CB-CD1 3.97Å; A124-Y164 HydrophobicContact CB-CG 4.49Å; A124-A165 WeakPolarHBondContact CB-O 3.38Å; A124-A165 PolarHBondContact N-O 3.44Å; A124-L167 HydrophobicContact CB-CB 3.77Å; A124-L167 HydrophobicContact CB-CD1 4Å; A124-L167 HydrophobicContact CB-CG 4.2Å
125	V	95.8	Very high	86	Confident	9 Å²	9	45.9 Å²	45.9	6%	0.055	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-96.4	133.1	178	174.5	0	0	0	0	109.3	V44 R46 Y49 E127 D128 F129	V44-V125 CarbonylContact O-C 3.5Å; V44-V125 VanDerWaalsContact O-CA 3.3Å; V44-V125 WeakPolarHBondContact O-CA 3.35Å; R46-V125 HydrophobicContact CB-CG1 4.06Å; Y49-V125 HydrophobicContact CD2-CG2 3.37Å; Y49-V125 HydrophobicContact CE2-CG2 3.89Å; Y49-V125 HydrophobicContact CG-CG2 3.77Å; V125-E127 VanDerWaalsContact C-N 3.3Å; V125-E127 HydrophobicContact CG1-CB 4.21Å; V125-E127 WeakPolarHBondContact CG1-OE2 3.36Å; V125-E127 PolarHBondContact O-N 3.22Å; V125-D128 HydrophobicContact CB-CB 4.14Å; V125-D128 CarbonylContact O-C 3.58Å; V125-D128 WeakPolarHBondContact O-CA 3.22Å; V125-D128 PolarHBondContact O-N 3.2Å; V125-F129 WeakPolarHBondContact O-CD1 3.21Å; V125-F129 WeakPolarHBondContact O-CE1 3.37Å; V125-F129 PolarHBondContact O-N 2.89Å; V125-F129 VanDerWaalsContact O-N 3.14Å
126	V	96.2	Very high	88	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-55.7	-43.7	-174.1	170.1	0	0	0	0	112.6	C31 T43 V44 T45 D128 F129	C31-V126 HydrophobicContact CB-CG1 4.14Å; C31-V126 WeakPolarHBondContact O-CG1 3.42Å; T43-V126 HydrophobicContact CG2-CG2 4.25Å; V44-V126 WeakPolarHBondContact O-CG2 3.5Å; V44-V126 PolarHBondContact O-N 3.49Å; T45-V126 HydrophobicContact CG2-CG2 4.44Å; V126-D128 PolarHBondContact O-N 3.04Å; V126-F129 HydrophobicContact CB-CE2 4.27Å; V126-F129 HydrophobicContact CB-CZ 4.28Å; V126-F129 HydrophobicContact CG1-CE2 4.41Å; V126-F129 HydrophobicContact CG2-CE1 4.39Å; V126-F129 HydrophobicContact CG2-CE2 3.92Å; V126-F129 HydrophobicContact CG2-CZ 3.73Å; V126-F129 WeakPolarHBondContact O-CB 3.33Å; V126-F129 WeakPolarHBondContact O-CG 3.5Å; V126-F129 PolarHBondContact O-N 3.29Å
127	E	94.6	Very high	90	Very high	34 Å²	34	35.3 Å²	35.3	16%	0.159	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-61	-29.3	178.3	-64.5	86.9	152.4	0	0	112.1	L32 T45 R46 V125	L32-E127 HydrophobicContact CD2-CG 4.04Å; T45-E127 VanDerWaalsContact CA-OE2 3.28Å; T45-E127 WeakPolarHBondContact CA-OE2 3.46Å; R46-E127 HydrophobicContact CB-CG 4.34Å; R46-E127 WeakPolarHBondContact CB-OE1 3.3Å; R46-E127 PolarHBondContact N-OE1 3.31Å; R46-E127 PolarHBondContact N-OE2 2.92Å; V125-E127 VanDerWaalsContact C-N 3.3Å; V125-E127 HydrophobicContact CG1-CB 4.21Å; V125-E127 WeakPolarHBondContact CG1-OE2 3.36Å; V125-E127 PolarHBondContact O-N 3.22Å
128	D	94.8	Very high	91.5	Very high	48 Å²	48	34 Å²	34	26%	0.257	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-102.2	1.1	-172.5	-53.6	0	0	0	0	111.2	R46 V125 V126 F130 D131 I132	R46-D128 IonicContact CZ-OD1 3.7Å; R46-D128 IonicContact NE-OD1 3.58Å; R46-D128 IonicContact NH2-OD1 2.97Å; R46-D128 PolarHBondContact NH2-OD1 2.93Å; R46-D128 IonicContact NH2-OD2 2.65Å; R46-D128 PolarHBondContact NH2-OD2 3.36Å; V125-D128 HydrophobicContact CB-CB 4.14Å; V125-D128 CarbonylContact O-C 3.58Å; V125-D128 WeakPolarHBondContact O-CA 3.22Å; V125-D128 PolarHBondContact O-N 3.2Å; V126-D128 PolarHBondContact O-N 3.04Å; D128-F130 PolarHBondContact O-N 3.5Å; D128-D131 PolarHBondContact O-N 3.11Å; D128-I132 HydrophobicContact CB-CD1 4.07Å; D128-I132 HydrophobicContact CB-CG1 4.48Å; D128-I132 WeakPolarHBondContact O-CB 3.46Å; D128-I132 VanDerWaalsContact O-CG1 3.26Å; D128-I132 WeakPolarHBondContact O-CG1 3.34Å; D128-I132 PolarHBondContact O-N 2.77Å
129	F	96.1	Very high	91.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.1	-35.2	179.4	-75.6	-4.8	0	0	0	112	F27 C31 Y35 T43 A124 V125 V126 I133 L167 P168 A171	F27-F129 HydrophobicContact CE1-CB 4.18Å; C31-F129 HydrophobicContact CB-CD2 4.47Å; Y35-F129 HydrophobicContact CD2-CD2 4.39Å; Y35-F129 AromaticContact CD2-CE2 3.97Å; Y35-F129 HydrophobicContact CD2-CE2 3.97Å; Y35-F129 HydrophobicContact CE2-CE2 4.48Å; T43-F129 HydrophobicContact CG2-CE2 4.39Å; T43-F129 HydrophobicContact CG2-CZ 4.16Å; A124-F129 HydrophobicContact CB-CD1 4.14Å; A124-F129 HydrophobicContact CB-CE1 3.74Å; V125-F129 WeakPolarHBondContact O-CD1 3.21Å; V125-F129 WeakPolarHBondContact O-CE1 3.37Å; V125-F129 PolarHBondContact O-N 2.89Å; V125-F129 VanDerWaalsContact O-N 3.14Å; V126-F129 HydrophobicContact CB-CE2 4.27Å; V126-F129 HydrophobicContact CB-CZ 4.28Å; V126-F129 HydrophobicContact CG1-CE2 4.41Å; V126-F129 HydrophobicContact CG2-CE1 4.39Å; V126-F129 HydrophobicContact CG2-CE2 3.92Å; V126-F129 HydrophobicContact CG2-CZ 3.73Å; V126-F129 WeakPolarHBondContact O-CB 3.33Å; V126-F129 WeakPolarHBondContact O-CG 3.5Å; V126-F129 PolarHBondContact O-N 3.29Å; F129-I133 WeakPolarHBondContact O-CB 3.48Å; F129-I133 VanDerWaalsContact O-CD1 3.26Å; F129-I133 WeakPolarHBondContact O-CD1 3.44Å; F129-I133 WeakPolarHBondContact O-CG1 3.1Å; F129-I133 PolarHBondContact O-N 3.23Å; F129-L167 HydrophobicContact CD1-CD1 4.02Å; F129-L167 HydrophobicContact CD1-CG 3.77Å; F129-L167 HydrophobicContact CE1-CB 4.21Å; F129-L167 HydrophobicContact CE1-CD1 4.46Å; F129-L167 HydrophobicContact CE1-CG 3.86Å; F129-L167 HydrophobicContact CG-CG 4.2Å; F129-L167 HydrophobicContact CZ-CG 4.35Å; F129-P168 HydrophobicContact CE2-CG 4.12Å; F129-P168 VanDerWaalsContact CZ-CD 3.44Å; F129-P168 HydrophobicContact CZ-CG 4.44Å; F129-A171 HydrophobicContact CD2-CB 4.26Å
130	F	94.6	Very high	90.7	Very high	5 Å²	5	37.5 Å²	37.5	2%	0.022	20%	0.196	C	C	.	.	H	α-helix	trans	-61.8	-55.8	176.6	-173.9	-91.7	0	0	0	111.2	P18 L23 F27 D128 I132 I133 Y134 F175	P18-F130 VanDerWaalsContact C-CE1 3.45Å; P18-F130 HydrophobicContact CB-CE1 4.04Å; P18-F130 VanDerWaalsContact O-CE1 3.3Å; P18-F130 WeakPolarHBondContact O-CE1 3.32Å; L23-F130 HydrophobicContact CG-CE2 4.14Å; F27-F130 HydrophobicContact CB-CD2 3.95Å; F27-F130 HydrophobicContact CD1-CB 3.89Å; F27-F130 AromaticContact CD1-CD2 3.79Å; F27-F130 HydrophobicContact CD1-CD2 3.79Å; F27-F130 HydrophobicContact CD1-CG 4.35Å; F27-F130 HydrophobicContact CE1-CB 4.34Å; F27-F130 AromaticContact CG-CD2 4Å; F27-F130 HydrophobicContact CG-CD2 4Å; D128-F130 PolarHBondContact O-N 3.5Å; F130-I132 VanDerWaalsContact C-N 3.32Å; F130-I132 PolarHBondContact O-N 3.31Å; F130-I133 PolarHBondContact O-N 3.35Å; F130-Y134 AromaticContact CE1-CD2 3.98Å; F130-Y134 HydrophobicContact CE1-CD2 3.98Å; F130-Y134 HydrophobicContact CE1-CG 4.27Å; F130-Y134 HydrophobicContact CZ-CD2 4.08Å; F130-Y134 WeakPolarHBondContact O-CB 3.21Å; F130-Y134 PolarHBondContact O-N 2.9Å; F130-F175 AromaticContact CD2-CD2 3.83Å; F130-F175 HydrophobicContact CD2-CD2 3.83Å; F130-F175 AromaticContact CD2-CE2 3.71Å; F130-F175 HydrophobicContact CD2-CE2 3.71Å; F130-F175 HydrophobicContact CE1-CE2 4.48Å; F130-F175 AromaticContact CE2-CD2 3.83Å; F130-F175 HydrophobicContact CE2-CD2 3.83Å; F130-F175 AromaticContact CE2-CE2 3.43Å; F130-F175 HydrophobicContact CE2-CE2 3.43Å; F130-F175 VanDerWaalsContact CE2-CE2 3.43Å; F130-F175 HydrophobicContact CG-CE2 4.39Å; F130-F175 AromaticContact CZ-CE2 3.87Å; F130-F175 HydrophobicContact CZ-CE2 3.87Å
131	D	93.1	Very high	88.9	Confident	54 Å²	54	35.1 Å²	35.1	29%	0.289	19%	0.187	S	C	.	.	H	α-helix	trans	-69.3	-30.9	-175.5	-56.3	-61.3	0	0	0	112.1	G19 D128 S135	G19-D131 PolarHBondContact N-OD1 2.95Å; G19-D131 VanDerWaalsContact N-OD1 3.17Å; D128-D131 PolarHBondContact O-N 3.11Å; D131-S135 VanDerWaalsContact O-CB 3.27Å; D131-S135 WeakPolarHBondContact O-CB 3.5Å; D131-S135 PolarHBondContact O-N 3.08Å; D131-S135 PolarHBondContact O-OG 3.41Å
132	I	94	Very high	87.1	Confident	15 Å²	15	38.6 Å²	38.6	8%	0.077	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-47.5	170.9	-68.3	166.4	0	0	0	111.2	A124 D128 F130 S135 M136 Y164 L167	A124-I132 HydrophobicContact CB-CD1 3.93Å; D128-I132 HydrophobicContact CB-CD1 4.07Å; D128-I132 HydrophobicContact CB-CG1 4.48Å; D128-I132 WeakPolarHBondContact O-CB 3.46Å; D128-I132 VanDerWaalsContact O-CG1 3.26Å; D128-I132 WeakPolarHBondContact O-CG1 3.34Å; D128-I132 PolarHBondContact O-N 2.77Å; F130-I132 VanDerWaalsContact C-N 3.32Å; F130-I132 PolarHBondContact O-N 3.31Å; I132-S135 PolarHBondContact O-OG 2.8Å; I132-M136 WeakPolarHBondContact O-CB 3.31Å; I132-M136 WeakPolarHBondContact O-CG 3.37Å; I132-M136 PolarHBondContact O-N 2.76Å; I132-Y164 HydrophobicContact CD1-CD1 4.31Å; I132-Y164 HydrophobicContact CD1-CE1 3.89Å; I132-Y164 HydrophobicContact CG1-CE1 4.07Å; I132-Y164 HydrophobicContact CG2-CD1 4.26Å; I132-Y164 HydrophobicContact CG2-CD2 3.82Å; I132-Y164 HydrophobicContact CG2-CE1 4.05Å; I132-Y164 HydrophobicContact CG2-CE2 3.62Å; I132-Y164 HydrophobicContact CG2-CG 4.15Å; I132-L167 HydrophobicContact CB-CD1 4.28Å; I132-L167 HydrophobicContact CG2-CD1 3.57Å
133	I	93.9	Very high	85.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-70.9	-42.1	179.4	-57.9	159	0	0	0	109.8	F27 F129 F130 M136 H137 T156 I160 L167 A171 V172 F175	F27-I133 HydrophobicContact CE1-CD1 4.16Å; F27-I133 HydrophobicContact CZ-CD1 3.76Å; F129-I133 WeakPolarHBondContact O-CB 3.48Å; F129-I133 VanDerWaalsContact O-CD1 3.26Å; F129-I133 WeakPolarHBondContact O-CD1 3.44Å; F129-I133 WeakPolarHBondContact O-CG1 3.1Å; F129-I133 PolarHBondContact O-N 3.23Å; F130-I133 PolarHBondContact O-N 3.35Å; I133-M136 PolarHBondContact O-N 3.47Å; I133-H137 WeakPolarHBondContact O-CB 3.4Å; I133-H137 PolarHBondContact O-N 3.41Å; I133-T156 HydrophobicContact CG2-CG2 4.41Å; I133-I160 HydrophobicContact CB-CD1 4.26Å; I133-I160 HydrophobicContact CG1-CD1 4.02Å; I133-I160 HydrophobicContact CG2-CD1 4Å; I133-L167 HydrophobicContact CD1-CD2 4.35Å; I133-L167 HydrophobicContact CG1-CD1 4.31Å; I133-L167 HydrophobicContact CG1-CD2 4.39Å; I133-A171 HydrophobicContact CD1-CB 4.45Å; I133-V172 HydrophobicContact CD1-CG2 4.26Å; I133-V172 HydrophobicContact CG1-CG2 4.24Å; I133-V172 HydrophobicContact CG2-CG1 4.32Å; I133-F175 HydrophobicContact CB-CD1 4.23Å; I133-F175 HydrophobicContact CB-CD2 4.11Å; I133-F175 HydrophobicContact CB-CE2 4.39Å; I133-F175 HydrophobicContact CB-CG 4.03Å; I133-F175 HydrophobicContact CD1-CB 4.05Å; I133-F175 HydrophobicContact CD1-CG 4.42Å; I133-F175 HydrophobicContact CG2-CB 3.93Å; I133-F175 HydrophobicContact CG2-CD1 3.28Å; I133-F175 HydrophobicContact CG2-CD2 4.03Å; I133-F175 HydrophobicContact CG2-CE1 3.73Å; I133-F175 HydrophobicContact CG2-CE2 4.38Å; I133-F175 HydrophobicContact CG2-CG 3.47Å; I133-F175 VanDerWaalsContact CG2-CG 3.47Å; I133-F175 HydrophobicContact CG2-CZ 4.27Å
134	Y	91.4	Very high	82.8	Confident	80 Å²	80	45.7 Å²	45.7	31%	0.314	27%	0.268	S	S	.	.	H	α-helix	trans	-58.9	-49.8	178.3	-173.4	-82.6	0	0	0	111.5	P18 F130 M136 H137 V138 F175	P18-Y134 HydrophobicContact CB-CD1 3.79Å; P18-Y134 HydrophobicContact CB-CD2 4.09Å; P18-Y134 HydrophobicContact CB-CE1 3.75Å; P18-Y134 HydrophobicContact CB-CE2 4.05Å; P18-Y134 HydrophobicContact CB-CG 3.98Å; P18-Y134 HydrophobicContact CG-CD1 3.93Å; P18-Y134 HydrophobicContact CG-CE1 3.65Å; F130-Y134 AromaticContact CE1-CD2 3.98Å; F130-Y134 HydrophobicContact CE1-CD2 3.98Å; F130-Y134 HydrophobicContact CE1-CG 4.27Å; F130-Y134 HydrophobicContact CZ-CD2 4.08Å; F130-Y134 WeakPolarHBondContact O-CB 3.21Å; F130-Y134 PolarHBondContact O-N 2.9Å; Y134-M136 VanDerWaalsContact C-N 3.3Å; Y134-M136 PolarHBondContact O-N 3.41Å; Y134-H137 PolarHBondContact O-N 3.05Å; Y134-H137 VanDerWaalsContact O-N 3.16Å; Y134-V138 HydrophobicContact CD1-CB 4.23Å; Y134-V138 HydrophobicContact CD1-CG2 4.29Å; Y134-V138 HydrophobicContact CD2-CG2 3.98Å; Y134-V138 HydrophobicContact CE1-CB 3.91Å; Y134-V138 HydrophobicContact CE1-CG1 4.19Å; Y134-V138 HydrophobicContact CE1-CG2 4.08Å; Y134-V138 HydrophobicContact CE2-CB 4.48Å; Y134-V138 HydrophobicContact CE2-CG2 3.76Å; Y134-V138 HydrophobicContact CG-CG2 4.22Å; Y134-V138 WeakPolarHBondContact O-CB 3.32Å; Y134-V138 PolarHBondContact O-N 3.5Å; Y134-F175 HydrophobicContact CD2-CE2 4.42Å; Y134-F175 HydrophobicContact CD2-CZ 4.01Å; Y134-F175 HydrophobicContact CG-CZ 4.41Å
135	S	90.9	Very high	81	Confident	62 Å²	62	49.9 Å²	49.9	43%	0.434	31%	0.312	S	S	.	.	H	α-helix	trans	-67.3	-25.5	179.2	56.7	0	0	0	0	114.4	D131 I132	D131-S135 VanDerWaalsContact O-CB 3.27Å; D131-S135 WeakPolarHBondContact O-CB 3.5Å; D131-S135 PolarHBondContact O-N 3.08Å; D131-S135 PolarHBondContact O-OG 3.41Å; I132-S135 PolarHBondContact O-OG 2.8Å
136	M	90.7	Very high	79.3	Confident	54 Å²	54	54.9 Å²	54.9	27%	0.266	33%	0.333	S	S	.	.	H	α-helix	trans	-87.9	-15.9	173.8	-62.2	-69.3	92.9	0	0	113.4	I132 I133 Y134 A159 I160 Y164	I132-M136 WeakPolarHBondContact O-CB 3.31Å; I132-M136 WeakPolarHBondContact O-CG 3.37Å; I132-M136 PolarHBondContact O-N 2.76Å; I133-M136 PolarHBondContact O-N 3.47Å; Y134-M136 VanDerWaalsContact C-N 3.3Å; Y134-M136 PolarHBondContact O-N 3.41Å; M136-A159 HydrophobicContact SD-CB 4.24Å; M136-I160 HydrophobicContact CB-CD1 4.24Å; M136-I160 HydrophobicContact CB-CG1 3.75Å; M136-I160 HydrophobicContact CG-CG1 3.89Å; M136-Y164 HydrophobicContact CG-CE2 4.49Å
137	H	90	Very high	77.6	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-99.9	-40.5	-180	-178.8	55.1	0	0	0	112.8	I133 Y134 E139 H150 A151 T156 F175 L176 C179 C182	I133-H137 WeakPolarHBondContact O-CB 3.4Å; I133-H137 PolarHBondContact O-N 3.41Å; Y134-H137 PolarHBondContact O-N 3.05Å; Y134-H137 VanDerWaalsContact O-N 3.16Å; H137-E139 PolarHBondContact O-N 2.75Å; H137-H150 AromaticContact CD2-ND1 3.41Å; H137-H150 PolarHBondContact CD2-ND1 2.86Å; H137-H150 AromaticContact CE1-ND1 3.91Å; H137-H150 AromaticContact NE2-CE1 3.97Å; H137-H150 AromaticContact NE2-CG 3.81Å; H137-H150 AromaticContact NE2-ND1 2.96Å; H137-H150 PolarHBondContact NE2-ND1 3.36Å; H137-H150 CarbonylContact O-C 3.59Å; H137-H150 WeakPolarHBondContact O-CA 3.18Å; H137-A151 PolarHBondContact CE1-O 3.08Å; H137-A151 PolarHBondContact ND1-O 2.79Å; H137-A151 WeakPolarHBondContact O-CB 3.26Å; H137-A151 PolarHBondContact O-N 2.81Å; H137-T156 HydrophobicContact CB-CG2 3.88Å; H137-T156 PolarHBondContact ND1-OG1 3.48Å; H137-F175 HydrophobicContact CB-CE1 3.97Å; H137-F175 AromaticContact CD2-CE1 3.64Å; H137-F175 AromaticContact CG-CE1 3.95Å; H137-L176 WeakPolarHBondContact CE1-CD2 3.39Å; H137-L176 VanDerWaalsContact ND1-CD2 3.27Å; H137-L176 WeakPolarHBondContact ND1-CD2 3.1Å; H137-C179 PolarHBondContact NE2-SG 2.99Å; H137-C182 PolarHBondContact CE1-SG 3.29Å; H137-C182 PolarHBondContact NE2-SG 2.9Å; H137-C182 VanDerWaalsContact NE2-SG 3.36Å
138	V	87.3	Confident	76.5	Confident	11 Å²	11	60.5 Å²	60.5	7%	0.067	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	89.6	-178.5	-173.7	0	0	0	0	107.4	Y134 S140 P148	Y134-V138 HydrophobicContact CD1-CB 4.23Å; Y134-V138 HydrophobicContact CD1-CG2 4.29Å; Y134-V138 HydrophobicContact CD2-CG2 3.98Å; Y134-V138 HydrophobicContact CE1-CB 3.91Å; Y134-V138 HydrophobicContact CE1-CG1 4.19Å; Y134-V138 HydrophobicContact CE1-CG2 4.08Å; Y134-V138 HydrophobicContact CE2-CB 4.48Å; Y134-V138 HydrophobicContact CE2-CG2 3.76Å; Y134-V138 HydrophobicContact CG-CG2 4.22Å; Y134-V138 WeakPolarHBondContact O-CB 3.32Å; Y134-V138 PolarHBondContact O-N 3.5Å; V138-S140 PolarHBondContact O-N 3.28Å; V138-P148 HydrophobicContact CG1-CB 3.51Å
139	E	75.6	Confident	75.7	Confident	95 Å²	95	64.3 Å²	64.3	44%	0.444	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	101.6	-175.8	-163.8	160.5	-138.1	0	0	108.9	H137 S141 K149 K155	H137-E139 PolarHBondContact O-N 2.75Å; E139-S141 PolarHBondContact O-N 3.29Å; E139-K149 HydrophobicContact CB-CB 4.49Å; E139-K149 VanDerWaalsContact CB-O 3.27Å; E139-K149 WeakPolarHBondContact CB-O 3.11Å; E139-K149 PolarHBondContact N-O 3.16Å; E139-K149 PolarHBondContact O-N 2.76Å; E139-K155 IonicContact OE1-NZ 2.83Å; E139-K155 PolarHBondContact OE1-NZ 2.85Å; E139-K155 IonicContact OE2-NZ 3.81Å; E139-K155 PolarHBondContact OE2-NZ 3.34Å
140	S	57	Low	75.2	Confident	113 Å²	113	65.9 Å²	65.9	79%	0.79	40%	0.4	S	S	*	.			trans	-64.3	119.5	-177	-166.7	0	0	0	0	110.2	V138 A142	V138-S140 PolarHBondContact O-N 3.28Å; S140-A142 PolarHBondContact O-N 3.49Å
141	S	52.5	Low	74.8	Confident	35 Å²	35	65.9 Å²	65.9	25%	0.245	40%	0.402	C	S	.	.			trans	-73.8	119.6	-178.8	-177.9	0	0	0	0	109.5	E139 E143	E139-S141 PolarHBondContact O-N 3.29Å; S141-E143 PolarHBondContact O-N 2.98Å; S141-E143 VanDerWaalsContact O-N 3.11Å; S141-E143 WeakPolarHBondContact OG-CB 3.49Å; S141-E143 PolarHBondContact OG-N 2.96Å; S141-E143 PolarHBondContact OG-O 2.72Å
142	A	55.2	Low	74.3	Confident	104 Å²	104	65.7 Å²	65.7	86%	0.86	41%	0.412	S	S	*	.	S	Bend	trans	-62.5	-15.1	173.4	0	0	0	0	0	113.1	S140 P144	S140-A142 PolarHBondContact O-N 3.49Å; A142-P144 WeakPolarHBondContact O-CD 3.5Å
143	E	51.3	Low	73.9	Confident	108 Å²	108	70.4 Å²	70.4	51%	0.505	43%	0.434	S	S	.	.	S	Bend	trans	-83.3	111.1	173.4	-62.9	-84.6	110.8	0	0	110.5	S141 G145 K146	S141-E143 PolarHBondContact O-N 2.98Å; S141-E143 VanDerWaalsContact O-N 3.11Å; S141-E143 WeakPolarHBondContact OG-CB 3.49Å; S141-E143 PolarHBondContact OG-N 2.96Å; S141-E143 PolarHBondContact OG-O 2.72Å; E143-G145 PolarHBondContact O-N 2.63Å; E143-K146 HydrophobicContact CB-CD 3.86Å; E143-K146 HydrophobicContact CG-CD 4.33Å; E143-K146 IonicContact OE2-NZ 2.74Å; E143-K146 PolarHBondContact OE2-NZ 3.15Å
144	P	46.7	Very low	73.6	Confident	130 Å²	130	78.3 Å²	78.3	84%	0.844	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	133.6	177.6	26.2	-33.5	0	0	0	111	A142	A142-P144 WeakPolarHBondContact O-CD 3.5Å
145	G	60.3	Low	73.6	Confident	88 Å²	88	79.2 Å²	79.2	91%	0.907	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	-0.6	177.6	0	0	0	0	0	116.3	E143	E143-G145 PolarHBondContact O-N 2.63Å
146	K	59.3	Low	73.6	Confident	115 Å²	115	76.3 Å²	76.3	50%	0.5	45%	0.453	S	S	.	.	S	Bend	trans	-96.6	130.6	171.5	-74	167.9	-171.6	153	0	110.9	E143	E143-K146 HydrophobicContact CB-CD 3.86Å; E143-K146 HydrophobicContact CG-CD 4.33Å; E143-K146 IonicContact OE2-NZ 2.74Å; E143-K146 PolarHBondContact OE2-NZ 3.15Å
147	A	60.8	Low	73.8	Confident	82 Å²	82	75.3 Å²	75.3	68%	0.678	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-56.8	143.7	-179.5	0	0	0	0	0	112.3	K149	A147-K149 PolarHBondContact O-N 3.04Å
148	P	71.6	Confident	73.9	Confident	70 Å²	70	82.2 Å²	82.2	46%	0.455	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-56.4	132.8	-174.1	-26.7	34.7	0	0	0	113.8	V138 H150	V138-P148 HydrophobicContact CG1-CB 3.51Å; P148-H150 PolarHBondContact O-N 3.2Å
149	K	77.6	Confident	74.2	Confident	128 Å²	128	82.8 Å²	82.8	56%	0.557	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	102.8	-175.8	-72.2	-173.2	179.4	179.5	0	110.7	E139 A147 A151	E139-K149 HydrophobicContact CB-CB 4.49Å; E139-K149 VanDerWaalsContact CB-O 3.27Å; E139-K149 WeakPolarHBondContact CB-O 3.11Å; E139-K149 PolarHBondContact N-O 3.16Å; E139-K149 PolarHBondContact O-N 2.76Å; A147-K149 PolarHBondContact O-N 3.04Å; K149-A151 PolarHBondContact O-N 2.74Å
150	H	86.4	Confident	75	Confident	33 Å²	33	78.6 Å²	78.6	15%	0.153	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	112.2	172	-72.3	-106.2	0	0	0	111	H137 P148 C179	H137-H150 AromaticContact CD2-ND1 3.41Å; H137-H150 PolarHBondContact CD2-ND1 2.86Å; H137-H150 AromaticContact CE1-ND1 3.91Å; H137-H150 AromaticContact NE2-CE1 3.97Å; H137-H150 AromaticContact NE2-CG 3.81Å; H137-H150 AromaticContact NE2-ND1 2.96Å; H137-H150 PolarHBondContact NE2-ND1 3.36Å; H137-H150 CarbonylContact O-C 3.59Å; H137-H150 WeakPolarHBondContact O-CA 3.18Å; P148-H150 PolarHBondContact O-N 3.2Å; H150-C179 VanDerWaalsContact CE1-SG 3.51Å; H150-C179 PolarHBondContact ND1-SG 3.38Å; H150-C179 VanDerWaalsContact ND1-SG 3.41Å
151	A	84.7	Confident	76.7	Confident	6 Å²	6	76.1 Å²	76.1	5%	0.05	45%	0.446	C	S	.	.			trans	-66.3	126.7	173	0	0	0	0	0	110.3	H137 K149 K155 T156	H137-A151 PolarHBondContact CE1-O 3.08Å; H137-A151 PolarHBondContact ND1-O 2.79Å; H137-A151 WeakPolarHBondContact O-CB 3.26Å; H137-A151 PolarHBondContact O-N 2.81Å; K149-A151 PolarHBondContact O-N 2.74Å; A151-K155 HydrophobicContact CB-CB 4.38Å; A151-K155 HydrophobicContact CB-CD 3.94Å; A151-K155 HydrophobicContact CB-CG 4.17Å; A151-T156 PolarHBondContact O-OG1 3.07Å
152	G	82.4	Confident	78.6	Confident	49 Å²	49	79.6 Å²	79.6	51%	0.505	46%	0.458	S	S	.	.			trans	-54.9	151.9	-179.8	0	0	0	0	0	113	K154 K155 T156	G152-K154 VanDerWaalsContact C-N 3.26Å; G152-K154 PolarHBondContact O-N 3.03Å; G152-K154 VanDerWaalsContact O-N 3.08Å; G152-K155 WeakPolarHBondContact O-CA 3.27Å; G152-K155 WeakPolarHBondContact O-CB 3.3Å; G152-K155 PolarHBondContact O-N 2.97Å; G152-T156 PolarHBondContact O-N 3.2Å; G152-T156 PolarHBondContact O-OG1 2.8Å
153	Q	86.6	Confident	80.3	Confident	115 Å²	115	76.6 Å²	76.6	54%	0.537	43%	0.429	S	S	.	.	H	α-helix	trans	-44.6	-46.9	-175.9	178.4	179.2	53.6	0	0	113.3	K155 T156 Y157 L176	Q153-K155 PolarHBondContact O-N 2.72Å; Q153-T156 PolarHBondContact O-N 3.14Å; Q153-Y157 HydrophobicContact CG-CD2 3.77Å; Q153-Y157 HydrophobicContact CG-CE2 3.47Å; Q153-Y157 VanDerWaalsContact CG-CE2 3.47Å; Q153-Y157 WeakPolarHBondContact O-CD2 3.44Å; Q153-Y157 PolarHBondContact O-N 3.01Å; Q153-L176 HydrophobicContact CB-CD1 4.29Å; Q153-L176 HydrophobicContact CG-CD1 3.91Å
154	K	88.1	Confident	82.4	Confident	166 Å²	166	73.1 Å²	73.1	72%	0.722	41%	0.412	S	S	*	.	H	α-helix	trans	-62.9	-33.9	178.4	-172.4	179.5	179.5	-178	0	113.9	G152 R158	G152-K154 VanDerWaalsContact C-N 3.26Å; G152-K154 PolarHBondContact O-N 3.03Å; G152-K154 VanDerWaalsContact O-N 3.08Å; K154-R158 WeakPolarHBondContact O-CG 3.48Å; K154-R158 PolarHBondContact O-N 2.98Å
155	K	90.3	Very high	84.7	Confident	99 Å²	99	67.6 Å²	67.6	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-74.3	-47.8	175.4	179.1	174.3	172.2	-179.8	0	110.5	E139 A151 G152 Q153 Y157 R158 A159	E139-K155 IonicContact OE1-NZ 2.83Å; E139-K155 PolarHBondContact OE1-NZ 2.85Å; E139-K155 IonicContact OE2-NZ 3.81Å; E139-K155 PolarHBondContact OE2-NZ 3.34Å; A151-K155 HydrophobicContact CB-CB 4.38Å; A151-K155 HydrophobicContact CB-CD 3.94Å; A151-K155 HydrophobicContact CB-CG 4.17Å; G152-K155 WeakPolarHBondContact O-CA 3.27Å; G152-K155 WeakPolarHBondContact O-CB 3.3Å; G152-K155 PolarHBondContact O-N 2.97Å; Q153-K155 PolarHBondContact O-N 2.72Å; K155-Y157 PolarHBondContact O-N 3.14Å; K155-R158 PolarHBondContact O-N 3.14Å; K155-R158 VanDerWaalsContact O-N 3.1Å; K155-A159 PolarHBondContact O-N 3.38Å
156	T	92.1	Very high	86.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-56.2	-47.6	178.8	-54	0	0	0	0	111.5	I133 H137 A151 G152 Q153 R158 I160 V172 L176	I133-T156 HydrophobicContact CG2-CG2 4.41Å; H137-T156 HydrophobicContact CB-CG2 3.88Å; H137-T156 PolarHBondContact ND1-OG1 3.48Å; A151-T156 PolarHBondContact O-OG1 3.07Å; G152-T156 PolarHBondContact O-N 3.2Å; G152-T156 PolarHBondContact O-OG1 2.8Å; Q153-T156 PolarHBondContact O-N 3.14Å; T156-R158 VanDerWaalsContact C-N 3.33Å; T156-R158 PolarHBondContact O-N 3.2Å; T156-I160 HydrophobicContact CG2-CD1 3.76Å; T156-I160 WeakPolarHBondContact O-CB 3.47Å; T156-I160 VanDerWaalsContact O-CG1 3.32Å; T156-I160 WeakPolarHBondContact O-CG1 3.43Å; T156-I160 PolarHBondContact O-N 3.31Å; T156-I160 VanDerWaalsContact O-N 3.15Å; T156-V172 HydrophobicContact CG2-CG1 4.32Å; T156-L176 HydrophobicContact CG2-CD1 4.32Å; T156-L176 HydrophobicContact CG2-CD2 4.2Å
157	Y	94	Very high	88.1	Confident	34 Å²	34	61.3 Å²	61.3	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-59.8	-39	176.6	-83.9	-60.1	0	0	0	113.8	Q153 K155 A161 R169 V172 T173 L176	Q153-Y157 HydrophobicContact CG-CD2 3.77Å; Q153-Y157 HydrophobicContact CG-CE2 3.47Å; Q153-Y157 VanDerWaalsContact CG-CE2 3.47Å; Q153-Y157 WeakPolarHBondContact O-CD2 3.44Å; Q153-Y157 PolarHBondContact O-N 3.01Å; K155-Y157 PolarHBondContact O-N 3.14Å; Y157-A161 WeakPolarHBondContact O-CB 3.14Å; Y157-A161 PolarHBondContact O-N 3.05Å; Y157-R169 HydrophobicContact CD1-CG 4.13Å; Y157-R169 HydrophobicContact CE1-CG 3.48Å; Y157-R169 VanDerWaalsContact CE1-CG 3.48Å; Y157-V172 HydrophobicContact CD1-CB 4.14Å; Y157-V172 HydrophobicContact CD1-CG1 3.76Å; Y157-V172 HydrophobicContact CE1-CB 3.65Å; Y157-V172 HydrophobicContact CE1-CG1 3.59Å; Y157-V172 HydrophobicContact CG-CG1 4.48Å; Y157-T173 WeakPolarHBondContact OH-CA 3.43Å; Y157-T173 PolarHBondContact OH-N 3.07Å; Y157-T173 PolarHBondContact OH-OG1 3.4Å; Y157-L176 HydrophobicContact CE2-CD1 4.26Å
158	R	92.8	Very high	89.8	Confident	145 Å²	145	58.6 Å²	58.6	55%	0.547	30%	0.301	S	S	.	.	H	α-helix	trans	-69.6	-54.6	-179.3	-82	178.7	170.8	-85.6	2.3	111.2	K154 K155 T156 I160 A161 E162	K154-R158 WeakPolarHBondContact O-CG 3.48Å; K154-R158 PolarHBondContact O-N 2.98Å; K155-R158 PolarHBondContact O-N 3.14Å; K155-R158 VanDerWaalsContact O-N 3.1Å; T156-R158 VanDerWaalsContact C-N 3.33Å; T156-R158 PolarHBondContact O-N 3.2Å; R158-I160 VanDerWaalsContact C-N 3.27Å; R158-I160 PolarHBondContact O-N 3.43Å; R158-A161 PolarHBondContact O-N 3.32Å; R158-E162 WeakPolarHBondContact CB-OE1 3.38Å; R158-E162 IonicContact NH1-OE1 3.69Å; R158-E162 VanDerWaalsContact O-CB 3.27Å; R158-E162 WeakPolarHBondContact O-CB 3.47Å; R158-E162 VanDerWaalsContact O-CD 3.23Å; R158-E162 VanDerWaalsContact O-CG 3.29Å; R158-E162 WeakPolarHBondContact O-CG 3.43Å; R158-E162 PolarHBondContact O-N 3.41Å
159	A	92.1	Very high	90.9	Very high	24 Å²	24	63.6 Å²	63.6	20%	0.198	31%	0.311	C	S	.	.	H	α-helix	trans	-53.2	-43.6	178.5	0	0	0	0	0	112.4	M136 K155 T163	M136-A159 HydrophobicContact SD-CB 4.24Å; K155-A159 PolarHBondContact O-N 3.38Å; A159-T163 WeakPolarHBondContact O-CB 3.36Å; A159-T163 PolarHBondContact O-N 3.25Å; A159-T163 PolarHBondContact O-OG1 3.36Å
160	I	94.3	Very high	91.7	Very high	7 Å²	7	62.6 Å²	62.6	4%	0.036	31%	0.309	C	S	.	.	H	α-helix	trans	-66.9	-49.8	176.2	-66.2	169.8	0	0	0	111.5	I133 M136 T156 R158 E162 T163 Y164 L167 V172	I133-I160 HydrophobicContact CB-CD1 4.26Å; I133-I160 HydrophobicContact CG1-CD1 4.02Å; I133-I160 HydrophobicContact CG2-CD1 4Å; M136-I160 HydrophobicContact CB-CD1 4.24Å; M136-I160 HydrophobicContact CB-CG1 3.75Å; M136-I160 HydrophobicContact CG-CG1 3.89Å; T156-I160 HydrophobicContact CG2-CD1 3.76Å; T156-I160 WeakPolarHBondContact O-CB 3.47Å; T156-I160 VanDerWaalsContact O-CG1 3.32Å; T156-I160 WeakPolarHBondContact O-CG1 3.43Å; T156-I160 PolarHBondContact O-N 3.31Å; T156-I160 VanDerWaalsContact O-N 3.15Å; R158-I160 VanDerWaalsContact C-N 3.27Å; R158-I160 PolarHBondContact O-N 3.43Å; I160-E162 VanDerWaalsContact C-N 3.28Å; I160-E162 PolarHBondContact O-N 3.41Å; I160-T163 PolarHBondContact O-N 2.96Å; I160-Y164 WeakPolarHBondContact O-CB 3.48Å; I160-Y164 PolarHBondContact O-N 3.27Å; I160-L167 HydrophobicContact CG2-CB 4.49Å; I160-L167 HydrophobicContact CG2-CD1 3.95Å; I160-L167 HydrophobicContact CG2-CD2 4.25Å; I160-L167 HydrophobicContact CG2-CG 4.46Å; I160-V172 HydrophobicContact CD1-CG1 3.9Å; I160-V172 HydrophobicContact CD1-CG2 3.97Å; I160-V172 HydrophobicContact CG2-CG2 4.35Å
161	A	92.4	Very high	92.1	Very high	60 Å²	60	61 Å²	61	50%	0.496	30%	0.301	S	S	.	.	H	α-helix	trans	-69.6	-24.4	-177.1	0	0	0	0	0	113.7	K121 Y157 R158	K121-A161 PolarHBondContact NZ-O 3.37Å; Y157-A161 WeakPolarHBondContact O-CB 3.14Å; Y157-A161 PolarHBondContact O-N 3.05Å; R158-A161 PolarHBondContact O-N 3.32Å
162	E	91.3	Very high	92.6	Very high	108 Å²	108	60.9 Å²	60.9	51%	0.505	30%	0.3	S	S	.	.	H	α-helix	trans	-78.9	-42.6	174.6	-73.1	150.2	-164	0	0	110.6	K121 R158 I160	K121-E162 VanDerWaalsContact CD-O 3.3Å; K121-E162 WeakPolarHBondContact CD-O 3.43Å; K121-E162 WeakPolarHBondContact CE-O 3.49Å; R158-E162 WeakPolarHBondContact CB-OE1 3.38Å; R158-E162 IonicContact NH1-OE1 3.69Å; R158-E162 VanDerWaalsContact O-CB 3.27Å; R158-E162 WeakPolarHBondContact O-CB 3.47Å; R158-E162 VanDerWaalsContact O-CD 3.23Å; R158-E162 VanDerWaalsContact O-CG 3.29Å; R158-E162 WeakPolarHBondContact O-CG 3.43Å; R158-E162 PolarHBondContact O-N 3.41Å; I160-E162 VanDerWaalsContact C-N 3.28Å; I160-E162 PolarHBondContact O-N 3.41Å
163	T	91.8	Very high	93.1	Very high	42 Å²	42	60.8 Å²	60.8	26%	0.258	29%	0.289	S	S	.	.	H	α-helix	trans	-88.5	-35	-172.8	-52.2	0	0	0	0	114.7	R122 A159 I160	R122-T163 VanDerWaalsContact CZ-CG2 3.42Å; R122-T163 PolarHBondContact N-O 3.28Å; R122-T163 VanDerWaalsContact NH2-CG2 3.27Å; A159-T163 WeakPolarHBondContact O-CB 3.36Å; A159-T163 PolarHBondContact O-N 3.25Å; A159-T163 PolarHBondContact O-OG1 3.36Å; I160-T163 PolarHBondContact O-N 2.96Å
164	Y	95.3	Very high	93.4	Very high	35 Å²	35	61.1 Å²	61.1	14%	0.137	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	151.7	-168.9	-70.4	-87.8	0	0	0	113.5	R122 A124 I132 M136 I160	R122-Y164 HydrophobicContact CB-CD1 3.84Å; R122-Y164 HydrophobicContact CB-CE1 3.95Å; R122-Y164 PolarHBondContact NH2-OH 3.06Å; R122-Y164 CarbonylContact O-C 3.57Å; R122-Y164 WeakPolarHBondContact O-CA 3.49Å; A124-Y164 HydrophobicContact CB-CD1 3.97Å; A124-Y164 HydrophobicContact CB-CG 4.49Å; I132-Y164 HydrophobicContact CD1-CD1 4.31Å; I132-Y164 HydrophobicContact CD1-CE1 3.89Å; I132-Y164 HydrophobicContact CG1-CE1 4.07Å; I132-Y164 HydrophobicContact CG2-CD1 4.26Å; I132-Y164 HydrophobicContact CG2-CD2 3.82Å; I132-Y164 HydrophobicContact CG2-CE1 4.05Å; I132-Y164 HydrophobicContact CG2-CE2 3.62Å; I132-Y164 HydrophobicContact CG2-CG 4.15Å; M136-Y164 HydrophobicContact CG-CE2 4.49Å; I160-Y164 WeakPolarHBondContact O-CB 3.48Å; I160-Y164 PolarHBondContact O-N 3.27Å
165	A	94.7	Very high	93.6	Very high	14 Å²	14	53.4 Å²	53.4	12%	0.116	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	161.4	169.5	0	0	0	0	0	111	V101 K121 R122 A124 L167	V101-A165 HydrophobicContact CG1-CB 3.34Å; K121-A165 HydrophobicContact CB-CB 4.08Å; R122-A165 PolarHBondContact O-N 3.15Å; A124-A165 WeakPolarHBondContact CB-O 3.38Å; A124-A165 PolarHBondContact N-O 3.44Å; A165-L167 PolarHBondContact O-N 3.42Å; A165-L167 VanDerWaalsContact O-N 3.07Å
166	F	95.1	Very high	93.7	Very high	44 Å²	44	49.5 Å²	49.5	19%	0.193	24%	0.236	C	C	.	.	S	Bend	trans	64.3	-1.7	178.3	-54.6	-74.3	0	0	0	117.4	K42 V44 F85 V101 V123 P168	K42-F166 WeakPolarHBondContact O-CD1 3.46Å; V44-F166 HydrophobicContact CG2-CB 4.27Å; V44-F166 HydrophobicContact CG2-CD2 4.23Å; V44-F166 HydrophobicContact CG2-CG 4.13Å; F85-F166 AromaticContact CE1-CE2 3.6Å; F85-F166 HydrophobicContact CE1-CE2 3.6Å; F85-F166 HydrophobicContact CE1-CZ 4.09Å; F85-F166 AromaticContact CZ-CE2 3.83Å; F85-F166 HydrophobicContact CZ-CE2 3.83Å; F85-F166 AromaticContact CZ-CZ 3.85Å; F85-F166 HydrophobicContact CZ-CZ 3.85Å; V101-F166 HydrophobicContact CB-CE2 4.12Å; V101-F166 HydrophobicContact CG1-CD2 4.49Å; V101-F166 HydrophobicContact CG1-CE2 3.82Å; V101-F166 HydrophobicContact CG2-CE2 4.16Å; V101-F166 HydrophobicContact CG2-CZ 4.35Å; V123-F166 HydrophobicContact CG1-CD2 4.1Å; V123-F166 HydrophobicContact CG2-CD2 4.26Å; V123-F166 HydrophobicContact CG2-CE2 4.3Å; F166-P168 WeakPolarHBondContact O-CD 3.47Å
167	L	96.4	Very high	93.5	Very high	26 Å²	26	55.5 Å²	55.5	14%	0.136	27%	0.266	C	S	.	.			trans	-77	119.3	170.9	-154.7	159.2	0	0	0	110.8	A124 F129 I132 I133 I160 A165 A171 V172	A124-L167 HydrophobicContact CB-CB 3.77Å; A124-L167 HydrophobicContact CB-CD1 4Å; A124-L167 HydrophobicContact CB-CG 4.2Å; F129-L167 HydrophobicContact CD1-CD1 4.02Å; F129-L167 HydrophobicContact CD1-CG 3.77Å; F129-L167 HydrophobicContact CE1-CB 4.21Å; F129-L167 HydrophobicContact CE1-CD1 4.46Å; F129-L167 HydrophobicContact CE1-CG 3.86Å; F129-L167 HydrophobicContact CG-CG 4.2Å; F129-L167 HydrophobicContact CZ-CG 4.35Å; I132-L167 HydrophobicContact CB-CD1 4.28Å; I132-L167 HydrophobicContact CG2-CD1 3.57Å; I133-L167 HydrophobicContact CD1-CD2 4.35Å; I133-L167 HydrophobicContact CG1-CD1 4.31Å; I133-L167 HydrophobicContact CG1-CD2 4.39Å; I160-L167 HydrophobicContact CG2-CB 4.49Å; I160-L167 HydrophobicContact CG2-CD1 3.95Å; I160-L167 HydrophobicContact CG2-CD2 4.25Å; I160-L167 HydrophobicContact CG2-CG 4.46Å; A165-L167 PolarHBondContact O-N 3.42Å; A165-L167 VanDerWaalsContact O-N 3.07Å; L167-A171 HydrophobicContact CD2-CB 4.43Å; L167-V172 HydrophobicContact CD2-CG2 3.39Å
168	P	95.5	Very high	93.1	Very high	25 Å²	25	55.6 Å²	55.6	16%	0.162	27%	0.271	C	S	.	.			trans	-70.7	139.2	-179.6	-20.1	34	0	0	0	113	Y35 T43 F129 F166 E170 A171	Y35-P168 HydrophobicContact CD1-CG 4.12Å; Y35-P168 HydrophobicContact CD2-CG 4.39Å; Y35-P168 HydrophobicContact CE1-CB 4.16Å; Y35-P168 HydrophobicContact CE1-CG 3.81Å; Y35-P168 HydrophobicContact CE2-CB 4.5Å; Y35-P168 HydrophobicContact CE2-CG 4.08Å; Y35-P168 HydrophobicContact CG-CG 4.41Å; T43-P168 HydrophobicContact CG2-CG 3.67Å; F129-P168 HydrophobicContact CE2-CG 4.12Å; F129-P168 VanDerWaalsContact CZ-CD 3.44Å; F129-P168 HydrophobicContact CZ-CG 4.44Å; F166-P168 WeakPolarHBondContact O-CD 3.47Å; P168-E170 PolarHBondContact O-N 2.88Å; P168-A171 WeakPolarHBondContact O-CB 3.27Å; P168-A171 PolarHBondContact O-N 3.18Å; P168-A171 VanDerWaalsContact O-N 3.15Å
169	R	94.3	Very high	92.9	Very high	176 Å²	176	49.1 Å²	49.1	66%	0.664	25%	0.248	S	C	*	.	H	α-helix	trans	-57.5	-38.5	176.9	-168.4	-178.6	177.5	130.2	-1.4	112.4	Y157 A171 V172 T173	Y157-R169 HydrophobicContact CD1-CG 4.13Å; Y157-R169 HydrophobicContact CE1-CG 3.48Å; Y157-R169 VanDerWaalsContact CE1-CG 3.48Å; R169-A171 VanDerWaalsContact C-N 3.33Å; R169-A171 PolarHBondContact O-N 2.99Å; R169-V172 WeakPolarHBondContact O-CB 3.27Å; R169-V172 PolarHBondContact O-N 2.97Å; R169-V172 VanDerWaalsContact O-N 3.15Å; R169-T173 PolarHBondContact O-N 3.34Å; R169-T173 PolarHBondContact O-OG1 3.44Å; R169-T173 VanDerWaalsContact O-OG1 3.08Å
170	E	95.1	Very high	92.3	Very high	107 Å²	107	51.5 Å²	51.5	50%	0.5	26%	0.26	S	S	.	.	H	α-helix	trans	-54.7	-43	176.4	-179.6	-168.6	-177.4	0	0	113	W30 Y35 P168 V172 T173 R174	W30-E170 HydrophobicContact CH2-CG 4.22Å; Y35-E170 WeakPolarHBondContact OH-CB 3.26Å; Y35-E170 PolarHBondContact OH-OE2 2.84Å; P168-E170 PolarHBondContact O-N 2.88Å; E170-V172 VanDerWaalsContact C-N 3.33Å; E170-V172 PolarHBondContact O-N 3.18Å; E170-T173 WeakPolarHBondContact O-CB 3.36Å; E170-T173 PolarHBondContact O-N 3.45Å; E170-R174 WeakPolarHBondContact O-CB 3.26Å; E170-R174 PolarHBondContact O-N 2.63Å
171	A	95.3	Very high	91.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-41.7	177.3	0	0	0	0	0	111.4	F27 W30 Y35 F129 I133 L167 P168 R169 R174 F175	F27-A171 WeakPolarHBondContact CE2-O 3.38Å; F27-A171 HydrophobicContact CZ-CB 4.15Å; F27-A171 WeakPolarHBondContact CZ-O 3.36Å; W30-A171 HydrophobicContact CZ3-CB 4.25Å; Y35-A171 HydrophobicContact CE2-CB 4.07Å; F129-A171 HydrophobicContact CD2-CB 4.26Å; I133-A171 HydrophobicContact CD1-CB 4.45Å; L167-A171 HydrophobicContact CD2-CB 4.43Å; P168-A171 WeakPolarHBondContact O-CB 3.27Å; P168-A171 PolarHBondContact O-N 3.18Å; P168-A171 VanDerWaalsContact O-N 3.15Å; R169-A171 VanDerWaalsContact C-N 3.33Å; R169-A171 PolarHBondContact O-N 2.99Å; A171-R174 PolarHBondContact O-N 2.73Å; A171-F175 WeakPolarHBondContact O-CB 3.45Å; A171-F175 PolarHBondContact O-N 2.99Å
172	V	94.6	Very high	90.8	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-41.5	173.8	-170.1	0	0	0	0	111.2	I133 T156 Y157 I160 L167 R169 E170 L176	I133-V172 HydrophobicContact CD1-CG2 4.26Å; I133-V172 HydrophobicContact CG1-CG2 4.24Å; I133-V172 HydrophobicContact CG2-CG1 4.32Å; T156-V172 HydrophobicContact CG2-CG1 4.32Å; Y157-V172 HydrophobicContact CD1-CB 4.14Å; Y157-V172 HydrophobicContact CD1-CG1 3.76Å; Y157-V172 HydrophobicContact CE1-CB 3.65Å; Y157-V172 HydrophobicContact CE1-CG1 3.59Å; Y157-V172 HydrophobicContact CG-CG1 4.48Å; I160-V172 HydrophobicContact CD1-CG1 3.9Å; I160-V172 HydrophobicContact CD1-CG2 3.97Å; I160-V172 HydrophobicContact CG2-CG2 4.35Å; L167-V172 HydrophobicContact CD2-CG2 3.39Å; R169-V172 WeakPolarHBondContact O-CB 3.27Å; R169-V172 PolarHBondContact O-N 2.97Å; R169-V172 VanDerWaalsContact O-N 3.15Å; E170-V172 VanDerWaalsContact C-N 3.33Å; E170-V172 PolarHBondContact O-N 3.18Å; V172-L176 HydrophobicContact CG1-CD1 3.86Å; V172-L176 HydrophobicContact CG1-CG 4.36Å; V172-L176 WeakPolarHBondContact O-CB 3.45Å; V172-L176 VanDerWaalsContact O-CG 3.26Å; V172-L176 WeakPolarHBondContact O-CG 3.46Å; V172-L176 PolarHBondContact O-N 3.08Å
173	T	93	Very high	90.1	Very high	47 Å²	47	52 Å²	52	29%	0.288	26%	0.255	S	S	.	.	H	α-helix	trans	-56.7	-52.3	174.3	-44.7	0	0	0	0	110.8	Y157 R169 E170 L176 M177	Y157-T173 WeakPolarHBondContact OH-CA 3.43Å; Y157-T173 PolarHBondContact OH-N 3.07Å; Y157-T173 PolarHBondContact OH-OG1 3.4Å; R169-T173 PolarHBondContact O-N 3.34Å; R169-T173 PolarHBondContact O-OG1 3.44Å; R169-T173 VanDerWaalsContact O-OG1 3.08Å; E170-T173 WeakPolarHBondContact O-CB 3.36Å; E170-T173 PolarHBondContact O-N 3.45Å; T173-L176 PolarHBondContact O-N 2.92Å; T173-M177 HydrophobicContact CG2-SD 3.91Å; T173-M177 WeakPolarHBondContact O-CG 3.16Å; T173-M177 PolarHBondContact O-N 3.15Å
174	R	92.4	Very high	88.9	Confident	121 Å²	121	55.1 Å²	55.1	46%	0.457	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-46.8	-175.8	-169.8	-173.9	-174.8	105.4	2.4	111.2	F27 W30 E170 A171 L176 M177 S178	F27-R174 HydrophobicContact CE2-CB 4.25Å; F27-R174 HydrophobicContact CE2-CG 4.47Å; W30-R174 VanDerWaalsContact CD2-CD 3.47Å; W30-R174 VanDerWaalsContact CE2-NH1 3.34Å; W30-R174 HydrophobicContact CH2-CB 4.47Å; W30-R174 HydrophobicContact CZ3-CB 4.38Å; W30-R174 VanDerWaalsContact CZ3-CD 3.42Å; E170-R174 WeakPolarHBondContact O-CB 3.26Å; E170-R174 PolarHBondContact O-N 2.63Å; A171-R174 PolarHBondContact O-N 2.73Å; R174-L176 PolarHBondContact O-N 3.41Å; R174-M177 PolarHBondContact O-N 3.16Å; R174-S178 WeakPolarHBondContact O-CB 3.29Å; R174-S178 PolarHBondContact O-N 3.25Å; R174-S178 PolarHBondContact O-OG 3.02Å
175	F	93.4	Very high	87.4	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.018	28%	0.282	C	S	.	.	H	α-helix	trans	-55.7	-50.2	175.6	176.9	-80.8	0	0	0	111.3	F27 F130 I133 Y134 H137 A171 M177 S178 C179	F27-F175 HydrophobicContact CD2-CB 4.34Å; F27-F175 HydrophobicContact CE2-CB 3.69Å; F27-F175 HydrophobicContact CZ-CB 3.99Å; F130-F175 AromaticContact CD2-CD2 3.83Å; F130-F175 HydrophobicContact CD2-CD2 3.83Å; F130-F175 AromaticContact CD2-CE2 3.71Å; F130-F175 HydrophobicContact CD2-CE2 3.71Å; F130-F175 HydrophobicContact CE1-CE2 4.48Å; F130-F175 AromaticContact CE2-CD2 3.83Å; F130-F175 HydrophobicContact CE2-CD2 3.83Å; F130-F175 AromaticContact CE2-CE2 3.43Å; F130-F175 HydrophobicContact CE2-CE2 3.43Å; F130-F175 VanDerWaalsContact CE2-CE2 3.43Å; F130-F175 HydrophobicContact CG-CE2 4.39Å; F130-F175 AromaticContact CZ-CE2 3.87Å; F130-F175 HydrophobicContact CZ-CE2 3.87Å; I133-F175 HydrophobicContact CB-CD1 4.23Å; I133-F175 HydrophobicContact CB-CD2 4.11Å; I133-F175 HydrophobicContact CB-CE2 4.39Å; I133-F175 HydrophobicContact CB-CG 4.03Å; I133-F175 HydrophobicContact CD1-CB 4.05Å; I133-F175 HydrophobicContact CD1-CG 4.42Å; I133-F175 HydrophobicContact CG2-CB 3.93Å; I133-F175 HydrophobicContact CG2-CD1 3.28Å; I133-F175 HydrophobicContact CG2-CD2 4.03Å; I133-F175 HydrophobicContact CG2-CE1 3.73Å; I133-F175 HydrophobicContact CG2-CE2 4.38Å; I133-F175 HydrophobicContact CG2-CG 3.47Å; I133-F175 VanDerWaalsContact CG2-CG 3.47Å; I133-F175 HydrophobicContact CG2-CZ 4.27Å; Y134-F175 HydrophobicContact CD2-CE2 4.42Å; Y134-F175 HydrophobicContact CD2-CZ 4.01Å; Y134-F175 HydrophobicContact CG-CZ 4.41Å; H137-F175 HydrophobicContact CB-CE1 3.97Å; H137-F175 AromaticContact CD2-CE1 3.64Å; H137-F175 AromaticContact CG-CE1 3.95Å; A171-F175 WeakPolarHBondContact O-CB 3.45Å; A171-F175 PolarHBondContact O-N 2.99Å; F175-M177 VanDerWaalsContact C-N 3.34Å; F175-M177 PolarHBondContact O-N 3.15Å; F175-S178 WeakPolarHBondContact CA-OG 3.44Å; F175-S178 CarbonylContact O-C 3.57Å; F175-S178 PolarHBondContact O-N 2.67Å; F175-S178 VanDerWaalsContact O-N 3.13Å; F175-S178 PolarHBondContact O-OG 3.38Å; F175-C179 PolarHBondContact O-N 3.38Å; F175-C179 VanDerWaalsContact O-N 3.07Å
176	L	91.1	Very high	85.5	Confident	18 Å²	18	66.1 Å²	66.1	9%	0.094	31%	0.311	C	S	.	.	H	α-helix	trans	-66.8	-33.7	-176.6	-71.7	174.6	0	0	0	112.8	H137 Q153 T156 Y157 V172 T173 R174 C179	H137-L176 WeakPolarHBondContact CE1-CD2 3.39Å; H137-L176 VanDerWaalsContact ND1-CD2 3.27Å; H137-L176 WeakPolarHBondContact ND1-CD2 3.1Å; Q153-L176 HydrophobicContact CB-CD1 4.29Å; Q153-L176 HydrophobicContact CG-CD1 3.91Å; T156-L176 HydrophobicContact CG2-CD1 4.32Å; T156-L176 HydrophobicContact CG2-CD2 4.2Å; Y157-L176 HydrophobicContact CE2-CD1 4.26Å; V172-L176 HydrophobicContact CG1-CD1 3.86Å; V172-L176 HydrophobicContact CG1-CG 4.36Å; V172-L176 WeakPolarHBondContact O-CB 3.45Å; V172-L176 VanDerWaalsContact O-CG 3.26Å; V172-L176 WeakPolarHBondContact O-CG 3.46Å; V172-L176 PolarHBondContact O-N 3.08Å; T173-L176 PolarHBondContact O-N 2.92Å; R174-L176 PolarHBondContact O-N 3.41Å; L176-C179 WeakPolarHBondContact O-CB 3.27Å; L176-C179 PolarHBondContact O-N 3.02Å
177	M	87.7	Confident	83.8	Confident	126 Å²	126	70.2 Å²	70.2	62%	0.621	33%	0.331	S	S	*	.	H	α-helix	trans	-70.9	-31.6	172.7	-70.6	177.9	69	0	0	112.6	T173 R174 F175 C179	T173-M177 HydrophobicContact CG2-SD 3.91Å; T173-M177 WeakPolarHBondContact O-CG 3.16Å; T173-M177 PolarHBondContact O-N 3.15Å; R174-M177 PolarHBondContact O-N 3.16Å; F175-M177 VanDerWaalsContact C-N 3.34Å; F175-M177 PolarHBondContact O-N 3.15Å; M177-C179 VanDerWaalsContact C-N 3.32Å
178	S	86.6	Confident	81.5	Confident	36 Å²	36	76.2 Å²	76.2	25%	0.252	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	0.7	175.6	62	0	0	0	0	114.7	L23 R174 F175 T180	L23-S178 WeakPolarHBondContact CD2-O 3.41Å; R174-S178 WeakPolarHBondContact O-CB 3.29Å; R174-S178 PolarHBondContact O-N 3.25Å; R174-S178 PolarHBondContact O-OG 3.02Å; F175-S178 WeakPolarHBondContact CA-OG 3.44Å; F175-S178 CarbonylContact O-C 3.57Å; F175-S178 PolarHBondContact O-N 2.67Å; F175-S178 VanDerWaalsContact O-N 3.13Å; F175-S178 PolarHBondContact O-OG 3.38Å; S178-T180 PolarHBondContact O-N 3.1Å
179	C	88.3	Confident	79	Confident	8 Å²	8	82 Å²	82	5%	0.054	39%	0.386	C	S	.	.			trans	-81.9	97	-177.2	-175.6	0	0	0	0	110.7	H137 H150 F175 L176 M177 E181 C182 Q183	H137-C179 PolarHBondContact NE2-SG 2.99Å; H150-C179 VanDerWaalsContact CE1-SG 3.51Å; H150-C179 PolarHBondContact ND1-SG 3.38Å; H150-C179 VanDerWaalsContact ND1-SG 3.41Å; F175-C179 PolarHBondContact O-N 3.38Å; F175-C179 VanDerWaalsContact O-N 3.07Å; L176-C179 WeakPolarHBondContact O-CB 3.27Å; L176-C179 PolarHBondContact O-N 3.02Å; M177-C179 VanDerWaalsContact C-N 3.32Å; C179-E181 PolarHBondContact O-N 3.49Å; C179-E181 VanDerWaalsContact O-N 3.14Å; C179-C182 HydrophobicContact CB-CB 4.25Å; C179-C182 PolarHBondContact O-N 3.37Å; C179-Q183 PolarHBondContact O-N 2.83Å
180	T	80.7	Confident	76.7	Confident	75 Å²	75	78 Å²	78	46%	0.46	39%	0.385	S	S	.	.	H	α-helix	trans	-52	-38.5	-174.9	55.4	0	0	0	0	113.6	S178 C182 Q183 K184	S178-T180 PolarHBondContact O-N 3.1Å; T180-C182 VanDerWaalsContact C-N 3.35Å; T180-C182 PolarHBondContact O-N 3.02Å; T180-Q183 PolarHBondContact O-N 3.07Å; T180-K184 WeakPolarHBondContact O-CB 3.49Å; T180-K184 VanDerWaalsContact O-CG 3.25Å; T180-K184 WeakPolarHBondContact O-CG 3.05Å; T180-K184 PolarHBondContact O-N 3Å
181	E	78	Confident	73.9	Confident	66 Å²	66	80.1 Å²	80.1	31%	0.308	40%	0.399	S	S	.	.	H	α-helix	trans	-75.2	-23.2	-177.9	-54.1	-41.6	110.2	0	0	113.5	C179 K184 R185	C179-E181 PolarHBondContact O-N 3.49Å; C179-E181 VanDerWaalsContact O-N 3.14Å; E181-K184 WeakPolarHBondContact OE1-CE 3.47Å; E181-K184 IonicContact OE1-NZ 2.75Å; E181-K184 PolarHBondContact OE1-NZ 2.99Å; E181-K184 WeakPolarHBondContact OE2-CD 3.33Å; E181-K184 IonicContact OE2-NZ 2.9Å; E181-K184 PolarHBondContact OE2-NZ 3.1Å; E181-R185 WeakPolarHBondContact O-CG 3.29Å; E181-R185 PolarHBondContact O-NE 3.2Å
182	C	77.1	Confident	71.3	Confident	30 Å²	30	84 Å²	84	20%	0.203	44%	0.439	C	S	.	.	H	α-helix	trans	-81.1	-39.6	167.1	-77.4	0	0	0	0	111.5	H137 C179 T180 R185 M186	H137-C182 PolarHBondContact CE1-SG 3.29Å; H137-C182 PolarHBondContact NE2-SG 2.9Å; H137-C182 VanDerWaalsContact NE2-SG 3.36Å; C179-C182 HydrophobicContact CB-CB 4.25Å; C179-C182 PolarHBondContact O-N 3.37Å; T180-C182 VanDerWaalsContact C-N 3.35Å; T180-C182 PolarHBondContact O-N 3.02Å; C182-R185 PolarHBondContact O-N 2.66Å; C182-M186 VanDerWaalsContact O-CG 3.28Å; C182-M186 WeakPolarHBondContact O-CG 3.25Å; C182-M186 PolarHBondContact O-N 2.9Å; C182-M186 VanDerWaalsContact O-N 3.11Å
183	Q	75.4	Confident	68.8	Low	89 Å²	89	91.5 Å²	91.5	42%	0.416	48%	0.478	S	S	.	.	H	α-helix	trans	-61.3	-47.4	177.3	-174.1	175.9	5.6	0	0	111.5	C179 T180 R185 M186 H187	C179-Q183 PolarHBondContact O-N 2.83Å; T180-Q183 PolarHBondContact O-N 3.07Å; Q183-R185 VanDerWaalsContact C-N 3.32Å; Q183-R185 PolarHBondContact O-N 3.48Å; Q183-M186 WeakPolarHBondContact O-CB 3.43Å; Q183-M186 PolarHBondContact O-N 3.29Å; Q183-H187 PolarHBondContact O-CD2 2.93Å; Q183-H187 PolarHBondContact O-N 2.87Å; Q183-H187 VanDerWaalsContact O-N 3.13Å
184	K	67.7	Low	66.1	Low	108 Å²	108	98 Å²	98	47%	0.47	51%	0.506	S	S	.	.	H	α-helix	trans	-50.7	-49.3	174.2	-75.9	166.7	-178.1	171.5	0	112	T180 E181 M186 H187 F188	T180-K184 WeakPolarHBondContact O-CB 3.49Å; T180-K184 VanDerWaalsContact O-CG 3.25Å; T180-K184 WeakPolarHBondContact O-CG 3.05Å; T180-K184 PolarHBondContact O-N 3Å; E181-K184 WeakPolarHBondContact OE1-CE 3.47Å; E181-K184 IonicContact OE1-NZ 2.75Å; E181-K184 PolarHBondContact OE1-NZ 2.99Å; E181-K184 WeakPolarHBondContact OE2-CD 3.33Å; E181-K184 IonicContact OE2-NZ 2.9Å; E181-K184 PolarHBondContact OE2-NZ 3.1Å; K184-M186 VanDerWaalsContact C-N 3.3Å; K184-M186 PolarHBondContact O-N 3.13Å; K184-H187 PolarHBondContact O-N 3.49Å; K184-F188 WeakPolarHBondContact O-CB 3.38Å; K184-F188 PolarHBondContact O-N 3.34Å
185	R	63.6	Low	63.4	Low	133 Å²	133	97.2 Å²	97.2	50%	0.502	52%	0.516	S	S	.	.	H	α-helix	trans	-65.7	-30.6	179.3	-63.8	175.7	-154.8	-173.8	2.6	112.9	E181 C182 Q183	E181-R185 WeakPolarHBondContact O-CG 3.29Å; E181-R185 PolarHBondContact O-NE 3.2Å; C182-R185 PolarHBondContact O-N 2.66Å; Q183-R185 VanDerWaalsContact C-N 3.32Å; Q183-R185 PolarHBondContact O-N 3.48Å
186	M	54.6	Low	60.6	Low	146 Å²	146	106.6 Å²	106.6	72%	0.719	56%	0.557	S	S	*	*	H	α-helix	trans	-70.4	-31.7	175.3	-66.5	-99.9	56.2	0	0	112.5	C182 Q183 K184	C182-M186 VanDerWaalsContact O-CG 3.28Å; C182-M186 WeakPolarHBondContact O-CG 3.25Å; C182-M186 PolarHBondContact O-N 2.9Å; C182-M186 VanDerWaalsContact O-N 3.11Å; Q183-M186 WeakPolarHBondContact O-CB 3.43Å; Q183-M186 PolarHBondContact O-N 3.29Å; K184-M186 VanDerWaalsContact C-N 3.3Å; K184-M186 PolarHBondContact O-N 3.13Å
187	H	60	Low	58.2	Low	131 Å²	131	113.8 Å²	113.8	61%	0.606	59%	0.59	S	S	*	*	H	α-helix	trans	-91.4	-33.3	179.7	-64.7	-68.7	0	0	0	114	Q183 K184 N189	Q183-H187 PolarHBondContact O-CD2 2.93Å; Q183-H187 PolarHBondContact O-N 2.87Å; Q183-H187 VanDerWaalsContact O-N 3.13Å; K184-H187 PolarHBondContact O-N 3.49Å; H187-N189 PolarHBondContact O-N 3.15Å; H187-N189 VanDerWaalsContact O-N 3.14Å
188	F	47.1	Very low	56	Low	152 Å²	152	115.2 Å²	115.2	67%	0.667	60%	0.6	S	S	*	*	H	α-helix	trans	-61.7	-21.1	176.8	-105.2	-90.5	0	0	0	113.7	K184 S190	K184-F188 WeakPolarHBondContact O-CB 3.38Å; K184-F188 PolarHBondContact O-N 3.34Å; F188-S190 PolarHBondContact O-N 2.98Å; F188-S190 VanDerWaalsContact O-N 3.14Å
189	N	43.3	Very low	53.5	Low	146 Å²	146	121.7 Å²	121.7	78%	0.781	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	10.8	-172.9	-123	115.2	0	0	0	115	H187	H187-N189 PolarHBondContact O-N 3.15Å; H187-N189 VanDerWaalsContact O-N 3.14Å
190	S	46.5	Very low	51	Low	92 Å²	92	126 Å²	126	64%	0.643	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	-4.8	-174.2	-165	0	0	0	0	116.3	F188	F188-S190 PolarHBondContact O-N 2.98Å; F188-S190 VanDerWaalsContact O-N 3.14Å
191	N	36.2	Very low	48.8	Very low	152 Å²	152	128.4 Å²	128.4	81%	0.813	67%	0.671	S	S	*	*			trans	-149.3	118.5	168.1	-100.5	-15.4	0	0	0	109.6	L193	N191-L193 PolarHBondContact O-N 2.97Å
192	G	40.8	Very low	46.4	Very low	81 Å²	81	129.9 Å²	129.9	84%	0.835	69%	0.689	S	S	*	*			trans	-96.7	74	-175.8	0	0	0	0	0	113.1
193	L	40.5	Very low	44.8	Very low	160 Å²	160	134.2 Å²	134.2	84%	0.838	72%	0.716	S	S	*	*			trans	-135.9	135.9	165.9	-72.5	177.2	0	0	0	110	N191 P195	N191-L193 PolarHBondContact O-N 2.97Å; L193-P195 WeakPolarHBondContact O-CD 3.28Å
194	E	38	Very low	43.3	Very low	185 Å²	185	137.3 Å²	137.3	86%	0.864	74%	0.735	S	S	*	*			trans	-67.1	123.1	179.6	-73.9	-87.7	94.4	0	0	111.2	K196	E194-K196 PolarHBondContact O-N 3.26Å; E194-K196 VanDerWaalsContact O-N 3.15Å
195	P	35.9	Very low	42.1	Very low	103 Å²	103	138.8 Å²	138.8	67%	0.669	75%	0.753	S	S	*	*			trans	-73.9	103.9	169.5	-10.6	27.3	0	0	0	109.3	L193 E197	L193-P195 WeakPolarHBondContact O-CD 3.28Å; P195-E197 PolarHBondContact O-N 3.11Å
196	K	34	Very low	41	Very low	201 Å²	201	138.5 Å²	138.5	87%	0.874	77%	0.771	S	S	*	*			trans	-70.3	127.3	173.9	-155.3	-179.6	-172.8	-175.5	0	109.5	E194 N198	E194-K196 PolarHBondContact O-N 3.26Å; E194-K196 VanDerWaalsContact O-N 3.15Å; K196-N198 PolarHBondContact O-N 3.34Å
197	E	39.4	Very low	40.2	Very low	170 Å²	170	134.2 Å²	134.2	79%	0.794	77%	0.765	S	S	*	*	S	Bend	trans	-62	115.2	-176.9	60.2	-153.2	83.3	0	0	113.1	P195	P195-E197 PolarHBondContact O-N 3.11Å
198	N	42.7	Very low	39.6	Very low	156 Å²	156	135.8 Å²	135.8	83%	0.834	78%	0.776	S	S	*	*			trans	165.8	85.2	140.1	-94.4	-72.6	0	0	0	112.3	K196	K196-N198 PolarHBondContact O-N 3.34Å
199	E	32.8	Very low	39.9	Very low	171 Å²	171	134.4 Å²	134.4	80%	0.799	77%	0.774	S	S	*	*			trans	-160	152.8	154.3	-116	-144	78.6	0	0	110.3
200	P	37.6	Very low	39.9	Very low	98 Å²	98	130.9 Å²	130.9	64%	0.636	76%	0.755	S	S	*	*			trans	-77.8	146.8	171.6	33.3	-32.4	0	0	0	111.1	S202	P200-S202 PolarHBondContact O-N 3.42Å; P200-S202 VanDerWaalsContact O-N 3.16Å
201	P	34.5	Very low	40.2	Very low	127 Å²	127	136.5 Å²	136.5	83%	0.825	76%	0.764	S	S	*	*			trans	-70.6	113.9	-174.9	27.4	-34.4	0	0	0	112.6
202	S	27.6	Very low	40.7	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	75%	0.747	S	S	*	*			trans	-61.7	131.7	172.5	-82	0	0	0	0	112.1	P200 L204	P200-S202 PolarHBondContact O-N 3.42Å; P200-S202 VanDerWaalsContact O-N 3.16Å; S202-L204 VanDerWaalsContact C-N 3.32Å; S202-L204 PolarHBondContact O-N 2.97Å
203	P	42.8	Very low	41.5	Very low	120 Å²	120	133.6 Å²	133.6	78%	0.779	73%	0.728	S	S	*	*			trans	-86.9	48.8	-164	36.1	-39.1	0	0	0	114.4
204	L	44.3	Very low	41.9	Very low	154 Å²	154	129.1 Å²	129.1	81%	0.806	71%	0.708	S	S	*	*			trans	-124.5	38.5	-168.5	-71.2	179.2	0	0	0	116.9	S202	S202-L204 VanDerWaalsContact C-N 3.32Å; S202-L204 PolarHBondContact O-N 2.97Å
205	V	41.1	Very low	42.8	Very low	140 Å²	140	127.4 Å²	127.4	85%	0.848	70%	0.704	S	S	*	*			trans	-138.6	71.9	149	-165.8	0	0	0	0	111.2
206	S	41.4	Very low	44.2	Very low	126 Å²	126	124.5 Å²	124.5	88%	0.881	68%	0.684	S	S	*	*			trans	-106	44.7	154.9	-72.9	0	0	0	0	110.6
207	G	37.8	Very low	45.1	Very low	57 Å²	57	119 Å²	119	59%	0.588	67%	0.671	S	S	*	*			trans	-70	130.4	168.3	0	0	0	0	0	110	I209	G207-I209 PolarHBondContact O-N 3.15Å
208	I	47.1	Very low	45.8	Very low	164 Å²	164	115.9 Å²	115.9	84%	0.841	66%	0.664	S	S	*	*			trans	-64	128.1	-178.7	-140.8	74.7	0	0	0	109.4	D210	I208-D210 PolarHBondContact O-N 2.91Å
209	I	53	Low	46.9	Very low	122 Å²	122	110.6 Å²	110.6	63%	0.626	63%	0.633	S	S	*	*			trans	-79.2	103.3	171.6	-60.4	178.8	0	0	0	106.9	G207 Y211	G207-I209 PolarHBondContact O-N 3.15Å; I209-Y211 VanDerWaalsContact O-CD2 3.28Å; I209-Y211 WeakPolarHBondContact O-CD2 3.38Å; I209-Y211 PolarHBondContact O-N 3.31Å
210	D	43.8	Very low	49.1	Very low	73 Å²	73	107 Å²	107	39%	0.39	62%	0.618	S	S	.	*			trans	-67.3	105.8	173.2	177.5	21.8	0	0	0	110.4	I208 N212 M213	I208-D210 PolarHBondContact O-N 2.91Å; D210-N212 PolarHBondContact O-N 3.4Å; D210-N212 VanDerWaalsContact OD1-CB 3.31Å; D210-N212 WeakPolarHBondContact OD1-CB 3.4Å; D210-N212 PolarHBondContact OD1-N 2.98Å; D210-N212 PolarHBondContact OD1-ND2 3.44Å; D210-M213 PolarHBondContact O-N 2.9Å; D210-M213 VanDerWaalsContact O-N 3.15Å
211	Y	52.4	Low	50.4	Low	210 Å²	210	108.9 Å²	108.9	82%	0.824	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-3.2	177.5	-68	-79.5	0	0	0	114.1	I209	I209-Y211 VanDerWaalsContact O-CD2 3.28Å; I209-Y211 WeakPolarHBondContact O-CD2 3.38Å; I209-Y211 PolarHBondContact O-N 3.31Å
212	N	47	Very low	52	Low	85 Å²	85	108.2 Å²	108.2	46%	0.455	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.9	-12.4	173.5	-60.2	-71.5	0	0	0	114.2	D210 R501	D210-N212 PolarHBondContact O-N 3.4Å; D210-N212 VanDerWaalsContact OD1-CB 3.31Å; D210-N212 WeakPolarHBondContact OD1-CB 3.4Å; D210-N212 PolarHBondContact OD1-N 2.98Å; D210-N212 PolarHBondContact OD1-ND2 3.44Å; N212-R501 PolarHBondContact OD1-NH1 2.83Å; N212-R501 PolarHBondContact OD1-NH2 3.41Å
213	M	57.1	Low	53.9	Low	87 Å²	87	107.8 Å²	107.8	43%	0.429	59%	0.591	S	S	.	*	S	Bend	trans	-71.6	126.3	179.9	-79.4	-63.5	106.2	0	0	112.4	D210 L215 Y219	D210-M213 PolarHBondContact O-N 2.9Å; D210-M213 VanDerWaalsContact O-N 3.15Å; M213-L215 PolarHBondContact O-N 3.11Å; M213-Y219 HydrophobicContact CB-CE1 4.25Å; M213-Y219 WeakPolarHBondContact CG-OH 3.35Å; M213-Y219 HydrophobicContact SD-CE1 4.49Å; M213-Y219 HydrophobicContact SD-CE2 3.52Å; M213-Y219 VanDerWaalsContact SD-CE2 3.52Å; M213-Y219 VanDerWaalsContact SD-CZ 3.52Å; M213-Y219 PolarHBondContact SD-OH 3.42Å
214	P	50.5	Low	55.1	Low	66 Å²	66	108.2 Å²	108.2	43%	0.429	58%	0.58	S	S	.	*			trans	-74.8	122.3	-174.5	29.9	-34.4	0	0	0	110.9	T216 Y219	P214-T216 HydrophobicContact CB-CG2 4.31Å; P214-T216 PolarHBondContact O-N 3.09Å; P214-Y219 WeakPolarHBondContact O-CB 3.47Å
215	L	55.1	Low	56	Low	149 Å²	149	106.5 Å²	106.5	78%	0.78	57%	0.571	S	S	*	*			trans	-72.6	43.9	176.1	-65.7	170.6	0	0	0	113.1	M213 L220	M213-L215 PolarHBondContact O-N 3.11Å; L215-L220 HydrophobicContact CD2-CD1 4.22Å
216	T	65.8	Low	57.1	Low	42 Å²	42	106.1 Å²	106.1	26%	0.258	55%	0.554	S	S	.	*			trans	-77.9	148.4	174.4	59.7	0	0	0	0	110.7	P214 T218 Y219 L220	P214-T216 HydrophobicContact CB-CG2 4.31Å; P214-T216 PolarHBondContact O-N 3.09Å; T216-T218 PolarHBondContact O-N 3.24Å; T216-Y219 PolarHBondContact O-N 3.27Å; T216-Y219 VanDerWaalsContact O-N 3.09Å; T216-Y219 WeakPolarHBondContact OG1-CB 3.5Å; T216-Y219 PolarHBondContact OG1-N 3.35Å; T216-L220 WeakPolarHBondContact O-CD1 3.36Å; T216-L220 PolarHBondContact O-N 2.87Å
217	S	53	Low	58.2	Low	86 Å²	86	104.6 Å²	104.6	60%	0.601	54%	0.54	S	S	*	.	H	α-helix	trans	-55.9	-34.3	175.1	-175.3	0	0	0	0	111.9	K221	S217-K221 WeakPolarHBondContact O-CB 3.3Å; S217-K221 VanDerWaalsContact O-CG 3.25Å; S217-K221 WeakPolarHBondContact O-CG 3.19Å; S217-K221 PolarHBondContact O-N 3.05Å
218	T	54.6	Low	59	Low	103 Å²	103	106.2 Å²	106.2	63%	0.632	53%	0.533	S	S	*	.	H	α-helix	trans	-65.5	-46.5	173.9	3.1	0	0	0	0	112.8	T216 K221 Q222	T216-T218 PolarHBondContact O-N 3.24Å; T218-K221 PolarHBondContact O-N 3.45Å; T218-Q222 WeakPolarHBondContact O-CB 3.46Å; T218-Q222 PolarHBondContact O-N 3.47Å
219	Y	65.8	Low	59.4	Low	46 Å²	46	103.3 Å²	103.3	18%	0.18	52%	0.519	C	S	.	.	H	α-helix	trans	-64	-45.7	178.1	-176.5	-92.7	0	0	0	111.4	M213 P214 T216 K221 Q222 M223	M213-Y219 HydrophobicContact CB-CE1 4.25Å; M213-Y219 WeakPolarHBondContact CG-OH 3.35Å; M213-Y219 HydrophobicContact SD-CE1 4.49Å; M213-Y219 HydrophobicContact SD-CE2 3.52Å; M213-Y219 VanDerWaalsContact SD-CE2 3.52Å; M213-Y219 VanDerWaalsContact SD-CZ 3.52Å; M213-Y219 PolarHBondContact SD-OH 3.42Å; P214-Y219 WeakPolarHBondContact O-CB 3.47Å; T216-Y219 PolarHBondContact O-N 3.27Å; T216-Y219 VanDerWaalsContact O-N 3.09Å; T216-Y219 WeakPolarHBondContact OG1-CB 3.5Å; T216-Y219 PolarHBondContact OG1-N 3.35Å; Y219-K221 VanDerWaalsContact C-N 3.3Å; Y219-K221 PolarHBondContact O-N 2.93Å; Y219-Q222 PolarHBondContact O-N 2.85Å; Y219-M223 HydrophobicContact CE1-CE 4.2Å; Y219-M223 HydrophobicContact CE1-SD 3.75Å; Y219-M223 WeakPolarHBondContact O-CB 3.28Å; Y219-M223 PolarHBondContact O-N 3.08Å; Y219-M223 WeakPolarHBondContact OH-CE 3.44Å
220	L	78.3	Confident	59	Low	96 Å²	96	100.9 Å²	100.9	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-61	-37.8	175.6	-88.1	73.6	0	0	0	112	L215 T216 K224	L215-L220 HydrophobicContact CD2-CD1 4.22Å; T216-L220 WeakPolarHBondContact O-CD1 3.36Å; T216-L220 PolarHBondContact O-N 2.87Å; L220-K224 VanDerWaalsContact O-CB 3.31Å; L220-K224 WeakPolarHBondContact O-CB 3.14Å; L220-K224 PolarHBondContact O-N 3.16Å
221	K	65	Low	58.9	Low	136 Å²	136	103.7 Å²	103.7	59%	0.591	52%	0.524	S	S	*	.	H	α-helix	trans	-65.1	-45.1	172.8	-79.2	176.7	179	-171.6	0	112.5	S217 T218 Y219 M223 K224 L225	S217-K221 WeakPolarHBondContact O-CB 3.3Å; S217-K221 VanDerWaalsContact O-CG 3.25Å; S217-K221 WeakPolarHBondContact O-CG 3.19Å; S217-K221 PolarHBondContact O-N 3.05Å; T218-K221 PolarHBondContact O-N 3.45Å; Y219-K221 VanDerWaalsContact C-N 3.3Å; Y219-K221 PolarHBondContact O-N 2.93Å; K221-M223 VanDerWaalsContact C-N 3.33Å; K221-M223 PolarHBondContact O-N 2.83Å; K221-K224 PolarHBondContact O-N 2.98Å; K221-L225 WeakPolarHBondContact O-CB 3.45Å; K221-L225 WeakPolarHBondContact O-CG 3.49Å; K221-L225 PolarHBondContact O-N 3.24Å
222	Q	67.9	Low	58.4	Low	114 Å²	114	100.1 Å²	100.1	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-67.9	-33.6	179.9	-164.2	-172.5	20.9	0	0	112.1	T218 Y219 R226	T218-Q222 WeakPolarHBondContact O-CB 3.46Å; T218-Q222 PolarHBondContact O-N 3.47Å; Y219-Q222 PolarHBondContact O-N 2.85Å; Q222-R226 PolarHBondContact O-N 3.42Å; Q222-R226 VanDerWaalsContact O-N 3.08Å
223	M	67.6	Low	58.1	Low	87 Å²	87	102.6 Å²	102.6	43%	0.429	52%	0.524	S	S	.	.	H	α-helix	trans	-71.5	-41.6	173.7	-158.4	171.5	-136.6	0	0	111.2	Y219 K221 R226 V227	Y219-M223 HydrophobicContact CE1-CE 4.2Å; Y219-M223 HydrophobicContact CE1-SD 3.75Å; Y219-M223 WeakPolarHBondContact O-CB 3.28Å; Y219-M223 PolarHBondContact O-N 3.08Å; Y219-M223 WeakPolarHBondContact OH-CE 3.44Å; K221-M223 VanDerWaalsContact C-N 3.33Å; K221-M223 PolarHBondContact O-N 2.83Å; M223-R226 PolarHBondContact O-N 2.64Å; M223-V227 WeakPolarHBondContact O-CG2 3.25Å; M223-V227 PolarHBondContact O-N 3.05Å
224	K	68.7	Low	57.2	Low	130 Å²	130	104.9 Å²	104.9	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-62.8	-39.9	172.2	-177.5	167.2	-178.9	169.1	0	112.5	L220 K221 V227 M228	L220-K224 VanDerWaalsContact O-CB 3.31Å; L220-K224 WeakPolarHBondContact O-CB 3.14Å; L220-K224 PolarHBondContact O-N 3.16Å; K221-K224 PolarHBondContact O-N 2.98Å; K224-V227 PolarHBondContact O-N 2.6Å; K224-M228 HydrophobicContact CG-SD 4.22Å; K224-M228 WeakPolarHBondContact O-CG 3.41Å; K224-M228 PolarHBondContact O-N 2.89Å
225	L	63	Low	56.5	Low	117 Å²	117	109.1 Å²	109.1	61%	0.613	55%	0.552	S	S	*	*	H	α-helix	trans	-61.9	-41.6	173.9	-82.5	163.4	0	0	0	112	K221 M228 N229	K221-L225 WeakPolarHBondContact O-CB 3.45Å; K221-L225 WeakPolarHBondContact O-CG 3.49Å; K221-L225 PolarHBondContact O-N 3.24Å; L225-M228 PolarHBondContact O-N 3.2Å; L225-N229 VanDerWaalsContact O-CB 3.31Å; L225-N229 WeakPolarHBondContact O-CB 3.46Å; L225-N229 PolarHBondContact O-N 3.13Å
226	R	63.5	Low	55.7	Low	132 Å²	132	107.2 Å²	107.2	50%	0.498	55%	0.546	S	S	.	.	H	α-helix	trans	-61.2	-44.8	172.8	-98.4	-178.8	-75.2	159	-7.2	112.5	Q222 M223 M228 N229 S230	Q222-R226 PolarHBondContact O-N 3.42Å; Q222-R226 VanDerWaalsContact O-N 3.08Å; M223-R226 PolarHBondContact O-N 2.64Å; R226-M228 PolarHBondContact O-N 3.43Å; R226-N229 PolarHBondContact O-N 3.35Å; R226-S230 PolarHBondContact O-N 3.39Å; R226-S230 PolarHBondContact O-OG 3.31Å
227	V	66.3	Low	54.2	Low	94 Å²	94	110.1 Å²	110.1	57%	0.57	57%	0.568	S	S	*	*	H	α-helix	trans	-62.6	-41.6	177.4	172.5	0	0	0	0	111.8	M223 K224 S230 Q231	M223-V227 WeakPolarHBondContact O-CG2 3.25Å; M223-V227 PolarHBondContact O-N 3.05Å; K224-V227 PolarHBondContact O-N 2.6Å; V227-S230 PolarHBondContact O-N 3.15Å; V227-Q231 PolarHBondContact O-N 2.81Å
228	M	53.7	Low	53.3	Low	91 Å²	91	112.5 Å²	112.5	45%	0.448	58%	0.579	S	S	.	*	H	α-helix	trans	-65.8	-44.9	175.8	-70	179.1	64.2	0	0	111.8	K224 L225 R226 S230 Q231 E232	K224-M228 HydrophobicContact CG-SD 4.22Å; K224-M228 WeakPolarHBondContact O-CG 3.41Å; K224-M228 PolarHBondContact O-N 2.89Å; L225-M228 PolarHBondContact O-N 3.2Å; R226-M228 PolarHBondContact O-N 3.43Å; M228-S230 VanDerWaalsContact C-N 3.28Å; M228-S230 PolarHBondContact O-N 3.03Å; M228-Q231 PolarHBondContact O-N 3.14Å; M228-E232 PolarHBondContact O-N 3.39Å
229	N	55.2	Low	52.3	Low	104 Å²	104	113.1 Å²	113.1	56%	0.556	59%	0.587	S	S	*	*	H	α-helix	trans	-65.9	-27.6	179.3	-165.5	72.6	0	0	0	113.3	L225 R226	L225-N229 VanDerWaalsContact O-CB 3.31Å; L225-N229 WeakPolarHBondContact O-CB 3.46Å; L225-N229 PolarHBondContact O-N 3.13Å; R226-N229 PolarHBondContact O-N 3.35Å
230	S	45.8	Very low	50.9	Low	71 Å²	71	116.5 Å²	116.5	50%	0.497	62%	0.618	S	S	.	*	H	α-helix	trans	-69.9	-36.5	169.9	-66.6	0	0	0	0	112.4	R226 V227 M228 E232 Q233	R226-S230 PolarHBondContact O-N 3.39Å; R226-S230 PolarHBondContact O-OG 3.31Å; V227-S230 PolarHBondContact O-N 3.15Å; M228-S230 VanDerWaalsContact C-N 3.28Å; M228-S230 PolarHBondContact O-N 3.03Å; S230-E232 VanDerWaalsContact C-N 3.25Å; S230-E232 PolarHBondContact O-N 3.23Å; S230-Q233 PolarHBondContact O-N 2.71Å
231	Q	40.7	Very low	49	Very low	132 Å²	132	120.1 Å²	120.1	62%	0.617	63%	0.632	S	S	*	*	H	α-helix	trans	-71.2	-20.6	179.5	-168.3	167.8	-0	0	0	112.9	V227 M228	V227-Q231 PolarHBondContact O-N 2.81Å; M228-Q231 PolarHBondContact O-N 3.14Å
232	E	42.3	Very low	48	Very low	135 Å²	135	119.8 Å²	119.8	63%	0.631	64%	0.637	S	S	*	*	H	α-helix	trans	-84	-4.9	175.5	-68.4	175.6	-148.9	0	0	113.6	M228 S230	M228-E232 PolarHBondContact O-N 3.39Å; S230-E232 VanDerWaalsContact C-N 3.25Å; S230-E232 PolarHBondContact O-N 3.23Å
233	Q	39.7	Very low	46.2	Very low	137 Å²	137	124.1 Å²	124.1	64%	0.64	65%	0.654	S	S	*	*	H	α-helix	trans	-94.5	-40.5	175	-68.2	-166.2	-64.9	0	0	113.9	S230 E235 T236	S230-Q233 PolarHBondContact O-N 2.71Å; Q233-E235 VanDerWaalsContact C-N 3.27Å; Q233-E235 PolarHBondContact O-N 3.25Å; Q233-T236 PolarHBondContact O-N 2.98Å; Q233-T236 VanDerWaalsContact O-N 3.16Å; Q233-T236 PolarHBondContact O-OG1 3.06Å
234	D	38.9	Very low	45	Very low	135 Å²	135	126.9 Å²	126.9	72%	0.722	67%	0.671	S	S	*	*	H	α-helix	trans	-62.6	-32.4	-177.8	-84.8	-27.9	0	0	0	112.9	T236 S237	D234-T236 PolarHBondContact O-N 3.21Å; D234-S237 PolarHBondContact O-N 2.83Å
235	E	36.4	Very low	43.4	Very low	154 Å²	154	129.4 Å²	129.4	72%	0.72	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-3.6	178.1	-60.6	-69.6	154.7	0	0	114	Q233	Q233-E235 VanDerWaalsContact C-N 3.27Å; Q233-E235 PolarHBondContact O-N 3.25Å
236	T	36.8	Very low	42.4	Very low	109 Å²	109	128.8 Å²	128.8	67%	0.669	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-7	176.9	64.3	0	0	0	0	114.3	Q233 D234 V238	Q233-T236 PolarHBondContact O-N 2.98Å; Q233-T236 VanDerWaalsContact O-N 3.16Å; Q233-T236 PolarHBondContact O-OG1 3.06Å; D234-T236 PolarHBondContact O-N 3.21Å; T236-V238 PolarHBondContact O-N 3.28Å; T236-V238 VanDerWaalsContact O-N 3.14Å
237	S	34.9	Very low	40.7	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	71%	0.705	S	S	*	*			trans	-89	61.4	-176.4	-65.3	0	0	0	0	113.7	D234	D234-S237 PolarHBondContact O-N 2.83Å
238	V	34.3	Very low	39.2	Very low	137 Å²	137	128.9 Å²	128.9	83%	0.83	71%	0.706	S	S	*	*			trans	-94	108.4	170.3	-73	0	0	0	0	111.5	T236	T236-V238 PolarHBondContact O-N 3.28Å; T236-V238 VanDerWaalsContact O-N 3.14Å
239	S	33.8	Very low	38.3	Very low	115 Å²	115	129.4 Å²	129.4	80%	0.804	72%	0.715	S	S	*	*			trans	-95.4	124.5	169.2	-176.2	0	0	0	0	110
240	S	36.4	Very low	37.4	Very low	117 Å²	117	136.3 Å²	136.3	82%	0.818	73%	0.733	S	S	*	*			trans	-159	158.6	161.7	-76	0	0	0	0	109.6
241	E	37.3	Very low	36.6	Very low	173 Å²	173	140.4 Å²	140.4	81%	0.808	75%	0.746	S	S	*	*			trans	-96.9	173.5	-160.6	53.3	-130.1	128.4	0	0	115.7
242	D	44.1	Very low	36.1	Very low	129 Å²	129	140 Å²	140	69%	0.69	76%	0.758	S	S	*	*			trans	19.8	131.5	175.5	59.8	-83.3	0	0	0	123
243	F	30.6	Very low	35.5	Very low	204 Å²	204	138.5 Å²	138.5	90%	0.895	77%	0.769	S	S	*	*				-156.1	140.1	114.7	-115.2	-78	0	0	0	110.5
244	D	43.4	Very low	34.9	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	78%	0.777	S	S	*	*			trans	-95.3	130.6	179.8	175.5	31.8	0	0	0	111.8
245	M	34.8	Very low	35.3	Very low	183 Å²	183	136.9 Å²	136.9	90%	0.901	77%	0.769	S	S	*	*			trans	-163.2	127.7	149.8	-119.3	-179.8	-178.5	0	0	113.3
246	S	41.1	Very low	35	Very low	105 Å²	105	136.7 Å²	136.7	73%	0.734	77%	0.768	S	S	*	*			trans	-71.9	148	171.1	56.6	0	0	0	0	113.7
247	D	28.5	Very low	34.9	Very low	143 Å²	143	139 Å²	139	77%	0.765	78%	0.776	S	S	*	*				169.4	171.9	109.9	-173.5	43.4	0	0	0	113.3
248	S	34.6	Very low	34.5	Very low	84 Å²	84	137.7 Å²	137.7	59%	0.587	77%	0.771	S	S	*	*			trans	77.7	66.3	153.2	-82.7	0	0	0	0	118.4
249	T	34.1	Very low	34.3	Very low	103 Å²	103	136.9 Å²	136.9	63%	0.632	77%	0.771	S	S	*	*				32.6	112.7	110.8	-57.8	0	0	0	0	118.4	M251	T249-M251 HydrophobicContact CG2-CE 3.55Å
250	W	37.4	Very low	34	Very low	249 Å²	249	136.1 Å²	136.1	94%	0.943	77%	0.766	S	S	*	*			trans	-127.8	144.5	146.5	-91.8	87.3	0	0	0	110.9
251	M	28.8	Very low	33.7	Very low	157 Å²	157	138.3 Å²	138.3	77%	0.773	77%	0.767	S	S	*	*			trans	-82.1	133.9	-169	-64.6	-82.3	98.9	0	0	112.4	T249	T249-M251 HydrophobicContact CG2-CE 3.55Å
252	S	29.2	Very low	33.3	Very low	123 Å²	123	135.3 Å²	135.3	86%	0.86	77%	0.766	S	S	*	*			trans	-106.7	141.1	154.3	-65.2	0	0	0	0	109.4
253	A	29.7	Very low	33.4	Very low	104 Å²	104	134.5 Å²	134.5	86%	0.86	77%	0.768	S	S	*	*			trans	-94.9	124.7	172.9	0	0	0	0	0	110.2
254	D	28.7	Very low	33.3	Very low	152 Å²	152	129.2 Å²	129.2	81%	0.813	76%	0.756	S	S	*	*			trans	-72.6	-178.7	166.1	-137.6	20.6	0	0	0	109.6
255	P	47.3	Very low	32.7	Very low	85 Å²	85	130.3 Å²	130.3	55%	0.552	76%	0.756	S	S	*	*			cis	-135.1	167.7	-1.6	27.2	-3.5	0	0	0	116.4
256	H	29.7	Very low	32.4	Very low	150 Å²	150	127.5 Å²	127.5	69%	0.694	75%	0.745	S	S	*	*				171.8	120.5	108.7	-100.5	-79.2	0	0	0	115.7
257	L	33.8	Very low	31.9	Very low	159 Å²	159	128.8 Å²	128.8	83%	0.832	74%	0.739	S	S	*	*			trans	65.8	155.2	150.3	-50.3	177.5	0	0	0	120.1
258	A	27.8	Very low	32.1	Very low	75 Å²	75	131.1 Å²	131.1	62%	0.62	74%	0.738	S	S	*	*			cis	-175.4	142.1	-36.6	0	0	0	0	0	109.2
259	S	28.7	Very low	31.9	Very low	119 Å²	119	134.9 Å²	134.9	83%	0.832	75%	0.748	S	S	*	*			trans	64.3	166.7	164.3	-58.8	0	0	0	0	116.8
260	S	27.5	Very low	31.7	Very low	100 Å²	100	141.1 Å²	141.1	70%	0.699	76%	0.76	S	S	*	*			cis	-172.8	165.7	-35.1	65.3	0	0	0	0	107.2
261	L	31.3	Very low	31.3	Very low	162 Å²	162	134.6 Å²	134.6	85%	0.848	75%	0.752	S	S	*	*			cis	-136.9	-173.8	2.9	-78.6	174.4	0	0	0	109.9
262	S	27.9	Very low	32.6	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	75%	0.745	S	S	*	*			trans	-112.3	-159.3	157.3	-49.4	0	0	0	0	108.3
263	P	46.1	Very low	32.6	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	74%	0.744	S	S	*	*			cis	-143.9	168.5	-7.1	45	-26.4	0	0	0	118
264	S	28.3	Very low	32.4	Very low	92 Å²	92	136 Å²	136	64%	0.643	74%	0.738	S	S	*	*			trans	49.7	154.8	130.6	75.7	0	0	0	0	127.2
265	Q	31	Very low	32.4	Very low	169 Å²	169	135.3 Å²	135.3	79%	0.79	73%	0.734	S	S	*	*			trans	75	148.3	155.8	-65.7	-166.6	-90.6	0	0	118
266	D	29.4	Very low	31.5	Very low	124 Å²	124	139.1 Å²	139.1	66%	0.663	74%	0.744	S	S	*	*			cis	-163.6	-171.7	-14.6	-120.7	-46.1	0	0	0	108.5
267	E	30.9	Very low	31.5	Very low	132 Å²	132	135.8 Å²	135.8	62%	0.617	74%	0.738	S	S	*	*			cis	-153.5	156.9	4.4	-136.7	-152.3	165.2	0	0	112
268	R	31.1	Very low	31.3	Very low	192 Å²	192	136 Å²	136	73%	0.725	73%	0.734	S	S	*	*			trans	61.9	96.7	132	-160.3	166.2	-167.3	150.3	-4.7	124.5
269	M	31.8	Very low	31.5	Very low	163 Å²	163	139.3 Å²	139.3	80%	0.803	74%	0.737	S	S	*	*				68	136.2	118	-77.5	-77.5	-151.9	0	0	125.2
270	R	30.5	Very low	31.5	Very low	233 Å²	233	140.3 Å²	140.3	88%	0.879	73%	0.733	S	S	*	*			trans	94.5	161.5	147.8	-76.6	174.9	179.7	-109.5	-0.6	120.6
271	S	28.5	Very low	32.1	Very low	113 Å²	113	143 Å²	143	79%	0.79	74%	0.739	S	S	*	*			trans	-157.3	179.8	-158.1	-137.5	0	0	0	0	108.4
272	P	54.8	Low	32.2	Very low	96 Å²	96	142.3 Å²	142.3	62%	0.623	74%	0.737	S	S	*	*			cis	-140.5	-175.2	-10	41.7	-23.2	0	0	0	115.7
273	Q	30	Very low	33.2	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	73%	0.731	S	S	*	*			trans	67.8	139.8	163.1	-52.7	-179.7	6.7	0	0	117.3
274	N	25.3	Very low	32.9	Very low	136 Å²	136	141.6 Å²	141.6	73%	0.727	73%	0.734	S	S	*	*			cis	-174.7	167.9	40.8	-164.1	2.9	0	0	0	112.3
275	L	29.3	Very low	33.4	Very low	139 Å²	139	142.2 Å²	142.2	73%	0.728	74%	0.739	S	S	*	*			trans	66.6	123.8	154	-89	163.5	0	0	0	124.6
276	H	28.8	Very low	34	Very low	165 Å²	165	142.3 Å²	142.3	76%	0.764	74%	0.739	S	S	*	*			trans	79.2	107.6	132.2	-128.9	69.5	0	0	0	124.1
277	S	28.3	Very low	34.3	Very low	80 Å²	80	142.1 Å²	142.1	56%	0.559	75%	0.747	S	S	*	*				48.8	125	128.5	-43.5	0	0	0	0	124.8
278	Q	30.8	Very low	34.5	Very low	162 Å²	162	139 Å²	139	76%	0.757	75%	0.751	S	S	*	*				82.9	149.2	128.9	-155.6	172.3	-45.5	0	0	120.6
279	E	30.5	Very low	34.9	Very low	145 Å²	145	135.9 Å²	135.9	68%	0.678	76%	0.758	S	S	*	*			trans	56.6	140.5	164.5	52	-154.3	75.6	0	0	119.8
280	D	30.6	Very low	35.2	Very low	140 Å²	140	131.5 Å²	131.5	75%	0.749	76%	0.755	S	S	*	*			cis	-162.5	171.6	-10.4	-99.3	-18.1	0	0	0	111
281	D	38.5	Very low	35.5	Very low	156 Å²	156	128.6 Å²	128.6	83%	0.834	76%	0.757	S	S	*	*			trans	59.6	158.6	165.9	-69.6	-42.9	0	0	0	119.5
282	D	34.7	Very low	35.8	Very low	149 Å²	149	126.4 Å²	126.4	80%	0.797	75%	0.753	S	S	*	*			cis	-149.7	-164.5	27.1	-158.7	-15.5	0	0	0	113.2
283	S	48.7	Very low	34.7	Very low	95 Å²	95	126.8 Å²	126.8	66%	0.664	76%	0.757	S	S	*	*			trans	-112.5	150.5	-146.9	-49.4	0	0	0	0	118.2
284	S	39.2	Very low	34.8	Very low	112 Å²	112	123.2 Å²	123.2	78%	0.783	75%	0.753	S	S	*	*			trans	178.1	118.5	143.3	-81.6	0	0	0	0	110.4
285	S	38.6	Very low	35.2	Very low	106 Å²	106	122.3 Å²	122.3	74%	0.741	75%	0.752	S	S	*	*				76.2	133.3	84.9	-62.5	0	0	0	0	113.8
286	E	44.1	Very low	35.8	Very low	170 Å²	170	122.3 Å²	122.3	79%	0.794	75%	0.752	S	S	*	*			cis	-164.6	155.9	8.1	53.1	-161.3	74.8	0	0	114.3
287	S	34.9	Very low	36	Very low	120 Å²	120	121.1 Å²	121.1	84%	0.839	75%	0.751	S	S	*	*			trans	47.3	150.2	150.4	-56	0	0	0	0	122.8
288	G	36	Very low	37.3	Very low	67 Å²	67	123.2 Å²	123.2	69%	0.691	76%	0.763	S	S	*	*			cis	130.1	151.5	-0.6	0	0	0	0	0	113
289	S	38.8	Very low	37.5	Very low	126 Å²	126	121.2 Å²	121.2	88%	0.881	77%	0.767	S	S	*	*			cis	-169.8	143.6	-9.1	-77.8	0	0	0	0	112
290	G	38.6	Very low	37.5	Very low	72 Å²	72	121.6 Å²	121.6	74%	0.742	78%	0.779	S	S	*	*			trans	96.8	160.8	145.5	0	0	0	0	0	118.8
291	N	37	Very low	37.6	Very low	171 Å²	171	120 Å²	120	91%	0.914	78%	0.779	S	S	*	*			cis	-142.2	172.3	2.7	-70.2	-28.3	0	0	0	108.5
292	G	34.6	Very low	37.2	Very low	68 Å²	68	118 Å²	118	70%	0.701	78%	0.777	S	S	*	*			cis	149.9	167.3	7.5	0	0	0	0	0	109.3
293	S	31.4	Very low	37	Very low	103 Å²	103	115.9 Å²	115.9	72%	0.72	77%	0.774	S	S	*	*			cis	-169.8	133.5	-9.3	-74.5	0	0	0	0	111.5
294	S	33.2	Very low	36.2	Very low	106 Å²	106	117.3 Å²	117.3	74%	0.741	78%	0.779	S	S	*	*				64.3	154.5	129	-53	0	0	0	0	122.9
295	T	32.4	Very low	35.7	Very low	116 Å²	116	121.4 Å²	121.4	71%	0.712	79%	0.786	S	S	*	*			cis	-170.7	137.6	-22.2	33.1	0	0	0	0	113.1
296	L	42.6	Very low	35.2	Very low	140 Å²	140	120.3 Å²	120.3	73%	0.733	79%	0.791	S	S	*	*			trans	52.7	127	136.2	-57.2	177.4	0	0	0	126.2
297	N	32.5	Very low	34.3	Very low	140 Å²	140	119.9 Å²	119.9	75%	0.749	80%	0.795	S	S	*	*			trans	71.1	176.2	134.6	-58.5	-7.9	0	0	0	120.5
298	P	55.3	Low	35.2	Very low	124 Å²	124	119.3 Å²	119.3	81%	0.805	79%	0.788	S	S	*	*				-128.7	-173.8	-74.8	41.2	-25.4	0	0	0	114.9
299	S	35.3	Very low	34.9	Very low	119 Å²	119	120.9 Å²	120.9	83%	0.832	79%	0.794	S	S	*	*			trans	-72.9	147.8	-165	-39.9	0	0	0	0	118.8
300	T	30.8	Very low	34.5	Very low	154 Å²	154	124.6 Å²	124.6	95%	0.945	80%	0.795	S	S	*	*			trans	-161.9	172.1	144.4	13.7	0	0	0	0	110.2
301	S	32.6	Very low	35.4	Very low	107 Å²	107	126.2 Å²	126.2	75%	0.748	79%	0.792	S	S	*	*			trans	-115.8	144.2	-163.6	54.2	0	0	0	0	115.7
302	S	29.5	Very low	35.1	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	79%	0.789	S	S	*	*			trans	178.2	128	135.6	-82	0	0	0	0	115.6
303	S	30.7	Very low	35.2	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	79%	0.791	S	S	*	*				53.6	147.8	125.5	-49	0	0	0	0	125.6
304	T	32.6	Very low	35.2	Very low	124 Å²	124	133 Å²	133	76%	0.761	80%	0.796	S	S	*	*			trans	80.1	109.5	151.9	44.2	0	0	0	0	123.3
305	Q	29.4	Very low	35.2	Very low	198 Å²	198	130.5 Å²	130.5	93%	0.925	79%	0.786	S	S	*	*			trans	46.7	133.2	131.9	-66.1	179.9	-62.5	0	0	122.9
306	G	27.9	Very low	35.3	Very low	83 Å²	83	133.4 Å²	133.4	86%	0.856	80%	0.798	S	S	*	*			trans	178	84.3	165.6	0	0	0	0	0	115.4
307	D	25.4	Very low	34.8	Very low	162 Å²	162	130.4 Å²	130.4	87%	0.866	80%	0.801	S	S	*	*			trans	-91.1	179.3	165.3	-124.1	-34.8	0	0	0	109.5
308	P	52.5	Low	34.8	Very low	108 Å²	108	128.5 Å²	128.5	70%	0.701	81%	0.805	S	S	*	*			cis	-136.8	170.9	-17.4	40.4	-24.4	0	0	0	115.5
309	A	29.6	Very low	33.8	Very low	100 Å²	100	129.4 Å²	129.4	83%	0.826	81%	0.808	S	S	*	*			trans	-169.1	154.3	148.2	0	0	0	0	0	114.1
310	F	29.9	Very low	33.9	Very low	204 Å²	204	127.7 Å²	127.7	90%	0.895	80%	0.801	S	S	*	*			trans	-128.8	-178.7	-176.4	-96	-83.4	0	0	0	110
311	P	58.4	Low	34.8	Very low	105 Å²	105	125.1 Å²	125.1	68%	0.682	79%	0.787	S	S	*	*			cis	-133.6	179.6	-17.8	35.3	-16.7	0	0	0	114.4
312	E	30.6	Very low	35	Very low	179 Å²	179	127.4 Å²	127.4	84%	0.836	79%	0.787	S	S	*	*				-175.1	172.7	113.9	-99.5	-157.5	80.4	0	0	114
313	M	37.4	Very low	34.9	Very low	153 Å²	153	128.9 Å²	128.9	75%	0.754	79%	0.786	S	S	*	*			trans	-55.5	163.3	-170.1	64.7	138.2	97.6	0	0	116.3
314	N	31	Very low	34.7	Very low	153 Å²	153	132.6 Å²	132.6	82%	0.818	79%	0.79	S	S	*	*			cis	-159.8	178.4	8.3	-134.5	-3.5	0	0	0	108.8
315	G	33.3	Very low	34.6	Very low	53 Å²	53	132.3 Å²	132.3	55%	0.546	79%	0.788	S	S	.	*			cis	158.9	135.2	-4.9	0	0	0	0	0	112.6
316	N	33.5	Very low	34.6	Very low	177 Å²	177	129.3 Å²	129.3	95%	0.947	78%	0.783	S	S	*	*			trans	63.4	138.8	-178.8	-56.6	-7.4	0	0	0	116.4
317	G	33.5	Very low	34.6	Very low	78 Å²	78	130 Å²	130	80%	0.804	78%	0.78	S	S	*	*			cis	171.1	157.9	-5.5	0	0	0	0	0	108.9
318	A	31.6	Very low	34.9	Very low	100 Å²	100	126.4 Å²	126.4	83%	0.826	77%	0.774	S	S	*	*			cis	-153.9	177.2	4.6	0	0	0	0	0	112.3
319	V	34.6	Very low	33.8	Very low	143 Å²	143	130.5 Å²	130.5	87%	0.867	78%	0.784	S	S	*	*			trans	-43.8	161.2	178.6	-66.9	0	0	0	0	117
320	A	38	Very low	34.1	Very low	83 Å²	83	133 Å²	133	69%	0.686	78%	0.783	S	S	*	*			cis	-153.8	171.8	29.8	0	0	0	0	0	115.9
321	P	49.3	Very low	34.3	Very low	100 Å²	100	131 Å²	131	65%	0.649	78%	0.777	S	S	*	*			trans	-81.4	-170.8	-176.7	-8.6	29.2	0	0	0	114.7
322	M	36	Very low	34	Very low	155 Å²	155	130.8 Å²	130.8	76%	0.764	78%	0.775	S	S	*	*			cis	-149.3	143.9	48.1	-30.6	-67.1	160.3	0	0	110.1
323	D	28.6	Very low	34.2	Very low	143 Å²	143	128.8 Å²	128.8	77%	0.765	77%	0.768	S	S	*	*				53.6	127.5	82.2	-97.7	-31.2	0	0	0	114.2
324	F	26.5	Very low	33.7	Very low	184 Å²	184	128.2 Å²	128.2	81%	0.807	77%	0.769	S	S	*	*			cis	-154.2	176.9	37	-144.5	-100.1	0	0	0	113.3
325	T	29.3	Very low	33.7	Very low	117 Å²	117	128.8 Å²	128.8	72%	0.718	77%	0.771	S	S	*	*			trans	-121.3	151.8	-178.4	57.3	0	0	0	0	115.1
326	T	29	Very low	33.5	Very low	135 Å²	135	131.6 Å²	131.6	83%	0.828	78%	0.781	S	S	*	*			trans	173.8	132.3	145.4	31	0	0	0	0	108.3
327	A	28.8	Very low	33.2	Very low	97 Å²	97	129.6 Å²	129.6	80%	0.802	77%	0.77	S	S	*	*				67.2	134.8	67.8	0	0	0	0	0	113.6
328	A	31.1	Very low	32.9	Very low	88 Å²	88	134.7 Å²	134.7	73%	0.727	77%	0.77	S	S	*	*			cis	-133.1	-148.3	-2.6	0	0	0	0	0	109.6
329	E	29.2	Very low	32.7	Very low	194 Å²	194	137.7 Å²	137.7	91%	0.907	77%	0.771	S	S	*	*			cis	-156.9	-158.3	5.7	-147.7	158.9	104.3	0	0	110.8
330	D	35.5	Very low	33.7	Very low	152 Å²	152	136.2 Å²	136.2	81%	0.813	77%	0.765	S	S	*	*			trans	-107.5	-171.6	-165.9	-148.4	-85.8	0	0	0	116.2
331	Q	34.2	Very low	33.9	Very low	163 Å²	163	138 Å²	138	76%	0.762	77%	0.769	S	S	*	*			trans	-76.8	-175.5	-179.6	-74.5	-121.5	-12.4	0	0	112.5
332	P	52.1	Low	32.9	Very low	100 Å²	100	137.2 Å²	137.2	65%	0.649	77%	0.772	S	S	*	*			cis	-159.5	171.2	26.7	47.7	-24.8	0	0	0	123
333	I	35.5	Very low	32.5	Very low	136 Å²	136	136.7 Å²	136.7	70%	0.697	78%	0.777	S	S	*	*			trans	57.2	147.7	151.7	-48.9	142	0	0	0	122
334	N	27.7	Very low	32.6	Very low	142 Å²	142	133.9 Å²	133.9	76%	0.759	77%	0.774	S	S	*	*			trans	101.9	150.6	165.1	-62	-73	0	0	0	116.1
335	L	29.8	Very low	32.8	Very low	165 Å²	165	133.8 Å²	133.8	86%	0.864	78%	0.781	S	S	*	*			cis	-145	-155.3	2.8	-131.1	164.1	0	0	0	111.2
336	C	29.3	Very low	32.6	Very low	112 Å²	112	131.2 Å²	131.2	76%	0.757	78%	0.777	S	S	*	*			trans	-130.6	174	-160.5	-156.5	0	0	0	0	116.2
337	D	27.1	Very low	32.7	Very low	135 Å²	135	131.9 Å²	131.9	72%	0.722	78%	0.781	S	S	*	*			trans	102.3	150.4	143.6	-141.9	-8.9	0	0	0	121.8
338	K	26.8	Very low	32.5	Very low	184 Å²	184	132.2 Å²	132.2	80%	0.8	78%	0.784	S	S	*	*			trans	85.7	136.8	157.1	-86.2	169.8	-175.1	172.3	0	126.1
339	L	27.6	Very low	32.6	Very low	163 Å²	163	132.4 Å²	132.4	85%	0.853	78%	0.78	S	S	*	*			trans	-120.6	-173.7	164.9	-68.7	168.5	0	0	0	108
340	P	55.8	Low	33	Very low	112 Å²	112	133.3 Å²	133.3	73%	0.727	78%	0.777	S	S	*	*				-117.4	-167.6	-59.4	39.5	-24.8	0	0	0	110.4
341	P	42.4	Very low	33.8	Very low	120 Å²	120	130.9 Å²	130.9	78%	0.779	77%	0.769	S	S	*	*				-159.5	148.7	87.4	40	-18.6	0	0	0	120
342	A	28.3	Very low	33.8	Very low	85 Å²	85	128.1 Å²	128.1	70%	0.702	77%	0.768	S	S	*	*			trans	51.1	149.6	135.4	0	0	0	0	0	127
343	T	28.7	Very low	32.9	Very low	144 Å²	144	130.5 Å²	130.5	88%	0.883	78%	0.775	S	S	*	*			trans	71.3	144.4	154.3	43.8	0	0	0	0	120.7
344	A	31	Very low	32.6	Very low	84 Å²	84	126.7 Å²	126.7	69%	0.694	77%	0.77	S	S	*	*			cis	-165.6	178.5	-8.5	0	0	0	0	0	113.4
345	L	28.9	Very low	32.7	Very low	182 Å²	182	126.8 Å²	126.8	95%	0.953	78%	0.78	S	S	*	*			trans	79.1	137	168.7	-58.1	164.2	0	0	0	118.3
346	G	26.3	Very low	32.6	Very low	62 Å²	62	122.3 Å²	122.3	64%	0.639	77%	0.773	S	S	*	*			cis	173.5	139	-13.7	0	0	0	0	0	116.4
347	T	30.8	Very low	32.6	Very low	149 Å²	149	121.5 Å²	121.5	91%	0.914	78%	0.775	S	S	*	*			trans	48.3	139.3	152.4	48.3	0	0	0	0	121.7
348	A	25.5	Very low	32.8	Very low	104 Å²	104	122.8 Å²	122.8	86%	0.86	78%	0.782	S	S	*	*				-136.7	-178	56.5	0	0	0	0	0	115.5
349	S	32.8	Very low	32.9	Very low	93 Å²	93	117.5 Å²	117.5	65%	0.65	78%	0.78	S	S	*	*			trans	-161.9	176.7	-159.3	-156	0	0	0	0	117.9
350	Y	37.5	Very low	33.1	Very low	212 Å²	212	116.1 Å²	116.1	83%	0.831	77%	0.772	S	S	*	*			trans	90.5	158.2	154.5	-62.8	-49.7	0	0	0	121.7
351	P	51.8	Low	31.9	Very low	101 Å²	101	121.4 Å²	121.4	66%	0.656	78%	0.778	S	S	*	*			cis	-146.7	173.1	-40.4	41.8	-25.5	0	0	0	117.1
352	S	33.6	Very low	31.4	Very low	106 Å²	106	120.9 Å²	120.9	74%	0.741	78%	0.777	S	S	*	*			trans	55.7	158.1	138	-74.3	0	0	0	0	123.6
353	D	34.1	Very low	31.6	Very low	149 Å²	149	127.5 Å²	127.5	80%	0.797	78%	0.784	S	S	*	*			cis	-163.3	165.8	-9.9	-122.1	-58	0	0	0	114.1
354	G	28.6	Very low	31.7	Very low	57 Å²	57	125.4 Å²	125.4	59%	0.588	77%	0.771	S	S	*	*			trans	78.6	119.3	139.3	0	0	0	0	0	125.7
355	C	30.6	Very low	32	Very low	144 Å²	144	129.4 Å²	129.4	97%	0.973	77%	0.773	S	S	*	*			trans	55.7	170.1	148.2	79.6	0	0	0	0	120.8
356	G	26.8	Very low	32.1	Very low	70 Å²	70	131 Å²	131	72%	0.722	77%	0.767	S	S	*	*			cis	167.3	154.8	-12	0	0	0	0	0	114.2
357	A	30.6	Very low	32.3	Very low	96 Å²	96	131.1 Å²	131.1	79%	0.793	77%	0.768	S	S	*	*			trans	78.1	127.8	163.1	0	0	0	0	0	123.8
358	D	30.7	Very low	32.2	Very low	162 Å²	162	130.6 Å²	130.6	87%	0.866	77%	0.765	S	S	*	*			trans	41.5	143.1	137.9	-63.8	-59.2	0	0	0	126
359	G	28.7	Very low	32.5	Very low	73 Å²	73	134.5 Å²	134.5	75%	0.753	76%	0.763	S	S	*	*			trans	-177.3	21.5	178.4	0	0	0	0	0	121.7
360	L	31.5	Very low	32.2	Very low	133 Å²	133	136.9 Å²	136.9	70%	0.696	77%	0.773	S	S	*	*			trans	30.3	125.1	146.5	-83.9	164	0	0	0	124.1
361	R	31.6	Very low	31.8	Very low	223 Å²	223	133 Å²	133	84%	0.842	77%	0.772	S	S	*	*			trans	77.2	162.5	151	-52.7	164	-159.9	-93.7	-1.6	118.5
362	S	31.4	Very low	31.4	Very low	110 Å²	110	133.3 Å²	133.3	77%	0.769	77%	0.774	S	S	*	*			cis	-178.2	156.2	-42.3	-162.3	0	0	0	0	111.4
363	R	33.3	Very low	31.2	Very low	224 Å²	224	136.3 Å²	136.3	85%	0.845	78%	0.776	S	S	*	*			trans	91.1	104	139.6	-149.3	172	-169.3	-158.9	1.6	123
364	V	30.6	Very low	30.9	Very low	100 Å²	100	133.5 Å²	133.5	61%	0.606	77%	0.768	S	S	*	*				87.8	109.8	129	170.7	0	0	0	0	123.8	Y366	V364-Y366 HydrophobicContact CG1-CE2 4.27Å
365	K	37.3	Very low	31.7	Very low	168 Å²	168	136.6 Å²	136.6	73%	0.73	78%	0.778	S	S	*	*				57.2	162.6	125.9	-59	-170.5	173.7	-173.7	0	124.6
366	Y	30.2	Very low	32.6	Very low	215 Å²	215	135.3 Å²	135.3	84%	0.843	77%	0.767	S	S	*	*			trans	82.5	143.5	166.9	-45.8	-72.7	0	0	0	115.1	V364	V364-Y366 HydrophobicContact CG1-CE2 4.27Å
367	G	29.7	Very low	32.5	Very low	64 Å²	64	141.8 Å²	141.8	66%	0.66	77%	0.772	S	S	*	*			cis	159.1	168.4	-6.6	0	0	0	0	0	112.1
368	V	28.8	Very low	32.5	Very low	139 Å²	139	140.9 Å²	140.9	84%	0.842	76%	0.76	S	S	*	*			trans	75.5	117.9	175.6	-172.2	0	0	0	0	113.1
369	K	31.5	Very low	32.4	Very low	186 Å²	186	138 Å²	138	81%	0.809	75%	0.752	S	S	*	*				85	120.5	51	-72.7	177.8	171.6	-173.6	0	114.6
370	T	27.2	Very low	32.3	Very low	143 Å²	143	138 Å²	138	88%	0.877	75%	0.751	S	S	*	*				173.2	165.1	116.1	37.5	0	0	0	0	113.7
371	T	28.9	Very low	32.1	Very low	131 Å²	131	137.2 Å²	137.2	80%	0.804	76%	0.758	S	S	*	*			trans	-98.7	-168.6	177.7	51.4	0	0	0	0	111
372	P	44.4	Very low	31.9	Very low	106 Å²	106	136.2 Å²	136.2	69%	0.688	76%	0.755	S	S	*	*			cis	-143.1	-174.5	3.3	44.9	-24.6	0	0	0	118.6
373	E	28.8	Very low	31.8	Very low	170 Å²	170	136 Å²	136	79%	0.794	75%	0.745	S	S	*	*			trans	65.7	126.1	145.3	-84.6	-154.2	74.7	0	0	127
374	S	27.8	Very low	32.1	Very low	90 Å²	90	129.7 Å²	129.7	63%	0.629	74%	0.735	S	S	*	*				67.1	157.9	124.3	-58	0	0	0	0	122.8
375	P	46.1	Very low	32	Very low	122 Å²	122	132.4 Å²	132.4	79%	0.792	75%	0.745	S	S	*	*			cis	-127.8	-122.1	-18.5	27.8	-0.9	0	0	0	115.4
376	P	48	Very low	32.1	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	75%	0.753	S	S	*	*				-135.6	-167.6	-115.7	46	-26.8	0	0	0	118.8
377	Y	26.4	Very low	32.1	Very low	206 Å²	206	128.6 Å²	128.6	81%	0.808	74%	0.741	S	S	*	*			trans	80.8	153.7	164.1	-166.1	-82.6	0	0	0	117.7
378	S	29.4	Very low	32.2	Very low	78 Å²	78	133.1 Å²	133.1	55%	0.545	75%	0.745	S	S	.	*			cis	178.2	159.1	-43.4	-175.9	0	0	0	0	108.8
379	S	29.2	Very low	32.2	Very low	102 Å²	102	133 Å²	133	71%	0.713	74%	0.744	S	S	*	*			trans	71	153	164.1	-44.5	0	0	0	0	116.1
380	G	25.8	Very low	32.1	Very low	71 Å²	71	130 Å²	130	73%	0.732	75%	0.747	S	S	*	*			cis	154	155.7	-9.9	0	0	0	0	0	113.4
381	S	27.7	Very low	32.2	Very low	118 Å²	118	126.5 Å²	126.5	83%	0.825	74%	0.739	S	S	*	*			trans	77	99.3	158.8	-164.2	0	0	0	0	121.8
382	Y	28.4	Very low	32.1	Very low	202 Å²	202	125.6 Å²	125.6	79%	0.792	74%	0.737	S	S	*	*				79.1	146.7	117.6	-154.4	-110.8	0	0	0	123.6
383	D	27.3	Very low	32	Very low	104 Å²	104	126.3 Å²	126.3	56%	0.556	74%	0.741	S	S	*	*			trans	56.7	134.8	168.8	-111	164.9	0	0	0	128.6
384	S	39.8	Very low	32.3	Very low	92 Å²	92	124.8 Å²	124.8	64%	0.643	73%	0.734	S	S	*	*			trans	-35.1	149.4	146.4	-31.7	0	0	0	0	117.4
385	I	29	Very low	32.4	Very low	158 Å²	158	128.1 Å²	128.1	81%	0.81	75%	0.745	S	S	*	*				-146.9	178.4	111.5	67.3	162.8	0	0	0	110.2
386	K	39.4	Very low	31.9	Very low	204 Å²	204	128.5 Å²	128.5	89%	0.887	74%	0.74	S	S	*	*			trans	-140.2	103.1	178.9	175.9	-157.1	171.2	-173.8	0	111.4
387	T	30.2	Very low	31.1	Very low	99 Å²	99	129.3 Å²	129.3	61%	0.607	74%	0.743	S	S	*	*			trans	-164.2	155.3	171.8	31.8	0	0	0	0	108.5
388	E	31.6	Very low	31.3	Very low	159 Å²	159	126.2 Å²	126.2	74%	0.743	75%	0.745	S	S	*	*			cis	-168.9	171.6	-12.9	54.6	-162.5	108.1	0	0	111.6
389	V	29.1	Very low	31.4	Very low	136 Å²	136	125.8 Å²	125.8	82%	0.824	75%	0.753	S	S	*	*			trans	73.6	147.9	152.2	96.5	0	0	0	0	122.2
390	S	30.5	Very low	31.4	Very low	124 Å²	124	132.7 Å²	132.7	87%	0.867	76%	0.763	S	S	*	*			trans	72.9	130.6	169.8	-149.6	0	0	0	0	117.8
391	G	27.5	Very low	31.6	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	76%	0.762	S	S	*	*			cis	-175.6	159	-3.4	0	0	0	0	0	113.7
392	C	28.4	Very low	32.3	Very low	112 Å²	112	133.8 Å²	133.8	76%	0.757	76%	0.762	S	S	*	*			trans	-58.3	171.2	176.7	-88.3	0	0	0	0	114.8	E394	C392-E394 PolarHBondContact SG-OE2 3.07Å; C392-E394 VanDerWaalsContact SG-OE2 3.38Å
393	P	41.4	Very low	32.6	Very low	121 Å²	121	130.9 Å²	130.9	79%	0.786	77%	0.766	S	S	*	*			cis	-137.7	174.6	24.4	41.2	-22.2	0	0	0	118.8
394	E	34.4	Very low	33.7	Very low	138 Å²	138	130.5 Å²	130.5	65%	0.645	78%	0.777	S	S	*	*			trans	-81.9	166.7	175.9	-47.5	92.9	109.5	0	0	114.2	C392	C392-E394 PolarHBondContact SG-OE2 3.07Å; C392-E394 VanDerWaalsContact SG-OE2 3.38Å
395	D	31	Very low	33.7	Very low	160 Å²	160	134.1 Å²	134.1	86%	0.856	79%	0.789	S	S	*	*				-144.6	162.7	122.7	-156.7	2.5	0	0	0	110.4
396	L	35.6	Very low	34.9	Very low	130 Å²	130	134.4 Å²	134.4	68%	0.681	79%	0.792	S	S	*	*			trans	-125.4	163.5	-162.4	-62.1	162.9	0	0	0	111.6
397	T	30	Very low	35.7	Very low	133 Å²	133	132.5 Å²	132.5	82%	0.816	79%	0.792	S	S	*	*				-179.6	130	120.2	24.6	0	0	0	0	113.9
398	V	31.1	Very low	36.7	Very low	142 Å²	142	135.1 Å²	135.1	86%	0.861	80%	0.802	S	S	*	*			trans	42.6	130.9	147.3	-167	0	0	0	0	120.1
399	G	31.3	Very low	38	Very low	69 Å²	69	135 Å²	135	71%	0.711	81%	0.806	S	S	*	*			cis	131.6	145	-6	0	0	0	0	0	115.1
400	R	29.1	Very low	39.2	Very low	246 Å²	246	136.3 Å²	136.3	93%	0.928	81%	0.809	S	S	*	*			trans	118.2	129.5	157.6	-167.9	176.7	-177.4	99.7	1.9	118.1
401	A	31.5	Very low	40.6	Very low	85 Å²	85	139 Å²	139	70%	0.702	81%	0.807	S	S	*	*			trans	73.9	139.3	161	0	0	0	0	0	119.1
402	P	41.2	Very low	41.9	Very low	128 Å²	128	141.4 Å²	141.4	83%	0.831	80%	0.804	S	S	*	*			trans	-87.2	139.5	177.2	35.1	-32.9	0	0	0	111.9
403	T	36	Very low	43.3	Very low	141 Å²	141	143.8 Å²	143.8	87%	0.865	81%	0.809	S	S	*	*			trans	-104.3	139.2	152.8	37.9	0	0	0	0	107.4
404	A	49.2	Very low	44.1	Very low	96 Å²	96	147.1 Å²	147.1	79%	0.793	81%	0.814	S	S	*	*			trans	-98.7	131	171.7	0	0	0	0	0	108.2
405	D	40.8	Very low	44.7	Very low	167 Å²	167	146.2 Å²	146.2	89%	0.893	81%	0.81	S	S	*	*			trans	-143.9	141.5	156.7	-95.7	-49.6	0	0	0	107.7
406	D	53.8	Low	45.7	Very low	164 Å²	164	144 Å²	144	88%	0.877	80%	0.798	S	S	*	*			trans	-78.2	120.8	-176.2	-93.1	-69.8	0	0	0	111.3
407	D	55.1	Low	46.4	Very low	164 Å²	164	145.1 Å²	145.1	88%	0.877	80%	0.804	S	S	*	*			trans	-155.2	43	160.1	-133.7	-6.5	0	0	0	113.5
408	D	52.3	Low	47.2	Very low	154 Å²	154	144 Å²	144	82%	0.824	79%	0.793	S	S	*	*			trans	-108.7	81.1	176.5	-103	-37.9	0	0	0	111.3
409	D	57.8	Low	48.1	Very low	157 Å²	157	143.9 Å²	143.9	84%	0.84	78%	0.781	S	S	*	*			trans	-139.5	28.5	179.6	-153.3	18.9	0	0	0	114.7
410	D	56.1	Low	48.9	Very low	163 Å²	163	148.8 Å²	148.8	87%	0.872	79%	0.788	S	S	*	*	S	Bend	trans	-147.7	32.2	172.8	-136.3	-1.6	0	0	0	115.8
411	H	59.7	Low	49.5	Very low	182 Å²	182	144.4 Å²	144.4	84%	0.843	78%	0.783	S	S	*	*			trans	-126.4	85.5	174	-99	-52.3	0	0	0	112.6
412	D	54.5	Low	50.2	Low	118 Å²	118	143.6 Å²	143.6	63%	0.631	77%	0.767	S	S	*	*			trans	-149.9	25.2	179.9	-146.8	18.5	0	0	0	113.7
413	D	56.3	Low	50.9	Low	162 Å²	162	141.6 Å²	141.6	87%	0.866	76%	0.756	S	S	*	*			trans	-99	22.9	-168.6	-128.1	6.4	0	0	0	114.4
414	H	58.3	Low	51.8	Low	190 Å²	190	144.1 Å²	144.1	88%	0.88	76%	0.758	S	S	*	*			trans	-128.9	18.1	-173.4	-81	-13.1	0	0	0	116.9
415	E	48	Very low	52.2	Low	119 Å²	119	142.9 Å²	142.9	56%	0.556	76%	0.755	S	S	*	*			trans	-100.7	44.9	169.4	-70.6	-165.1	161.5	0	0	114.1	N417 K480	E415-N417 VanDerWaalsContact C-N 3.34Å; E415-K480 IonicContact OE2-NZ 2.82Å; E415-K480 PolarHBondContact OE2-NZ 3.17Å
416	D	52.6	Low	53.8	Low	115 Å²	115	138.1 Å²	138.1	62%	0.615	73%	0.728	S	S	*	*			trans	-93.6	11.6	176.2	-138.8	38.9	0	0	0	113.7	K419	D416-K419 IonicContact OD1-NZ 2.72Å; D416-K419 PolarHBondContact OD1-NZ 2.7Å; D416-K419 IonicContact OD2-NZ 2.83Å; D416-K419 PolarHBondContact OD2-NZ 3.44Å
417	N	50.3	Low	55.1	Low	152 Å²	152	133 Å²	133	81%	0.813	70%	0.7	S	S	*	*	S	Bend	trans	-95.3	-25.3	-172.7	-160.1	34.6	0	0	0	115	E415 K419	E415-N417 VanDerWaalsContact C-N 3.34Å; N417-K419 PolarHBondContact O-N 3.49Å
418	D	45.8	Very low	56.6	Low	109 Å²	109	128.6 Å²	128.6	58%	0.583	68%	0.681	S	S	*	*	S	Bend	trans	-70.5	12.3	179.6	-52.6	-39.3	0	0	0	114	M420	D418-M420 VanDerWaalsContact C-N 3.35Å; D418-M420 PolarHBondContact O-N 3.08Å
419	K	51.3	Low	58.3	Low	140 Å²	140	123.1 Å²	123.1	61%	0.609	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-2.1	-150.9	-154.3	162	-177.8	164	0	114.8	D416 N417	D416-K419 IonicContact OD1-NZ 2.72Å; D416-K419 PolarHBondContact OD1-NZ 2.7Å; D416-K419 IonicContact OD2-NZ 2.83Å; D416-K419 PolarHBondContact OD2-NZ 3.44Å; N417-K419 PolarHBondContact O-N 3.49Å
420	M	46.9	Very low	59.9	Low	172 Å²	172	120.3 Å²	120.3	85%	0.847	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.1	-25.4	179.8	-82.2	-175.3	152.8	0	0	116	D418	D418-M420 VanDerWaalsContact C-N 3.35Å; D418-M420 PolarHBondContact O-N 3.08Å
421	N	41.9	Very low	61.5	Low	155 Å²	155	115.1 Å²	115.1	83%	0.829	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-30.3	-171.4	-162.7	80.9	0	0	0	114.4	S423	N421-S423 PolarHBondContact O-N 2.84Å
422	D	47.2	Very low	63	Low	68 Å²	68	110.4 Å²	110.4	36%	0.364	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.1	46.7	-168.9	-174.8	34.6	0	0	0	112.7	R477	D422-R477 VanDerWaalsContact O-CZ 3.31Å; D422-R477 PolarHBondContact O-NH1 3.49Å; D422-R477 PolarHBondContact O-NH2 3.21Å; D422-R477 IonicContact OD2-CZ 2.66Å; D422-R477 IonicContact OD2-NE 2.83Å; D422-R477 PolarHBondContact OD2-NE 3.27Å; D422-R477 IonicContact OD2-NH2 2.64Å; D422-R477 PolarHBondContact OD2-NH2 2.94Å
423	S	55.5	Low	64.8	Low	85 Å²	85	104.8 Å²	104.8	59%	0.594	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.9	-6.4	175.6	-71.7	0	0	0	0	115.7	N421 G425	N421-S423 PolarHBondContact O-N 2.84Å; S423-G425 VanDerWaalsContact C-N 3.3Å; S423-G425 PolarHBondContact O-N 3.36Å; S423-G425 VanDerWaalsContact O-N 3.13Å
424	E	53.7	Low	66.6	Low	194 Å²	194	97.1 Å²	97.1	91%	0.907	51%	0.506	S	S	*	.	S	Bend	trans	-88	65	176	-59.9	-160	125.8	0	0	111.2
425	G	59.1	Low	68.2	Low	71 Å²	71	89.2 Å²	89.2	73%	0.732	47%	0.47	S	S	*	.	S	Bend	trans	173.7	-30.4	174.2	0	0	0	0	0	116.9	S423	S423-G425 VanDerWaalsContact C-N 3.3Å; S423-G425 PolarHBondContact O-N 3.36Å; S423-G425 VanDerWaalsContact O-N 3.13Å
426	M	73	Confident	70.4	Confident	66 Å²	66	85 Å²	85	33%	0.325	45%	0.451	S	S	.	.			trans	-74	136.6	-171.8	-84.4	69	-174.1	0	0	114	P428 E473 F474	M426-P428 WeakPolarHBondContact O-CD 3.44Å; M426-E473 HydrophobicContact CG-CB 4.48Å; M426-F474 HydrophobicContact CB-CE1 3.82Å; M426-F474 HydrophobicContact CB-CZ 3.96Å; M426-F474 HydrophobicContact CG-CE1 3.7Å; M426-F474 HydrophobicContact CG-CZ 4.1Å
427	D	81.4	Confident	72.4	Confident	56 Å²	56	79.6 Å²	79.6	30%	0.299	42%	0.422	S	S	.	.			trans	-52.6	116	175.9	174.6	-0.3	0	0	0	111.9	E429 R430 L431	D427-E429 VanDerWaalsContact C-N 3.28Å; D427-E429 PolarHBondContact O-N 2.85Å; D427-E429 WeakPolarHBondContact OD1-CA 3.1Å; D427-E429 WeakPolarHBondContact OD1-CB 3.25Å; D427-E429 PolarHBondContact OD1-N 3.27Å; D427-R430 HydrophobicContact CB-CB 3.8Å; D427-R430 PolarHBondContact O-N 2.79Å; D427-R430 PolarHBondContact OD1-N 2.96Å; D427-R430 WeakPolarHBondContact OD2-CB 3.25Å; D427-L431 WeakPolarHBondContact O-CB 3.47Å; D427-L431 PolarHBondContact O-N 3.15Å
428	P	86.6	Confident	74.5	Confident	73 Å²	73	72.5 Å²	72.5	47%	0.474	38%	0.384	S	S	.	.	H	α-helix	trans	-70.1	-20.2	-179.2	25.3	-29.5	0	0	0	113.4	M426 K432	M426-P428 WeakPolarHBondContact O-CD 3.44Å; P428-K432 VanDerWaalsContact O-CD 3.22Å; P428-K432 WeakPolarHBondContact O-CD 3.31Å; P428-K432 VanDerWaalsContact O-CE 3.26Å; P428-K432 WeakPolarHBondContact O-CE 3.45Å; P428-K432 WeakPolarHBondContact O-CG 3.3Å; P428-K432 PolarHBondContact O-N 3.03Å; P428-K432 VanDerWaalsContact O-N 3.12Å
429	E	88.8	Confident	76.8	Confident	38 Å²	38	71.6 Å²	71.6	18%	0.178	37%	0.373	C	S	.	.	H	α-helix	trans	-74.8	-46.6	173.1	-46.8	-33.6	-65.3	0	0	109.9	D427 L431 K432 A433 S509 M511 A512 I515	D427-E429 VanDerWaalsContact C-N 3.28Å; D427-E429 PolarHBondContact O-N 2.85Å; D427-E429 WeakPolarHBondContact OD1-CA 3.1Å; D427-E429 WeakPolarHBondContact OD1-CB 3.25Å; D427-E429 PolarHBondContact OD1-N 3.27Å; E429-L431 VanDerWaalsContact C-N 3.28Å; E429-L431 PolarHBondContact O-N 3.21Å; E429-K432 WeakPolarHBondContact O-CB 3.36Å; E429-K432 PolarHBondContact O-N 2.75Å; E429-K432 VanDerWaalsContact O-N 3.09Å; E429-K432 IonicContact OE1-NZ 3Å; E429-K432 PolarHBondContact OE1-NZ 3.22Å; E429-K432 IonicContact OE2-NZ 2.61Å; E429-K432 PolarHBondContact OE2-NZ 3.41Å; E429-A433 PolarHBondContact O-N 3.14Å; E429-S509 WeakPolarHBondContact OE1-CB 3.22Å; E429-S509 PolarHBondContact OE1-OG 3.25Å; E429-M511 HydrophobicContact CB-CB 4.45Å; E429-M511 HydrophobicContact CB-CE 4.26Å; E429-M511 HydrophobicContact CB-CG 4.05Å; E429-M511 HydrophobicContact CB-SD 4.24Å; E429-M511 HydrophobicContact CG-CB 4.38Å; E429-M511 HydrophobicContact CG-CE 4.27Å; E429-M511 HydrophobicContact CG-CG 4.17Å; E429-M511 HydrophobicContact CG-SD 3.87Å; E429-A512 HydrophobicContact CB-CB 4.27Å; E429-A512 WeakPolarHBondContact O-CB 3.42Å; E429-I515 HydrophobicContact CB-CD1 4.35Å
430	R	90.2	Very high	78.8	Confident	98 Å²	98	69.2 Å²	69.2	37%	0.37	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-36.7	174.4	-155	169.1	-161.8	153.3	3.1	112.1	D427 A433 F434 F471 F474 I515	D427-R430 HydrophobicContact CB-CB 3.8Å; D427-R430 PolarHBondContact O-N 2.79Å; D427-R430 PolarHBondContact OD1-N 2.96Å; D427-R430 WeakPolarHBondContact OD2-CB 3.25Å; R430-A433 PolarHBondContact O-N 3.14Å; R430-F434 WeakPolarHBondContact O-CB 3.35Å; R430-F434 PolarHBondContact O-N 3.36Å; R430-F471 HydrophobicContact CG-CD1 3.94Å; R430-F471 HydrophobicContact CG-CE1 4.01Å; R430-F474 HydrophobicContact CB-CE2 4.39Å; R430-F474 HydrophobicContact CG-CE2 4.37Å; R430-I515 HydrophobicContact CB-CD1 4.47Å; R430-I515 HydrophobicContact CG-CG2 4.36Å
431	L	90.6	Very high	81.1	Confident	55 Å²	55	62.6 Å²	62.6	29%	0.288	33%	0.333	S	S	.	.	H	α-helix	trans	-65	-41.2	172.5	-176.9	58.9	0	0	0	111.9	D427 E429 F434 N435 F474	D427-L431 WeakPolarHBondContact O-CB 3.47Å; D427-L431 PolarHBondContact O-N 3.15Å; E429-L431 VanDerWaalsContact C-N 3.28Å; E429-L431 PolarHBondContact O-N 3.21Å; L431-F434 HydrophobicContact CD1-CD1 4.18Å; L431-N435 WeakPolarHBondContact CD1-ND2 3.45Å; L431-N435 WeakPolarHBondContact O-CB 3.09Å; L431-N435 PolarHBondContact O-N 3.07Å; L431-N435 PolarHBondContact O-ND2 3.29Å; L431-F474 HydrophobicContact CB-CE1 4.42Å; L431-F474 HydrophobicContact CB-CE2 4.07Å; L431-F474 HydrophobicContact CB-CZ 3.7Å; L431-F474 HydrophobicContact CD1-CD1 4.15Å; L431-F474 HydrophobicContact CD1-CD2 4.45Å; L431-F474 HydrophobicContact CD1-CE1 3.81Å; L431-F474 HydrophobicContact CD1-CE2 4.17Å; L431-F474 HydrophobicContact CD1-CG 4.47Å; L431-F474 HydrophobicContact CD1-CZ 3.83Å; L431-F474 HydrophobicContact CG-CZ 4.31Å
432	K	90.7	Very high	83.6	Confident	83 Å²	83	55.2 Å²	55.2	36%	0.361	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-46	173.9	-69.1	154.8	-160.4	157	0	110.8	P428 E429 N435 M436 A512	P428-K432 VanDerWaalsContact O-CD 3.22Å; P428-K432 WeakPolarHBondContact O-CD 3.31Å; P428-K432 VanDerWaalsContact O-CE 3.26Å; P428-K432 WeakPolarHBondContact O-CE 3.45Å; P428-K432 WeakPolarHBondContact O-CG 3.3Å; P428-K432 PolarHBondContact O-N 3.03Å; P428-K432 VanDerWaalsContact O-N 3.12Å; E429-K432 WeakPolarHBondContact O-CB 3.36Å; E429-K432 PolarHBondContact O-N 2.75Å; E429-K432 VanDerWaalsContact O-N 3.09Å; E429-K432 IonicContact OE1-NZ 3Å; E429-K432 PolarHBondContact OE1-NZ 3.22Å; E429-K432 IonicContact OE2-NZ 2.61Å; E429-K432 PolarHBondContact OE2-NZ 3.41Å; K432-N435 PolarHBondContact O-N 3.25Å; K432-N435 VanDerWaalsContact O-N 3.17Å; K432-M436 PolarHBondContact O-N 2.83Å; K432-A512 HydrophobicContact CB-CB 3.79Å
433	A	92.4	Very high	85.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-58.9	-50.8	178.1	0	0	0	0	0	112.2	E429 R430 N435 M436 F437 F471 A512 I515 L516	E429-A433 PolarHBondContact O-N 3.14Å; R430-A433 PolarHBondContact O-N 3.14Å; A433-N435 VanDerWaalsContact C-N 3.27Å; A433-N435 PolarHBondContact O-N 2.82Å; A433-M436 PolarHBondContact O-N 3.08Å; A433-F437 WeakPolarHBondContact O-CB 3.4Å; A433-F437 PolarHBondContact O-N 2.83Å; A433-F471 HydrophobicContact CB-CE1 3.91Å; A433-F471 HydrophobicContact CB-CZ 3.94Å; A433-A512 HydrophobicContact CB-CB 4.3Å; A433-A512 WeakPolarHBondContact CB-O 3.42Å; A433-I515 HydrophobicContact CB-CB 3.87Å; A433-I515 HydrophobicContact CB-CG2 3.54Å; A433-L516 HydrophobicContact CB-CB 4.36Å
434	F	94.7	Very high	87.6	Confident	1 Å²	1	56.7 Å²	56.7	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-53.5	-43.4	173.1	167.2	-110.4	0	0	0	112.5	R430 L431 M436 F437 V438 C467 F471 F474 R477 A478 R481	R430-F434 WeakPolarHBondContact O-CB 3.35Å; R430-F434 PolarHBondContact O-N 3.36Å; L431-F434 HydrophobicContact CD1-CD1 4.18Å; F434-M436 VanDerWaalsContact C-N 3.29Å; F434-M436 PolarHBondContact O-N 3.34Å; F434-F437 PolarHBondContact O-N 3.45Å; F434-V438 HydrophobicContact CD2-CG2 3.95Å; F434-V438 HydrophobicContact CE2-CG2 3.62Å; F434-V438 HydrophobicContact CZ-CG2 4.01Å; F434-V438 WeakPolarHBondContact O-CG2 3.28Å; F434-V438 PolarHBondContact O-N 3.01Å; F434-C467 HydrophobicContact CE2-CB 4.23Å; F434-F471 HydrophobicContact CB-CB 4.34Å; F434-F471 HydrophobicContact CB-CD1 3.71Å; F434-F471 HydrophobicContact CB-CD2 4.08Å; F434-F471 HydrophobicContact CB-CE1 3.99Å; F434-F471 HydrophobicContact CB-CE2 4.36Å; F434-F471 HydrophobicContact CB-CG 3.76Å; F434-F471 HydrophobicContact CB-CZ 4.32Å; F434-F471 HydrophobicContact CD2-CB 3.79Å; F434-F471 AromaticContact CD2-CD2 3.89Å; F434-F471 HydrophobicContact CD2-CD2 3.89Å; F434-F471 AromaticContact CD2-CG 3.85Å; F434-F471 HydrophobicContact CD2-CG 3.85Å; F434-F471 HydrophobicContact CG-CB 4.38Å; F434-F471 HydrophobicContact CG-CD2 4.49Å; F434-F471 HydrophobicContact CG-CG 4.24Å; F434-F474 HydrophobicContact CB-CD2 3.66Å; F434-F474 HydrophobicContact CB-CE2 4.22Å; F434-F474 HydrophobicContact CD1-CB 3.8Å; F434-F474 AromaticContact CD1-CD2 3.9Å; F434-F474 HydrophobicContact CD1-CD2 3.9Å; F434-F474 AromaticContact CD1-CG 3.95Å; F434-F474 HydrophobicContact CD1-CG 3.95Å; F434-F474 HydrophobicContact CD2-CB 3.9Å; F434-F474 HydrophobicContact CD2-CD2 4.29Å; F434-F474 HydrophobicContact CE1-CB 3.66Å; F434-F474 HydrophobicContact CE1-CG 4.23Å; F434-F474 HydrophobicContact CE2-CB 3.76Å; F434-F474 HydrophobicContact CG-CB 3.9Å; F434-F474 AromaticContact CG-CD2 3.7Å; F434-F474 HydrophobicContact CG-CD2 3.7Å; F434-F474 HydrophobicContact CG-CG 4.1Å; F434-F474 HydrophobicContact CZ-CB 3.63Å; F434-F474 WeakPolarHBondContact CZ-O 3.5Å; F434-R477 HydrophobicContact CE1-CB 4.39Å; F434-R477 HydrophobicContact CZ-CB 4.34Å; F434-A478 HydrophobicContact CE2-CB 4.27Å; F434-A478 HydrophobicContact CZ-CB 4.32Å; F434-R481 HydrophobicContact CE1-CG 3.88Å; F434-R481 HydrophobicContact CZ-CG 4.22Å
435	N	92.8	Very high	89.3	Confident	24 Å²	24	50.1 Å²	50.1	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-68.9	-23.2	178.2	-79.6	-72.7	0	0	0	113.6	L431 K432 A433 R439 R481	L431-N435 WeakPolarHBondContact CD1-ND2 3.45Å; L431-N435 WeakPolarHBondContact O-CB 3.09Å; L431-N435 PolarHBondContact O-N 3.07Å; L431-N435 PolarHBondContact O-ND2 3.29Å; K432-N435 PolarHBondContact O-N 3.25Å; K432-N435 VanDerWaalsContact O-N 3.17Å; A433-N435 VanDerWaalsContact C-N 3.27Å; A433-N435 PolarHBondContact O-N 2.82Å; N435-R439 WeakPolarHBondContact O-CG 3.1Å; N435-R439 PolarHBondContact O-NH1 3.42Å; N435-R481 PolarHBondContact ND2-NH2 3.08Å; N435-R481 PolarHBondContact OD1-NE 2.86Å; N435-R481 PolarHBondContact OD1-NH2 3.19Å
436	M	92.9	Very high	91	Very high	31 Å²	31	47.3 Å²	47.3	15%	0.153	23%	0.229	C	C	.	.	H	α-helix	trans	-81.6	-44.7	169.3	-73	-62.7	109.2	0	0	111.3	K432 A433 F434 V438 R439 L440 T503 L516	K432-M436 PolarHBondContact O-N 2.83Å; A433-M436 PolarHBondContact O-N 3.08Å; F434-M436 VanDerWaalsContact C-N 3.29Å; F434-M436 PolarHBondContact O-N 3.34Å; M436-V438 PolarHBondContact O-N 3.2Å; M436-R439 WeakPolarHBondContact O-CA 3.37Å; M436-R439 WeakPolarHBondContact O-CB 3.46Å; M436-R439 PolarHBondContact O-N 3.09Å; M436-L440 PolarHBondContact O-N 3.18Å; M436-T503 HydrophobicContact CE-CG2 4.49Å; M436-T503 HydrophobicContact SD-CG2 4.45Å; M436-L516 HydrophobicContact CB-CD1 4Å; M436-L516 HydrophobicContact CB-CD2 3.59Å; M436-L516 HydrophobicContact CB-CG 4.41Å; M436-L516 HydrophobicContact CG-CD2 4.29Å
437	F	94.5	Very high	92	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-54.5	-50.1	179.1	-171.7	-94.1	0	0	0	112.1	A433 F434 R439 L440 F441 S466 Q470 F471 L516 A519	A433-F437 WeakPolarHBondContact O-CB 3.4Å; A433-F437 PolarHBondContact O-N 2.83Å; F434-F437 PolarHBondContact O-N 3.45Å; F437-R439 PolarHBondContact O-N 3.22Å; F437-L440 PolarHBondContact O-N 3.4Å; F437-F441 HydrophobicContact CD1-CD2 4.14Å; F437-F441 HydrophobicContact CD1-CE2 4.47Å; F437-F441 HydrophobicContact CD2-CD2 4.1Å; F437-F441 AromaticContact CD2-CE2 3.85Å; F437-F441 HydrophobicContact CD2-CE2 3.85Å; F437-F441 AromaticContact CE1-CD2 3.89Å; F437-F441 HydrophobicContact CE1-CD2 3.89Å; F437-F441 AromaticContact CE1-CE2 3.96Å; F437-F441 HydrophobicContact CE1-CE2 3.96Å; F437-F441 HydrophobicContact CE1-CG 4.3Å; F437-F441 HydrophobicContact CE1-CZ 4.39Å; F437-F441 AromaticContact CE2-CD2 3.86Å; F437-F441 HydrophobicContact CE2-CD2 3.86Å; F437-F441 AromaticContact CE2-CE2 3.25Å; F437-F441 HydrophobicContact CE2-CE2 3.25Å; F437-F441 AromaticContact CE2-CZ 3.87Å; F437-F441 HydrophobicContact CE2-CZ 3.87Å; F437-F441 HydrophobicContact CG-CD2 4.24Å; F437-F441 HydrophobicContact CG-CE2 4.42Å; F437-F441 AromaticContact CZ-CD2 3.74Å; F437-F441 HydrophobicContact CZ-CD2 3.74Å; F437-F441 HydrophobicContact CZ-CE1 4.27Å; F437-F441 AromaticContact CZ-CE2 3.3Å; F437-F441 HydrophobicContact CZ-CE2 3.3Å; F437-F441 HydrophobicContact CZ-CG 4.4Å; F437-F441 AromaticContact CZ-CZ 3.6Å; F437-F441 HydrophobicContact CZ-CZ 3.6Å; F437-F441 PolarHBondContact O-N 3.32Å; F437-S466 WeakPolarHBondContact CZ-OG 3.39Å; F437-Q470 HydrophobicContact CE1-CG 4.42Å; F437-Q470 HydrophobicContact CE2-CG 4.14Å; F437-Q470 HydrophobicContact CZ-CB 4.48Å; F437-Q470 HydrophobicContact CZ-CG 3.83Å; F437-F471 HydrophobicContact CB-CE2 3.73Å; F437-F471 HydrophobicContact CB-CZ 4.38Å; F437-F471 HydrophobicContact CD1-CD2 4.34Å; F437-F471 HydrophobicContact CD1-CE2 4.06Å; F437-F471 HydrophobicContact CD2-CE2 4.1Å; F437-F471 HydrophobicContact CG-CD2 4.42Å; F437-F471 AromaticContact CG-CE2 3.71Å; F437-F471 HydrophobicContact CG-CE2 3.71Å; F437-L516 HydrophobicContact CB-CD1 3.72Å; F437-L516 HydrophobicContact CD2-CD1 4.13Å; F437-L516 HydrophobicContact CG-CD1 4.45Å; F437-A519 HydrophobicContact CD2-CB 3.89Å; F437-A519 HydrophobicContact CE2-CB 3.91Å
438	V	94.8	Very high	92.5	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-29.1	176.2	173.2	0	0	0	0	112.5	F434 M436 V442 R481 I482	F434-V438 HydrophobicContact CD2-CG2 3.95Å; F434-V438 HydrophobicContact CE2-CG2 3.62Å; F434-V438 HydrophobicContact CZ-CG2 4.01Å; F434-V438 WeakPolarHBondContact O-CG2 3.28Å; F434-V438 PolarHBondContact O-N 3.01Å; M436-V438 PolarHBondContact O-N 3.2Å; V438-V442 HydrophobicContact CG1-CG2 4.45Å; V438-V442 VanDerWaalsContact O-CB 3.29Å; V438-V442 WeakPolarHBondContact O-CB 3.29Å; V438-V442 WeakPolarHBondContact O-CG2 3.32Å; V438-V442 PolarHBondContact O-N 2.86Å; V438-R481 HydrophobicContact CG1-CB 4.1Å; V438-I482 HydrophobicContact CG1-CG1 3.84Å
439	R	93.9	Very high	92.6	Very high	90 Å²	90	50 Å²	50	34%	0.34	23%	0.232	S	C	.	.	H	α-helix	trans	-72.9	-53.5	175.3	-71.6	178.4	169.9	90.5	-14	111	N435 M436 F437 F441 V442 D443 Y485	N435-R439 WeakPolarHBondContact O-CG 3.1Å; N435-R439 PolarHBondContact O-NH1 3.42Å; M436-R439 WeakPolarHBondContact O-CA 3.37Å; M436-R439 WeakPolarHBondContact O-CB 3.46Å; M436-R439 PolarHBondContact O-N 3.09Å; F437-R439 PolarHBondContact O-N 3.22Å; R439-F441 PolarHBondContact O-N 3.36Å; R439-V442 PolarHBondContact O-N 2.73Å; R439-D443 VanDerWaalsContact O-CB 3.28Å; R439-D443 WeakPolarHBondContact O-CB 3.34Å; R439-D443 PolarHBondContact O-N 3.12Å; R439-Y485 HydrophobicContact CB-CD1 4.42Å; R439-Y485 HydrophobicContact CB-CE1 3.9Å; R439-Y485 HydrophobicContact CB-CE2 4.46Å; R439-Y485 HydrophobicContact CG-CD1 4.1Å; R439-Y485 HydrophobicContact CG-CD2 3.93Å; R439-Y485 HydrophobicContact CG-CE1 3.88Å; R439-Y485 HydrophobicContact CG-CE2 3.72Å; R439-Y485 HydrophobicContact CG-CG 4.13Å
440	L	93.9	Very high	92.7	Very high	90 Å²	90	50 Å²	50	47%	0.471	24%	0.235	S	C	.	.	H	α-helix	trans	-54.7	-52.1	-178.6	-66.2	175.4	0	0	0	111.5	M436 F437 V442 D443 E444 L516	M436-L440 PolarHBondContact O-N 3.18Å; F437-L440 PolarHBondContact O-N 3.4Å; L440-V442 VanDerWaalsContact C-N 3.34Å; L440-V442 PolarHBondContact O-N 3.32Å; L440-D443 PolarHBondContact O-N 2.97Å; L440-E444 WeakPolarHBondContact O-CB 3.4Å; L440-E444 PolarHBondContact O-N 3.45Å; L440-L516 HydrophobicContact CD1-CD1 4.26Å; L440-L516 HydrophobicContact CD1-CD2 4.22Å
441	F	94.1	Very high	92.8	Very high	33 Å²	33	47.5 Å²	47.5	15%	0.145	23%	0.231	C	C	.	.	H	α-helix	trans	-63.8	-36.4	-178.9	-87.4	-103.7	0	0	0	112.9	F437 R439 N445 I463 E523	F437-F441 HydrophobicContact CD1-CD2 4.14Å; F437-F441 HydrophobicContact CD1-CE2 4.47Å; F437-F441 HydrophobicContact CD2-CD2 4.1Å; F437-F441 AromaticContact CD2-CE2 3.85Å; F437-F441 HydrophobicContact CD2-CE2 3.85Å; F437-F441 AromaticContact CE1-CD2 3.89Å; F437-F441 HydrophobicContact CE1-CD2 3.89Å; F437-F441 AromaticContact CE1-CE2 3.96Å; F437-F441 HydrophobicContact CE1-CE2 3.96Å; F437-F441 HydrophobicContact CE1-CG 4.3Å; F437-F441 HydrophobicContact CE1-CZ 4.39Å; F437-F441 AromaticContact CE2-CD2 3.86Å; F437-F441 HydrophobicContact CE2-CD2 3.86Å; F437-F441 AromaticContact CE2-CE2 3.25Å; F437-F441 HydrophobicContact CE2-CE2 3.25Å; F437-F441 AromaticContact CE2-CZ 3.87Å; F437-F441 HydrophobicContact CE2-CZ 3.87Å; F437-F441 HydrophobicContact CG-CD2 4.24Å; F437-F441 HydrophobicContact CG-CE2 4.42Å; F437-F441 AromaticContact CZ-CD2 3.74Å; F437-F441 HydrophobicContact CZ-CD2 3.74Å; F437-F441 HydrophobicContact CZ-CE1 4.27Å; F437-F441 AromaticContact CZ-CE2 3.3Å; F437-F441 HydrophobicContact CZ-CE2 3.3Å; F437-F441 HydrophobicContact CZ-CG 4.4Å; F437-F441 AromaticContact CZ-CZ 3.6Å; F437-F441 HydrophobicContact CZ-CZ 3.6Å; F437-F441 PolarHBondContact O-N 3.32Å; R439-F441 PolarHBondContact O-N 3.36Å; F441-N445 VanDerWaalsContact O-CB 3.24Å; F441-N445 WeakPolarHBondContact O-CB 3.42Å; F441-N445 PolarHBondContact O-N 2.77Å; F441-N445 PolarHBondContact O-ND2 3.03Å; F441-I463 HydrophobicContact CB-CG1 4.23Å; F441-I463 HydrophobicContact CB-CG2 4.02Å; F441-E523 HydrophobicContact CE1-CG 4.19Å; F441-E523 HydrophobicContact CZ-CB 4.2Å; F441-E523 HydrophobicContact CZ-CG 4.14Å
442	V	95.3	Very high	92.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-72.1	-38.7	175.2	169.8	0	0	0	0	111.8	V438 R439 L440 E444 L446 I463 I482 Y485 L486	V438-V442 HydrophobicContact CG1-CG2 4.45Å; V438-V442 VanDerWaalsContact O-CB 3.29Å; V438-V442 WeakPolarHBondContact O-CB 3.29Å; V438-V442 WeakPolarHBondContact O-CG2 3.32Å; V438-V442 PolarHBondContact O-N 2.86Å; R439-V442 PolarHBondContact O-N 2.73Å; L440-V442 VanDerWaalsContact C-N 3.34Å; L440-V442 PolarHBondContact O-N 3.32Å; V442-E444 VanDerWaalsContact C-N 3.29Å; V442-E444 PolarHBondContact O-N 2.86Å; V442-L446 HydrophobicContact CG1-CB 4.32Å; V442-L446 HydrophobicContact CG1-CD1 4.31Å; V442-L446 HydrophobicContact CG2-CD1 4.27Å; V442-L446 PolarHBondContact O-N 3.4Å; V442-L446 VanDerWaalsContact O-N 3.09Å; V442-I463 HydrophobicContact CG2-CD1 4.16Å; V442-I482 HydrophobicContact CG2-CB 4.35Å; V442-I482 HydrophobicContact CG2-CG1 3.94Å; V442-I482 HydrophobicContact CG2-CG2 3.9Å; V442-Y485 HydrophobicContact CB-CD1 3.99Å; V442-Y485 HydrophobicContact CB-CE1 4.3Å; V442-Y485 HydrophobicContact CG1-CD1 3.77Å; V442-Y485 HydrophobicContact CG1-CE1 4.15Å; V442-L486 HydrophobicContact CG1-CD2 3.57Å; V442-L486 HydrophobicContact CG1-CG 3.95Å
443	D	93	Very high	92.8	Very high	38 Å²	38	46.9 Å²	46.9	20%	0.203	24%	0.24	C	C	.	.	H	α-helix	trans	-70.3	-24.4	-179.2	-94.5	3.3	0	0	0	113.6	R439 L440 R448 Y485	R439-D443 VanDerWaalsContact O-CB 3.28Å; R439-D443 WeakPolarHBondContact O-CB 3.34Å; R439-D443 PolarHBondContact O-N 3.12Å; L440-D443 PolarHBondContact O-N 2.97Å; D443-R448 VanDerWaalsContact CB-CZ 3.46Å; D443-R448 PolarHBondContact O-NE 3.4Å; D443-R448 PolarHBondContact O-NH2 2.61Å; D443-R448 WeakPolarHBondContact OD1-CD 3.44Å; D443-R448 IonicContact OD1-CZ 2.97Å; D443-R448 VanDerWaalsContact OD1-CZ 3.27Å; D443-R448 IonicContact OD1-NE 2.88Å; D443-R448 PolarHBondContact OD1-NE 2.82Å; D443-R448 VanDerWaalsContact OD1-NE 3.08Å; D443-R448 IonicContact OD1-NH1 3.64Å; D443-R448 PolarHBondContact OD1-NH1 3Å; D443-R448 IonicContact OD2-CZ 2.63Å; D443-R448 IonicContact OD2-NE 3.22Å; D443-R448 IonicContact OD2-NH1 2.67Å; D443-R448 PolarHBondContact OD2-NH1 2.68Å; D443-R448 IonicContact OD2-NH2 2.72Å; D443-Y485 VanDerWaalsContact CG-OH 3.24Å; D443-Y485 WeakPolarHBondContact OD1-CE1 3.38Å; D443-Y485 PolarHBondContact OD1-OH 2.97Å; D443-Y485 VanDerWaalsContact OD1-OH 3.07Å; D443-Y485 PolarHBondContact OD2-OH 2.83Å
444	E	92.8	Very high	92.9	Very high	145 Å²	145	55 Å²	55	68%	0.678	28%	0.275	S	S	*	.	H	α-helix	trans	-88	-46.3	174.1	178.4	-172.8	-131.6	0	0	112.5	L440 V442	L440-E444 WeakPolarHBondContact O-CB 3.4Å; L440-E444 PolarHBondContact O-N 3.45Å; V442-E444 VanDerWaalsContact C-N 3.29Å; V442-E444 PolarHBondContact O-N 2.86Å
445	N	90.4	Very high	92.8	Very high	56 Å²	56	55.6 Å²	55.6	30%	0.299	28%	0.278	S	S	.	.	H	α-helix	trans	-98.9	-20.7	-165.4	-67.4	-92.3	0	0	0	115	F441 K459 I463	F441-N445 VanDerWaalsContact O-CB 3.24Å; F441-N445 WeakPolarHBondContact O-CB 3.42Å; F441-N445 PolarHBondContact O-N 2.77Å; F441-N445 PolarHBondContact O-ND2 3.03Å; N445-K459 WeakPolarHBondContact O-CD 3.48Å; N445-K459 PolarHBondContact O-NZ 3.23Å; N445-I463 HydrophobicContact CB-CD1 4.17Å
446	L	95.2	Very high	92.9	Very high	13 Å²	13	57.3 Å²	57.3	7%	0.068	29%	0.29	C	S	.	.	S	Bend	trans	-123.9	152.3	-172.8	-59.9	-175.6	0	0	0	112.7	V442 R448 Q455 K459 I460 I463 I482 L486	V442-L446 HydrophobicContact CG1-CB 4.32Å; V442-L446 HydrophobicContact CG1-CD1 4.31Å; V442-L446 HydrophobicContact CG2-CD1 4.27Å; V442-L446 PolarHBondContact O-N 3.4Å; V442-L446 VanDerWaalsContact O-N 3.09Å; L446-R448 PolarHBondContact O-N 3.15Å; L446-Q455 HydrophobicContact CD1-CG 4.45Å; L446-Q455 HydrophobicContact CD2-CB 4.29Å; L446-K459 HydrophobicContact CD2-CB 3.63Å; L446-K459 HydrophobicContact CD2-CD 4.38Å; L446-I460 HydrophobicContact CD1-CG1 4.04Å; L446-I460 HydrophobicContact CD2-CG1 4.36Å; L446-I463 HydrophobicContact CD1-CD1 3.84Å; L446-I463 HydrophobicContact CD2-CD1 4.45Å; L446-I463 HydrophobicContact CG-CD1 3.85Å; L446-I482 HydrophobicContact CD1-CG2 4.16Å; L446-L486 HydrophobicContact CD1-CD1 4.3Å
447	D	93.4	Very high	92.9	Very high	84 Å²	84	63.5 Å²	63.5	45%	0.449	32%	0.316	S	S	.	.			trans	-75.8	112.7	173.7	179.3	4.5	0	0	0	110.6	M449 V450 Q455	D447-M449 PolarHBondContact O-N 3.39Å; D447-M449 WeakPolarHBondContact OD1-CB 3.4Å; D447-M449 PolarHBondContact OD1-N 3.43Å; D447-V450 HydrophobicContact CB-CB 4.16Å; D447-V450 HydrophobicContact CB-CG2 4.08Å; D447-V450 PolarHBondContact O-N 3.24Å; D447-V450 VanDerWaalsContact OD2-CG2 3.25Å; D447-V450 WeakPolarHBondContact OD2-CG2 3.48Å; D447-Q455 PolarHBondContact O-NE2 3.2Å
448	R	92.1	Very high	92.8	Very high	88 Å²	88	69.8 Å²	69.8	33%	0.332	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-20.3	177.9	-50.4	178.1	-157.9	-164.2	9.2	113.2	D443 L446 C489 R490	D443-R448 VanDerWaalsContact CB-CZ 3.46Å; D443-R448 PolarHBondContact O-NE 3.4Å; D443-R448 PolarHBondContact O-NH2 2.61Å; D443-R448 WeakPolarHBondContact OD1-CD 3.44Å; D443-R448 IonicContact OD1-CZ 2.97Å; D443-R448 VanDerWaalsContact OD1-CZ 3.27Å; D443-R448 IonicContact OD1-NE 2.88Å; D443-R448 PolarHBondContact OD1-NE 2.82Å; D443-R448 VanDerWaalsContact OD1-NE 3.08Å; D443-R448 IonicContact OD1-NH1 3.64Å; D443-R448 PolarHBondContact OD1-NH1 3Å; D443-R448 IonicContact OD2-CZ 2.63Å; D443-R448 IonicContact OD2-NE 3.22Å; D443-R448 IonicContact OD2-NH1 2.67Å; D443-R448 PolarHBondContact OD2-NH1 2.68Å; D443-R448 IonicContact OD2-NH2 2.72Å; L446-R448 PolarHBondContact O-N 3.15Å; R448-C489 HydrophobicContact CB-CB 4.05Å; R448-R490 WeakPolarHBondContact O-CG 3.36Å
449	M	87.3	Confident	92.7	Very high	78 Å²	78	74.4 Å²	74.4	38%	0.384	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-12.6	177.6	-66.5	-52.3	-52.3	0	0	115.7	D447 R490 K493	D447-M449 PolarHBondContact O-N 3.39Å; D447-M449 WeakPolarHBondContact OD1-CB 3.4Å; D447-M449 PolarHBondContact OD1-N 3.43Å; M449-R490 HydrophobicContact CE-CG 4.46Å; M449-R490 WeakPolarHBondContact O-CD 3.25Å; M449-K493 HydrophobicContact CE-CD 3.86Å; M449-K493 HydrophobicContact CG-CD 4.48Å; M449-K493 HydrophobicContact SD-CB 4.27Å; M449-K493 HydrophobicContact SD-CD 3.27Å; M449-K493 WeakPolarHBondContact SD-CD 3.24Å; M449-K493 HydrophobicContact SD-CG 4.38Å
450	V	92.1	Very high	92.8	Very high	38 Å²	38	70.8 Å²	70.8	23%	0.23	35%	0.352	C	S	.	.	S	Bend	trans	-104	137.4	-171.5	166.2	0	0	0	0	111.3	D447 K454 Q455 R490	D447-V450 HydrophobicContact CB-CB 4.16Å; D447-V450 HydrophobicContact CB-CG2 4.08Å; D447-V450 PolarHBondContact O-N 3.24Å; D447-V450 VanDerWaalsContact OD2-CG2 3.25Å; D447-V450 WeakPolarHBondContact OD2-CG2 3.48Å; V450-K454 VanDerWaalsContact CG1-C 3.47Å; V450-K454 HydrophobicContact CG1-CB 3.75Å; V450-K454 VanDerWaalsContact CG1-O 3.29Å; V450-K454 WeakPolarHBondContact CG1-O 3.35Å; V450-Q455 HydrophobicContact CG1-CG 4.17Å; V450-Q455 PolarHBondContact O-NE2 2.99Å; V450-R490 PolarHBondContact O-NH1 3.37Å; V450-R490 VanDerWaalsContact O-NH1 3.09Å
451	P	91.8	Very high	92.8	Very high	46 Å²	46	72 Å²	72	30%	0.299	36%	0.356	S	S	.	.			trans	-66.5	150.5	175	29.2	-35.4	0	0	0	111.5	S453 K454 Q455	P451-S453 PolarHBondContact O-N 2.8Å; P451-K454 HydrophobicContact CG-CB 4.16Å; P451-K454 HydrophobicContact CG-CD 4.42Å; P451-K454 HydrophobicContact CG-CG 4.19Å; P451-K454 PolarHBondContact O-N 3.02Å; P451-Q455 PolarHBondContact O-N 3.37Å
452	I	90.7	Very high	92.8	Very high	31 Å²	31	73 Å²	73	16%	0.159	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-57.2	-27.7	-173.7	-163.6	174.2	0	0	0	113.6	K454 I460 I482 R483 L486	I452-K454 VanDerWaalsContact C-N 3.3Å; I452-K454 PolarHBondContact O-N 2.94Å; I452-I460 HydrophobicContact CD1-CD1 4.47Å; I452-I460 HydrophobicContact CD1-CG2 4.47Å; I452-I460 HydrophobicContact CG1-CD1 3.58Å; I452-I460 HydrophobicContact CG1-CG1 4.28Å; I452-I460 VanDerWaalsContact O-CD1 3.25Å; I452-I460 WeakPolarHBondContact O-CD1 3.48Å; I452-I482 HydrophobicContact CD1-CB 4.27Å; I452-I482 HydrophobicContact CD1-CG2 3.86Å; I452-I482 HydrophobicContact CG1-CG2 4.44Å; I452-R483 HydrophobicContact CD1-CB 3.99Å; I452-R483 HydrophobicContact CG2-CB 4.31Å; I452-R483 HydrophobicContact CG2-CG 4.06Å; I452-L486 HydrophobicContact CB-CD1 4.26Å
453	S	91.7	Very high	92.7	Very high	95 Å²	95	73 Å²	73	66%	0.664	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-70.7	-19.4	175.1	44.7	0	0	0	0	114.5	P451	P451-S453 PolarHBondContact O-N 2.8Å
454	K	92.9	Very high	92.9	Very high	170 Å²	170	72.2 Å²	72.2	74%	0.739	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-112.2	11.4	-179.9	-61.4	-165.4	176.8	-163.6	0	113.6	V450 P451 I452	V450-K454 VanDerWaalsContact CG1-C 3.47Å; V450-K454 HydrophobicContact CG1-CB 3.75Å; V450-K454 VanDerWaalsContact CG1-O 3.29Å; V450-K454 WeakPolarHBondContact CG1-O 3.35Å; P451-K454 HydrophobicContact CG-CB 4.16Å; P451-K454 HydrophobicContact CG-CD 4.42Å; P451-K454 HydrophobicContact CG-CG 4.19Å; P451-K454 PolarHBondContact O-N 3.02Å; I452-K454 VanDerWaalsContact C-N 3.3Å; I452-K454 PolarHBondContact O-N 2.94Å
455	Q	93	Very high	92.9	Very high	14 Å²	14	68.8 Å²	68.8	7%	0.065	35%	0.35	C	S	.	.	S	Bend	trans	-85.4	158.9	169.2	-61.9	-72.9	-11.5	0	0	110.1	L446 D447 V450 P451 K457 I460 L486	L446-Q455 HydrophobicContact CD1-CG 4.45Å; L446-Q455 HydrophobicContact CD2-CB 4.29Å; D447-Q455 PolarHBondContact O-NE2 3.2Å; V450-Q455 HydrophobicContact CG1-CG 4.17Å; V450-Q455 PolarHBondContact O-NE2 2.99Å; P451-Q455 PolarHBondContact O-N 3.37Å; Q455-K457 PolarHBondContact O-N 3.01Å; Q455-I460 HydrophobicContact CB-CD1 3.59Å; Q455-I460 HydrophobicContact CB-CG1 4.04Å; Q455-I460 HydrophobicContact CG-CD1 4.31Å; Q455-L486 HydrophobicContact CG-CD1 4.25Å
456	P	95.5	Very high	93.1	Very high	60 Å²	60	66.2 Å²	66.2	39%	0.39	34%	0.336	S	S	.	.			trans	-56.1	121.4	166.6	-22.2	33.6	0	0	0	110.7	E458 K459 I460	P456-E458 WeakPolarHBondContact CB-OE2 3.42Å; P456-E458 PolarHBondContact O-N 2.9Å; P456-K459 HydrophobicContact CB-CB 4.2Å; P456-K459 HydrophobicContact CB-CD 4.49Å; P456-K459 HydrophobicContact CB-CG 4.05Å; P456-K459 HydrophobicContact CG-CD 4.44Å; P456-K459 PolarHBondContact O-N 3.3Å; P456-I460 PolarHBondContact O-N 3.39Å
457	K	91.6	Very high	93.1	Very high	160 Å²	160	65.6 Å²	65.6	70%	0.696	33%	0.333	S	S	*	.	H	α-helix	trans	-64.8	-32.1	-176	-67.1	177.8	179.3	176	0	110.7	Q455 I460 Q461	Q455-K457 PolarHBondContact O-N 3.01Å; K457-I460 PolarHBondContact O-N 3.06Å; K457-Q461 VanDerWaalsContact O-CB 3.32Å; K457-Q461 WeakPolarHBondContact O-CB 3.24Å; K457-Q461 PolarHBondContact O-N 3.1Å
458	E	93.8	Very high	93.1	Very high	133 Å²	133	63.4 Å²	63.4	62%	0.621	32%	0.324	S	S	*	.	H	α-helix	trans	-65	-46	-179.4	-50.6	64.1	-130.5	0	0	110	P456 Q461 A462	P456-E458 WeakPolarHBondContact CB-OE2 3.42Å; P456-E458 PolarHBondContact O-N 2.9Å; E458-Q461 PolarHBondContact O-N 3.02Å; E458-A462 WeakPolarHBondContact O-CB 3.45Å; E458-A462 PolarHBondContact O-N 3.48Å
459	K	93.1	Very high	93.1	Very high	101 Å²	101	62.6 Å²	62.6	44%	0.439	32%	0.321	S	S	.	.	H	α-helix	trans	-69	-40.6	176.5	-66.6	-161.4	-177.8	-166.5	0	112.1	N445 L446 P456 Q461 A462 I463	N445-K459 WeakPolarHBondContact O-CD 3.48Å; N445-K459 PolarHBondContact O-NZ 3.23Å; L446-K459 HydrophobicContact CD2-CB 3.63Å; L446-K459 HydrophobicContact CD2-CD 4.38Å; P456-K459 HydrophobicContact CB-CB 4.2Å; P456-K459 HydrophobicContact CB-CD 4.49Å; P456-K459 HydrophobicContact CB-CG 4.05Å; P456-K459 HydrophobicContact CG-CD 4.44Å; P456-K459 PolarHBondContact O-N 3.3Å; K459-Q461 VanDerWaalsContact C-N 3.3Å; K459-Q461 PolarHBondContact O-N 2.95Å; K459-A462 PolarHBondContact O-N 3.24Å; K459-I463 VanDerWaalsContact O-CG1 3.29Å; K459-I463 WeakPolarHBondContact O-CG1 3.37Å; K459-I463 PolarHBondContact O-N 3.48Å; K459-I463 VanDerWaalsContact O-N 3.14Å
460	I	94.8	Very high	93.3	Very high	13 Å²	13	60.5 Å²	60.5	7%	0.067	31%	0.31	C	S	.	.	H	α-helix	trans	-58.8	-46.7	172.2	-66.2	162.1	0	0	0	110	L446 I452 Q455 P456 K457 A462 I463 I464	L446-I460 HydrophobicContact CD1-CG1 4.04Å; L446-I460 HydrophobicContact CD2-CG1 4.36Å; I452-I460 HydrophobicContact CD1-CD1 4.47Å; I452-I460 HydrophobicContact CD1-CG2 4.47Å; I452-I460 HydrophobicContact CG1-CD1 3.58Å; I452-I460 HydrophobicContact CG1-CG1 4.28Å; I452-I460 VanDerWaalsContact O-CD1 3.25Å; I452-I460 WeakPolarHBondContact O-CD1 3.48Å; Q455-I460 HydrophobicContact CB-CD1 3.59Å; Q455-I460 HydrophobicContact CB-CG1 4.04Å; Q455-I460 HydrophobicContact CG-CD1 4.31Å; P456-I460 PolarHBondContact O-N 3.39Å; K457-I460 PolarHBondContact O-N 3.06Å; I460-A462 PolarHBondContact O-N 3.42Å; I460-I463 PolarHBondContact O-N 3.47Å; I460-I464 HydrophobicContact CG2-CD1 3.69Å; I460-I464 HydrophobicContact CG2-CG1 4.34Å; I460-I464 WeakPolarHBondContact O-CG1 3.48Å; I460-I464 PolarHBondContact O-N 3.14Å
461	Q	94.7	Very high	93.3	Very high	116 Å²	116	58.7 Å²	58.7	54%	0.542	30%	0.299	S	S	.	.	H	α-helix	trans	-66.3	-37.6	-177.5	-168.8	61.5	17	0	0	111.8	K457 E458 K459 I463 I464 E465	K457-Q461 VanDerWaalsContact O-CB 3.32Å; K457-Q461 WeakPolarHBondContact O-CB 3.24Å; K457-Q461 PolarHBondContact O-N 3.1Å; E458-Q461 PolarHBondContact O-N 3.02Å; K459-Q461 VanDerWaalsContact C-N 3.3Å; K459-Q461 PolarHBondContact O-N 2.95Å; Q461-I463 PolarHBondContact O-N 3.34Å; Q461-I464 PolarHBondContact O-N 3.35Å; Q461-E465 WeakPolarHBondContact O-CB 3.29Å; Q461-E465 PolarHBondContact O-N 3.07Å
462	A	93.8	Very high	93.2	Very high	53 Å²	53	59.7 Å²	59.7	44%	0.438	31%	0.306	S	S	.	.	H	α-helix	trans	-61.1	-41	173.1	0	0	0	0	0	112.6	E458 K459 I460 E465 S466	E458-A462 WeakPolarHBondContact O-CB 3.45Å; E458-A462 PolarHBondContact O-N 3.48Å; K459-A462 PolarHBondContact O-N 3.24Å; I460-A462 PolarHBondContact O-N 3.42Å; A462-E465 PolarHBondContact O-N 3.01Å; A462-S466 WeakPolarHBondContact O-CB 3.44Å; A462-S466 PolarHBondContact O-N 2.88Å
463	I	94.1	Very high	93.1	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-66.4	-42	175.6	-60.8	165.6	0	0	0	110.7	F441 V442 N445 L446 K459 I460 Q461 S466 C467 I482	F441-I463 HydrophobicContact CB-CG1 4.23Å; F441-I463 HydrophobicContact CB-CG2 4.02Å; V442-I463 HydrophobicContact CG2-CD1 4.16Å; N445-I463 HydrophobicContact CB-CD1 4.17Å; L446-I463 HydrophobicContact CD1-CD1 3.84Å; L446-I463 HydrophobicContact CD2-CD1 4.45Å; L446-I463 HydrophobicContact CG-CD1 3.85Å; K459-I463 VanDerWaalsContact O-CG1 3.29Å; K459-I463 WeakPolarHBondContact O-CG1 3.37Å; K459-I463 PolarHBondContact O-N 3.48Å; K459-I463 VanDerWaalsContact O-N 3.14Å; I460-I463 PolarHBondContact O-N 3.47Å; Q461-I463 PolarHBondContact O-N 3.34Å; I463-S466 PolarHBondContact O-N 3.03Å; I463-C467 PolarHBondContact O-N 3.17Å; I463-C467 PolarHBondContact O-SG 3.46Å; I463-I482 HydrophobicContact CB-CD1 4.26Å; I463-I482 HydrophobicContact CG2-CD1 3.8Å; I463-I482 HydrophobicContact CG2-CG1 4.37Å
464	I	95.1	Very high	93	Very high	20 Å²	20	58.5 Å²	58.5	10%	0.103	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-47.1	175.6	-66.6	169.2	0	0	0	110.6	I460 Q461 S466 C467 S468 A478 R479 I482	I460-I464 HydrophobicContact CG2-CD1 3.69Å; I460-I464 HydrophobicContact CG2-CG1 4.34Å; I460-I464 WeakPolarHBondContact O-CG1 3.48Å; I460-I464 PolarHBondContact O-N 3.14Å; Q461-I464 PolarHBondContact O-N 3.35Å; I464-S466 VanDerWaalsContact C-N 3.25Å; I464-S466 PolarHBondContact O-N 2.85Å; I464-C467 CarbonylContact O-C 3.56Å; I464-C467 WeakPolarHBondContact O-CA 3.39Å; I464-C467 WeakPolarHBondContact O-CB 3.18Å; I464-C467 PolarHBondContact O-N 3.39Å; I464-S468 PolarHBondContact O-N 3Å; I464-S468 PolarHBondContact O-OG 3.28Å; I464-A478 HydrophobicContact CG1-CB 4.43Å; I464-R479 HydrophobicContact CD1-CB 3.86Å; I464-R479 HydrophobicContact CD1-CG 3.96Å; I464-I482 HydrophobicContact CD1-CD1 4.49Å; I464-I482 HydrophobicContact CG1-CD1 3.78Å
465	E	94.6	Very high	92.7	Very high	74 Å²	74	54.1 Å²	54.1	35%	0.346	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-31.1	179.6	-166.8	-117.4	168.9	0	0	111.9	Q461 A462 R469 K526 R530	Q461-E465 WeakPolarHBondContact O-CB 3.29Å; Q461-E465 PolarHBondContact O-N 3.07Å; A462-E465 PolarHBondContact O-N 3.01Å; E465-R469 PolarHBondContact O-NH1 3.43Å; E465-R469 IonicContact OE1-CZ 2.82Å; E465-R469 IonicContact OE1-NH1 3.07Å; E465-R469 PolarHBondContact OE1-NH1 3.48Å; E465-R469 IonicContact OE1-NH2 3.96Å; E465-R469 IonicContact OE2-CZ 3.84Å; E465-R469 VanDerWaalsContact OE2-CZ 3.27Å; E465-R469 IonicContact OE2-NH1 3.08Å; E465-R469 PolarHBondContact OE2-NH1 2.79Å; E465-R469 IonicContact OE2-NH2 3.29Å; E465-R469 PolarHBondContact OE2-NH2 2.94Å; E465-K526 IonicContact OE1-NZ 2.75Å; E465-K526 PolarHBondContact OE1-NZ 3.13Å; E465-R530 IonicContact OE1-NH2 3.27Å; E465-R530 IonicContact OE2-NH2 3.34Å; E465-R530 PolarHBondContact OE2-NH2 3.34Å
466	S	93.8	Very high	92.5	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.014	30%	0.304	C	S	.	.	H	α-helix	trans	-73.3	-43.7	169.3	-168.9	0	0	0	0	112.6	F437 A462 I463 I464 S468 R469 Q470 E523	F437-S466 WeakPolarHBondContact CZ-OG 3.39Å; A462-S466 WeakPolarHBondContact O-CB 3.44Å; A462-S466 PolarHBondContact O-N 2.88Å; I463-S466 PolarHBondContact O-N 3.03Å; I464-S466 VanDerWaalsContact C-N 3.25Å; I464-S466 PolarHBondContact O-N 2.85Å; S466-S468 VanDerWaalsContact C-N 3.31Å; S466-S468 PolarHBondContact O-N 3.06Å; S466-R469 WeakPolarHBondContact O-CB 3.4Å; S466-R469 PolarHBondContact O-N 3.32Å; S466-Q470 WeakPolarHBondContact O-CG 3.16Å; S466-Q470 PolarHBondContact O-N 2.85Å; S466-E523 WeakPolarHBondContact CB-OE2 3.45Å; S466-E523 VanDerWaalsContact OG-CD 3.24Å; S466-E523 WeakPolarHBondContact OG-CG 3.45Å; S466-E523 PolarHBondContact OG-OE2 2.97Å
467	C	94.9	Very high	92.2	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-57.6	-42.7	173.5	-67.7	0	0	0	0	112	F434 I463 I464 R469 Q470 F471 A478	F434-C467 HydrophobicContact CE2-CB 4.23Å; I463-C467 PolarHBondContact O-N 3.17Å; I463-C467 PolarHBondContact O-SG 3.46Å; I464-C467 CarbonylContact O-C 3.56Å; I464-C467 WeakPolarHBondContact O-CA 3.39Å; I464-C467 WeakPolarHBondContact O-CB 3.18Å; I464-C467 PolarHBondContact O-N 3.39Å; C467-R469 PolarHBondContact O-N 2.91Å; C467-Q470 PolarHBondContact O-N 3.09Å; C467-F471 CarbonylContact O-C 3.52Å; C467-F471 VanDerWaalsContact O-C 3.24Å; C467-F471 WeakPolarHBondContact O-CA 3.43Å; C467-F471 PolarHBondContact O-N 3.12Å; C467-A478 HydrophobicContact CB-CB 3.73Å
468	S	93.9	Very high	92.3	Very high	37 Å²	37	54 Å²	54	26%	0.259	27%	0.265	S	S	.	.	H	α-helix	trans	-58.1	-29.6	174.4	-73.8	0	0	0	0	114.1	I464 S466 P472 Q475	I464-S468 PolarHBondContact O-N 3Å; I464-S468 PolarHBondContact O-OG 3.28Å; S466-S468 VanDerWaalsContact C-N 3.31Å; S466-S468 PolarHBondContact O-N 3.06Å; S468-P472 WeakPolarHBondContact O-CG 3.26Å; S468-Q475 WeakPolarHBondContact OG-CB 3.22Å; S468-Q475 PolarHBondContact OG-OE1 3.29Å
469	R	92	Very high	92.3	Very high	72 Å²	72	55.1 Å²	55.1	27%	0.272	26%	0.263	S	S	.	.	H	α-helix	trans	-79.2	-52.5	175.6	-77.4	-176.6	-75.3	-77.7	9.2	112.6	E465 S466 C467 E523	E465-R469 PolarHBondContact O-NH1 3.43Å; E465-R469 IonicContact OE1-CZ 2.82Å; E465-R469 IonicContact OE1-NH1 3.07Å; E465-R469 PolarHBondContact OE1-NH1 3.48Å; E465-R469 IonicContact OE1-NH2 3.96Å; E465-R469 IonicContact OE2-CZ 3.84Å; E465-R469 VanDerWaalsContact OE2-CZ 3.27Å; E465-R469 IonicContact OE2-NH1 3.08Å; E465-R469 PolarHBondContact OE2-NH1 2.79Å; E465-R469 IonicContact OE2-NH2 3.29Å; E465-R469 PolarHBondContact OE2-NH2 2.94Å; S466-R469 WeakPolarHBondContact O-CB 3.4Å; S466-R469 PolarHBondContact O-N 3.32Å; C467-R469 PolarHBondContact O-N 2.91Å; R469-E523 IonicContact CZ-OE1 3.91Å; R469-E523 IonicContact CZ-OE2 3.42Å; R469-E523 IonicContact NE-OE1 2.75Å; R469-E523 IonicContact NE-OE2 2.78Å; R469-E523 PolarHBondContact NE-OE2 2.93Å; R469-E523 IonicContact NH2-OE1 2.91Å; R469-E523 PolarHBondContact NH2-OE1 3.37Å; R469-E523 IonicContact NH2-OE2 2.67Å; R469-E523 PolarHBondContact NH2-OE2 3.39Å
470	Q	91.4	Very high	92.4	Very high	34 Å²	34	55.1 Å²	55.1	16%	0.159	26%	0.263	C	S	.	.	H	α-helix	trans	-78.5	-30.8	-170	-55.9	-57.8	-7.5	0	0	111.9	F437 S466 C467 A519 S522	F437-Q470 HydrophobicContact CE1-CG 4.42Å; F437-Q470 HydrophobicContact CE2-CG 4.14Å; F437-Q470 HydrophobicContact CZ-CB 4.48Å; F437-Q470 HydrophobicContact CZ-CG 3.83Å; S466-Q470 WeakPolarHBondContact O-CG 3.16Å; S466-Q470 PolarHBondContact O-N 2.85Å; C467-Q470 PolarHBondContact O-N 3.09Å; Q470-A519 HydrophobicContact CB-CB 3.91Å; Q470-A519 HydrophobicContact CG-CB 3.98Å; Q470-A519 PolarHBondContact NE2-O 3.07Å; Q470-A519 VanDerWaalsContact NE2-O 3.11Å; Q470-S522 PolarHBondContact NE2-OG 3.18Å; Q470-S522 PolarHBondContact OE1-OG 3.24Å; Q470-S522 VanDerWaalsContact OE1-OG 3.1Å
471	F	92.4	Very high	92.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.279	C	S	.	.			trans	-138.2	65.9	-175.3	-57.8	-77	0	0	0	111	R430 A433 F434 F437 C467 E473 F474 Q475 I515 A519	R430-F471 HydrophobicContact CG-CD1 3.94Å; R430-F471 HydrophobicContact CG-CE1 4.01Å; A433-F471 HydrophobicContact CB-CE1 3.91Å; A433-F471 HydrophobicContact CB-CZ 3.94Å; F434-F471 HydrophobicContact CB-CB 4.34Å; F434-F471 HydrophobicContact CB-CD1 3.71Å; F434-F471 HydrophobicContact CB-CD2 4.08Å; F434-F471 HydrophobicContact CB-CE1 3.99Å; F434-F471 HydrophobicContact CB-CE2 4.36Å; F434-F471 HydrophobicContact CB-CG 3.76Å; F434-F471 HydrophobicContact CB-CZ 4.32Å; F434-F471 HydrophobicContact CD2-CB 3.79Å; F434-F471 AromaticContact CD2-CD2 3.89Å; F434-F471 HydrophobicContact CD2-CD2 3.89Å; F434-F471 AromaticContact CD2-CG 3.85Å; F434-F471 HydrophobicContact CD2-CG 3.85Å; F434-F471 HydrophobicContact CG-CB 4.38Å; F434-F471 HydrophobicContact CG-CD2 4.49Å; F434-F471 HydrophobicContact CG-CG 4.24Å; F437-F471 HydrophobicContact CB-CE2 3.73Å; F437-F471 HydrophobicContact CB-CZ 4.38Å; F437-F471 HydrophobicContact CD1-CD2 4.34Å; F437-F471 HydrophobicContact CD1-CE2 4.06Å; F437-F471 HydrophobicContact CD2-CE2 4.1Å; F437-F471 HydrophobicContact CG-CD2 4.42Å; F437-F471 AromaticContact CG-CE2 3.71Å; F437-F471 HydrophobicContact CG-CE2 3.71Å; C467-F471 CarbonylContact O-C 3.52Å; C467-F471 VanDerWaalsContact O-C 3.24Å; C467-F471 WeakPolarHBondContact O-CA 3.43Å; C467-F471 PolarHBondContact O-N 3.12Å; F471-E473 PolarHBondContact O-N 2.71Å; F471-F474 HydrophobicContact CB-CB 4.37Å; F471-F474 HydrophobicContact CB-CD2 4.05Å; F471-F474 HydrophobicContact CD1-CD2 4.31Å; F471-F474 PolarHBondContact O-N 3.43Å; F471-Q475 PolarHBondContact O-N 3.1Å; F471-I515 HydrophobicContact CE1-CG2 3.86Å; F471-I515 HydrophobicContact CZ-CG2 4.21Å; F471-A519 HydrophobicContact CE2-CB 3.99Å; F471-A519 HydrophobicContact CZ-CB 4.01Å
472	P	89.2	Confident	92.4	Very high	67 Å²	67	54.1 Å²	54.1	44%	0.435	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-52.7	-41.9	178.6	-23.5	32.8	0	0	0	112.1	S468 F474 Q475	S468-P472 WeakPolarHBondContact O-CG 3.26Å; P472-F474 PolarHBondContact O-N 3.28Å; P472-Q475 WeakPolarHBondContact O-CG 3.47Å; P472-Q475 PolarHBondContact O-N 3.17Å
473	E	88.1	Confident	92.4	Very high	97 Å²	97	56 Å²	56	45%	0.453	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-47.5	-23	172.8	-47.9	-70.3	-178	0	0	115	M426 F471	M426-E473 HydrophobicContact CG-CB 4.48Å; F471-E473 PolarHBondContact O-N 2.71Å
474	F	89.4	Confident	92.5	Very high	3 Å²	3	59.6 Å²	59.6	1%	0.013	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-128.9	14.4	-172.5	-53.1	-51.2	0	0	0	113.3	M426 R430 L431 F434 F471 P472 E476 R477 A478	M426-F474 HydrophobicContact CB-CE1 3.82Å; M426-F474 HydrophobicContact CB-CZ 3.96Å; M426-F474 HydrophobicContact CG-CE1 3.7Å; M426-F474 HydrophobicContact CG-CZ 4.1Å; R430-F474 HydrophobicContact CB-CE2 4.39Å; R430-F474 HydrophobicContact CG-CE2 4.37Å; L431-F474 HydrophobicContact CB-CE1 4.42Å; L431-F474 HydrophobicContact CB-CE2 4.07Å; L431-F474 HydrophobicContact CB-CZ 3.7Å; L431-F474 HydrophobicContact CD1-CD1 4.15Å; L431-F474 HydrophobicContact CD1-CD2 4.45Å; L431-F474 HydrophobicContact CD1-CE1 3.81Å; L431-F474 HydrophobicContact CD1-CE2 4.17Å; L431-F474 HydrophobicContact CD1-CG 4.47Å; L431-F474 HydrophobicContact CD1-CZ 3.83Å; L431-F474 HydrophobicContact CG-CZ 4.31Å; F434-F474 HydrophobicContact CB-CD2 3.66Å; F434-F474 HydrophobicContact CB-CE2 4.22Å; F434-F474 HydrophobicContact CD1-CB 3.8Å; F434-F474 AromaticContact CD1-CD2 3.9Å; F434-F474 HydrophobicContact CD1-CD2 3.9Å; F434-F474 AromaticContact CD1-CG 3.95Å; F434-F474 HydrophobicContact CD1-CG 3.95Å; F434-F474 HydrophobicContact CD2-CB 3.9Å; F434-F474 HydrophobicContact CD2-CD2 4.29Å; F434-F474 HydrophobicContact CE1-CB 3.66Å; F434-F474 HydrophobicContact CE1-CG 4.23Å; F434-F474 HydrophobicContact CE2-CB 3.76Å; F434-F474 HydrophobicContact CG-CB 3.9Å; F434-F474 AromaticContact CG-CD2 3.7Å; F434-F474 HydrophobicContact CG-CD2 3.7Å; F434-F474 HydrophobicContact CG-CG 4.1Å; F434-F474 HydrophobicContact CZ-CB 3.63Å; F434-F474 WeakPolarHBondContact CZ-O 3.5Å; F471-F474 HydrophobicContact CB-CB 4.37Å; F471-F474 HydrophobicContact CB-CD2 4.05Å; F471-F474 HydrophobicContact CD1-CD2 4.31Å; F471-F474 PolarHBondContact O-N 3.43Å; P472-F474 PolarHBondContact O-N 3.28Å; F474-E476 PolarHBondContact O-N 2.96Å; F474-R477 WeakPolarHBondContact O-CA 3.44Å; F474-R477 WeakPolarHBondContact O-CB 3.39Å; F474-R477 PolarHBondContact O-N 2.95Å; F474-R477 VanDerWaalsContact O-N 3.1Å; F474-A478 PolarHBondContact O-N 3.41Å; F474-A478 VanDerWaalsContact O-N 3.15Å
475	Q	87.8	Confident	92.5	Very high	79 Å²	79	60.3 Å²	60.3	37%	0.369	27%	0.273	S	S	.	.	H	α-helix	trans	-60.8	-45.7	-173	67.5	-179	-14.7	0	0	113.7	S468 F471 P472 R477 A478	S468-Q475 WeakPolarHBondContact OG-CB 3.22Å; S468-Q475 PolarHBondContact OG-OE1 3.29Å; F471-Q475 PolarHBondContact O-N 3.1Å; P472-Q475 WeakPolarHBondContact O-CG 3.47Å; P472-Q475 PolarHBondContact O-N 3.17Å; Q475-R477 PolarHBondContact O-N 3.13Å; Q475-A478 WeakPolarHBondContact O-CB 3.38Å; Q475-A478 PolarHBondContact O-N 3.3Å
476	E	88.1	Confident	92.5	Very high	161 Å²	161	56.8 Å²	56.8	75%	0.752	26%	0.257	S	S	*	.	H	α-helix	trans	-63.1	-31.8	177.3	-72.4	151.7	-143.5	0	0	111.4	F474 A478	F474-E476 PolarHBondContact O-N 2.96Å; E476-A478 VanDerWaalsContact C-N 3.3Å; E476-A478 PolarHBondContact O-N 3.03Å
477	R	89.7	Confident	92.5	Very high	71 Å²	71	63.1 Å²	63.1	27%	0.268	28%	0.284	S	S	.	.	H	α-helix	trans	-74.5	-18.1	177.1	-61.5	170.6	170.8	-139.8	-23.5	112.4	D422 F434 F474 Q475 K480 R481	D422-R477 VanDerWaalsContact O-CZ 3.31Å; D422-R477 PolarHBondContact O-NH1 3.49Å; D422-R477 PolarHBondContact O-NH2 3.21Å; D422-R477 IonicContact OD2-CZ 2.66Å; D422-R477 IonicContact OD2-NE 2.83Å; D422-R477 PolarHBondContact OD2-NE 3.27Å; D422-R477 IonicContact OD2-NH2 2.64Å; D422-R477 PolarHBondContact OD2-NH2 2.94Å; F434-R477 HydrophobicContact CE1-CB 4.39Å; F434-R477 HydrophobicContact CZ-CB 4.34Å; F474-R477 WeakPolarHBondContact O-CA 3.44Å; F474-R477 WeakPolarHBondContact O-CB 3.39Å; F474-R477 PolarHBondContact O-N 2.95Å; F474-R477 VanDerWaalsContact O-N 3.1Å; Q475-R477 PolarHBondContact O-N 3.13Å; R477-K480 PolarHBondContact O-N 3.27Å; R477-R481 WeakPolarHBondContact O-CB 3.16Å; R477-R481 WeakPolarHBondContact O-CG 3.37Å; R477-R481 PolarHBondContact O-N 3.49Å
478	A	94.1	Very high	92.2	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.9	-51.6	-175.7	0	0	0	0	0	112.6	F434 I464 C467 F474 Q475 E476 K480 R481 I482	F434-A478 HydrophobicContact CE2-CB 4.27Å; F434-A478 HydrophobicContact CZ-CB 4.32Å; I464-A478 HydrophobicContact CG1-CB 4.43Å; C467-A478 HydrophobicContact CB-CB 3.73Å; F474-A478 PolarHBondContact O-N 3.41Å; F474-A478 VanDerWaalsContact O-N 3.15Å; Q475-A478 WeakPolarHBondContact O-CB 3.38Å; Q475-A478 PolarHBondContact O-N 3.3Å; E476-A478 VanDerWaalsContact C-N 3.3Å; E476-A478 PolarHBondContact O-N 3.03Å; A478-K480 VanDerWaalsContact C-N 3.35Å; A478-K480 PolarHBondContact O-N 2.83Å; A478-R481 PolarHBondContact O-N 3.34Å; A478-R481 VanDerWaalsContact O-N 3.12Å; A478-I482 WeakPolarHBondContact O-CG1 3.38Å; A478-I482 PolarHBondContact O-N 2.89Å
479	R	94.1	Very high	92	Very high	156 Å²	156	64.8 Å²	64.8	59%	0.589	30%	0.296	S	S	*	.	H	α-helix	trans	-61.5	-41.9	179.1	-164	176.1	-176.3	-154.6	1.3	111.7	I464 R481 R483	I464-R479 HydrophobicContact CD1-CB 3.86Å; I464-R479 HydrophobicContact CD1-CG 3.96Å; R479-R481 VanDerWaalsContact C-N 3.34Å; R479-R481 PolarHBondContact O-N 2.93Å; R479-R483 VanDerWaalsContact O-CB 3.3Å; R479-R483 WeakPolarHBondContact O-CB 3.45Å; R479-R483 PolarHBondContact O-N 3.36Å; R479-R483 VanDerWaalsContact O-N 3.08Å
480	K	94.3	Very high	92	Very high	101 Å²	101	64.5 Å²	64.5	44%	0.439	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-36.4	176.2	-147.8	155.6	-175.6	161	0	110.6	E415 R477 A478 T484	E415-K480 IonicContact OE2-NZ 2.82Å; E415-K480 PolarHBondContact OE2-NZ 3.17Å; R477-K480 PolarHBondContact O-N 3.27Å; A478-K480 VanDerWaalsContact C-N 3.35Å; A478-K480 PolarHBondContact O-N 2.83Å; K480-T484 WeakPolarHBondContact O-CB 3.4Å; K480-T484 PolarHBondContact O-N 3.28Å; K480-T484 VanDerWaalsContact O-N 3.17Å; K480-T484 PolarHBondContact O-OG1 3.09Å
481	R	94.4	Very high	91.7	Very high	107 Å²	107	69.8 Å²	69.8	40%	0.404	31%	0.313	S	S	.	.	H	α-helix	trans	-72.5	-46.4	174	-76.4	-52.2	-140.4	-138.3	7.3	114.3	F434 N435 V438 R477 A478 R479 R483 T484 Y485	F434-R481 HydrophobicContact CE1-CG 3.88Å; F434-R481 HydrophobicContact CZ-CG 4.22Å; N435-R481 PolarHBondContact ND2-NH2 3.08Å; N435-R481 PolarHBondContact OD1-NE 2.86Å; N435-R481 PolarHBondContact OD1-NH2 3.19Å; V438-R481 HydrophobicContact CG1-CB 4.1Å; R477-R481 WeakPolarHBondContact O-CB 3.16Å; R477-R481 WeakPolarHBondContact O-CG 3.37Å; R477-R481 PolarHBondContact O-N 3.49Å; A478-R481 PolarHBondContact O-N 3.34Å; A478-R481 VanDerWaalsContact O-N 3.12Å; R479-R481 VanDerWaalsContact C-N 3.34Å; R479-R481 PolarHBondContact O-N 2.93Å; R481-R483 VanDerWaalsContact C-N 3.34Å; R481-R483 PolarHBondContact O-N 3.01Å; R481-T484 CarbonylContact O-C 3.24Å; R481-T484 WeakPolarHBondContact O-CB 3.38Å; R481-T484 PolarHBondContact O-N 3.05Å; R481-T484 VanDerWaalsContact O-N 3.07Å; R481-Y485 PolarHBondContact O-N 3.01Å
482	I	95.2	Very high	90.7	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-56.7	-49.3	175.8	-64.9	162.2	0	0	0	110	V438 V442 L446 I452 I463 I464 A478 T484 Y485 L486	V438-I482 HydrophobicContact CG1-CG1 3.84Å; V442-I482 HydrophobicContact CG2-CB 4.35Å; V442-I482 HydrophobicContact CG2-CG1 3.94Å; V442-I482 HydrophobicContact CG2-CG2 3.9Å; L446-I482 HydrophobicContact CD1-CG2 4.16Å; I452-I482 HydrophobicContact CD1-CB 4.27Å; I452-I482 HydrophobicContact CD1-CG2 3.86Å; I452-I482 HydrophobicContact CG1-CG2 4.44Å; I463-I482 HydrophobicContact CB-CD1 4.26Å; I463-I482 HydrophobicContact CG2-CD1 3.8Å; I463-I482 HydrophobicContact CG2-CG1 4.37Å; I464-I482 HydrophobicContact CD1-CD1 4.49Å; I464-I482 HydrophobicContact CG1-CD1 3.78Å; A478-I482 WeakPolarHBondContact O-CG1 3.38Å; A478-I482 PolarHBondContact O-N 2.89Å; I482-T484 VanDerWaalsContact C-N 3.26Å; I482-T484 PolarHBondContact O-N 3.19Å; I482-Y485 PolarHBondContact O-N 3.47Å; I482-L486 HydrophobicContact CG2-CD1 4.04Å; I482-L486 PolarHBondContact O-N 2.83Å
483	R	94.8	Very high	90	Very high	93 Å²	93	76.7 Å²	76.7	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-54.5	-41.4	175	-177.4	-168.5	-77.7	173	-9.8	111.7	I452 R479 R481 K487	I452-R483 HydrophobicContact CD1-CB 3.99Å; I452-R483 HydrophobicContact CG2-CB 4.31Å; I452-R483 HydrophobicContact CG2-CG 4.06Å; R479-R483 VanDerWaalsContact O-CB 3.3Å; R479-R483 WeakPolarHBondContact O-CB 3.45Å; R479-R483 PolarHBondContact O-N 3.36Å; R479-R483 VanDerWaalsContact O-N 3.08Å; R481-R483 VanDerWaalsContact C-N 3.34Å; R481-R483 PolarHBondContact O-N 3.01Å; R483-K487 VanDerWaalsContact O-CB 3.3Å; R483-K487 WeakPolarHBondContact O-CB 3.31Å; R483-K487 PolarHBondContact O-N 3.06Å
484	T	94.3	Very high	89.1	Confident	77 Å²	77	81.2 Å²	81.2	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-73	-41.2	-179.7	-60.8	0	0	0	0	112.5	K480 R481 I482 K487 S488	K480-T484 WeakPolarHBondContact O-CB 3.4Å; K480-T484 PolarHBondContact O-N 3.28Å; K480-T484 VanDerWaalsContact O-N 3.17Å; K480-T484 PolarHBondContact O-OG1 3.09Å; R481-T484 CarbonylContact O-C 3.24Å; R481-T484 WeakPolarHBondContact O-CB 3.38Å; R481-T484 PolarHBondContact O-N 3.05Å; R481-T484 VanDerWaalsContact O-N 3.07Å; I482-T484 VanDerWaalsContact C-N 3.26Å; I482-T484 PolarHBondContact O-N 3.19Å; T484-K487 WeakPolarHBondContact O-CB 3.42Å; T484-K487 PolarHBondContact O-N 2.92Å; T484-S488 PolarHBondContact O-N 2.93Å
485	Y	95.3	Very high	88.1	Confident	36 Å²	36	86.1 Å²	86.1	14%	0.141	38%	0.382	C	S	.	.	H	α-helix	trans	-67.8	-48.7	-179.2	-176.6	-128.3	0	0	0	111.7	R439 V442 D443 R481 I482 K487 S488 C489	R439-Y485 HydrophobicContact CB-CD1 4.42Å; R439-Y485 HydrophobicContact CB-CE1 3.9Å; R439-Y485 HydrophobicContact CB-CE2 4.46Å; R439-Y485 HydrophobicContact CG-CD1 4.1Å; R439-Y485 HydrophobicContact CG-CD2 3.93Å; R439-Y485 HydrophobicContact CG-CE1 3.88Å; R439-Y485 HydrophobicContact CG-CE2 3.72Å; R439-Y485 HydrophobicContact CG-CG 4.13Å; V442-Y485 HydrophobicContact CB-CD1 3.99Å; V442-Y485 HydrophobicContact CB-CE1 4.3Å; V442-Y485 HydrophobicContact CG1-CD1 3.77Å; V442-Y485 HydrophobicContact CG1-CE1 4.15Å; D443-Y485 VanDerWaalsContact CG-OH 3.24Å; D443-Y485 WeakPolarHBondContact OD1-CE1 3.38Å; D443-Y485 PolarHBondContact OD1-OH 2.97Å; D443-Y485 VanDerWaalsContact OD1-OH 3.07Å; D443-Y485 PolarHBondContact OD2-OH 2.83Å; R481-Y485 PolarHBondContact O-N 3.01Å; I482-Y485 PolarHBondContact O-N 3.47Å; Y485-K487 VanDerWaalsContact C-N 3.26Å; Y485-K487 PolarHBondContact O-N 2.79Å; Y485-S488 CarbonylContact O-C 3.55Å; Y485-S488 WeakPolarHBondContact O-CA 3.38Å; Y485-S488 VanDerWaalsContact O-CB 3.25Å; Y485-S488 WeakPolarHBondContact O-CB 3.49Å; Y485-S488 PolarHBondContact O-N 2.94Å; Y485-C489 VanDerWaalsContact CE2-SG 3.57Å; Y485-C489 VanDerWaalsContact CZ-SG 3.59Å; Y485-C489 PolarHBondContact O-N 2.95Å; Y485-C489 PolarHBondContact O-SG 2.88Å; Y485-C489 VanDerWaalsContact O-SG 3.39Å
486	L	94.8	Very high	86.4	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-57.1	-39	173.1	-68.4	172.8	0	0	0	112	V442 L446 I452 Q455 I482 S488 C489 R490	V442-L486 HydrophobicContact CG1-CD2 3.57Å; V442-L486 HydrophobicContact CG1-CG 3.95Å; L446-L486 HydrophobicContact CD1-CD1 4.3Å; I452-L486 HydrophobicContact CB-CD1 4.26Å; Q455-L486 HydrophobicContact CG-CD1 4.25Å; I482-L486 HydrophobicContact CG2-CD1 4.04Å; I482-L486 PolarHBondContact O-N 2.83Å; L486-S488 VanDerWaalsContact C-N 3.29Å; L486-S488 PolarHBondContact O-N 3.41Å; L486-C489 PolarHBondContact O-N 2.65Å; L486-R490 VanDerWaalsContact C-NH1 3.32Å; L486-R490 PolarHBondContact O-N 3.06Å; L486-R490 VanDerWaalsContact O-N 3.15Å; L486-R490 PolarHBondContact O-NH1 2.75Å; L486-R490 VanDerWaalsContact O-NH1 3.11Å
487	K	93.4	Very high	84.7	Confident	135 Å²	135	85 Å²	85	59%	0.587	40%	0.399	S	S	*	.	H	α-helix	trans	-63	-34.9	173.7	-172.5	-178.7	-68.2	-170.6	0	111.8	R483 T484 Y485 R491	R483-K487 VanDerWaalsContact O-CB 3.3Å; R483-K487 WeakPolarHBondContact O-CB 3.31Å; R483-K487 PolarHBondContact O-N 3.06Å; T484-K487 WeakPolarHBondContact O-CB 3.42Å; T484-K487 PolarHBondContact O-N 2.92Å; Y485-K487 VanDerWaalsContact C-N 3.26Å; Y485-K487 PolarHBondContact O-N 2.79Å; K487-R491 WeakPolarHBondContact O-CB 3.43Å; K487-R491 PolarHBondContact O-N 2.91Å
488	S	88.8	Confident	82.7	Confident	65 Å²	65	88.8 Å²	88.8	46%	0.455	42%	0.42	S	S	.	.	H	α-helix	trans	-70.6	-45.6	174.4	-162.9	0	0	0	0	112.5	T484 Y485 L486 R490 R491 M492	T484-S488 PolarHBondContact O-N 2.93Å; Y485-S488 CarbonylContact O-C 3.55Å; Y485-S488 WeakPolarHBondContact O-CA 3.38Å; Y485-S488 VanDerWaalsContact O-CB 3.25Å; Y485-S488 WeakPolarHBondContact O-CB 3.49Å; Y485-S488 PolarHBondContact O-N 2.94Å; L486-S488 VanDerWaalsContact C-N 3.29Å; L486-S488 PolarHBondContact O-N 3.41Å; S488-R490 PolarHBondContact O-N 3.04Å; S488-R491 WeakPolarHBondContact O-CB 3.38Å; S488-R491 PolarHBondContact O-N 2.78Å; S488-R491 VanDerWaalsContact O-N 3.15Å; S488-M492 WeakPolarHBondContact O-CB 3.36Å; S488-M492 PolarHBondContact O-N 2.5Å
489	C	91.4	Very high	80.7	Confident	7 Å²	7	92.8 Å²	92.8	5%	0.047	44%	0.439	C	S	.	.	H	α-helix	trans	-60.5	-47.6	-179.9	-62.3	0	0	0	0	111.9	R448 Y485 L486 R491 M492 K493 M499	R448-C489 HydrophobicContact CB-CB 4.05Å; Y485-C489 VanDerWaalsContact CE2-SG 3.57Å; Y485-C489 VanDerWaalsContact CZ-SG 3.59Å; Y485-C489 PolarHBondContact O-N 2.95Å; Y485-C489 PolarHBondContact O-SG 2.88Å; Y485-C489 VanDerWaalsContact O-SG 3.39Å; L486-C489 PolarHBondContact O-N 2.65Å; C489-R491 VanDerWaalsContact C-N 3.3Å; C489-R491 PolarHBondContact O-N 2.82Å; C489-M492 PolarHBondContact O-N 2.67Å; C489-K493 PolarHBondContact O-N 2.75Å; C489-K493 VanDerWaalsContact O-N 3.1Å; C489-M499 HydrophobicContact CB-CE 4.45Å
490	R	92.1	Very high	78.4	Confident	66 Å²	66	90.2 Å²	90.2	25%	0.249	44%	0.441	C	S	.	.	H	α-helix	trans	-58.8	-38.4	173.8	-68.9	-167.5	-57.2	-80.6	8.6	113.1	R448 M449 V450 L486 S488 K494	R448-R490 WeakPolarHBondContact O-CG 3.36Å; M449-R490 HydrophobicContact CE-CG 4.46Å; M449-R490 WeakPolarHBondContact O-CD 3.25Å; V450-R490 PolarHBondContact O-NH1 3.37Å; V450-R490 VanDerWaalsContact O-NH1 3.09Å; L486-R490 VanDerWaalsContact C-NH1 3.32Å; L486-R490 PolarHBondContact O-N 3.06Å; L486-R490 VanDerWaalsContact O-N 3.15Å; L486-R490 PolarHBondContact O-NH1 2.75Å; L486-R490 VanDerWaalsContact O-NH1 3.11Å; S488-R490 PolarHBondContact O-N 3.04Å; R490-K494 PolarHBondContact O-N 3.34Å
491	R	83.8	Confident	75.8	Confident	144 Å²	144	93.2 Å²	93.2	54%	0.543	45%	0.45	S	S	.	.	H	α-helix	trans	-66.4	-46.2	175.7	-178	-179.7	177.4	176	0.6	111.2	K487 S488 C489 K494 N495	K487-R491 WeakPolarHBondContact O-CB 3.43Å; K487-R491 PolarHBondContact O-N 2.91Å; S488-R491 WeakPolarHBondContact O-CB 3.38Å; S488-R491 PolarHBondContact O-N 2.78Å; S488-R491 VanDerWaalsContact O-N 3.15Å; C489-R491 VanDerWaalsContact C-N 3.3Å; C489-R491 PolarHBondContact O-N 2.82Å; R491-K494 PolarHBondContact O-N 2.91Å; R491-N495 PolarHBondContact O-N 2.77Å; R491-N495 PolarHBondContact O-OD1 3.42Å
492	M	71.1	Confident	73.8	Confident	70 Å²	70	93.3 Å²	93.3	35%	0.345	46%	0.464	S	S	.	.	H	α-helix	trans	-63	-46	-175.3	-163.1	160.2	78.5	0	0	111.8	S488 C489 K494 N495 G496 M497 M499	S488-M492 WeakPolarHBondContact O-CB 3.36Å; S488-M492 PolarHBondContact O-N 2.5Å; C489-M492 PolarHBondContact O-N 2.67Å; M492-K494 PolarHBondContact O-N 3.37Å; M492-N495 CarbonylContact O-C 3.59Å; M492-N495 WeakPolarHBondContact O-CA 3.34Å; M492-N495 WeakPolarHBondContact O-CB 3.22Å; M492-N495 PolarHBondContact O-N 3.36Å; M492-G496 PolarHBondContact O-N 2.93Å; M492-M497 HydrophobicContact CG-CB 4.44Å; M492-M499 HydrophobicContact CE-CE 4.03Å; M492-M499 HydrophobicContact CE-CG 3.82Å; M492-M499 HydrophobicContact CE-SD 3.71Å
493	K	75.4	Confident	71.4	Confident	142 Å²	142	96.8 Å²	96.8	62%	0.617	49%	0.485	S	S	*	.	H	α-helix	trans	-60.9	-42.1	174.2	-167.8	-178.1	-174.4	174.8	0	112.3	M449 C489 N495 G496	M449-K493 HydrophobicContact CE-CD 3.86Å; M449-K493 HydrophobicContact CG-CD 4.48Å; M449-K493 HydrophobicContact SD-CB 4.27Å; M449-K493 HydrophobicContact SD-CD 3.27Å; M449-K493 WeakPolarHBondContact SD-CD 3.24Å; M449-K493 HydrophobicContact SD-CG 4.38Å; C489-K493 PolarHBondContact O-N 2.75Å; C489-K493 VanDerWaalsContact O-N 3.1Å; K493-N495 PolarHBondContact O-N 3.29Å; K493-G496 PolarHBondContact O-N 3.21Å; K493-G496 VanDerWaalsContact O-N 3.14Å
494	K	69.9	Low	68.9	Low	193 Å²	193	95.2 Å²	95.2	84%	0.839	49%	0.487	S	S	*	.	H	α-helix	trans	-65.8	-15.8	174.6	-176.9	158.5	-176.8	159.2	0	113.4	R490 R491 M492	R490-K494 PolarHBondContact O-N 3.34Å; R491-K494 PolarHBondContact O-N 2.91Å; M492-K494 PolarHBondContact O-N 3.37Å
495	N	66.5	Low	66.6	Low	105 Å²	105	96.2 Å²	96.2	56%	0.561	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	2.1	176	-91.1	112.3	0	0	0	114.1	R491 M492 K493 M497	R491-N495 PolarHBondContact O-N 2.77Å; R491-N495 PolarHBondContact O-OD1 3.42Å; M492-N495 CarbonylContact O-C 3.59Å; M492-N495 WeakPolarHBondContact O-CA 3.34Å; M492-N495 WeakPolarHBondContact O-CB 3.22Å; M492-N495 PolarHBondContact O-N 3.36Å; K493-N495 PolarHBondContact O-N 3.29Å; N495-M497 VanDerWaalsContact C-N 3.25Å; N495-M497 PolarHBondContact O-N 2.93Å
496	G	52.9	Low	64.3	Low	74 Å²	74	102.1 Å²	102.1	76%	0.763	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	10.5	172.6	0	0	0	0	0	115.6	M492 K493	M492-G496 PolarHBondContact O-N 2.93Å; K493-G496 PolarHBondContact O-N 3.21Å; K493-G496 VanDerWaalsContact O-N 3.14Å
497	M	52.5	Low	62.4	Low	144 Å²	144	108.4 Å²	108.4	71%	0.709	56%	0.556	S	S	*	*			trans	-90.2	125.6	173	-155.2	76.9	-170.3	0	0	109	M492 N495	M492-M497 HydrophobicContact CG-CB 4.44Å; N495-M497 VanDerWaalsContact C-N 3.25Å; N495-M497 PolarHBondContact O-N 2.93Å
498	E	48.6	Very low	61.1	Low	150 Å²	150	103 Å²	103	70%	0.701	54%	0.535	S	S	*	.			trans	-69.8	151	-171.5	-150.1	-179.2	118.2	0	0	113.1	T500	E498-T500 VanDerWaalsContact CD-OG1 3.25Å; E498-T500 HydrophobicContact CG-CG2 4.32Å; E498-T500 WeakPolarHBondContact CG-OG1 3.38Å; E498-T500 WeakPolarHBondContact OE1-CB 3.33Å; E498-T500 WeakPolarHBondContact OE1-CG2 3.48Å; E498-T500 PolarHBondContact OE1-OG1 3.36Å
499	M	50.9	Low	60.6	Low	83 Å²	83	101.6 Å²	101.6	41%	0.409	53%	0.525	S	S	.	.	S	Bend	trans	-93.8	12.1	-173.1	-121.4	-63.3	-156.2	0	0	113.6	C489 M492	C489-M499 HydrophobicContact CB-CE 4.45Å; M492-M499 HydrophobicContact CE-CE 4.03Å; M492-M499 HydrophobicContact CE-CG 3.82Å; M492-M499 HydrophobicContact CE-SD 3.71Å
500	T	46.3	Very low	60.2	Low	102 Å²	102	104.8 Å²	104.8	63%	0.626	55%	0.552	S	S	*	*			trans	-92.6	2.3	-166.2	37.5	0	0	0	0	115.4	E498 P502	E498-T500 VanDerWaalsContact CD-OG1 3.25Å; E498-T500 HydrophobicContact CG-CG2 4.32Å; E498-T500 WeakPolarHBondContact CG-OG1 3.38Å; E498-T500 WeakPolarHBondContact OE1-CB 3.33Å; E498-T500 WeakPolarHBondContact OE1-CG2 3.48Å; E498-T500 PolarHBondContact OE1-OG1 3.36Å; T500-P502 WeakPolarHBondContact O-CD 3.46Å
501	R	40.4	Very low	59.8	Low	165 Å²	165	106.7 Å²	106.7	62%	0.623	57%	0.565	S	S	*	*			trans	-101.8	112.3	173.1	175.5	157.1	-74.1	167.4	3.5	111	N212	N212-R501 PolarHBondContact OD1-NH1 2.83Å; N212-R501 PolarHBondContact OD1-NH2 3.41Å
502	P	50.7	Low	60	Low	109 Å²	109	99.9 Å²	99.9	71%	0.708	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-52.9	149.6	164.4	-25.2	34.7	0	0	0	111.5	T500 P504	T500-P502 WeakPolarHBondContact O-CD 3.46Å; P502-P504 WeakPolarHBondContact O-CD 3.35Å
503	T	45.8	Very low	60.8	Low	73 Å²	73	100.3 Å²	100.3	45%	0.448	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-53.7	122.8	175.6	-48.9	0	0	0	0	109.3	M436 L507	M436-T503 HydrophobicContact CE-CG2 4.49Å; M436-T503 HydrophobicContact SD-CG2 4.45Å; T503-L507 HydrophobicContact CG2-CD1 4.39Å
504	P	41.6	Very low	61.5	Low	60 Å²	60	99 Å²	99	39%	0.39	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-57.7	130.3	-178.6	-26.9	34.6	0	0	0	111	P502 H506 L507	P502-P504 WeakPolarHBondContact O-CD 3.35Å; P504-H506 PolarHBondContact O-N 3.25Å; P504-H506 VanDerWaalsContact O-N 3.1Å; P504-L507 HydrophobicContact CB-CG 4.48Å; P504-L507 HydrophobicContact CG-CD1 4.48Å; P504-L507 WeakPolarHBondContact O-CB 3.46Å; P504-L507 PolarHBondContact O-N 3.04Å
505	P	47	Very low	62.6	Low	97 Å²	97	91.5 Å²	91.5	63%	0.63	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-58.7	-31.7	-172.1	20.3	-32.3	0	0	0	112.5	L507 T508	P505-L507 PolarHBondContact O-N 2.71Å; P505-T508 PolarHBondContact O-N 3.29Å
506	H	46.6	Very low	63.8	Low	160 Å²	160	87.8 Å²	87.8	74%	0.741	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-63	0.3	175.9	-154.7	-51.8	0	0	0	115	P504	P504-H506 PolarHBondContact O-N 3.25Å; P504-H506 VanDerWaalsContact O-N 3.1Å
507	L	54.8	Low	65.7	Low	132 Å²	132	86.3 Å²	86.3	69%	0.691	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-98.4	-10	172.3	-61.4	-176.9	0	0	0	114	T503 P504 P505	T503-L507 HydrophobicContact CG2-CD1 4.39Å; P504-L507 HydrophobicContact CB-CG 4.48Å; P504-L507 HydrophobicContact CG-CD1 4.48Å; P504-L507 WeakPolarHBondContact O-CB 3.46Å; P504-L507 PolarHBondContact O-N 3.04Å; P505-L507 PolarHBondContact O-N 2.71Å
508	T	65.6	Low	67.6	Low	23 Å²	23	82.1 Å²	82.1	14%	0.141	46%	0.458	C	S	.	.	S	Bend	trans	-104.5	143.5	173.1	-39	0	0	0	0	108.6	P505 A512 E513	P505-T508 PolarHBondContact O-N 3.29Å; T508-A512 HydrophobicContact CG2-CB 3.87Å; T508-E513 HydrophobicContact CG2-CG 3.43Å; T508-E513 VanDerWaalsContact CG2-CG 3.43Å
509	S	78	Confident	69.6	Low	34 Å²	34	75.1 Å²	75.1	24%	0.238	43%	0.426	C	S	.	.			trans	-80.7	141	170.1	41.5	0	0	0	0	109.3	E429 M511 A512 E513	E429-S509 WeakPolarHBondContact OE1-CB 3.22Å; E429-S509 PolarHBondContact OE1-OG 3.25Å; S509-M511 PolarHBondContact O-N 3.16Å; S509-A512 CarbonylContact O-C 3.53Å; S509-A512 WeakPolarHBondContact O-CA 3.35Å; S509-A512 WeakPolarHBondContact O-CB 3.43Å; S509-A512 PolarHBondContact O-N 3.28Å; S509-A512 WeakPolarHBondContact OG-CB 3.31Å; S509-E513 PolarHBondContact O-N 3.39Å
510	A	83.4	Confident	71.5	Confident	75 Å²	75	72.7 Å²	72.7	62%	0.62	42%	0.416	S	S	*	.	H	α-helix	trans	-54.9	-31.6	-178	0	0	0	0	0	113.4	E513 N514	A510-E513 PolarHBondContact O-N 3.03Å; A510-N514 WeakPolarHBondContact O-CB 3.42Å; A510-N514 PolarHBondContact O-N 2.99Å
511	M	84.6	Confident	73.5	Confident	106 Å²	106	73.1 Å²	73.1	52%	0.522	41%	0.411	S	S	.	.	H	α-helix	trans	-64.8	-42.1	171.3	178.5	170.3	166.1	0	0	112.5	E429 S509 N514 I515	E429-M511 HydrophobicContact CB-CB 4.45Å; E429-M511 HydrophobicContact CB-CE 4.26Å; E429-M511 HydrophobicContact CB-CG 4.05Å; E429-M511 HydrophobicContact CB-SD 4.24Å; E429-M511 HydrophobicContact CG-CB 4.38Å; E429-M511 HydrophobicContact CG-CE 4.27Å; E429-M511 HydrophobicContact CG-CG 4.17Å; E429-M511 HydrophobicContact CG-SD 3.87Å; S509-M511 PolarHBondContact O-N 3.16Å; M511-N514 PolarHBondContact O-N 2.92Å; M511-I515 HydrophobicContact CE-CD1 4.19Å; M511-I515 HydrophobicContact CG-CD1 4.04Å; M511-I515 WeakPolarHBondContact O-CD1 3.47Å; M511-I515 VanDerWaalsContact O-CG1 3.22Å; M511-I515 WeakPolarHBondContact O-CG1 3.34Å; M511-I515 PolarHBondContact O-N 3.12Å
512	A	87.5	Confident	75.7	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-69.9	-30.8	174.5	0	0	0	0	0	112.6	E429 K432 A433 T508 S509 L516	E429-A512 HydrophobicContact CB-CB 4.27Å; E429-A512 WeakPolarHBondContact O-CB 3.42Å; K432-A512 HydrophobicContact CB-CB 3.79Å; A433-A512 HydrophobicContact CB-CB 4.3Å; A433-A512 WeakPolarHBondContact CB-O 3.42Å; T508-A512 HydrophobicContact CG2-CB 3.87Å; S509-A512 CarbonylContact O-C 3.53Å; S509-A512 WeakPolarHBondContact O-CA 3.35Å; S509-A512 WeakPolarHBondContact O-CB 3.43Å; S509-A512 PolarHBondContact O-N 3.28Å; S509-A512 WeakPolarHBondContact OG-CB 3.31Å; A512-L516 VanDerWaalsContact O-CB 3.24Å; A512-L516 WeakPolarHBondContact O-CB 3.5Å; A512-L516 PolarHBondContact O-N 3.32Å
513	E	87.1	Confident	77.5	Confident	79 Å²	79	63.1 Å²	63.1	37%	0.369	37%	0.367	S	S	.	.	H	α-helix	trans	-67.3	-42.6	171.3	-63.4	-175.1	139.7	0	0	111.4	T508 S509 A510 L516 A517	T508-E513 HydrophobicContact CG2-CG 3.43Å; T508-E513 VanDerWaalsContact CG2-CG 3.43Å; S509-E513 PolarHBondContact O-N 3.39Å; A510-E513 PolarHBondContact O-N 3.03Å; E513-L516 WeakPolarHBondContact O-CB 3.48Å; E513-L516 PolarHBondContact O-N 3.36Å; E513-A517 WeakPolarHBondContact O-CB 3.47Å; E513-A517 PolarHBondContact O-N 3.49Å
514	N	91.9	Very high	79.4	Confident	116 Å²	116	64.3 Å²	64.3	62%	0.62	37%	0.374	S	S	*	.	H	α-helix	trans	-64.1	-42	174.5	-175	59.8	0	0	0	112.5	A510 M511 L516 A517 A518	A510-N514 WeakPolarHBondContact O-CB 3.42Å; A510-N514 PolarHBondContact O-N 2.99Å; M511-N514 PolarHBondContact O-N 2.92Å; N514-L516 VanDerWaalsContact C-N 3.32Å; N514-L516 PolarHBondContact O-N 3.47Å; N514-A517 PolarHBondContact O-N 3.3Å; N514-A518 PolarHBondContact O-N 2.85Å; N514-A518 VanDerWaalsContact O-N 3.07Å
515	I	91.7	Very high	81.5	Confident	35 Å²	35	69.6 Å²	69.6	18%	0.179	39%	0.387	C	S	.	.	H	α-helix	trans	-62.5	-40.5	173.3	-67.6	163.2	0	0	0	110.7	E429 R430 A433 F471 M511 A519	E429-I515 HydrophobicContact CB-CD1 4.35Å; R430-I515 HydrophobicContact CB-CD1 4.47Å; R430-I515 HydrophobicContact CG-CG2 4.36Å; A433-I515 HydrophobicContact CB-CB 3.87Å; A433-I515 HydrophobicContact CB-CG2 3.54Å; F471-I515 HydrophobicContact CE1-CG2 3.86Å; F471-I515 HydrophobicContact CZ-CG2 4.21Å; M511-I515 HydrophobicContact CE-CD1 4.19Å; M511-I515 HydrophobicContact CG-CD1 4.04Å; M511-I515 WeakPolarHBondContact O-CD1 3.47Å; M511-I515 VanDerWaalsContact O-CG1 3.22Å; M511-I515 WeakPolarHBondContact O-CG1 3.34Å; M511-I515 PolarHBondContact O-N 3.12Å; I515-A519 WeakPolarHBondContact O-CB 3.45Å; I515-A519 PolarHBondContact O-N 3.09Å
516	L	92.7	Very high	83.2	Confident	26 Å²	26	68.1 Å²	68.1	14%	0.136	37%	0.37	C	S	.	.	H	α-helix	trans	-64.9	-45.9	176.9	178.7	65.9	0	0	0	111.9	A433 M436 F437 L440 A512 E513 N514 A519 C520	A433-L516 HydrophobicContact CB-CB 4.36Å; M436-L516 HydrophobicContact CB-CD1 4Å; M436-L516 HydrophobicContact CB-CD2 3.59Å; M436-L516 HydrophobicContact CB-CG 4.41Å; M436-L516 HydrophobicContact CG-CD2 4.29Å; F437-L516 HydrophobicContact CB-CD1 3.72Å; F437-L516 HydrophobicContact CD2-CD1 4.13Å; F437-L516 HydrophobicContact CG-CD1 4.45Å; L440-L516 HydrophobicContact CD1-CD1 4.26Å; L440-L516 HydrophobicContact CD1-CD2 4.22Å; A512-L516 VanDerWaalsContact O-CB 3.24Å; A512-L516 WeakPolarHBondContact O-CB 3.5Å; A512-L516 PolarHBondContact O-N 3.32Å; E513-L516 WeakPolarHBondContact O-CB 3.48Å; E513-L516 PolarHBondContact O-N 3.36Å; N514-L516 VanDerWaalsContact C-N 3.32Å; N514-L516 PolarHBondContact O-N 3.47Å; L516-A519 PolarHBondContact O-N 3.28Å; L516-C520 PolarHBondContact O-N 2.92Å; L516-C520 PolarHBondContact O-SG 3.25Å
517	A	91.4	Very high	84.9	Confident	44 Å²	44	62.9 Å²	62.9	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-58.8	-49.9	177.9	0	0	0	0	0	111.3	E513 N514 A519 C520 E521	E513-A517 WeakPolarHBondContact O-CB 3.47Å; E513-A517 PolarHBondContact O-N 3.49Å; N514-A517 PolarHBondContact O-N 3.3Å; A517-A519 VanDerWaalsContact C-N 3.31Å; A517-A519 PolarHBondContact O-N 3.11Å; A517-C520 PolarHBondContact O-N 2.91Å; A517-E521 WeakPolarHBondContact O-CB 3.46Å; A517-E521 PolarHBondContact O-N 3.24Å
518	A	92.2	Very high	86.2	Confident	55 Å²	55	59.4 Å²	59.4	46%	0.455	35%	0.345	S	S	.	.	H	α-helix	trans	-61.4	-36.3	176.8	0	0	0	0	0	113.1	N514 S522	N514-A518 PolarHBondContact O-N 2.85Å; N514-A518 VanDerWaalsContact O-N 3.07Å; A518-S522 WeakPolarHBondContact O-CB 3.46Å; A518-S522 PolarHBondContact O-N 3.2Å; A518-S522 VanDerWaalsContact O-N 3.11Å; A518-S522 PolarHBondContact O-OG 3.11Å
519	A	91.4	Very high	87.1	Confident	4 Å²	4	65.9 Å²	65.9	3%	0.033	37%	0.371	C	S	.	.	H	α-helix	trans	-67.9	-41.3	175.2	0	0	0	0	0	112.5	F437 Q470 F471 I515 L516 A517 S522 E523	F437-A519 HydrophobicContact CD2-CB 3.89Å; F437-A519 HydrophobicContact CE2-CB 3.91Å; Q470-A519 HydrophobicContact CB-CB 3.91Å; Q470-A519 HydrophobicContact CG-CB 3.98Å; Q470-A519 PolarHBondContact NE2-O 3.07Å; Q470-A519 VanDerWaalsContact NE2-O 3.11Å; F471-A519 HydrophobicContact CE2-CB 3.99Å; F471-A519 HydrophobicContact CZ-CB 4.01Å; I515-A519 WeakPolarHBondContact O-CB 3.45Å; I515-A519 PolarHBondContact O-N 3.09Å; L516-A519 PolarHBondContact O-N 3.28Å; A517-A519 VanDerWaalsContact C-N 3.31Å; A517-A519 PolarHBondContact O-N 3.11Å; A519-S522 PolarHBondContact O-OG 3.35Å; A519-E523 PolarHBondContact O-N 2.84Å
520	C	91.3	Very high	87.1	Confident	31 Å²	31	68.6 Å²	68.6	21%	0.209	38%	0.376	C	S	.	.	H	α-helix	trans	-66.3	-53.8	174.5	-73.7	0	0	0	0	111.2	L516 A517 S522 E523 T524	L516-C520 PolarHBondContact O-N 2.92Å; L516-C520 PolarHBondContact O-SG 3.25Å; A517-C520 PolarHBondContact O-N 2.91Å; C520-S522 VanDerWaalsContact C-N 3.26Å; C520-S522 PolarHBondContact O-N 3.11Å; C520-E523 PolarHBondContact O-N 3.21Å; C520-T524 PolarHBondContact O-N 3.43Å; C520-T524 PolarHBondContact O-OG1 2.71Å; C520-T524 VanDerWaalsContact O-OG1 3.09Å
521	E	88.9	Confident	86.6	Confident	112 Å²	112	71 Å²	71	52%	0.523	38%	0.376	S	S	.	.	H	α-helix	trans	-53.4	-40.8	179.1	-81.7	-172.6	-140.2	0	0	113.2	A517 T524 R525	A517-E521 WeakPolarHBondContact O-CB 3.46Å; A517-E521 PolarHBondContact O-N 3.24Å; E521-T524 PolarHBondContact O-N 2.97Å; E521-R525 WeakPolarHBondContact O-CB 3.44Å; E521-R525 PolarHBondContact O-N 2.91Å; E521-R525 IonicContact OE2-NH2 3.52Å
522	S	86.3	Confident	86.5	Confident	46 Å²	46	73.5 Å²	73.5	32%	0.322	38%	0.38	S	S	.	.	H	α-helix	trans	-76.1	-30.4	-177.3	56.1	0	0	0	0	113.2	Q470 A518 A519 C520 K526	Q470-S522 PolarHBondContact NE2-OG 3.18Å; Q470-S522 PolarHBondContact OE1-OG 3.24Å; Q470-S522 VanDerWaalsContact OE1-OG 3.1Å; A518-S522 WeakPolarHBondContact O-CB 3.46Å; A518-S522 PolarHBondContact O-N 3.2Å; A518-S522 VanDerWaalsContact O-N 3.11Å; A518-S522 PolarHBondContact O-OG 3.11Å; A519-S522 PolarHBondContact O-OG 3.35Å; C520-S522 VanDerWaalsContact C-N 3.26Å; C520-S522 PolarHBondContact O-N 3.11Å; S522-K526 WeakPolarHBondContact O-CB 3.44Å; S522-K526 PolarHBondContact O-N 2.91Å
523	E	87.9	Confident	85.7	Confident	17 Å²	17	78.7 Å²	78.7	8%	0.079	41%	0.407	C	S	.	.	H	α-helix	trans	-74	-38.9	168.1	-166.6	71.2	-136.1	0	0	111.4	F441 S466 R469 A519 C520 R525 K526 A527 R530	F441-E523 HydrophobicContact CE1-CG 4.19Å; F441-E523 HydrophobicContact CZ-CB 4.2Å; F441-E523 HydrophobicContact CZ-CG 4.14Å; S466-E523 WeakPolarHBondContact CB-OE2 3.45Å; S466-E523 VanDerWaalsContact OG-CD 3.24Å; S466-E523 WeakPolarHBondContact OG-CG 3.45Å; S466-E523 PolarHBondContact OG-OE2 2.97Å; R469-E523 IonicContact CZ-OE1 3.91Å; R469-E523 IonicContact CZ-OE2 3.42Å; R469-E523 IonicContact NE-OE1 2.75Å; R469-E523 IonicContact NE-OE2 2.78Å; R469-E523 PolarHBondContact NE-OE2 2.93Å; R469-E523 IonicContact NH2-OE1 2.91Å; R469-E523 PolarHBondContact NH2-OE1 3.37Å; R469-E523 IonicContact NH2-OE2 2.67Å; R469-E523 PolarHBondContact NH2-OE2 3.39Å; A519-E523 PolarHBondContact O-N 2.84Å; C520-E523 PolarHBondContact O-N 3.21Å; E523-R525 VanDerWaalsContact C-N 3.29Å; E523-R525 PolarHBondContact O-N 3.32Å; E523-K526 CarbonylContact O-C 3.5Å; E523-K526 WeakPolarHBondContact O-CA 3.46Å; E523-K526 WeakPolarHBondContact O-CB 3.47Å; E523-K526 PolarHBondContact O-N 3.5Å; E523-A527 PolarHBondContact O-N 3.03Å; E523-R530 IonicContact OE1-CZ 3.27Å; E523-R530 IonicContact OE1-NH1 3.77Å; E523-R530 PolarHBondContact OE1-NH1 2.77Å
524	T	85.9	Confident	84.8	Confident	98 Å²	98	80.6 Å²	80.6	60%	0.601	42%	0.416	S	S	*	.	H	α-helix	trans	-57.2	-43.8	171.4	-56.8	0	0	0	0	111.1	C520 E521 K526 A527 A528	C520-T524 PolarHBondContact O-N 3.43Å; C520-T524 PolarHBondContact O-OG1 2.71Å; C520-T524 VanDerWaalsContact O-OG1 3.09Å; E521-T524 PolarHBondContact O-N 2.97Å; T524-K526 VanDerWaalsContact C-N 3.34Å; T524-K526 PolarHBondContact O-N 3.41Å; T524-A527 PolarHBondContact O-N 3.49Å; T524-A528 WeakPolarHBondContact O-CB 3.22Å; T524-A528 PolarHBondContact O-N 3.05Å
525	R	85.6	Confident	83.8	Confident	172 Å²	172	80.2 Å²	80.2	65%	0.649	41%	0.413	S	S	*	.	H	α-helix	trans	-65.7	-33.2	174.7	-162.7	-178.6	-54.6	-110.1	2.3	112.3	E521 E523 K529	E521-R525 WeakPolarHBondContact O-CB 3.44Å; E521-R525 PolarHBondContact O-N 2.91Å; E521-R525 IonicContact OE2-NH2 3.52Å; E523-R525 VanDerWaalsContact C-N 3.29Å; E523-R525 PolarHBondContact O-N 3.32Å; R525-K529 WeakPolarHBondContact O-CB 3.48Å; R525-K529 PolarHBondContact O-N 3.12Å; R525-K529 VanDerWaalsContact O-N 3.07Å
526	K	83.6	Confident	82.5	Confident	66 Å²	66	85 Å²	85	29%	0.287	43%	0.429	S	S	.	.	H	α-helix	trans	-70.4	-40.7	172.1	-166.4	-175.7	-178.5	-161.2	0	111.7	E465 S522 E523 T524 K529 R530	E465-K526 IonicContact OE1-NZ 2.75Å; E465-K526 PolarHBondContact OE1-NZ 3.13Å; S522-K526 WeakPolarHBondContact O-CB 3.44Å; S522-K526 PolarHBondContact O-N 2.91Å; E523-K526 CarbonylContact O-C 3.5Å; E523-K526 WeakPolarHBondContact O-CA 3.46Å; E523-K526 WeakPolarHBondContact O-CB 3.47Å; E523-K526 PolarHBondContact O-N 3.5Å; T524-K526 VanDerWaalsContact C-N 3.34Å; T524-K526 PolarHBondContact O-N 3.41Å; K526-K529 PolarHBondContact O-N 3.47Å; K526-R530 WeakPolarHBondContact O-CG 3.33Å; K526-R530 PolarHBondContact O-N 3.47Å
527	A	81.3	Confident	80.8	Confident	49 Å²	49	89.5 Å²	89.5	41%	0.405	45%	0.45	S	S	.	.	H	α-helix	trans	-62.7	-48.5	175.7	0	0	0	0	0	111.1	E523 T524 K529 R530 M531	E523-A527 PolarHBondContact O-N 3.03Å; T524-A527 PolarHBondContact O-N 3.49Å; A527-K529 VanDerWaalsContact C-N 3.27Å; A527-K529 PolarHBondContact O-N 3.1Å; A527-R530 WeakPolarHBondContact O-CB 3.33Å; A527-R530 PolarHBondContact O-N 2.85Å; A527-R530 VanDerWaalsContact O-N 3.11Å; A527-M531 PolarHBondContact O-N 3.14Å
528	A	82.2	Confident	79.1	Confident	59 Å²	59	92.2 Å²	92.2	49%	0.488	47%	0.466	S	S	.	.	H	α-helix	trans	-58.7	-36.6	173.2	0	0	0	0	0	112.6	T524 R532	T524-A528 WeakPolarHBondContact O-CB 3.22Å; T524-A528 PolarHBondContact O-N 3.05Å; A528-R532 WeakPolarHBondContact O-CB 3.37Å; A528-R532 PolarHBondContact O-N 3.28Å
529	K	83.6	Confident	77.5	Confident	160 Å²	160	93.5 Å²	93.5	70%	0.696	47%	0.471	S	S	*	.	H	α-helix	trans	-69.8	-38	174.1	-170.7	176.8	179.6	-178.3	0	112.9	R525 K526 A527 L533	R525-K529 WeakPolarHBondContact O-CB 3.48Å; R525-K529 PolarHBondContact O-N 3.12Å; R525-K529 VanDerWaalsContact O-N 3.07Å; K526-K529 PolarHBondContact O-N 3.47Å; A527-K529 VanDerWaalsContact C-N 3.27Å; A527-K529 PolarHBondContact O-N 3.1Å; K529-L533 WeakPolarHBondContact O-CB 3.3Å; K529-L533 PolarHBondContact O-N 3.14Å
530	R	79.1	Confident	75.6	Confident	90 Å²	90	101.2 Å²	101.2	34%	0.34	51%	0.507	S	S	.	.	H	α-helix	trans	-61.6	-54	173	-74.7	176.1	173.9	124.7	-15.8	110.2	E465 E523 K526 A527 R532 L533 E534	E465-R530 IonicContact OE1-NH2 3.27Å; E465-R530 IonicContact OE2-NH2 3.34Å; E465-R530 PolarHBondContact OE2-NH2 3.34Å; E523-R530 IonicContact OE1-CZ 3.27Å; E523-R530 IonicContact OE1-NH1 3.77Å; E523-R530 PolarHBondContact OE1-NH1 2.77Å; K526-R530 WeakPolarHBondContact O-CG 3.33Å; K526-R530 PolarHBondContact O-N 3.47Å; A527-R530 WeakPolarHBondContact O-CB 3.33Å; A527-R530 PolarHBondContact O-N 2.85Å; A527-R530 VanDerWaalsContact O-N 3.11Å; R530-R532 VanDerWaalsContact C-N 3.3Å; R530-R532 PolarHBondContact O-N 2.86Å; R530-L533 WeakPolarHBondContact O-CA 3.42Å; R530-L533 WeakPolarHBondContact O-CB 3.39Å; R530-L533 PolarHBondContact O-N 3.18Å; R530-E534 PolarHBondContact O-N 3.1Å
531	M	73.4	Confident	73.4	Confident	125 Å²	125	106.3 Å²	106.3	62%	0.616	53%	0.532	S	S	*	.	H	α-helix	trans	-55.9	-42.3	178.4	-171.7	-176	-173.3	0	0	112.3	A527 L533 E534 I535	A527-M531 PolarHBondContact O-N 3.14Å; M531-L533 VanDerWaalsContact C-N 3.33Å; M531-L533 PolarHBondContact O-N 3.4Å; M531-E534 WeakPolarHBondContact CA-OE2 3.42Å; M531-E534 PolarHBondContact O-N 3.22Å; M531-I535 HydrophobicContact CG-CD1 4.46Å; M531-I535 WeakPolarHBondContact O-CD1 3.43Å; M531-I535 VanDerWaalsContact O-CG1 3.3Å; M531-I535 WeakPolarHBondContact O-CG1 3.47Å; M531-I535 PolarHBondContact O-N 3.44Å; M531-I535 VanDerWaalsContact O-N 3.1Å
532	R	81.3	Confident	70.9	Confident	160 Å²	160	108.9 Å²	108.9	60%	0.604	54%	0.544	S	S	*	.	H	α-helix	trans	-67.2	-31.6	175	-173.1	170.6	-179	175.9	-1.3	113.1	A528 R530 Y536	A528-R532 WeakPolarHBondContact O-CB 3.37Å; A528-R532 PolarHBondContact O-N 3.28Å; R530-R532 VanDerWaalsContact C-N 3.3Å; R530-R532 PolarHBondContact O-N 2.86Å; R532-Y536 HydrophobicContact CG-CD2 4.31Å; R532-Y536 HydrophobicContact CG-CE2 4.09Å; R532-Y536 VanDerWaalsContact O-CD2 3.24Å; R532-Y536 WeakPolarHBondContact O-CD2 3.34Å; R532-Y536 PolarHBondContact O-N 3.05Å
533	L	70.7	Confident	69	Low	108 Å²	108	111.9 Å²	111.9	57%	0.565	56%	0.563	S	S	*	*	H	α-helix	trans	-72.9	-43	175.9	-165.2	75.3	0	0	0	111.2	K529 R530 M531 I535 Y536 Q537	K529-L533 WeakPolarHBondContact O-CB 3.3Å; K529-L533 PolarHBondContact O-N 3.14Å; R530-L533 WeakPolarHBondContact O-CA 3.42Å; R530-L533 WeakPolarHBondContact O-CB 3.39Å; R530-L533 PolarHBondContact O-N 3.18Å; M531-L533 VanDerWaalsContact C-N 3.33Å; M531-L533 PolarHBondContact O-N 3.4Å; L533-I535 VanDerWaalsContact C-N 3.3Å; L533-I535 PolarHBondContact O-N 3.26Å; L533-Y536 PolarHBondContact O-N 2.91Å; L533-Y536 VanDerWaalsContact O-N 3.12Å; L533-Q537 WeakPolarHBondContact O-CB 3.24Å; L533-Q537 PolarHBondContact O-N 3.06Å
534	E	67.8	Low	66.9	Low	120 Å²	120	118.6 Å²	118.6	56%	0.561	60%	0.597	S	S	*	*	H	α-helix	trans	-57.4	-42.4	175	-71	166	155	0	0	111.1	R530 M531 Y536 Q537 S538	R530-E534 PolarHBondContact O-N 3.1Å; M531-E534 WeakPolarHBondContact CA-OE2 3.42Å; M531-E534 PolarHBondContact O-N 3.22Å; E534-Y536 PolarHBondContact O-N 3.11Å; E534-Q537 PolarHBondContact O-N 3.3Å; E534-S538 WeakPolarHBondContact O-CB 3.36Å; E534-S538 PolarHBondContact O-N 3.07Å; E534-S538 PolarHBondContact O-OG 3.38Å; E534-S538 VanDerWaalsContact O-OG 3.12Å
535	I	71.6	Confident	64.6	Low	108 Å²	108	118.8 Å²	118.8	55%	0.554	61%	0.608	S	S	*	*	H	α-helix	trans	-59.2	-43.9	174	-70	164.2	0	0	0	112.3	M531 L533 S539	M531-I535 HydrophobicContact CG-CD1 4.46Å; M531-I535 WeakPolarHBondContact O-CD1 3.43Å; M531-I535 VanDerWaalsContact O-CG1 3.3Å; M531-I535 WeakPolarHBondContact O-CG1 3.47Å; M531-I535 PolarHBondContact O-N 3.44Å; M531-I535 VanDerWaalsContact O-N 3.1Å; L533-I535 VanDerWaalsContact C-N 3.3Å; L533-I535 PolarHBondContact O-N 3.26Å; I535-S539 PolarHBondContact O-N 3Å
536	Y	65.1	Low	62.6	Low	134 Å²	134	117.9 Å²	117.9	53%	0.525	62%	0.616	S	S	.	*	H	α-helix	trans	-70	-36	176.3	-80.9	-65.5	0	0	0	112.5	R532 L533 E534 S539 Q540	R532-Y536 HydrophobicContact CG-CD2 4.31Å; R532-Y536 HydrophobicContact CG-CE2 4.09Å; R532-Y536 VanDerWaalsContact O-CD2 3.24Å; R532-Y536 WeakPolarHBondContact O-CD2 3.34Å; R532-Y536 PolarHBondContact O-N 3.05Å; L533-Y536 PolarHBondContact O-N 2.91Å; L533-Y536 VanDerWaalsContact O-N 3.12Å; E534-Y536 PolarHBondContact O-N 3.11Å; Y536-S539 WeakPolarHBondContact CA-OG 3.19Å; Y536-S539 PolarHBondContact O-N 3.28Å; Y536-S539 PolarHBondContact O-OG 2.87Å; Y536-Q540 WeakPolarHBondContact O-CG 3.48Å
537	Q	55.8	Low	60.2	Low	122 Å²	122	121.4 Å²	121.4	57%	0.57	64%	0.638	S	S	*	*	H	α-helix	trans	-72	-42.6	-178	-162.5	155.2	8.9	0	0	111.4	L533 E534 S539 Q540	L533-Q537 WeakPolarHBondContact O-CB 3.24Å; L533-Q537 PolarHBondContact O-N 3.06Å; E534-Q537 PolarHBondContact O-N 3.3Å; Q537-S539 PolarHBondContact O-N 2.9Å; Q537-S539 VanDerWaalsContact O-N 3.14Å; Q537-Q540 PolarHBondContact O-N 2.87Å
538	S	56.4	Low	58.2	Low	100 Å²	100	126.4 Å²	126.4	70%	0.699	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-14.3	169.4	-59.4	0	0	0	0	114	E534	E534-S538 WeakPolarHBondContact O-CB 3.36Å; E534-S538 PolarHBondContact O-N 3.07Å; E534-S538 PolarHBondContact O-OG 3.38Å; E534-S538 VanDerWaalsContact O-OG 3.12Å
539	S	58.4	Low	55.8	Low	82 Å²	82	129.8 Å²	129.8	57%	0.573	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	6	173.3	75.8	0	0	0	0	114.5	I535 Y536 Q537	I535-S539 PolarHBondContact O-N 3Å; Y536-S539 WeakPolarHBondContact CA-OG 3.19Å; Y536-S539 PolarHBondContact O-N 3.28Å; Y536-S539 PolarHBondContact O-OG 2.87Å; Q537-S539 PolarHBondContact O-N 2.9Å; Q537-S539 VanDerWaalsContact O-N 3.14Å
540	Q	52.8	Low	53.2	Low	167 Å²	167	130.2 Å²	130.2	78%	0.78	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	-23.7	178.5	-64.1	-110.6	-67.1	0	0	113.6	Y536 Q537 E542	Y536-Q540 WeakPolarHBondContact O-CG 3.48Å; Q537-Q540 PolarHBondContact O-N 2.87Å; Q540-E542 VanDerWaalsContact C-N 3.33Å; Q540-E542 PolarHBondContact O-N 3.12Å; Q540-E542 VanDerWaalsContact O-N 3.11Å
541	D	44.4	Very low	51.2	Low	137 Å²	137	131 Å²	131	73%	0.733	68%	0.679	S	S	*	*			trans	-85.4	65.6	177.2	-79.6	-58.5	0	0	0	112.3	P543	D541-P543 WeakPolarHBondContact O-CD 3.42Å
542	E	36.5	Very low	49.2	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	69%	0.694	S	S	*	*			trans	-114	86	170	-142.6	-81.6	96.7	0	0	109.1	Q540 I544	Q540-E542 VanDerWaalsContact C-N 3.33Å; Q540-E542 PolarHBondContact O-N 3.12Å; Q540-E542 VanDerWaalsContact O-N 3.11Å; E542-I544 PolarHBondContact O-N 2.85Å
543	P	45.4	Very low	46.8	Very low	109 Å²	109	135.9 Å²	135.9	71%	0.708	70%	0.702	S	S	*	*			trans	-80.9	108.9	-171.3	30.9	-34.2	0	0	0	112.3	D541 A545	D541-P543 WeakPolarHBondContact O-CD 3.42Å; P543-A545 PolarHBondContact O-N 3.16Å; P543-A545 VanDerWaalsContact O-N 3.12Å
544	I	44.4	Very low	44.8	Very low	158 Å²	158	136.1 Å²	136.1	81%	0.81	71%	0.713	S	S	*	*			trans	-29.4	108.8	171.2	-63.1	160.4	0	0	0	113.2	E542	E542-I544 PolarHBondContact O-N 2.85Å
545	A	37.2	Very low	43	Very low	101 Å²	101	134.9 Å²	134.9	84%	0.835	72%	0.723	S	S	*	*			trans	-84.9	141.4	162.2	0	0	0	0	0	110.1	P543	P543-A545 PolarHBondContact O-N 3.16Å; P543-A545 VanDerWaalsContact O-N 3.12Å
546	L	44.5	Very low	41	Very low	154 Å²	154	133.7 Å²	133.7	81%	0.806	73%	0.729	S	S	*	*			trans	-121.1	124.8	-162.2	-175.7	165.9	0	0	0	111.2
547	D	32.2	Very low	39.4	Very low	140 Å²	140	134.6 Å²	134.6	75%	0.749	74%	0.742	S	S	*	*			trans	-136.6	117.6	160.1	-156.7	-120	0	0	0	113
548	K	39.9	Very low	38.1	Very low	154 Å²	154	133.7 Å²	133.7	67%	0.67	74%	0.744	S	S	*	*			trans	30.5	136	139.3	-98.7	169	170.6	172.5	0	119.5
549	Q	31.3	Very low	37	Very low	130 Å²	130	137.3 Å²	137.3	61%	0.607	75%	0.75	S	S	*	*			cis	-179.8	167.5	33.8	-159.5	163.4	-70.3	0	0	110.4
550	H	29.4	Very low	35.8	Very low	168 Å²	168	138 Å²	138	78%	0.778	76%	0.755	S	S	*	*			trans	81.5	142.1	165.5	-61.4	125.1	0	0	0	119.5
551	S	36.2	Very low	34.8	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	75%	0.751	S	S	*	*			trans	-110.8	139	174.8	156.8	0	0	0	0	109.5
552	R	33.1	Very low	34.1	Very low	244 Å²	244	139.8 Å²	139.8	92%	0.921	76%	0.759	S	S	*	*			trans	-168.3	155.9	134.5	-114.5	175.3	174.2	172.5	-2.1	113.4
553	D	29	Very low	34	Very low	145 Å²	145	137.2 Å²	137.2	78%	0.775	76%	0.759	S	S	*	*			trans	-78.3	165.3	176	-77	-78	0	0	0	114.8
554	S	30.5	Very low	33.4	Very low	113 Å²	113	140.1 Å²	140.1	79%	0.79	77%	0.768	S	S	*	*			trans	86.4	118.7	147.2	-67.8	0	0	0	0	121.5
555	A	28.8	Very low	33.6	Very low	94 Å²	94	138.2 Å²	138.2	78%	0.777	77%	0.766	S	S	*	*				91.2	120.2	127.8	0	0	0	0	0	121.8
556	A	30.2	Very low	33.2	Very low	83 Å²	83	137.6 Å²	137.6	69%	0.686	76%	0.76	S	S	*	*				75	116.1	128	0	0	0	0	0	121.8
557	I	31.4	Very low	32.7	Very low	153 Å²	153	135.8 Å²	135.8	79%	0.785	76%	0.76	S	S	*	*				63.9	129.4	116.8	-63.5	167.3	0	0	0	116.6
558	T	28.1	Very low	32.8	Very low	102 Å²	102	134.8 Å²	134.8	63%	0.626	77%	0.765	S	S	*	*			cis	-164.9	145.2	48.4	-8.4	0	0	0	0	110.7
559	H	33.7	Very low	32.3	Very low	177 Å²	177	136.5 Å²	136.5	82%	0.819	77%	0.768	S	S	*	*			trans	54.6	162.7	148.4	-61.7	-33.3	0	0	0	121.6
560	S	31.9	Very low	32.9	Very low	97 Å²	97	134.2 Å²	134.2	68%	0.678	77%	0.766	S	S	*	*			cis	179.2	171.3	-29.8	-159.2	0	0	0	0	106.1
561	T	32.7	Very low	32.8	Very low	114 Å²	114	135 Å²	135	70%	0.699	77%	0.77	S	S	*	*			cis	-156.2	137.3	9.8	-49	0	0	0	0	109
562	Y	30.5	Very low	32.5	Very low	227 Å²	227	136.7 Å²	136.7	89%	0.89	77%	0.771	S	S	*	*			trans	177.1	120.3	135.5	-114	-80.1	0	0	0	111.1
563	S	34.1	Very low	32.9	Very low	112 Å²	112	130.7 Å²	130.7	78%	0.783	76%	0.764	S	S	*	*			trans	-173.9	129.2	170.5	-81.6	0	0	0	0	112
564	L	33.3	Very low	33.4	Very low	171 Å²	171	129.9 Å²	129.9	90%	0.895	76%	0.764	S	S	*	*			trans	-167.9	162.8	165.5	-82.3	-168.7	0	0	0	108.5
565	P	48.6	Very low	33.2	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	77%	0.77	S	S	*	*				-122.1	-166.2	-62.7	35.7	-16.1	0	0	0	109.5
566	A	28.5	Very low	33.3	Very low	88 Å²	88	135 Å²	135	73%	0.727	76%	0.764	S	S	*	*			cis	-164.8	-165.7	17.1	0	0	0	0	0	106.9
567	S	34.1	Very low	33.3	Very low	115 Å²	115	139.2 Å²	139.2	80%	0.804	78%	0.776	S	S	*	*			cis	179.5	154.2	-37.4	-89.4	0	0	0	0	107
568	S	32.6	Very low	33.2	Very low	120 Å²	120	135.5 Å²	135.5	84%	0.839	78%	0.775	S	S	*	*			cis	-142.7	-110	-4.5	55.7	0	0	0	0	111.9
569	Y	31.3	Very low	33.3	Very low	189 Å²	189	134 Å²	134	74%	0.741	78%	0.779	S	S	*	*			trans	-163.1	161.8	-171	156.9	-83.4	0	0	0	114.6
570	S	42.3	Very low	33.4	Very low	82 Å²	82	132.7 Å²	132.7	57%	0.573	78%	0.778	S	S	*	*			trans	-48.2	152.9	-172	-41.5	0	0	0	0	122
571	Q	27.4	Very low	33.5	Very low	184 Å²	184	134 Å²	134	86%	0.86	78%	0.778	S	S	*	*				-179.4	172.3	116.7	-100.1	-177.9	-11	0	0	113
572	D	30.2	Very low	33.6	Very low	143 Å²	143	137.7 Å²	137.7	77%	0.765	78%	0.78	S	S	*	*			trans	-126	130.4	-175.9	178.4	28	0	0	0	109.5
573	P	40.9	Very low	33.9	Very low	118 Å²	118	130.9 Å²	130.9	77%	0.766	77%	0.765	S	S	*	*				-153.1	160.9	107.8	39.7	-21.7	0	0	0	117.9
574	V	39.3	Very low	33.6	Very low	127 Å²	127	134 Å²	134	77%	0.77	76%	0.761	S	S	*	*			trans	-13.7	125.4	158	-176.6	0	0	0	0	118.9
575	Y	27.6	Very low	34	Very low	234 Å²	234	133.1 Å²	133.1	92%	0.918	75%	0.746	S	S	*	*				-158.6	178.2	129.7	-123.3	-88.1	0	0	0	111
576	A	30	Very low	33.1	Very low	80 Å²	80	130.4 Å²	130.4	66%	0.661	74%	0.74	S	S	*	*			trans	-131.3	171	-157.2	0	0	0	0	0	117.3
577	N	31.4	Very low	33.4	Very low	173 Å²	173	135.9 Å²	135.9	93%	0.925	74%	0.743	S	S	*	*			trans	94.1	145.9	154.8	-99.2	-53.6	0	0	0	122
578	G	27.7	Very low	33.3	Very low	74 Å²	74	133.7 Å²	133.7	76%	0.763	74%	0.739	S	S	*	*			trans	87.8	119.7	179.9	0	0	0	0	0	113.4
579	G	30.4	Very low	33.2	Very low	70 Å²	70	132.7 Å²	132.7	72%	0.722	74%	0.738	S	S	*	*			cis	105.3	135.3	13.8	0	0	0	0	0	110.4
580	L	36.7	Very low	33.3	Very low	151 Å²	151	131.8 Å²	131.8	79%	0.791	75%	0.745	S	S	*	*			cis	-157	145.4	25.2	-68.4	171.7	0	0	0	113.3
581	N	33	Very low	32.5	Very low	125 Å²	125	133.1 Å²	133.1	67%	0.668	75%	0.754	S	S	*	*			trans	64.6	158.3	132.1	-64.2	-14.4	0	0	0	121.1
582	Y	35	Very low	32.6	Very low	190 Å²	190	130.6 Å²	130.6	75%	0.745	76%	0.756	S	S	*	*			cis	-157.4	167.7	4.9	-146.8	-124	0	0	0	109.9
583	S	37.1	Very low	32.6	Very low	84 Å²	84	130.9 Å²	130.9	59%	0.587	76%	0.758	S	S	*	*			cis	-178.2	-174	-43.9	-82.5	0	0	0	0	109.8
584	Y	28.2	Very low	32.1	Very low	178 Å²	178	133 Å²	133	70%	0.698	76%	0.762	S	S	*	*			trans	97.2	124.3	152.2	-149	-86.5	0	0	0	116.8
585	R	41.5	Very low	31.8	Very low	152 Å²	152	135.6 Å²	135.6	57%	0.574	77%	0.766	S	S	*	*			cis	-143.6	165.8	-13.8	-107.8	-165.6	-151.8	-74.7	-4.4	106.6	Y587	R585-Y587 PolarHBondContact NH1-OH 3.29Å
586	G	30.4	Very low	33.2	Very low	62 Å²	62	129.5 Å²	129.5	64%	0.639	76%	0.755	S	S	*	*			cis	92.8	122.3	38.8	0	0	0	0	0	109.5
587	Y	33.9	Very low	33.7	Very low	203 Å²	203	132 Å²	132	80%	0.796	76%	0.764	S	S	*	*			cis	-146.8	179.1	18.5	-60.9	-102.3	0	0	0	109.2	R585	R585-Y587 PolarHBondContact NH1-OH 3.29Å
588	G	33	Very low	33.6	Very low	69 Å²	69	128 Å²	128	71%	0.711	76%	0.756	S	S	*	*			cis	149	166.7	-4.9	0	0	0	0	0	112.9
589	A	30.1	Very low	33.6	Very low	99 Å²	99	129.5 Å²	129.5	82%	0.818	75%	0.754	S	S	*	*			trans	71.1	140.2	174.8	0	0	0	0	0	118.8
590	L	32.6	Very low	33.6	Very low	170 Å²	170	133 Å²	133	89%	0.89	76%	0.755	S	S	*	*			cis	-153.6	162	-12.1	-113	175.9	0	0	0	110.4
591	S	26.7	Very low	33.1	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	75%	0.754	S	S	*	*			trans	-109.8	161.8	-164.3	-42.8	0	0	0	0	115
592	S	29.5	Very low	32.7	Very low	131 Å²	131	133.9 Å²	133.9	92%	0.916	76%	0.761	S	S	*	*			trans	-159.8	143.9	143.6	-85.5	0	0	0	0	114.8
593	N	28.7	Very low	32.3	Very low	149 Å²	149	127.6 Å²	127.6	80%	0.797	75%	0.754	S	S	*	*			trans	-97.5	-179.4	-155.9	-171.3	2	0	0	0	114
594	L	32.2	Very low	32	Very low	164 Å²	164	131.2 Å²	131.2	86%	0.859	77%	0.767	S	S	*	*			trans	103.7	155.8	158	-69.6	126.6	0	0	0	120.8
595	Q	31.1	Very low	32.3	Very low	181 Å²	181	131.8 Å²	131.8	85%	0.846	78%	0.775	S	S	*	*			trans	-102.4	171.4	-162.2	-108.4	-177	-111.2	0	0	113.5
596	P	58.1	Low	31.8	Very low	106 Å²	106	129.2 Å²	129.2	69%	0.688	78%	0.781	S	S	*	*			trans	-84.1	172.3	-171.4	36.8	-38.4	0	0	0	114.1
597	P	40.9	Very low	31.9	Very low	132 Å²	132	134 Å²	134	86%	0.857	79%	0.792	S	S	*	*				-130.8	-166.7	116.3	39.2	-31.4	0	0	0	112.8
598	A	28.5	Very low	32	Very low	90 Å²	90	127.6 Å²	127.6	74%	0.744	79%	0.788	S	S	*	*			trans	-131.5	170.8	-160.1	0	0	0	0	0	115.4
599	S	28.3	Very low	32.8	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	79%	0.794	S	S	*	*			trans	77	156.9	150.7	79.8	0	0	0	0	120.9
600	L	29.6	Very low	33.2	Very low	143 Å²	143	131.8 Å²	131.8	75%	0.749	79%	0.792	S	S	*	*			trans	71.6	141.1	169.1	-59.5	171.8	0	0	0	116.9
601	Q	27.2	Very low	33.3	Very low	161 Å²	161	130.6 Å²	130.6	75%	0.752	79%	0.786	S	S	*	*			cis	-167	164.4	-20.3	-147.7	176.1	19.9	0	0	110.2
602	T	25	Very low	34.1	Very low	135 Å²	135	132.5 Å²	132.5	83%	0.828	79%	0.787	S	S	*	*			trans	72.3	142.7	151.9	-52.3	0	0	0	0	119.7
603	G	26	Very low	34.1	Very low	58 Å²	58	131 Å²	131	60%	0.598	78%	0.777	S	S	*	*			trans	142.3	79.1	149.4	0	0	0	0	0	118.8
604	N	31.1	Very low	34.5	Very low	160 Å²	160	132.5 Å²	132.5	86%	0.856	78%	0.781	S	S	*	*			trans	-48.7	144.4	172.5	-56.2	1.5	0	0	0	114.7
605	H	33.8	Very low	34.7	Very low	189 Å²	189	134.6 Å²	134.6	88%	0.875	78%	0.783	S	S	*	*			trans	-159.3	157.8	134.1	33.4	-77.3	0	0	0	112.2
606	S	30.7	Very low	34.7	Very low	99 Å²	99	129.7 Å²	129.7	69%	0.692	78%	0.782	S	S	*	*			trans	-110.3	165.7	-152.9	-39.9	0	0	0	0	115.2
607	N	32.9	Very low	33.3	Very low	163 Å²	163	128.6 Å²	128.6	87%	0.872	79%	0.789	S	S	*	*			trans	73.9	145.2	152.7	-57.7	-14.8	0	0	0	119.5
608	G	35.1	Very low	32.8	Very low	68 Å²	68	126.9 Å²	126.9	70%	0.701	79%	0.786	S	S	*	*			trans	-86.6	-160.1	168.8	0	0	0	0	0	113.1
609	P	50.5	Low	33	Very low	130 Å²	130	127.6 Å²	127.6	84%	0.844	79%	0.786	S	S	*	*				-149.9	-177.3	67.1	42.2	-23.6	0	0	0	118
610	T	39.4	Very low	33.1	Very low	126 Å²	126	128.6 Å²	128.6	77%	0.773	79%	0.788	S	S	*	*			trans	-35.4	150	163.2	-31.2	0	0	0	0	118.4
611	D	34.3	Very low	33.1	Very low	145 Å²	145	127.6 Å²	127.6	78%	0.775	79%	0.788	S	S	*	*				-160.9	168.1	120.8	-158.9	18.4	0	0	0	113.7
612	L	42.6	Very low	33.3	Very low	148 Å²	148	124.6 Å²	124.6	78%	0.775	79%	0.785	S	S	*	*			trans	-127.9	124.6	-177.3	-67.9	168.3	0	0	0	112.6
613	S	31.1	Very low	33.5	Very low	101 Å²	101	125.1 Å²	125.1	71%	0.706	79%	0.788	S	S	*	*			trans	-171.3	149.2	171.5	-93.2	0	0	0	0	111.1
614	M	36.8	Very low	34	Very low	180 Å²	180	128.7 Å²	128.7	89%	0.887	80%	0.798	S	S	*	*			cis	-145.6	179.9	2.9	-102.5	-77.8	169.7	0	0	110.4
615	K	36.2	Very low	34.6	Very low	207 Å²	207	127.1 Å²	127.1	90%	0.9	80%	0.797	S	S	*	*			trans	-123.2	139.2	-172.7	164	-169.4	167.8	-170.2	0	112.8
616	G	30.4	Very low	34.6	Very low	79 Å²	79	124.3 Å²	124.3	81%	0.814	79%	0.793	S	S	*	*			trans	135.8	152.6	168.9	0	0	0	0	0	112.2
617	G	28.8	Very low	35.5	Very low	82 Å²	82	125.4 Å²	125.4	85%	0.845	80%	0.798	S	S	*	*			cis	-157.1	-173.2	-3	0	0	0	0	0	110
618	A	30.9	Very low	35.7	Very low	97 Å²	97	123.5 Å²	123.5	80%	0.802	79%	0.792	S	S	*	*			trans	-120.8	148.6	-173.5	0	0	0	0	0	113.3
619	S	33.2	Very low	36.6	Very low	105 Å²	105	125.7 Å²	125.7	73%	0.734	79%	0.794	S	S	*	*				158.1	142.7	126.7	-71.2	0	0	0	0	116.4
620	T	29.8	Very low	35.6	Very low	124 Å²	124	125.6 Å²	125.6	76%	0.761	80%	0.796	S	S	*	*			trans	75.3	136.6	139.3	47.1	0	0	0	0	125.7
621	T	29	Very low	35.5	Very low	123 Å²	123	124.7 Å²	124.7	76%	0.755	80%	0.795	S	S	*	*			trans	72.6	90.2	142.8	48.7	0	0	0	0	123.2
622	S	32.3	Very low	35.4	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	80%	0.799	S	S	*	*				30	126.6	117.5	60.2	0	0	0	0	122.3
623	T	29.3	Very low	35.3	Very low	146 Å²	146	122.3 Å²	122.3	90%	0.896	80%	0.797	S	S	*	*				-175.2	156.4	113.8	20.4	0	0	0	0	113.1
624	T	35.3	Very low	35.7	Very low	132 Å²	132	123.7 Å²	123.7	81%	0.81	80%	0.801	S	S	*	*			trans	-108.3	148.9	165.4	50	0	0	0	0	109.3
625	P	43.4	Very low	36.4	Very low	127 Å²	127	120.8 Å²	120.8	83%	0.825	80%	0.798	S	S	*	*				-153.2	166.1	96.8	39.7	-22.3	0	0	0	117
626	T	35	Very low	36.9	Very low	130 Å²	130	121.6 Å²	121.6	80%	0.798	80%	0.796	S	S	*	*			trans	-98.8	157.7	155.3	3.9	0	0	0	0	108.9
627	P	48.7	Very low	37.7	Very low	123 Å²	123	123.8 Å²	123.8	80%	0.799	80%	0.796	S	S	*	*				-146.5	-167.1	63	40	-18.6	0	0	0	116.2
628	T	37.8	Very low	38.9	Very low	123 Å²	123	126 Å²	126	76%	0.755	79%	0.793	S	S	*	*			trans	-89.3	-170.1	-179.8	59.9	0	0	0	0	111.5
629	P	53.4	Low	39.7	Very low	113 Å²	113	126.9 Å²	126.9	73%	0.734	79%	0.79	S	S	*	*			cis	-132.4	176.5	-9.6	42.1	-26.7	0	0	0	114.9
630	S	30.3	Very low	40.8	Very low	128 Å²	128	127.4 Å²	127.4	90%	0.895	79%	0.789	S	S	*	*			trans	174.7	162.7	132.3	43.4	0	0	0	0	112.4
631	S	36.1	Very low	42.1	Very low	108 Å²	108	126.1 Å²	126.1	76%	0.755	79%	0.791	S	S	*	*			trans	-109.1	151.2	-171	53.9	0	0	0	0	113.4
632	T	33.5	Very low	44.1	Very low	137 Å²	137	128 Å²	128	84%	0.84	79%	0.791	S	S	*	*				-168.9	153.1	128.5	-76.1	0	0	0	0	110.1
633	S	39.6	Very low	46.5	Very low	105 Å²	105	127.3 Å²	127.3	73%	0.734	78%	0.779	S	S	*	*			trans	-74.4	142.2	-171.8	53.1	0	0	0	0	116.1
634	T	40.4	Very low	49.2	Very low	130 Å²	130	122.4 Å²	122.4	80%	0.798	75%	0.751	S	S	*	*			trans	-152.5	137	139.5	-72.9	0	0	0	0	108.7	R636	T634-R636 PolarHBondContact O-N 3.31Å
635	S	50.3	Low	51.7	Low	119 Å²	119	121.4 Å²	121.4	83%	0.832	75%	0.747	S	S	*	*			trans	-70.6	124.3	-177.6	39.5	0	0	0	0	112.4
636	R	46.8	Very low	53.8	Low	225 Å²	225	120.7 Å²	120.7	85%	0.849	74%	0.74	S	S	*	*			trans	-138.1	146.8	163.1	-76.4	-170.4	169.5	-158.1	-3.5	109.2	T634 V638	T634-R636 PolarHBondContact O-N 3.31Å; R636-V638 PolarHBondContact O-N 3.21Å
637	P	48.4	Very low	56.5	Low	124 Å²	124	119.1 Å²	119.1	81%	0.805	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-63.6	136	176.2	27.4	-34.1	0	0	0	110.1
638	V	54	Low	58.6	Low	130 Å²	130	116.4 Å²	116.4	79%	0.788	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-66.4	126.6	174.1	-173	0	0	0	0	108	R636 T640	R636-V638 PolarHBondContact O-N 3.21Å; V638-T640 PolarHBondContact O-N 2.94Å
639	P	47.3	Very low	61.1	Low	115 Å²	115	113.8 Å²	113.8	75%	0.747	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-64.3	122.6	171.1	27.4	-32.6	0	0	0	108.2	A641	P639-A641 PolarHBondContact O-N 3.06Å
640	T	56.8	Low	63.1	Low	116 Å²	116	111.2 Å²	111.2	71%	0.712	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-63.1	126.9	173.6	42.2	0	0	0	0	108.9	V638 Q642	V638-T640 PolarHBondContact O-N 2.94Å; T640-Q642 PolarHBondContact O-N 3.2Å
641	A	57	Low	66.2	Low	97 Å²	97	108.2 Å²	108.2	80%	0.802	65%	0.653	S	S	*	*			trans	-69.5	84.7	176	0	0	0	0	0	109.5	P639 L643	P639-A641 PolarHBondContact O-N 3.06Å; A641-L643 PolarHBondContact O-N 2.88Å
642	Q	70.9	Confident	69	Low	162 Å²	162	111.4 Å²	111.4	76%	0.757	65%	0.649	S	S	*	*			trans	-63.6	97.7	170.1	-71.6	-77	-0	0	0	108.1	T640 S644	T640-Q642 PolarHBondContact O-N 3.2Å; Q642-S644 PolarHBondContact O-N 3.46Å
643	L	81.4	Confident	71.9	Confident	84 Å²	84	112 Å²	112	44%	0.44	64%	0.641	S	S	.	*			trans	-53	134.7	169.6	-66.2	174.9	0	0	0	108.9	A641 E647 I648	A641-L643 PolarHBondContact O-N 2.88Å; L643-E647 HydrophobicContact CB-CB 4.17Å; L643-E647 HydrophobicContact CD2-CB 4.37Å; L643-I648 HydrophobicContact CB-CD1 4.32Å; L643-I648 HydrophobicContact CB-CG1 3.7Å; L643-I648 VanDerWaalsContact O-CD1 3.31Å; L643-I648 WeakPolarHBondContact O-CD1 3.38Å
644	S	87.8	Confident	74.6	Confident	42 Å²	42	111.8 Å²	111.8	29%	0.294	63%	0.632	S	S	.	*			trans	-61.3	156.9	176.9	66.2	0	0	0	0	111	Q642 T646 E647 I648	Q642-S644 PolarHBondContact O-N 3.46Å; S644-T646 PolarHBondContact O-N 3.27Å; S644-T646 VanDerWaalsContact O-N 3.07Å; S644-E647 WeakPolarHBondContact CB-OE2 3.34Å; S644-E647 PolarHBondContact N-OE2 3.16Å; S644-E647 PolarHBondContact O-N 3.38Å; S644-E647 WeakPolarHBondContact OG-CG 3.23Å; S644-E647 PolarHBondContact OG-N 3.06Å; S644-E647 PolarHBondContact OG-OE2 2.96Å; S644-I648 WeakPolarHBondContact O-CG1 3.38Å; S644-I648 PolarHBondContact O-N 3Å
645	P	86.7	Confident	77.2	Confident	111 Å²	111	109.5 Å²	109.5	72%	0.721	61%	0.614	S	S	*	*	H	α-helix	trans	-53	-32.6	175.4	-28	36.1	0	0	0	113.3	S649	P645-S649 WeakPolarHBondContact O-CB 3.44Å; P645-S649 PolarHBondContact O-N 2.78Å
646	T	88.3	Confident	79.4	Confident	113 Å²	113	105.7 Å²	105.7	69%	0.693	59%	0.589	S	S	*	*	H	α-helix	trans	-67.8	-46	175.3	-48.5	0	0	0	0	112.2	S644 S649 A650	S644-T646 PolarHBondContact O-N 3.27Å; S644-T646 VanDerWaalsContact O-N 3.07Å; T646-S649 WeakPolarHBondContact O-CB 3.49Å; T646-S649 PolarHBondContact O-N 2.95Å; T646-A650 PolarHBondContact O-N 3.36Å
647	E	91.9	Very high	81.7	Confident	97 Å²	97	96.3 Å²	96.3	45%	0.453	56%	0.563	S	S	.	*	H	α-helix	trans	-67	-39.8	176.1	-70.7	160.6	120.3	0	0	111.6	L643 S644 S649 A650 V651	L643-E647 HydrophobicContact CB-CB 4.17Å; L643-E647 HydrophobicContact CD2-CB 4.37Å; S644-E647 WeakPolarHBondContact CB-OE2 3.34Å; S644-E647 PolarHBondContact N-OE2 3.16Å; S644-E647 PolarHBondContact O-N 3.38Å; S644-E647 WeakPolarHBondContact OG-CG 3.23Å; S644-E647 PolarHBondContact OG-N 3.06Å; S644-E647 PolarHBondContact OG-OE2 2.96Å; E647-S649 VanDerWaalsContact C-N 3.27Å; E647-S649 PolarHBondContact O-N 3.48Å; E647-A650 PolarHBondContact O-N 3.02Å; E647-V651 WeakPolarHBondContact O-CB 3.37Å; E647-V651 VanDerWaalsContact O-CG2 3.3Å; E647-V651 WeakPolarHBondContact O-CG2 3.42Å; E647-V651 PolarHBondContact O-N 3.16Å
648	I	92.8	Very high	84	Confident	65 Å²	65	98.1 Å²	98.1	33%	0.333	56%	0.555	S	S	.	*	H	α-helix	trans	-59.6	-40.4	172.9	-67.2	172.1	0	0	0	110.6	L643 S644 R652	L643-I648 HydrophobicContact CB-CD1 4.32Å; L643-I648 HydrophobicContact CB-CG1 3.7Å; L643-I648 VanDerWaalsContact O-CD1 3.31Å; L643-I648 WeakPolarHBondContact O-CD1 3.38Å; S644-I648 WeakPolarHBondContact O-CG1 3.38Å; S644-I648 PolarHBondContact O-N 3Å; I648-R652 WeakPolarHBondContact O-CB 3.35Å; I648-R652 WeakPolarHBondContact O-CD 3.46Å; I648-R652 WeakPolarHBondContact O-CG 3.48Å; I648-R652 PolarHBondContact O-N 3.42Å
649	S	90.4	Very high	86.1	Confident	69 Å²	69	100.8 Å²	100.8	48%	0.483	55%	0.551	S	S	.	*	H	α-helix	trans	-65.2	-48	175.4	-165.4	0	0	0	0	111.8	P645 T646 E647 V651 R652 Q653	P645-S649 WeakPolarHBondContact O-CB 3.44Å; P645-S649 PolarHBondContact O-N 2.78Å; T646-S649 WeakPolarHBondContact O-CB 3.49Å; T646-S649 PolarHBondContact O-N 2.95Å; E647-S649 VanDerWaalsContact C-N 3.27Å; E647-S649 PolarHBondContact O-N 3.48Å; S649-V651 PolarHBondContact O-N 3.45Å; S649-R652 WeakPolarHBondContact O-CB 3.42Å; S649-R652 PolarHBondContact O-N 3.01Å; S649-Q653 PolarHBondContact O-N 3.3Å
650	A	93.9	Very high	88.3	Confident	58 Å²	58	101.8 Å²	101.8	48%	0.479	55%	0.545	S	S	.	.	H	α-helix	trans	-60.7	-42.7	177.7	0	0	0	0	0	112.5	T646 E647 Q653 L654	T646-A650 PolarHBondContact O-N 3.36Å; E647-A650 PolarHBondContact O-N 3.02Å; A650-Q653 PolarHBondContact O-N 3.17Å; A650-L654 WeakPolarHBondContact O-CB 3.38Å; A650-L654 PolarHBondContact O-N 3.3Å
651	V	95.5	Very high	90.1	Very high	66 Å²	66	99.3 Å²	99.3	40%	0.4	53%	0.533	S	S	.	.	H	α-helix	trans	-64.7	-40.4	175.4	169.7	0	0	0	0	111.3	E647 S649 L654 I655	E647-V651 WeakPolarHBondContact O-CB 3.37Å; E647-V651 VanDerWaalsContact O-CG2 3.3Å; E647-V651 WeakPolarHBondContact O-CG2 3.42Å; E647-V651 PolarHBondContact O-N 3.16Å; S649-V651 PolarHBondContact O-N 3.45Å; V651-L654 PolarHBondContact O-N 2.67Å; V651-I655 HydrophobicContact CG1-CD1 3.8Å; V651-I655 HydrophobicContact CG1-CG1 4.49Å; V651-I655 WeakPolarHBondContact O-CB 3.46Å; V651-I655 WeakPolarHBondContact O-CD1 3.34Å; V651-I655 VanDerWaalsContact O-CG1 3.24Å; V651-I655 WeakPolarHBondContact O-CG1 3.26Å; V651-I655 PolarHBondContact O-N 3.28Å
652	R	95.1	Very high	92	Very high	175 Å²	175	97.4 Å²	97.4	66%	0.66	52%	0.517	S	S	*	.	H	α-helix	trans	-62.5	-41.7	173.9	-75.8	168	-177.8	-89.1	0.3	112.1	I648 S649 I655 A656	I648-R652 WeakPolarHBondContact O-CB 3.35Å; I648-R652 WeakPolarHBondContact O-CD 3.46Å; I648-R652 WeakPolarHBondContact O-CG 3.48Å; I648-R652 PolarHBondContact O-N 3.42Å; S649-R652 WeakPolarHBondContact O-CB 3.42Å; S649-R652 PolarHBondContact O-N 3.01Å; R652-I655 PolarHBondContact O-N 3.32Å; R652-A656 PolarHBondContact O-N 3.42Å
653	Q	94.9	Very high	93.1	Very high	148 Å²	148	92 Å²	92	69%	0.692	50%	0.5	S	S	*	.	H	α-helix	trans	-68.8	-36.9	178.5	-165.2	167.9	15.6	0	0	112	S649 A650 A656 G657	S649-Q653 PolarHBondContact O-N 3.3Å; A650-Q653 PolarHBondContact O-N 3.17Å; Q653-A656 PolarHBondContact O-N 2.92Å; Q653-G657 PolarHBondContact O-N 3.46Å
654	L	95.3	Very high	93.8	Very high	101 Å²	101	93.9 Å²	93.9	53%	0.529	51%	0.505	S	S	.	.	H	α-helix	trans	-63.9	-43.8	171.9	-177.5	62.9	0	0	0	111.9	A650 V651 A656 G657 Y658	A650-L654 WeakPolarHBondContact O-CB 3.38Å; A650-L654 PolarHBondContact O-N 3.3Å; V651-L654 PolarHBondContact O-N 2.67Å; L654-A656 VanDerWaalsContact C-N 3.32Å; L654-A656 PolarHBondContact O-N 3.02Å; L654-G657 PolarHBondContact O-N 2.83Å; L654-Y658 HydrophobicContact CD1-CD2 4.09Å; L654-Y658 HydrophobicContact CD1-CE2 3.59Å; L654-Y658 HydrophobicContact CD2-CE2 4.22Å; L654-Y658 HydrophobicContact CG-CD2 3.97Å; L654-Y658 HydrophobicContact CG-CE2 3.67Å; L654-Y658 VanDerWaalsContact O-CD2 3.26Å; L654-Y658 WeakPolarHBondContact O-CD2 3.35Å; L654-Y658 PolarHBondContact O-N 2.95Å
655	I	96.8	Very high	94.3	Very high	82 Å²	82	97.6 Å²	97.6	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-63.2	-37.4	175.1	-70.2	164.9	0	0	0	111.4	V651 R652 R659	V651-I655 HydrophobicContact CG1-CD1 3.8Å; V651-I655 HydrophobicContact CG1-CG1 4.49Å; V651-I655 WeakPolarHBondContact O-CB 3.46Å; V651-I655 WeakPolarHBondContact O-CD1 3.34Å; V651-I655 VanDerWaalsContact O-CG1 3.24Å; V651-I655 WeakPolarHBondContact O-CG1 3.26Å; V651-I655 PolarHBondContact O-N 3.28Å; R652-I655 PolarHBondContact O-N 3.32Å; I655-R659 WeakPolarHBondContact O-CG 3.44Å; I655-R659 PolarHBondContact O-N 3.32Å; I655-R659 VanDerWaalsContact O-N 3.07Å
656	A	95	Very high	94.7	Very high	39 Å²	39	97.6 Å²	97.6	32%	0.322	51%	0.514	S	S	.	.	H	α-helix	trans	-62.4	-49.8	173.8	0	0	0	0	0	111.4	R652 Q653 L654 Y658 R659 E660	R652-A656 PolarHBondContact O-N 3.42Å; Q653-A656 PolarHBondContact O-N 2.92Å; L654-A656 VanDerWaalsContact C-N 3.32Å; L654-A656 PolarHBondContact O-N 3.02Å; A656-Y658 VanDerWaalsContact C-N 3.32Å; A656-Y658 PolarHBondContact O-N 3.45Å; A656-R659 WeakPolarHBondContact O-CB 3.48Å; A656-R659 PolarHBondContact O-N 3.03Å; A656-E660 PolarHBondContact O-N 3.11Å
657	G	95.6	Very high	95.1	Very high	28 Å²	28	99.7 Å²	99.7	29%	0.289	51%	0.509	S	S	.	.	H	α-helix	trans	-58.8	-38.1	177	0	0	0	0	0	113.9	Q653 L654 S661	Q653-G657 PolarHBondContact O-N 3.46Å; L654-G657 PolarHBondContact O-N 2.83Å; G657-S661 WeakPolarHBondContact O-CB 3.4Å; G657-S661 PolarHBondContact O-N 2.72Å; G657-S661 PolarHBondContact O-OG 2.96Å
658	Y	97.4	Very high	95.1	Very high	162 Å²	162	96.7 Å²	96.7	64%	0.635	50%	0.499	S	S	*	.	H	α-helix	trans	-67.3	-36.8	172.7	-79.3	-58.2	0	0	0	113.1	L654 A656 S661 A662	L654-Y658 HydrophobicContact CD1-CD2 4.09Å; L654-Y658 HydrophobicContact CD1-CE2 3.59Å; L654-Y658 HydrophobicContact CD2-CE2 4.22Å; L654-Y658 HydrophobicContact CG-CD2 3.97Å; L654-Y658 HydrophobicContact CG-CE2 3.67Å; L654-Y658 VanDerWaalsContact O-CD2 3.26Å; L654-Y658 WeakPolarHBondContact O-CD2 3.35Å; L654-Y658 PolarHBondContact O-N 2.95Å; A656-Y658 VanDerWaalsContact C-N 3.32Å; A656-Y658 PolarHBondContact O-N 3.45Å; Y658-S661 PolarHBondContact O-N 2.87Å; Y658-A662 WeakPolarHBondContact O-CB 3.49Å; Y658-A662 PolarHBondContact O-N 3.38Å
659	R	97	Very high	95.3	Very high	187 Å²	187	96 Å²	96	71%	0.706	50%	0.503	S	S	*	.	H	α-helix	trans	-66.8	-42.6	174.7	-74.4	173.8	172.7	-149.2	-4.7	112	I655 A656 S661 A662 A663	I655-R659 WeakPolarHBondContact O-CG 3.44Å; I655-R659 PolarHBondContact O-N 3.32Å; I655-R659 VanDerWaalsContact O-N 3.07Å; A656-R659 WeakPolarHBondContact O-CB 3.48Å; A656-R659 PolarHBondContact O-N 3.03Å; R659-S661 VanDerWaalsContact C-N 3.34Å; R659-A662 PolarHBondContact O-N 2.94Å; R659-A663 WeakPolarHBondContact O-CB 3.43Å; R659-A663 PolarHBondContact O-N 3.34Å
660	E	93.4	Very high	95.5	Very high	135 Å²	135	96 Å²	96	63%	0.631	50%	0.497	S	S	*	.	H	α-helix	trans	-62.9	-41.3	174.8	-71.6	169.5	-162.1	0	0	111.4	A656 A663 F664	A656-E660 PolarHBondContact O-N 3.11Å; E660-A663 PolarHBondContact O-N 2.91Å; E660-F664 PolarHBondContact O-N 3.02Å
661	S	95.8	Very high	95.4	Very high	65 Å²	65	99.3 Å²	99.3	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-43.5	175.4	-57.2	0	0	0	0	112.2	G657 Y658 R659 F664 L665	G657-S661 WeakPolarHBondContact O-CB 3.4Å; G657-S661 PolarHBondContact O-N 2.72Å; G657-S661 PolarHBondContact O-OG 2.96Å; Y658-S661 PolarHBondContact O-N 2.87Å; R659-S661 VanDerWaalsContact C-N 3.34Å; S661-F664 WeakPolarHBondContact O-CB 3.49Å; S661-F664 PolarHBondContact O-N 3.48Å; S661-L665 WeakPolarHBondContact O-CG 3.3Å; S661-L665 PolarHBondContact O-N 2.95Å
662	A	95.8	Very high	95.3	Very high	57 Å²	57	101.4 Å²	101.4	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-65.3	-40.2	175.5	0	0	0	0	0	112.2	Y658 R659 F664 L665 L666	Y658-A662 WeakPolarHBondContact O-CB 3.49Å; Y658-A662 PolarHBondContact O-N 3.38Å; R659-A662 PolarHBondContact O-N 2.94Å; A662-F664 VanDerWaalsContact C-N 3.27Å; A662-F664 PolarHBondContact O-N 3.33Å; A662-L665 PolarHBondContact O-N 2.93Å; A662-L666 PolarHBondContact O-N 3.46Å
663	A	94.8	Very high	95.2	Very high	47 Å²	47	98.9 Å²	98.9	39%	0.388	51%	0.507	S	S	.	.	H	α-helix	trans	-72.3	-17.4	175.8	0	0	0	0	0	113.7	R659 E660 R667	R659-A663 WeakPolarHBondContact O-CB 3.43Å; R659-A663 PolarHBondContact O-N 3.34Å; E660-A663 PolarHBondContact O-N 2.91Å; A663-R667 PolarHBondContact O-NE 3.03Å; A663-R667 PolarHBondContact O-NH2 3.07Å
664	F	96.1	Very high	94.9	Very high	124 Å²	124	96.2 Å²	96.2	54%	0.544	50%	0.498	S	S	.	.	H	α-helix	trans	-75.8	-52.6	165.3	177.9	-95.1	0	0	0	110.6	E660 S661 A662 L666 R667 S668	E660-F664 PolarHBondContact O-N 3.02Å; S661-F664 WeakPolarHBondContact O-CB 3.49Å; S661-F664 PolarHBondContact O-N 3.48Å; A662-F664 VanDerWaalsContact C-N 3.27Å; A662-F664 PolarHBondContact O-N 3.33Å; F664-L666 VanDerWaalsContact C-N 3.3Å; F664-L666 PolarHBondContact O-N 3.38Å; F664-R667 PolarHBondContact O-N 2.95Å; F664-S668 PolarHBondContact O-N 3.35Å; F664-S668 PolarHBondContact O-OG 3.31Å
665	L	97.4	Very high	94.6	Very high	121 Å²	121	95.8 Å²	95.8	63%	0.634	50%	0.496	S	S	*	.	H	α-helix	trans	-57.2	-40.4	-179.9	-70.9	171.4	0	0	0	113	S661 A662 S668 A669	S661-L665 WeakPolarHBondContact O-CG 3.3Å; S661-L665 PolarHBondContact O-N 2.95Å; A662-L665 PolarHBondContact O-N 2.93Å; L665-S668 PolarHBondContact O-N 3.4Å; L665-A669 PolarHBondContact O-N 2.92Å
666	L	95.7	Very high	94.3	Very high	110 Å²	110	97 Å²	97	58%	0.576	50%	0.502	S	S	*	.	H	α-helix	trans	-61.8	-50.2	176.4	-175.2	62	0	0	0	111.4	A662 F664 S668 A669 D670	A662-L666 PolarHBondContact O-N 3.46Å; F664-L666 VanDerWaalsContact C-N 3.3Å; F664-L666 PolarHBondContact O-N 3.38Å; L666-S668 VanDerWaalsContact C-N 3.29Å; L666-S668 PolarHBondContact O-N 2.9Å; L666-A669 CarbonylContact O-C 3.6Å; L666-A669 WeakPolarHBondContact O-CA 3.41Å; L666-A669 WeakPolarHBondContact O-CB 3.47Å; L666-A669 PolarHBondContact O-N 3.19Å; L666-D670 PolarHBondContact O-N 3Å
667	R	95.9	Very high	93.8	Very high	158 Å²	158	100.7 Å²	100.7	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-62.3	-34.1	178.5	-75.3	-179.7	-69.1	165.2	1.2	113.2	A663 F664 A669 D670 E671	A663-R667 PolarHBondContact O-NE 3.03Å; A663-R667 PolarHBondContact O-NH2 3.07Å; F664-R667 PolarHBondContact O-N 2.95Å; R667-A669 VanDerWaalsContact C-N 3.34Å; R667-D670 WeakPolarHBondContact CA-OD2 3.43Å; R667-D670 PolarHBondContact O-N 2.85Å; R667-E671 WeakPolarHBondContact O-CB 3.21Å; R667-E671 PolarHBondContact O-N 3.27Å
668	S	93.5	Very high	92.8	Very high	34 Å²	34	106.6 Å²	106.6	24%	0.238	54%	0.535	C	S	.	.	H	α-helix	trans	-70.9	-28.6	172.6	-64.4	0	0	0	0	113	F664 L665 L666 L672	F664-S668 PolarHBondContact O-N 3.35Å; F664-S668 PolarHBondContact O-OG 3.31Å; L665-S668 PolarHBondContact O-N 3.4Å; L666-S668 VanDerWaalsContact C-N 3.29Å; L666-S668 PolarHBondContact O-N 2.9Å; S668-L672 WeakPolarHBondContact O-CD1 3.36Å; S668-L672 VanDerWaalsContact O-CG 3.23Å; S668-L672 WeakPolarHBondContact O-CG 3.17Å; S668-L672 PolarHBondContact O-N 3.43Å; S668-L672 VanDerWaalsContact O-N 3.16Å
669	A	95.6	Very high	91.6	Very high	51 Å²	51	107.1 Å²	107.1	42%	0.421	54%	0.544	S	S	.	.	H	α-helix	trans	-71.1	-45.1	170.2	0	0	0	0	0	111.1	L665 L666 R667 E671 L672 E673	L665-A669 PolarHBondContact O-N 2.92Å; L666-A669 CarbonylContact O-C 3.6Å; L666-A669 WeakPolarHBondContact O-CA 3.41Å; L666-A669 WeakPolarHBondContact O-CB 3.47Å; L666-A669 PolarHBondContact O-N 3.19Å; R667-A669 VanDerWaalsContact C-N 3.34Å; A669-E671 VanDerWaalsContact C-N 3.28Å; A669-E671 PolarHBondContact O-N 3.39Å; A669-L672 PolarHBondContact O-N 2.93Å; A669-L672 VanDerWaalsContact O-N 3.16Å; A669-E673 PolarHBondContact O-N 2.99Å
670	D	95.1	Very high	89.5	Confident	67 Å²	67	107.2 Å²	107.2	36%	0.358	56%	0.558	S	S	.	*	H	α-helix	trans	-57.4	-41.7	175	-51.9	-29.4	0	0	0	111.1	L666 R667 E673 N674	L666-D670 PolarHBondContact O-N 3Å; R667-D670 WeakPolarHBondContact CA-OD2 3.43Å; R667-D670 PolarHBondContact O-N 2.85Å; D670-E673 PolarHBondContact O-N 2.88Å; D670-N674 PolarHBondContact O-N 2.59Å; D670-N674 PolarHBondContact O-ND2 3.23Å
671	E	92.9	Very high	89.3	Confident	128 Å²	128	105.8 Å²	105.8	60%	0.598	55%	0.554	S	S	*	*	H	α-helix	trans	-64.9	-41	176.6	-174.4	172.9	-160.5	0	0	112.2	R667 A669 N674 L675	R667-E671 WeakPolarHBondContact O-CB 3.21Å; R667-E671 PolarHBondContact O-N 3.27Å; A669-E671 VanDerWaalsContact C-N 3.28Å; A669-E671 PolarHBondContact O-N 3.39Å; E671-N674 PolarHBondContact O-N 2.81Å; E671-L675 WeakPolarHBondContact O-CG 3.24Å; E671-L675 PolarHBondContact O-N 3Å
672	L	92.9	Very high	89	Confident	110 Å²	110	107.9 Å²	107.9	58%	0.576	56%	0.56	S	S	*	*	H	α-helix	trans	-68.6	-38.4	175.3	-73.3	167.5	0	0	0	112.6	S668 A669 L675 I676	S668-L672 WeakPolarHBondContact O-CD1 3.36Å; S668-L672 VanDerWaalsContact O-CG 3.23Å; S668-L672 WeakPolarHBondContact O-CG 3.17Å; S668-L672 PolarHBondContact O-N 3.43Å; S668-L672 VanDerWaalsContact O-N 3.16Å; A669-L672 PolarHBondContact O-N 2.93Å; A669-L672 VanDerWaalsContact O-N 3.16Å; L672-L675 HydrophobicContact CD2-CD1 4.45Å; L672-L675 PolarHBondContact O-N 3.27Å; L672-I676 WeakPolarHBondContact O-CG1 3.4Å; L672-I676 PolarHBondContact O-N 3.42Å
673	E	91.8	Very high	88.6	Confident	123 Å²	123	110.8 Å²	110.8	58%	0.575	57%	0.565	S	S	*	*	H	α-helix	trans	-63.8	-43.3	174.6	-174.4	169.8	-149.5	0	0	111	A669 D670 L675 I676 L677	A669-E673 PolarHBondContact O-N 2.99Å; D670-E673 PolarHBondContact O-N 2.88Å; E673-L675 VanDerWaalsContact C-N 3.31Å; E673-L675 PolarHBondContact O-N 3.07Å; E673-I676 PolarHBondContact O-N 2.98Å; E673-L677 HydrophobicContact CG-CD1 4.16Å; E673-L677 WeakPolarHBondContact O-CG 3.43Å; E673-L677 PolarHBondContact O-N 3.29Å
674	N	88.6	Confident	88.3	Confident	92 Å²	92	114.5 Å²	114.5	49%	0.492	58%	0.575	S	S	.	*	H	α-helix	trans	-62.7	-34	174.1	-82.5	-85.4	0	0	0	113.1	D670 E671 Q678	D670-N674 PolarHBondContact O-N 2.59Å; D670-N674 PolarHBondContact O-ND2 3.23Å; E671-N674 PolarHBondContact O-N 2.81Å; N674-Q678 WeakPolarHBondContact O-CG 3.31Å; N674-Q678 PolarHBondContact O-N 2.8Å
675	L	89.8	Confident	87.8	Confident	92 Å²	92	113.9 Å²	113.9	48%	0.482	58%	0.577	S	S	.	*	H	α-helix	trans	-68.6	-37.6	174.3	-75.9	165.1	0	0	0	112.3	E671 L672 E673 Q678	E671-L675 WeakPolarHBondContact O-CG 3.24Å; E671-L675 PolarHBondContact O-N 3Å; L672-L675 HydrophobicContact CD2-CD1 4.45Å; L672-L675 PolarHBondContact O-N 3.27Å; E673-L675 VanDerWaalsContact C-N 3.31Å; E673-L675 PolarHBondContact O-N 3.07Å; L675-Q678 PolarHBondContact O-N 3.23Å
676	I	89.9	Confident	87.1	Confident	107 Å²	107	113.5 Å²	113.5	55%	0.549	57%	0.573	S	S	.	*	H	α-helix	trans	-68.4	-39	175.1	-66.6	165.7	0	0	0	110.8	L672 E673 Q678 Q679 N680	L672-I676 WeakPolarHBondContact O-CG1 3.4Å; L672-I676 PolarHBondContact O-N 3.42Å; E673-I676 PolarHBondContact O-N 2.98Å; I676-Q678 PolarHBondContact O-N 3.49Å; I676-Q679 PolarHBondContact O-N 3.46Å; I676-Q679 VanDerWaalsContact O-N 3.16Å; I676-N680 PolarHBondContact O-ND2 3Å; I676-N680 VanDerWaalsContact O-ND2 3.11Å
677	L	83.9	Confident	86.5	Confident	116 Å²	116	113.7 Å²	113.7	61%	0.607	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-9.1	175.1	-69.2	171.7	0	0	0	114.2	E673	E673-L677 HydrophobicContact CG-CD1 4.16Å; E673-L677 WeakPolarHBondContact O-CG 3.43Å; E673-L677 PolarHBondContact O-N 3.29Å
678	Q	76.1	Confident	85.8	Confident	152 Å²	152	110.3 Å²	110.3	71%	0.71	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-1.5	171.4	-73.6	177.6	27.4	0	0	113.5	N674 L675 I676	N674-Q678 WeakPolarHBondContact O-CG 3.31Å; N674-Q678 PolarHBondContact O-N 2.8Å; L675-Q678 PolarHBondContact O-N 3.23Å; I676-Q678 PolarHBondContact O-N 3.49Å
679	Q	71.2	Confident	85.1	Confident	174 Å²	174	116.7 Å²	116.7	81%	0.813	60%	0.599	S	S	*	*			trans	-107	2.3	176.6	-70.8	-168.7	-14.8	0	0	113.9	I676	I676-Q679 PolarHBondContact O-N 3.46Å; I676-Q679 VanDerWaalsContact O-N 3.16Å
680	N	54	Low	84.2	Confident	188 Å²	188	122.6 Å²	122.6	100%	1.005	62%	0.615	S	S	*	*			trans	-119.1	0	170.9	-63.6	-89.7	0	0	0	110.2	I676	I676-N680 PolarHBondContact O-ND2 3Å; I676-N680 VanDerWaalsContact O-ND2 3.11Å

Retrieved 680 of 680 residues in 813.1 ms (Link to these results)

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