A0A5K4F2T2_SCHMA Loading...

VWFA domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F2T2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 747 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	31.1	Very low	37.6	Very low	243 Å²	243	117.6 Å²	117.6	100%	1.197	69%	0.687	S	S	*	*				0	115.7	0	-78.3	175.8	168.6	0	0	107
2	G	32.1	Very low	38.6	Very low	72 Å²	72	110.9 Å²	110.9	74%	0.742	65%	0.648	S	S	*	*			trans	-78.3	126.1	-175.2	0	0	0	0	0	111	N4	G2-N4 PolarHBondContact O-N 3.26Å
3	C	33.1	Very low	40.3	Very low	118 Å²	118	109.5 Å²	109.5	80%	0.797	64%	0.636	S	S	*	*			trans	-74.9	48.5	172.1	-61.8	0	0	0	0	111.7	E5	C3-E5 VanDerWaalsContact C-N 3.27Å
4	N	30.7	Very low	42	Very low	155 Å²	155	108.2 Å²	108.2	83%	0.829	62%	0.621	S	S	*	*			trans	-90.8	12	166.1	-86.1	2.9	0	0	0	112.1	G2 F6	G2-N4 PolarHBondContact O-N 3.26Å; N4-F6 PolarHBondContact O-N 3.04Å
5	E	29	Very low	42.7	Very low	171 Å²	171	104.9 Å²	104.9	80%	0.799	60%	0.601	S	S	*	*			trans	-96.6	72.4	162.5	-78.8	-179.5	163	0	0	108.7	C3 V7	C3-E5 VanDerWaalsContact C-N 3.27Å; E5-V7 HydrophobicContact CB-CG2 4.1Å; E5-V7 PolarHBondContact O-N 3.45Å
6	F	35.4	Very low	43.8	Very low	195 Å²	195	101.8 Å²	101.8	86%	0.855	58%	0.579	S	S	*	*			trans	-62.3	85.6	142.5	-76.7	-84.6	0	0	0	105.5	N4 G8	N4-F6 PolarHBondContact O-N 3.04Å; F6-G8 PolarHBondContact O-N 3.01Å
7	V	37.7	Very low	45.2	Very low	108 Å²	108	99 Å²	99	66%	0.655	57%	0.567	S	S	*	*			trans	-64.5	86	160.8	-174.8	0	0	0	0	104.3	E5 V9	E5-V7 HydrophobicContact CB-CG2 4.1Å; E5-V7 PolarHBondContact O-N 3.45Å; V7-V9 HydrophobicContact CG1-CG2 3.76Å; V7-V9 PolarHBondContact O-N 3.06Å
8	G	38.1	Very low	46.5	Very low	70 Å²	70	97.5 Å²	97.5	72%	0.722	55%	0.551	S	S	*	*			trans	-62.3	84.4	162.9	0	0	0	0	0	105.9	F6 D10	F6-G8 PolarHBondContact O-N 3.01Å; G8-D10 PolarHBondContact O-N 3.08Å
9	V	43.4	Very low	47.1	Very low	77 Å²	77	96.9 Å²	96.9	47%	0.467	55%	0.546	S	S	.	.			trans	-69.2	95.8	157.3	-175.5	0	0	0	0	103.2	V7 V11 E14	V7-V9 HydrophobicContact CG1-CG2 3.76Å; V7-V9 PolarHBondContact O-N 3.06Å; V9-V11 PolarHBondContact O-N 2.9Å; V9-E14 HydrophobicContact CG1-CB 3.87Å; V9-E14 HydrophobicContact CG1-CG 4.24Å; V9-E14 WeakPolarHBondContact CG1-OE2 3.29Å
10	D	54.5	Low	48.1	Very low	33 Å²	33	94.9 Å²	94.9	18%	0.176	53%	0.531	C	S	.	.			trans	-59.4	108.3	168.9	-170.8	-15.2	0	0	0	105.4	G8 V12 D13 E14 S49	G8-D10 PolarHBondContact O-N 3.08Å; D10-V12 PolarHBondContact O-N 3.03Å; D10-V12 VanDerWaalsContact O-N 3.07Å; D10-V12 VanDerWaalsContact OD1-CB 3.29Å; D10-V12 WeakPolarHBondContact OD1-CB 3.38Å; D10-V12 PolarHBondContact OD1-N 3Å; D10-D13 HydrophobicContact CB-CB 3.93Å; D10-D13 PolarHBondContact O-N 3.31Å; D10-E14 PolarHBondContact O-N 3.14Å; D10-S49 VanDerWaalsContact OD2-CB 3.25Å; D10-S49 WeakPolarHBondContact OD2-CB 3.4Å
11	V	48.9	Very low	49.1	Very low	52 Å²	52	97.4 Å²	97.4	32%	0.315	53%	0.533	S	S	.	.	H	α-helix	trans	-55.6	-28	-179	177.2	0	0	0	0	109.4	V9 L15 V62	V9-V11 PolarHBondContact O-N 2.9Å; V11-L15 WeakPolarHBondContact O-CB 3.42Å; V11-L15 PolarHBondContact O-N 2.91Å; V11-V62 HydrophobicContact CG1-CG1 4.12Å
12	V	48.9	Very low	50.2	Low	37 Å²	37	89.2 Å²	89.2	22%	0.224	49%	0.492	C	S	.	.	H	α-helix	trans	-72.9	-45	175.7	-173.2	0	0	0	0	111.3	D10 L15 E16 I47	D10-V12 PolarHBondContact O-N 3.03Å; D10-V12 VanDerWaalsContact O-N 3.07Å; D10-V12 VanDerWaalsContact OD1-CB 3.29Å; D10-V12 WeakPolarHBondContact OD1-CB 3.38Å; D10-V12 PolarHBondContact OD1-N 3Å; V12-L15 WeakPolarHBondContact O-CB 3.21Å; V12-L15 PolarHBondContact O-N 2.9Å; V12-E16 WeakPolarHBondContact O-CB 3.29Å; V12-E16 PolarHBondContact O-N 3.19Å; V12-I47 HydrophobicContact CG1-CB 4.22Å; V12-I47 HydrophobicContact CG1-CG2 4.43Å
13	D	61.8	Low	51.3	Low	92 Å²	92	90.1 Å²	90.1	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-67.5	-37.3	176.2	-71.6	-18.4	0	0	0	111.8	D10 L15 E16 S17	D10-D13 HydrophobicContact CB-CB 3.93Å; D10-D13 PolarHBondContact O-N 3.31Å; D13-L15 VanDerWaalsContact C-N 3.31Å; D13-E16 PolarHBondContact O-N 3.5Å; D13-S17 WeakPolarHBondContact O-CB 3.3Å; D13-S17 PolarHBondContact O-N 3.19Å
14	E	64	Low	52.6	Low	92 Å²	92	91.6 Å²	91.6	43%	0.43	47%	0.467	S	S	.	.	H	α-helix	trans	-65.2	-39.4	175	-165.9	-179.7	-171.4	0	0	110.4	V9 D10 Y18	V9-E14 HydrophobicContact CG1-CB 3.87Å; V9-E14 HydrophobicContact CG1-CG 4.24Å; V9-E14 WeakPolarHBondContact CG1-OE2 3.29Å; D10-E14 PolarHBondContact O-N 3.14Å; E14-Y18 WeakPolarHBondContact O-CB 3.41Å; E14-Y18 PolarHBondContact O-N 2.98Å
15	L	51.4	Low	53.9	Low	59 Å²	59	85.5 Å²	85.5	31%	0.309	44%	0.441	S	S	.	.	H	α-helix	trans	-67	-46.8	174.3	-168.5	85.4	0	0	0	111.7	V11 V12 D13 Y18 I19 V66	V11-L15 WeakPolarHBondContact O-CB 3.42Å; V11-L15 PolarHBondContact O-N 2.91Å; V12-L15 WeakPolarHBondContact O-CB 3.21Å; V12-L15 PolarHBondContact O-N 2.9Å; D13-L15 VanDerWaalsContact C-N 3.31Å; L15-Y18 PolarHBondContact O-N 2.91Å; L15-I19 HydrophobicContact CD2-CD1 4.2Å; L15-I19 HydrophobicContact CG-CD1 3.91Å; L15-I19 WeakPolarHBondContact O-CB 3.33Å; L15-I19 VanDerWaalsContact O-CG1 3.26Å; L15-I19 WeakPolarHBondContact O-CG1 3.4Å; L15-I19 PolarHBondContact O-N 3.05Å; L15-V66 HydrophobicContact CD1-CG1 3.51Å
16	E	61	Low	54.9	Low	55 Å²	55	81.1 Å²	81.1	26%	0.257	43%	0.426	S	S	.	.	H	α-helix	trans	-61.5	-48	177	-174	176.7	171.8	0	0	109.9	V12 D13 Y18 I19 E20 K44	V12-E16 WeakPolarHBondContact O-CB 3.29Å; V12-E16 PolarHBondContact O-N 3.19Å; D13-E16 PolarHBondContact O-N 3.5Å; E16-Y18 VanDerWaalsContact C-N 3.3Å; E16-Y18 PolarHBondContact O-N 3.37Å; E16-I19 PolarHBondContact O-N 3.44Å; E16-E20 HydrophobicContact CG-CG 4.41Å; E16-E20 WeakPolarHBondContact O-CB 3.35Å; E16-E20 WeakPolarHBondContact O-CG 3.42Å; E16-E20 PolarHBondContact O-N 3.41Å; E16-K44 IonicContact OE1-NZ 2.9Å; E16-K44 PolarHBondContact OE1-NZ 3.36Å
17	S	68.1	Low	55.6	Low	54 Å²	54	75.3 Å²	75.3	38%	0.378	40%	0.401	S	S	.	.	H	α-helix	trans	-61.1	-38.6	177.4	-169.3	0	0	0	0	112.1	D13 R21	D13-S17 WeakPolarHBondContact O-CB 3.3Å; D13-S17 PolarHBondContact O-N 3.19Å; S17-R21 VanDerWaalsContact O-CB 3.24Å; S17-R21 WeakPolarHBondContact O-CB 3.48Å; S17-R21 PolarHBondContact O-N 3.15Å; S17-R21 PolarHBondContact OG-NH2 3.15Å
18	Y	67.9	Low	56.2	Low	72 Å²	72	73.2 Å²	73.2	28%	0.282	39%	0.392	S	S	.	.	H	α-helix	trans	-69	-48.1	176.7	-175.8	-95.5	0	0	0	111.8	E14 L15 E16 E20 R21 Q22	E14-Y18 WeakPolarHBondContact O-CB 3.41Å; E14-Y18 PolarHBondContact O-N 2.98Å; L15-Y18 PolarHBondContact O-N 2.91Å; E16-Y18 VanDerWaalsContact C-N 3.3Å; E16-Y18 PolarHBondContact O-N 3.37Å; Y18-E20 VanDerWaalsContact C-N 3.32Å; Y18-E20 PolarHBondContact O-N 2.97Å; Y18-R21 WeakPolarHBondContact O-CB 3.26Å; Y18-R21 PolarHBondContact O-N 3.5Å; Y18-R21 VanDerWaalsContact O-N 3.15Å; Y18-Q22 HydrophobicContact CD1-CG 4.1Å; Y18-Q22 HydrophobicContact CE1-CG 3.7Å; Y18-Q22 HydrophobicContact CE2-CG 4.47Å; Y18-Q22 VanDerWaalsContact CZ-NE2 3.3Å; Y18-Q22 WeakPolarHBondContact O-CG 3.3Å; Y18-Q22 PolarHBondContact O-N 3.06Å; Y18-Q22 PolarHBondContact OH-NE2 3.04Å
19	I	58.6	Low	56.4	Low	87 Å²	87	76.4 Å²	76.4	45%	0.446	39%	0.388	S	S	.	.	H	α-helix	trans	-59.1	-45.3	175.9	-69	168.5	0	0	0	110	L15 E16 R21 Q22 I23	L15-I19 HydrophobicContact CD2-CD1 4.2Å; L15-I19 HydrophobicContact CG-CD1 3.91Å; L15-I19 WeakPolarHBondContact O-CB 3.33Å; L15-I19 VanDerWaalsContact O-CG1 3.26Å; L15-I19 WeakPolarHBondContact O-CG1 3.4Å; L15-I19 PolarHBondContact O-N 3.05Å; E16-I19 PolarHBondContact O-N 3.44Å; I19-R21 VanDerWaalsContact C-N 3.33Å; I19-R21 PolarHBondContact O-N 3.02Å; I19-Q22 PolarHBondContact O-N 2.72Å; I19-I23 HydrophobicContact CG2-CD1 3.8Å; I19-I23 HydrophobicContact CG2-CG1 4.37Å; I19-I23 WeakPolarHBondContact O-CG1 3.25Å; I19-I23 PolarHBondContact O-N 3.43Å
20	E	67.5	Low	56.4	Low	55 Å²	55	78.7 Å²	78.7	26%	0.257	39%	0.391	S	S	.	.	H	α-helix	trans	-61.2	-40.3	175.4	-79.3	-166.5	172.3	0	0	112.7	E16 Y18 Q22 R24 K44	E16-E20 HydrophobicContact CG-CG 4.41Å; E16-E20 WeakPolarHBondContact O-CB 3.35Å; E16-E20 WeakPolarHBondContact O-CG 3.42Å; E16-E20 PolarHBondContact O-N 3.41Å; Y18-E20 VanDerWaalsContact C-N 3.32Å; Y18-E20 PolarHBondContact O-N 2.97Å; E20-Q22 VanDerWaalsContact C-N 3.31Å; E20-R24 WeakPolarHBondContact O-CB 3.22Å; E20-R24 PolarHBondContact O-N 3Å; E20-R24 IonicContact OE2-NH2 3.07Å; E20-R24 PolarHBondContact OE2-NH2 2.78Å; E20-R24 VanDerWaalsContact OE2-NH2 3.07Å; E20-K44 WeakPolarHBondContact OE1-CE 3.4Å; E20-K44 IonicContact OE1-NZ 2.63Å; E20-K44 PolarHBondContact OE1-NZ 2.96Å
21	R	69.1	Low	55.8	Low	149 Å²	149	83.7 Å²	83.7	56%	0.562	42%	0.418	S	S	*	.	H	α-helix	trans	-65.2	-38.3	177.1	-165	-178.9	-59.5	123.2	5.9	110.8	S17 Y18 I19 R24 G25	S17-R21 VanDerWaalsContact O-CB 3.24Å; S17-R21 WeakPolarHBondContact O-CB 3.48Å; S17-R21 PolarHBondContact O-N 3.15Å; S17-R21 PolarHBondContact OG-NH2 3.15Å; Y18-R21 WeakPolarHBondContact O-CB 3.26Å; Y18-R21 PolarHBondContact O-N 3.5Å; Y18-R21 VanDerWaalsContact O-N 3.15Å; I19-R21 VanDerWaalsContact C-N 3.33Å; I19-R21 PolarHBondContact O-N 3.02Å; R21-R24 PolarHBondContact O-N 2.96Å; R21-G25 PolarHBondContact O-N 3.49Å
22	Q	53.2	Low	55.5	Low	70 Å²	70	88.1 Å²	88.1	33%	0.327	44%	0.439	S	S	.	.	H	α-helix	trans	-70.9	-43.7	176.6	-68.7	-61	-8.1	0	0	112.3	Y18 I19 E20 R24 G25 V26	Y18-Q22 HydrophobicContact CD1-CG 4.1Å; Y18-Q22 HydrophobicContact CE1-CG 3.7Å; Y18-Q22 HydrophobicContact CE2-CG 4.47Å; Y18-Q22 VanDerWaalsContact CZ-NE2 3.3Å; Y18-Q22 WeakPolarHBondContact O-CG 3.3Å; Y18-Q22 PolarHBondContact O-N 3.06Å; Y18-Q22 PolarHBondContact OH-NE2 3.04Å; I19-Q22 PolarHBondContact O-N 2.72Å; E20-Q22 VanDerWaalsContact C-N 3.31Å; Q22-R24 VanDerWaalsContact C-N 3.28Å; Q22-R24 PolarHBondContact O-N 2.93Å; Q22-G25 WeakPolarHBondContact O-CA 3.48Å; Q22-G25 PolarHBondContact O-N 2.87Å; Q22-V26 WeakPolarHBondContact O-CG2 3.28Å; Q22-V26 PolarHBondContact O-N 3.35Å
23	I	55.6	Low	55	Low	91 Å²	91	92.4 Å²	92.4	47%	0.467	46%	0.461	S	S	.	.	H	α-helix	trans	-58.4	-43.6	172.8	-67.4	168.7	0	0	0	110.1	I19 G25 V26 E27	I19-I23 HydrophobicContact CG2-CD1 3.8Å; I19-I23 HydrophobicContact CG2-CG1 4.37Å; I19-I23 WeakPolarHBondContact O-CG1 3.25Å; I19-I23 PolarHBondContact O-N 3.43Å; I23-G25 VanDerWaalsContact C-N 3.34Å; I23-G25 PolarHBondContact O-N 3.29Å; I23-V26 PolarHBondContact O-N 2.77Å; I23-E27 HydrophobicContact CG2-CG 4.37Å; I23-E27 WeakPolarHBondContact O-CB 3.04Å; I23-E27 PolarHBondContact O-N 2.79Å
24	R	60.9	Low	53.6	Low	150 Å²	150	92 Å²	92	57%	0.566	47%	0.466	S	S	*	.	H	α-helix	trans	-62.3	-38.5	173.7	-114.1	177.6	-70.9	-120.9	-1.8	112.6	E20 R21 Q22 V26 E27 S28	E20-R24 WeakPolarHBondContact O-CB 3.22Å; E20-R24 PolarHBondContact O-N 3Å; E20-R24 IonicContact OE2-NH2 3.07Å; E20-R24 PolarHBondContact OE2-NH2 2.78Å; E20-R24 VanDerWaalsContact OE2-NH2 3.07Å; R21-R24 PolarHBondContact O-N 2.96Å; Q22-R24 VanDerWaalsContact C-N 3.28Å; Q22-R24 PolarHBondContact O-N 2.93Å; R24-V26 VanDerWaalsContact C-N 3.35Å; R24-E27 PolarHBondContact O-N 3.17Å; R24-S28 VanDerWaalsContact O-CB 3.29Å; R24-S28 WeakPolarHBondContact O-CB 3.35Å; R24-S28 PolarHBondContact O-N 2.79Å; R24-S28 PolarHBondContact O-OG 3.27Å
25	G	58.1	Low	51.9	Low	27 Å²	27	96.3 Å²	96.3	28%	0.278	49%	0.489	S	S	.	.	H	α-helix	trans	-60.6	-43.2	174.4	0	0	0	0	0	112.3	R21 Q22 I23 S28 Q29	R21-G25 PolarHBondContact O-N 3.49Å; Q22-G25 WeakPolarHBondContact O-CA 3.48Å; Q22-G25 PolarHBondContact O-N 2.87Å; I23-G25 VanDerWaalsContact C-N 3.34Å; I23-G25 PolarHBondContact O-N 3.29Å; G25-S28 WeakPolarHBondContact CA-OG 3.08Å; G25-S28 PolarHBondContact O-OG 3.24Å; G25-Q29 PolarHBondContact O-N 2.85Å
26	V	49.7	Very low	50.9	Low	79 Å²	79	98 Å²	98	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-71.9	-41.4	177.1	178	0	0	0	0	111.8	Q22 I23 R24 Q29 K30	Q22-V26 WeakPolarHBondContact O-CG2 3.28Å; Q22-V26 PolarHBondContact O-N 3.35Å; I23-V26 PolarHBondContact O-N 2.77Å; R24-V26 VanDerWaalsContact C-N 3.35Å; V26-Q29 PolarHBondContact O-N 3.34Å; V26-K30 WeakPolarHBondContact O-CB 3.27Å; V26-K30 PolarHBondContact O-N 3.48Å
27	E	49.4	Very low	49.5	Very low	73 Å²	73	99.6 Å²	99.6	34%	0.341	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-38.7	174.7	-79.9	-178.6	167.3	0	0	111.7	I23 R24 K30 N31 K42	I23-E27 HydrophobicContact CG2-CG 4.37Å; I23-E27 WeakPolarHBondContact O-CB 3.04Å; I23-E27 PolarHBondContact O-N 2.79Å; R24-E27 PolarHBondContact O-N 3.17Å; E27-K30 CarbonylContact O-C 3.52Å; E27-K30 WeakPolarHBondContact O-CB 3.48Å; E27-K30 PolarHBondContact O-N 3.32Å; E27-N31 PolarHBondContact O-N 3.28Å; E27-K42 WeakPolarHBondContact OE1-CE 3.44Å; E27-K42 IonicContact OE1-NZ 3Å; E27-K42 PolarHBondContact OE1-NZ 3.32Å; E27-K42 IonicContact OE2-NZ 3.36Å; E27-K42 PolarHBondContact OE2-NZ 2.89Å
28	S	50.2	Low	47.7	Very low	64 Å²	64	106.9 Å²	106.9	45%	0.448	55%	0.554	S	S	.	*	H	α-helix	trans	-71	-35.2	176	50.5	0	0	0	0	112.7	R24 G25 N31 L32	R24-S28 VanDerWaalsContact O-CB 3.29Å; R24-S28 WeakPolarHBondContact O-CB 3.35Å; R24-S28 PolarHBondContact O-N 2.79Å; R24-S28 PolarHBondContact O-OG 3.27Å; G25-S28 WeakPolarHBondContact CA-OG 3.08Å; G25-S28 PolarHBondContact O-OG 3.24Å; S28-N31 PolarHBondContact O-N 3.41Å; S28-L32 PolarHBondContact O-N 2.85Å
29	Q	43.4	Very low	45.8	Very low	137 Å²	137	111.3 Å²	111.3	64%	0.64	58%	0.582	S	S	*	*	H	α-helix	trans	-66.4	-35.7	168.6	-80.7	-176.8	-12.2	0	0	112.5	G25 V26 L32 N33	G25-Q29 PolarHBondContact O-N 2.85Å; V26-Q29 PolarHBondContact O-N 3.34Å; Q29-L32 PolarHBondContact O-N 3.4Å; Q29-N33 PolarHBondContact O-N 2.93Å
30	K	42.3	Very low	44.4	Very low	124 Å²	124	110.7 Å²	110.7	54%	0.539	60%	0.598	S	S	.	*	H	α-helix	trans	-67.2	-37.1	171	-88.9	-174.5	172.9	-177.6	0	112.5	V26 E27 L32 N33	V26-K30 WeakPolarHBondContact O-CB 3.27Å; V26-K30 PolarHBondContact O-N 3.48Å; E27-K30 CarbonylContact O-C 3.52Å; E27-K30 WeakPolarHBondContact O-CB 3.48Å; E27-K30 PolarHBondContact O-N 3.32Å; K30-L32 VanDerWaalsContact C-N 3.26Å; K30-L32 PolarHBondContact O-N 3.2Å; K30-N33 CarbonylContact O-C 3.58Å; K30-N33 WeakPolarHBondContact O-CA 3.45Å; K30-N33 PolarHBondContact O-N 3.39Å
31	N	42.5	Very low	42.5	Very low	139 Å²	139	111.1 Å²	111.1	74%	0.743	62%	0.617	S	S	*	*	H	α-helix	trans	-69.8	-23.1	177.5	-77.4	-16.9	0	0	0	113.1	E27 S28 N33	E27-N31 PolarHBondContact O-N 3.28Å; S28-N31 PolarHBondContact O-N 3.41Å; N31-N33 VanDerWaalsContact C-N 3.32Å
32	L	42.2	Very low	40.6	Very low	145 Å²	145	111.9 Å²	111.9	76%	0.759	62%	0.624	S	S	*	*	H	α-helix	trans	-74.1	-26.3	168.2	-73.4	167	0	0	0	112.2	S28 Q29 K30	S28-L32 PolarHBondContact O-N 2.85Å; Q29-L32 PolarHBondContact O-N 3.4Å; K30-L32 VanDerWaalsContact C-N 3.26Å; K30-L32 PolarHBondContact O-N 3.2Å
33	N	38.8	Very low	39.4	Very low	126 Å²	126	113.7 Å²	113.7	67%	0.674	64%	0.644	S	S	*	*	S	Bend	trans	-128.4	89.5	-177.5	-74.1	-22.9	0	0	0	110.8	Q29 K30 N31	Q29-N33 PolarHBondContact O-N 2.93Å; K30-N33 CarbonylContact O-C 3.58Å; K30-N33 WeakPolarHBondContact O-CA 3.45Å; K30-N33 PolarHBondContact O-N 3.39Å; N31-N33 VanDerWaalsContact C-N 3.32Å
34	S	32.3	Very low	38.2	Very low	85 Å²	85	115.9 Å²	115.9	59%	0.594	65%	0.651	S	S	*	*			trans	104.1	102	165.6	75.5	0	0	0	0	117.2	S36	S34-S36 VanDerWaalsContact C-N 3.34Å; S34-S36 PolarHBondContact O-N 3.01Å; S34-S36 VanDerWaalsContact O-N 3.13Å
35	I	28.6	Very low	36.6	Very low	181 Å²	181	114.4 Å²	114.4	93%	0.928	66%	0.658	S	S	*	*			trans	-61.4	95.6	145	-62.5	163.6	0	0	0	106.9
36	S	29.9	Very low	34.9	Very low	94 Å²	94	124 Å²	124	66%	0.657	69%	0.686	S	S	*	*			trans	-163.8	128.7	153.7	57	0	0	0	0	110.5	S34	S34-S36 VanDerWaalsContact C-N 3.34Å; S34-S36 PolarHBondContact O-N 3.01Å; S34-S36 VanDerWaalsContact O-N 3.13Å
37	A	31.1	Very low	33.9	Very low	89 Å²	89	124.9 Å²	124.9	74%	0.736	69%	0.687	S	S	*	*			trans	-42.2	138.2	-179.7	0	0	0	0	0	115.4
38	F	29.4	Very low	32.7	Very low	208 Å²	208	127.5 Å²	127.5	91%	0.912	71%	0.708	S	S	*	*				-175.1	108	116.8	-110.8	-84	0	0	0	107.6
39	D	29.9	Very low	31.6	Very low	164 Å²	164	127.6 Å²	127.6	88%	0.877	71%	0.709	S	S	*	*			trans	-81.1	128.5	175.4	-166.3	9.9	0	0	0	108.6
40	G	27.7	Very low	30.9	Very low	74 Å²	74	122.3 Å²	122.3	76%	0.763	69%	0.691	S	S	*	*			trans	-166.5	77.1	-168	0	0	0	0	0	113
41	G	28.4	Very low	30.3	Very low	64 Å²	64	127.2 Å²	127.2	66%	0.66	71%	0.708	S	S	*	*			trans	75.6	77.3	147.9	0	0	0	0	0	117.2	S43	G41-S43 VanDerWaalsContact C-N 3.28Å; G41-S43 PolarHBondContact O-N 3.2Å
42	K	29.9	Very low	30	Very low	166 Å²	166	129.6 Å²	129.6	72%	0.722	71%	0.708	S	S	*	*			trans	-68.4	84.4	162	-65.4	-173.6	178.6	-163.6	0	109.8	E27 K44	E27-K42 WeakPolarHBondContact OE1-CE 3.44Å; E27-K42 IonicContact OE1-NZ 3Å; E27-K42 PolarHBondContact OE1-NZ 3.32Å; E27-K42 IonicContact OE2-NZ 3.36Å; E27-K42 PolarHBondContact OE2-NZ 2.89Å; K42-K44 PolarHBondContact O-N 3.34Å; K42-K44 VanDerWaalsContact O-N 3.15Å
43	S	27.9	Very low	29.5	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	71%	0.712	S	S	*	*			trans	-78.1	92.6	165	-59.5	0	0	0	0	107.9	G41 V45	G41-S43 VanDerWaalsContact C-N 3.28Å; G41-S43 PolarHBondContact O-N 3.2Å; S43-V45 PolarHBondContact O-N 3.02Å
44	K	29	Very low	29.6	Very low	138 Å²	138	125.6 Å²	125.6	60%	0.6	70%	0.698	S	S	*	*			trans	-61.5	104.2	165.1	-100.4	-174.6	169.2	-116.7	0	107.5	E16 E20 K42 R46	E16-K44 IonicContact OE1-NZ 2.9Å; E16-K44 PolarHBondContact OE1-NZ 3.36Å; E20-K44 WeakPolarHBondContact OE1-CE 3.4Å; E20-K44 IonicContact OE1-NZ 2.63Å; E20-K44 PolarHBondContact OE1-NZ 2.96Å; K42-K44 PolarHBondContact O-N 3.34Å; K42-K44 VanDerWaalsContact O-N 3.15Å; K44-R46 PolarHBondContact O-N 3.49Å
45	V	28.3	Very low	30.3	Very low	119 Å²	119	126.8 Å²	126.8	72%	0.721	70%	0.698	S	S	*	*			trans	-68.7	99.2	166.7	178.4	0	0	0	0	106.4	S43 I47	S43-V45 PolarHBondContact O-N 3.02Å; V45-I47 HydrophobicContact CG1-CG1 4.06Å; V45-I47 PolarHBondContact O-N 3.35Å
46	R	23	Very low	31.4	Very low	227 Å²	227	129 Å²	129	86%	0.857	70%	0.695	S	S	*	*			trans	-79.5	95.6	175.3	-157	-178.2	-156.7	-177.5	5.3	107.4	K44 T48	K44-R46 PolarHBondContact O-N 3.49Å; R46-T48 PolarHBondContact O-N 3.34Å
47	I	27.2	Very low	32.2	Very low	99 Å²	99	129.9 Å²	129.9	51%	0.508	69%	0.689	S	S	.	*	P	Polyproline II helix	trans	-74.5	122	171.2	-52.4	178	0	0	0	106.2	V12 V45 S49	V12-I47 HydrophobicContact CG1-CB 4.22Å; V12-I47 HydrophobicContact CG1-CG2 4.43Å; V45-I47 HydrophobicContact CG1-CG1 4.06Å; V45-I47 PolarHBondContact O-N 3.35Å; I47-S49 PolarHBondContact O-N 2.86Å
48	T	25.7	Very low	33.2	Very low	127 Å²	127	127 Å²	127	78%	0.779	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-61.1	117.4	178.3	48.5	0	0	0	0	109.7	R46 G50	R46-T48 PolarHBondContact O-N 3.34Å; T48-G50 PolarHBondContact O-N 3.13Å
49	S	26.8	Very low	34.5	Very low	66 Å²	66	118.5 Å²	118.5	46%	0.462	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-65.2	116.1	174.5	58.2	0	0	0	0	109.7	D10 I47	D10-S49 VanDerWaalsContact OD2-CB 3.25Å; D10-S49 WeakPolarHBondContact OD2-CB 3.4Å; I47-S49 PolarHBondContact O-N 2.86Å
50	G	28	Very low	35.9	Very low	26 Å²	26	114.7 Å²	114.7	27%	0.268	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-93.9	123.2	162.7	0	0	0	0	0	107.6	T48 Y52	T48-G50 PolarHBondContact O-N 3.13Å; G50-Y52 VanDerWaalsContact C-N 3.28Å; G50-Y52 WeakPolarHBondContact O-CD2 3.34Å; G50-Y52 PolarHBondContact O-N 2.81Å
51	Y	28.8	Very low	37.4	Very low	227 Å²	227	112.9 Å²	112.9	89%	0.89	58%	0.583	S	S	*	*			trans	-64	92.2	166.7	-81	-85.3	0	0	0	108.9
52	Y	36.8	Very low	38.9	Very low	190 Å²	190	112.8 Å²	112.8	75%	0.745	57%	0.57	S	S	*	*			trans	-95.2	113.2	168	-61.2	-77.5	0	0	0	107.8	G50 V54	G50-Y52 VanDerWaalsContact C-N 3.28Å; G50-Y52 WeakPolarHBondContact O-CD2 3.34Å; G50-Y52 PolarHBondContact O-N 2.81Å; Y52-V54 PolarHBondContact O-N 2.9Å
53	S	32.5	Very low	40.5	Very low	121 Å²	121	106.3 Å²	106.3	85%	0.846	55%	0.545	S	S	*	.			trans	-68	84.9	164.7	56.3	0	0	0	0	108
54	V	41.2	Very low	42.5	Very low	65 Å²	65	107.8 Å²	107.8	39%	0.394	54%	0.538	S	S	.	.			trans	-82.6	125.9	173.8	-176	0	0	0	0	107	Y52 S58 A59	Y52-V54 PolarHBondContact O-N 2.9Å; V54-S58 WeakPolarHBondContact CG1-OG 3.5Å; V54-A59 HydrophobicContact CB-CB 4.35Å; V54-A59 HydrophobicContact CG1-CB 3.96Å; V54-A59 VanDerWaalsContact CG1-N 3.29Å
55	D	46.9	Very low	43.9	Very low	110 Å²	110	101.9 Å²	101.9	59%	0.588	52%	0.515	S	S	*	.			trans	-51.9	145.3	172.1	173.7	37.5	0	0	0	110.4	H57 S58 A59	D55-H57 PolarHBondContact O-N 3.31Å; D55-H57 WeakPolarHBondContact OD2-CB 3.45Å; D55-S58 PolarHBondContact N-OG 3.47Å; D55-S58 PolarHBondContact O-N 3.38Å; D55-S58 PolarHBondContact O-OG 2.82Å; D55-A59 PolarHBondContact O-N 3.32Å
56	R	50.9	Low	45.6	Very low	227 Å²	227	98.4 Å²	98.4	86%	0.857	49%	0.494	S	S	*	.	H	α-helix	trans	-56.6	-29.2	-174.6	-170.9	175.1	-176.8	167.6	2	111.8	N60	R56-N60 WeakPolarHBondContact O-CB 3.36Å; R56-N60 PolarHBondContact O-N 2.84Å
57	H	47.7	Very low	47.9	Very low	114 Å²	114	93.3 Å²	93.3	53%	0.528	48%	0.478	S	S	.	.	H	α-helix	trans	-70.6	-49.3	175.7	-163.2	57.2	0	0	0	112.3	D55 A59 N60 I61 Q112	D55-H57 PolarHBondContact O-N 3.31Å; D55-H57 WeakPolarHBondContact OD2-CB 3.45Å; H57-A59 VanDerWaalsContact C-N 3.34Å; H57-A59 PolarHBondContact O-N 3.18Å; H57-N60 PolarHBondContact O-N 2.79Å; H57-I61 WeakPolarHBondContact O-CD1 3.22Å; H57-I61 VanDerWaalsContact O-CG1 3.29Å; H57-I61 WeakPolarHBondContact O-CG1 3.48Å; H57-I61 PolarHBondContact O-N 3.24Å; H57-I61 VanDerWaalsContact O-N 3.1Å; H57-Q112 PolarHBondContact NE2-OE1 3.2Å
58	S	52.3	Low	50	Low	28 Å²	28	94.5 Å²	94.5	20%	0.196	48%	0.479	C	S	.	.	H	α-helix	trans	-66.1	-35.3	177.4	41.5	0	0	0	0	112.2	V54 D55 N60 I61 V62	V54-S58 WeakPolarHBondContact CG1-OG 3.5Å; D55-S58 PolarHBondContact N-OG 3.47Å; D55-S58 PolarHBondContact O-N 3.38Å; D55-S58 PolarHBondContact O-OG 2.82Å; S58-N60 PolarHBondContact O-N 3.38Å; S58-I61 PolarHBondContact O-N 2.93Å; S58-V62 VanDerWaalsContact O-CG2 3.28Å; S58-V62 WeakPolarHBondContact O-CG2 3.35Å; S58-V62 PolarHBondContact O-N 2.78Å
59	A	54.9	Low	51.7	Low	30 Å²	30	90.5 Å²	90.5	25%	0.248	45%	0.453	C	S	.	.	H	α-helix	trans	-63.4	-41.7	175.1	0	0	0	0	0	112	V54 D55 H57 V62 S63	V54-A59 HydrophobicContact CB-CB 4.35Å; V54-A59 HydrophobicContact CG1-CB 3.96Å; V54-A59 VanDerWaalsContact CG1-N 3.29Å; D55-A59 PolarHBondContact O-N 3.32Å; H57-A59 VanDerWaalsContact C-N 3.34Å; H57-A59 PolarHBondContact O-N 3.18Å; A59-V62 PolarHBondContact O-N 3.25Å; A59-S63 VanDerWaalsContact O-CB 3.29Å; A59-S63 WeakPolarHBondContact O-CB 3.29Å; A59-S63 PolarHBondContact O-N 3.19Å
60	N	60.2	Low	53.6	Low	83 Å²	83	88.3 Å²	88.3	44%	0.444	44%	0.438	S	S	.	.	H	α-helix	trans	-68	-36.7	177.4	-165.2	-3.6	0	0	0	111.9	R56 H57 S58 K64	R56-N60 WeakPolarHBondContact O-CB 3.36Å; R56-N60 PolarHBondContact O-N 2.84Å; H57-N60 PolarHBondContact O-N 2.79Å; S58-N60 PolarHBondContact O-N 3.38Å; N60-K64 WeakPolarHBondContact O-CB 3.31Å; N60-K64 VanDerWaalsContact O-CG 3.31Å; N60-K64 WeakPolarHBondContact O-CG 3.42Å; N60-K64 PolarHBondContact O-N 3.44Å; N60-K64 WeakPolarHBondContact OD1-CE 3.48Å
61	I	58.5	Low	55.5	Low	37 Å²	37	90.2 Å²	90.2	19%	0.19	45%	0.446	C	S	.	.	H	α-helix	trans	-66.3	-48.1	175.5	-65.1	158.4	0	0	0	110.4	H57 S58 S63 K64 A65	H57-I61 WeakPolarHBondContact O-CD1 3.22Å; H57-I61 VanDerWaalsContact O-CG1 3.29Å; H57-I61 WeakPolarHBondContact O-CG1 3.48Å; H57-I61 PolarHBondContact O-N 3.24Å; H57-I61 VanDerWaalsContact O-N 3.1Å; S58-I61 PolarHBondContact O-N 2.93Å; I61-S63 PolarHBondContact O-N 2.91Å; I61-K64 PolarHBondContact O-N 3.38Å; I61-A65 VanDerWaalsContact O-CB 3.29Å; I61-A65 WeakPolarHBondContact O-CB 3.47Å; I61-A65 PolarHBondContact O-N 3.48Å
62	V	60.7	Low	57.1	Low	62 Å²	62	83.1 Å²	83.1	38%	0.376	42%	0.421	S	S	.	.	H	α-helix	trans	-60.5	-45.3	176.5	173.7	0	0	0	0	110.3	V11 S58 A59 K64 A65 V66	V11-V62 HydrophobicContact CG1-CG1 4.12Å; S58-V62 VanDerWaalsContact O-CG2 3.28Å; S58-V62 WeakPolarHBondContact O-CG2 3.35Å; S58-V62 PolarHBondContact O-N 2.78Å; A59-V62 PolarHBondContact O-N 3.25Å; V62-K64 PolarHBondContact O-N 3.19Å; V62-A65 WeakPolarHBondContact O-CB 3.44Å; V62-A65 PolarHBondContact O-N 2.85Å; V62-V66 HydrophobicContact CG1-CG2 4.24Å; V62-V66 WeakPolarHBondContact O-CB 3.23Å; V62-V66 VanDerWaalsContact O-CG2 3.25Å; V62-V66 WeakPolarHBondContact O-CG2 3.35Å; V62-V66 PolarHBondContact O-N 3.18Å
63	S	63.8	Low	58.4	Low	30 Å²	30	79.1 Å²	79.1	21%	0.21	41%	0.412	C	S	.	.	H	α-helix	trans	-61.2	-43.6	176.6	-176.4	0	0	0	0	112.5	A59 I61 V66 K67	A59-S63 VanDerWaalsContact O-CB 3.29Å; A59-S63 WeakPolarHBondContact O-CB 3.29Å; A59-S63 PolarHBondContact O-N 3.19Å; I61-S63 PolarHBondContact O-N 2.91Å; S63-V66 PolarHBondContact O-N 2.82Å; S63-K67 WeakPolarHBondContact O-CB 3.45Å; S63-K67 VanDerWaalsContact O-CG 3.31Å; S63-K67 WeakPolarHBondContact O-CG 3.32Å; S63-K67 PolarHBondContact O-N 3.15Å
64	K	69.2	Low	59.9	Low	138 Å²	138	76.3 Å²	76.3	60%	0.6	39%	0.388	S	S	*	.	H	α-helix	trans	-63.6	-41	174.6	-78.7	178.9	-178.6	-178.3	0	112.2	N60 I61 V62 K67 K68	N60-K64 WeakPolarHBondContact O-CB 3.31Å; N60-K64 VanDerWaalsContact O-CG 3.31Å; N60-K64 WeakPolarHBondContact O-CG 3.42Å; N60-K64 PolarHBondContact O-N 3.44Å; N60-K64 WeakPolarHBondContact OD1-CE 3.48Å; I61-K64 PolarHBondContact O-N 3.38Å; V62-K64 PolarHBondContact O-N 3.19Å; K64-K67 PolarHBondContact O-N 3.21Å; K64-K68 WeakPolarHBondContact O-CB 3.42Å; K64-K68 PolarHBondContact O-N 3.11Å
65	A	58.4	Low	61	Low	13 Å²	13	77.1 Å²	77.1	11%	0.107	39%	0.387	C	S	.	.	H	α-helix	trans	-62.2	-48.5	176	0	0	0	0	0	111.6	I61 V62 K67 K68 L69 M105	I61-A65 VanDerWaalsContact O-CB 3.29Å; I61-A65 WeakPolarHBondContact O-CB 3.47Å; I61-A65 PolarHBondContact O-N 3.48Å; V62-A65 WeakPolarHBondContact O-CB 3.44Å; V62-A65 PolarHBondContact O-N 2.85Å; A65-K67 PolarHBondContact O-N 2.89Å; A65-K68 PolarHBondContact O-N 2.83Å; A65-K68 VanDerWaalsContact O-N 3.17Å; A65-L69 WeakPolarHBondContact O-CB 3.49Å; A65-L69 WeakPolarHBondContact O-CG 3.07Å; A65-L69 PolarHBondContact O-N 3.42Å; A65-M105 HydrophobicContact CB-CE 3.58Å; A65-M105 HydrophobicContact CB-CG 4.18Å; A65-M105 HydrophobicContact CB-SD 3.28Å; A65-M105 WeakPolarHBondContact CB-SD 3.38Å
66	V	64.8	Low	61.4	Low	47 Å²	47	73.3 Å²	73.3	29%	0.285	37%	0.368	S	S	.	.	H	α-helix	trans	-60.1	-45.2	176.7	169.8	0	0	0	0	110.7	L15 V62 S63 K68 L69 S70	L15-V66 HydrophobicContact CD1-CG1 3.51Å; V62-V66 HydrophobicContact CG1-CG2 4.24Å; V62-V66 WeakPolarHBondContact O-CB 3.23Å; V62-V66 VanDerWaalsContact O-CG2 3.25Å; V62-V66 WeakPolarHBondContact O-CG2 3.35Å; V62-V66 PolarHBondContact O-N 3.18Å; S63-V66 PolarHBondContact O-N 2.82Å; V66-K68 VanDerWaalsContact C-N 3.31Å; V66-K68 PolarHBondContact O-N 3.43Å; V66-L69 PolarHBondContact O-N 2.75Å; V66-S70 PolarHBondContact O-N 3.31Å; V66-S70 PolarHBondContact O-OG 3.18Å
67	K	70.4	Confident	62	Low	120 Å²	120	65.9 Å²	65.9	52%	0.522	35%	0.348	S	S	.	.	H	α-helix	trans	-61.3	-38.9	175.3	-75.6	175.1	-178	174.6	0	112.6	S63 K64 A65 S70 C71	S63-K67 WeakPolarHBondContact O-CB 3.45Å; S63-K67 VanDerWaalsContact O-CG 3.31Å; S63-K67 WeakPolarHBondContact O-CG 3.32Å; S63-K67 PolarHBondContact O-N 3.15Å; K64-K67 PolarHBondContact O-N 3.21Å; A65-K67 PolarHBondContact O-N 2.89Å; K67-S70 WeakPolarHBondContact CA-OG 3.31Å; K67-S70 PolarHBondContact O-OG 3.01Å; K67-C71 WeakPolarHBondContact O-CB 3.18Å; K67-C71 PolarHBondContact O-N 3.23Å; K67-C71 PolarHBondContact O-SG 3.39Å
68	K	70.7	Confident	62.6	Low	123 Å²	123	63.8 Å²	63.8	54%	0.535	35%	0.346	S	S	.	.	H	α-helix	trans	-66.2	-47.4	176	-169.1	179.7	179.2	-174	0	110.7	K64 A65 V66 S70 C71 E72	K64-K68 WeakPolarHBondContact O-CB 3.42Å; K64-K68 PolarHBondContact O-N 3.11Å; A65-K68 PolarHBondContact O-N 2.83Å; A65-K68 VanDerWaalsContact O-N 3.17Å; V66-K68 VanDerWaalsContact C-N 3.31Å; V66-K68 PolarHBondContact O-N 3.43Å; K68-S70 VanDerWaalsContact C-N 3.32Å; K68-S70 PolarHBondContact O-N 3.22Å; K68-C71 PolarHBondContact O-N 3.4Å; K68-E72 WeakPolarHBondContact O-CG 3.25Å; K68-E72 PolarHBondContact O-N 3.38Å
69	L	61.5	Low	62.7	Low	44 Å²	44	70 Å²	70	23%	0.23	37%	0.365	C	S	.	.	H	α-helix	trans	-59.1	-41.7	176.4	-73.2	174	0	0	0	112	A65 V66 E72 L73 F98 V102 M105	A65-L69 WeakPolarHBondContact O-CB 3.49Å; A65-L69 WeakPolarHBondContact O-CG 3.07Å; A65-L69 PolarHBondContact O-N 3.42Å; V66-L69 PolarHBondContact O-N 2.75Å; L69-E72 PolarHBondContact O-N 3.33Å; L69-L73 WeakPolarHBondContact O-CB 3.3Å; L69-L73 PolarHBondContact O-N 2.95Å; L69-F98 HydrophobicContact CD2-CD2 3.92Å; L69-F98 HydrophobicContact CD2-CE2 3.66Å; L69-V102 HydrophobicContact CD2-CG2 4.41Å; L69-M105 HydrophobicContact CD1-CE 3.99Å; L69-M105 HydrophobicContact CD2-CE 4.44Å; L69-M105 HydrophobicContact CG-CE 4.12Å
70	S	67.1	Low	62.8	Low	19 Å²	19	71 Å²	71	13%	0.133	37%	0.368	C	S	.	.	H	α-helix	trans	-65.8	-42.9	176.9	64.6	0	0	0	0	112	V66 K67 K68 E72 L73 D74	V66-S70 PolarHBondContact O-N 3.31Å; V66-S70 PolarHBondContact O-OG 3.18Å; K67-S70 WeakPolarHBondContact CA-OG 3.31Å; K67-S70 PolarHBondContact O-OG 3.01Å; K68-S70 VanDerWaalsContact C-N 3.32Å; K68-S70 PolarHBondContact O-N 3.22Å; S70-E72 VanDerWaalsContact C-N 3.34Å; S70-E72 PolarHBondContact O-N 2.91Å; S70-L73 PolarHBondContact O-N 2.91Å; S70-D74 WeakPolarHBondContact O-CB 3.5Å; S70-D74 VanDerWaalsContact O-CG 3.27Å; S70-D74 PolarHBondContact O-N 3.46Å
71	C	68.1	Low	62.7	Low	67 Å²	67	75.6 Å²	75.6	45%	0.453	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-38.2	177.1	-72.9	0	0	0	0	112.5	K67 K68 Q75	K67-C71 WeakPolarHBondContact O-CB 3.18Å; K67-C71 PolarHBondContact O-N 3.23Å; K67-C71 PolarHBondContact O-SG 3.39Å; K68-C71 PolarHBondContact O-N 3.4Å; C71-Q75 WeakPolarHBondContact O-CG 3.38Å; C71-Q75 PolarHBondContact O-N 2.9Å
72	E	61.8	Low	62.7	Low	78 Å²	78	79.8 Å²	79.8	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-66.6	-43.6	174.5	-68.6	-59.6	155.4	0	0	110.9	K68 L69 S70 D74 Q75 V76	K68-E72 WeakPolarHBondContact O-CG 3.25Å; K68-E72 PolarHBondContact O-N 3.38Å; L69-E72 PolarHBondContact O-N 3.33Å; S70-E72 VanDerWaalsContact C-N 3.34Å; S70-E72 PolarHBondContact O-N 2.91Å; E72-D74 VanDerWaalsContact C-N 3.34Å; E72-D74 PolarHBondContact O-N 2.99Å; E72-Q75 PolarHBondContact O-N 2.86Å; E72-V76 WeakPolarHBondContact O-CB 3.39Å; E72-V76 WeakPolarHBondContact O-CG2 3.4Å; E72-V76 PolarHBondContact O-N 2.87Å
73	L	65.7	Low	62.2	Low	105 Å²	105	83 Å²	83	55%	0.55	41%	0.414	S	S	.	.	H	α-helix	trans	-60.7	-42.4	175.5	-170.1	70.9	0	0	0	111.8	L69 S70 V76 V77	L69-L73 WeakPolarHBondContact O-CB 3.3Å; L69-L73 PolarHBondContact O-N 2.95Å; S70-L73 PolarHBondContact O-N 2.91Å; L73-V76 WeakPolarHBondContact O-CB 3.25Å; L73-V76 PolarHBondContact O-N 3.24Å; L73-V77 WeakPolarHBondContact O-CG2 3.33Å; L73-V77 PolarHBondContact O-N 3.35Å
74	D	64	Low	61.9	Low	62 Å²	62	86.2 Å²	86.2	33%	0.332	43%	0.434	S	S	.	.	H	α-helix	trans	-64.8	-42.1	178.2	-74.2	-22.5	0	0	0	112.1	S70 E72 V76 V77 S78	S70-D74 WeakPolarHBondContact O-CB 3.5Å; S70-D74 VanDerWaalsContact O-CG 3.27Å; S70-D74 PolarHBondContact O-N 3.46Å; E72-D74 VanDerWaalsContact C-N 3.34Å; E72-D74 PolarHBondContact O-N 2.99Å; D74-V76 VanDerWaalsContact C-N 3.25Å; D74-V76 PolarHBondContact O-N 3.38Å; D74-V77 PolarHBondContact O-N 3.4Å; D74-S78 WeakPolarHBondContact O-CB 3.42Å; D74-S78 PolarHBondContact O-N 2.81Å; D74-S78 PolarHBondContact O-OG 3.23Å
75	Q	63.2	Low	61.2	Low	83 Å²	83	88.1 Å²	88.1	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-61	-38.8	173.3	-76.5	-179.6	57	0	0	111.4	C71 E72 R79	C71-Q75 WeakPolarHBondContact O-CG 3.38Å; C71-Q75 PolarHBondContact O-N 2.9Å; E72-Q75 PolarHBondContact O-N 2.86Å; Q75-R79 WeakPolarHBondContact O-CB 3.32Å; Q75-R79 VanDerWaalsContact O-CG 3.25Å; Q75-R79 WeakPolarHBondContact O-CG 3.34Å; Q75-R79 PolarHBondContact O-N 2.83Å
76	V	55.8	Low	60.9	Low	29 Å²	29	92 Å²	92	18%	0.176	46%	0.463	C	S	.	.	H	α-helix	trans	-69.2	-45.9	179	162.7	0	0	0	0	112.1	E72 L73 D74 S78 R79 T80 I94	E72-V76 WeakPolarHBondContact O-CB 3.39Å; E72-V76 WeakPolarHBondContact O-CG2 3.4Å; E72-V76 PolarHBondContact O-N 2.87Å; L73-V76 WeakPolarHBondContact O-CB 3.25Å; L73-V76 PolarHBondContact O-N 3.24Å; D74-V76 VanDerWaalsContact C-N 3.25Å; D74-V76 PolarHBondContact O-N 3.38Å; V76-S78 VanDerWaalsContact C-N 3.29Å; V76-S78 PolarHBondContact O-N 3.42Å; V76-R79 PolarHBondContact O-N 3.49Å; V76-T80 WeakPolarHBondContact O-CG2 3.49Å; V76-T80 PolarHBondContact O-N 3.35Å; V76-T80 PolarHBondContact O-OG1 3.44Å; V76-I94 HydrophobicContact CB-CD1 4.47Å; V76-I94 HydrophobicContact CB-CG1 4.41Å; V76-I94 HydrophobicContact CG1-CB 4.34Å; V76-I94 HydrophobicContact CG1-CD1 3.29Å; V76-I94 HydrophobicContact CG1-CG1 3.59Å; V76-I94 HydrophobicContact CG1-CG2 3.76Å; V76-I94 HydrophobicContact CG2-CD1 4.49Å; V76-I94 HydrophobicContact CG2-CG1 3.93Å; V76-I94 HydrophobicContact CG2-CG2 4.26Å
77	V	62.8	Low	60.3	Low	72 Å²	72	91 Å²	91	44%	0.436	46%	0.463	S	S	.	.	H	α-helix	trans	-60.8	-42.6	175	172.1	0	0	0	0	109.9	L73 D74 R79 T80 Y81	L73-V77 WeakPolarHBondContact O-CG2 3.33Å; L73-V77 PolarHBondContact O-N 3.35Å; D74-V77 PolarHBondContact O-N 3.4Å; V77-R79 PolarHBondContact O-N 2.86Å; V77-T80 WeakPolarHBondContact CA-OG1 3.26Å; V77-T80 PolarHBondContact O-N 2.89Å; V77-T80 PolarHBondContact O-OG1 2.91Å; V77-Y81 WeakPolarHBondContact O-CB 3.32Å; V77-Y81 PolarHBondContact O-N 3.15Å
78	S	61.7	Low	59.6	Low	69 Å²	69	94 Å²	94	48%	0.483	48%	0.476	S	S	.	.	H	α-helix	trans	-62.8	-41.5	176.9	-58.2	0	0	0	0	112.6	D74 V76 N82	D74-S78 WeakPolarHBondContact O-CB 3.42Å; D74-S78 PolarHBondContact O-N 2.81Å; D74-S78 PolarHBondContact O-OG 3.23Å; V76-S78 VanDerWaalsContact C-N 3.29Å; V76-S78 PolarHBondContact O-N 3.42Å; S78-N82 PolarHBondContact O-N 2.81Å; S78-N82 PolarHBondContact O-ND2 3.22Å
79	R	52.9	Low	58.9	Low	160 Å²	160	94 Å²	94	60%	0.604	48%	0.48	S	S	*	.	H	α-helix	trans	-72.8	-31	178.4	-72.9	176.3	-168.9	175.7	9.4	113.3	Q75 V76 V77 R90	Q75-R79 WeakPolarHBondContact O-CB 3.32Å; Q75-R79 VanDerWaalsContact O-CG 3.25Å; Q75-R79 WeakPolarHBondContact O-CG 3.34Å; Q75-R79 PolarHBondContact O-N 2.83Å; V76-R79 PolarHBondContact O-N 3.49Å; V77-R79 PolarHBondContact O-N 2.86Å; R79-R90 PolarHBondContact O-NH1 3.08Å; R79-R90 VanDerWaalsContact O-NH1 3.12Å
80	T	57.3	Low	58.6	Low	51 Å²	51	94.6 Å²	94.6	31%	0.313	48%	0.479	S	S	.	.	H	α-helix	trans	-74.2	-37.7	176	45.6	0	0	0	0	111.5	V76 V77 N82 I94	V76-T80 WeakPolarHBondContact O-CG2 3.49Å; V76-T80 PolarHBondContact O-N 3.35Å; V76-T80 PolarHBondContact O-OG1 3.44Å; V77-T80 WeakPolarHBondContact CA-OG1 3.26Å; V77-T80 PolarHBondContact O-N 2.89Å; V77-T80 PolarHBondContact O-OG1 2.91Å; T80-N82 VanDerWaalsContact C-N 3.32Å; T80-N82 PolarHBondContact O-N 2.83Å; T80-I94 HydrophobicContact CG2-CD1 4.14Å
81	Y	58.4	Low	58.1	Low	179 Å²	179	98 Å²	98	70%	0.702	50%	0.495	S	S	*	.	H	α-helix	trans	-61.8	-38.7	175.2	-130.7	-88.1	0	0	0	112.6	V77	V77-Y81 WeakPolarHBondContact O-CB 3.32Å; V77-Y81 PolarHBondContact O-N 3.15Å
82	N	57.9	Low	57.9	Low	124 Å²	124	98.5 Å²	98.5	66%	0.663	50%	0.496	S	S	*	.	H	α-helix	trans	-71.4	-33.6	-175.1	-73.7	-20.7	0	0	0	113.6	S78 T80	S78-N82 PolarHBondContact O-N 2.81Å; S78-N82 PolarHBondContact O-ND2 3.22Å; T80-N82 VanDerWaalsContact C-N 3.32Å; T80-N82 PolarHBondContact O-N 2.83Å
83	H	51.1	Low	58.2	Low	131 Å²	131	97.2 Å²	97.2	61%	0.606	50%	0.496	S	S	*	.			trans	-141.4	99.3	-177.4	-72.8	-8.4	0	0	0	112.8	H85 R90	H83-H85 PolarHBondContact O-N 2.9Å; H83-R90 VanDerWaalsContact CB-NH2 3.28Å; H83-R90 PolarHBondContact O-NH1 2.93Å; H83-R90 PolarHBondContact O-NH2 2.68Å
84	P	57.1	Low	57.8	Low	96 Å²	96	94.2 Å²	94.2	62%	0.623	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-73.7	-21.8	-172.1	24.8	-32.8	0	0	0	115.8	N86 G87	P84-N86 PolarHBondContact O-N 2.8Å; P84-G87 PolarHBondContact O-N 3.23Å
85	H	53.6	Low	58.1	Low	179 Å²	179	95.3 Å²	95.3	83%	0.829	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-76.4	-11.1	-165.4	-71.7	-60.1	0	0	0	117.2	H83	H83-H85 PolarHBondContact O-N 2.9Å
86	N	52	Low	58.5	Low	94 Å²	94	97.2 Å²	97.2	50%	0.503	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-110.3	28.4	173.7	-58.8	-13.4	0	0	0	112.6	P84 K88 I89 R90	P84-N86 PolarHBondContact O-N 2.8Å; N86-K88 PolarHBondContact O-N 3.28Å; N86-I89 PolarHBondContact O-N 2.66Å; N86-R90 HydrophobicContact CB-CG 4.44Å; N86-R90 WeakPolarHBondContact O-CG 3.34Å; N86-R90 PolarHBondContact O-N 3.37Å; N86-R90 VanDerWaalsContact O-N 3.12Å
87	G	54.1	Low	59.2	Low	27 Å²	27	100.6 Å²	100.6	28%	0.278	51%	0.511	S	S	.	.	H	α-helix	trans	-52	-45.7	-170.4	0	0	0	0	0	115.1	P84 R90 I91	P84-G87 PolarHBondContact O-N 3.23Å; G87-R90 PolarHBondContact O-N 2.84Å; G87-I91 WeakPolarHBondContact O-CD1 3.33Å; G87-I91 WeakPolarHBondContact O-CG1 3.42Å; G87-I91 PolarHBondContact O-N 3.43Å
88	K	54.9	Low	59.3	Low	183 Å²	183	102.6 Å²	102.6	80%	0.796	51%	0.514	S	S	*	.	H	α-helix	trans	-67.9	-48.7	-176.9	-77.6	-173.7	177.6	-178.7	0	113.8	N86 R90 I91 T92	N86-K88 PolarHBondContact O-N 3.28Å; K88-R90 PolarHBondContact O-N 3Å; K88-I91 PolarHBondContact O-N 2.86Å; K88-T92 PolarHBondContact O-N 3.06Å; K88-T92 PolarHBondContact O-OG1 2.83Å
89	I	56.9	Low	59.8	Low	121 Å²	121	104.7 Å²	104.7	62%	0.621	52%	0.516	S	S	*	.	H	α-helix	trans	-62.2	-35	178.8	-61.2	171.4	0	0	0	109.9	N86 T92 S93	N86-I89 PolarHBondContact O-N 2.66Å; I89-T92 WeakPolarHBondContact CA-OG1 3.46Å; I89-T92 PolarHBondContact O-OG1 3.13Å; I89-S93 PolarHBondContact O-N 3.29Å; I89-S93 VanDerWaalsContact O-N 3.15Å; I89-S93 PolarHBondContact O-OG 3.43Å
90	R	53.4	Low	61	Low	57 Å²	57	103.4 Å²	103.4	22%	0.215	52%	0.515	C	S	.	.	H	α-helix	trans	-70.2	-46.4	175	-68.4	-174	-147.8	158.7	18.9	112.2	R79 H83 N86 G87 K88 T92 S93 I94	R79-R90 PolarHBondContact O-NH1 3.08Å; R79-R90 VanDerWaalsContact O-NH1 3.12Å; H83-R90 VanDerWaalsContact CB-NH2 3.28Å; H83-R90 PolarHBondContact O-NH1 2.93Å; H83-R90 PolarHBondContact O-NH2 2.68Å; N86-R90 HydrophobicContact CB-CG 4.44Å; N86-R90 WeakPolarHBondContact O-CG 3.34Å; N86-R90 PolarHBondContact O-N 3.37Å; N86-R90 VanDerWaalsContact O-N 3.12Å; G87-R90 PolarHBondContact O-N 2.84Å; K88-R90 PolarHBondContact O-N 3Å; R90-T92 PolarHBondContact O-N 3.43Å; R90-S93 PolarHBondContact O-N 3.41Å; R90-S93 VanDerWaalsContact O-N 3.14Å; R90-I94 HydrophobicContact CB-CD1 4.22Å; R90-I94 WeakPolarHBondContact O-CB 3.4Å; R90-I94 WeakPolarHBondContact O-CD1 3.3Å; R90-I94 WeakPolarHBondContact O-CG1 3.25Å; R90-I94 PolarHBondContact O-N 3.46Å
91	I	58.5	Low	61.7	Low	92 Å²	92	102.6 Å²	102.6	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-57.3	-41.2	178.5	-69.5	160.9	0	0	0	110.6	G87 K88 I94 I95	G87-I91 WeakPolarHBondContact O-CD1 3.33Å; G87-I91 WeakPolarHBondContact O-CG1 3.42Å; G87-I91 PolarHBondContact O-N 3.43Å; K88-I91 PolarHBondContact O-N 2.86Å; I91-I94 WeakPolarHBondContact O-CB 3.31Å; I91-I94 PolarHBondContact O-N 2.89Å; I91-I95 HydrophobicContact CG2-CD1 3.85Å; I91-I95 HydrophobicContact CG2-CG1 4.43Å; I91-I95 VanDerWaalsContact O-CG1 3.3Å; I91-I95 WeakPolarHBondContact O-CG1 3.35Å; I91-I95 PolarHBondContact O-N 2.92Å
92	T	63.2	Low	62.3	Low	76 Å²	76	96.4 Å²	96.4	47%	0.466	49%	0.491	S	S	.	.	H	α-helix	trans	-66	-43.1	176.3	48.6	0	0	0	0	112.6	K88 I89 R90 I94 I95 Q96	K88-T92 PolarHBondContact O-N 3.06Å; K88-T92 PolarHBondContact O-OG1 2.83Å; I89-T92 WeakPolarHBondContact CA-OG1 3.46Å; I89-T92 PolarHBondContact O-OG1 3.13Å; R90-T92 PolarHBondContact O-N 3.43Å; T92-I94 VanDerWaalsContact C-N 3.29Å; T92-I94 PolarHBondContact O-N 2.93Å; T92-I95 PolarHBondContact O-N 2.87Å; T92-Q96 WeakPolarHBondContact O-CG 3.28Å; T92-Q96 PolarHBondContact O-N 2.85Å
93	S	67.1	Low	63	Low	52 Å²	52	93.7 Å²	93.7	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-36	174.2	-61.9	0	0	0	0	112.1	I89 R90 Q96 D97	I89-S93 PolarHBondContact O-N 3.29Å; I89-S93 VanDerWaalsContact O-N 3.15Å; I89-S93 PolarHBondContact O-OG 3.43Å; R90-S93 PolarHBondContact O-N 3.41Å; R90-S93 VanDerWaalsContact O-N 3.14Å; S93-Q96 PolarHBondContact O-N 2.99Å; S93-D97 WeakPolarHBondContact O-CB 3.31Å; S93-D97 PolarHBondContact O-N 3.46Å
94	I	58.6	Low	64.2	Low	41 Å²	41	90.8 Å²	90.8	21%	0.21	47%	0.468	C	S	.	.	H	α-helix	trans	-64.2	-46.1	176.4	-70	157.4	0	0	0	110.9	V76 T80 R90 I91 T92 Q96 D97 F98	V76-I94 HydrophobicContact CB-CD1 4.47Å; V76-I94 HydrophobicContact CB-CG1 4.41Å; V76-I94 HydrophobicContact CG1-CB 4.34Å; V76-I94 HydrophobicContact CG1-CD1 3.29Å; V76-I94 HydrophobicContact CG1-CG1 3.59Å; V76-I94 HydrophobicContact CG1-CG2 3.76Å; V76-I94 HydrophobicContact CG2-CD1 4.49Å; V76-I94 HydrophobicContact CG2-CG1 3.93Å; V76-I94 HydrophobicContact CG2-CG2 4.26Å; T80-I94 HydrophobicContact CG2-CD1 4.14Å; R90-I94 HydrophobicContact CB-CD1 4.22Å; R90-I94 WeakPolarHBondContact O-CB 3.4Å; R90-I94 WeakPolarHBondContact O-CD1 3.3Å; R90-I94 WeakPolarHBondContact O-CG1 3.25Å; R90-I94 PolarHBondContact O-N 3.46Å; I91-I94 WeakPolarHBondContact O-CB 3.31Å; I91-I94 PolarHBondContact O-N 2.89Å; T92-I94 VanDerWaalsContact C-N 3.29Å; T92-I94 PolarHBondContact O-N 2.93Å; I94-Q96 VanDerWaalsContact C-N 3.31Å; I94-Q96 PolarHBondContact O-N 2.87Å; I94-D97 PolarHBondContact O-N 3.3Å; I94-F98 WeakPolarHBondContact O-CB 3.46Å; I94-F98 PolarHBondContact O-N 3.36Å
95	I	69.5	Low	64.7	Low	86 Å²	86	88.8 Å²	88.8	44%	0.441	45%	0.451	S	S	.	.	H	α-helix	trans	-63.3	-41.7	177.5	-68.6	166.8	0	0	0	109.7	I91 T92 F98 E99	I91-I95 HydrophobicContact CG2-CD1 3.85Å; I91-I95 HydrophobicContact CG2-CG1 4.43Å; I91-I95 VanDerWaalsContact O-CG1 3.3Å; I91-I95 WeakPolarHBondContact O-CG1 3.35Å; I91-I95 PolarHBondContact O-N 2.92Å; T92-I95 PolarHBondContact O-N 2.87Å; I95-F98 WeakPolarHBondContact O-CB 3.5Å; I95-F98 PolarHBondContact O-N 3.25Å; I95-E99 HydrophobicContact CG2-CG 4.35Å; I95-E99 WeakPolarHBondContact O-CB 3.42Å; I95-E99 WeakPolarHBondContact O-CG 3.39Å; I95-E99 PolarHBondContact O-N 3.21Å
96	Q	72.7	Confident	65.4	Low	123 Å²	123	83.5 Å²	83.5	58%	0.575	43%	0.433	S	S	*	.	H	α-helix	trans	-64.4	-41.9	176.9	-74	176.5	-11.8	0	0	112.9	T92 S93 I94 F98 E99 K100	T92-Q96 WeakPolarHBondContact O-CG 3.28Å; T92-Q96 PolarHBondContact O-N 2.85Å; S93-Q96 PolarHBondContact O-N 2.99Å; I94-Q96 VanDerWaalsContact C-N 3.31Å; I94-Q96 PolarHBondContact O-N 2.87Å; Q96-F98 VanDerWaalsContact C-N 3.33Å; Q96-E99 PolarHBondContact O-N 3.4Å; Q96-K100 VanDerWaalsContact O-CB 3.31Å; Q96-K100 WeakPolarHBondContact O-CB 3.27Å; Q96-K100 PolarHBondContact O-N 3.12Å
97	D	69.6	Low	66.6	Low	100 Å²	100	85 Å²	85	54%	0.535	44%	0.435	S	S	.	.	H	α-helix	trans	-66.3	-37.4	175.6	-74.2	-22.5	0	0	0	111.3	S93 I94 K100 T101	S93-D97 WeakPolarHBondContact O-CB 3.31Å; S93-D97 PolarHBondContact O-N 3.46Å; I94-D97 PolarHBondContact O-N 3.3Å; D97-K100 PolarHBondContact O-N 2.89Å; D97-T101 WeakPolarHBondContact O-CG2 3.44Å; D97-T101 PolarHBondContact O-N 2.87Å; D97-T101 PolarHBondContact O-OG1 2.93Å
98	F	65.1	Low	67.5	Low	113 Å²	113	89.4 Å²	89.4	50%	0.496	45%	0.448	S	S	.	.	H	α-helix	trans	-64.5	-49.5	173.6	-177.4	-96.3	0	0	0	111.7	L69 I94 I95 Q96 K100 T101 V102	L69-F98 HydrophobicContact CD2-CD2 3.92Å; L69-F98 HydrophobicContact CD2-CE2 3.66Å; I94-F98 WeakPolarHBondContact O-CB 3.46Å; I94-F98 PolarHBondContact O-N 3.36Å; I95-F98 WeakPolarHBondContact O-CB 3.5Å; I95-F98 PolarHBondContact O-N 3.25Å; Q96-F98 VanDerWaalsContact C-N 3.33Å; F98-K100 VanDerWaalsContact C-N 3.27Å; F98-K100 PolarHBondContact O-N 2.79Å; F98-T101 WeakPolarHBondContact CA-OG1 3.44Å; F98-T101 PolarHBondContact O-N 2.95Å; F98-T101 PolarHBondContact O-OG1 3.49Å; F98-V102 HydrophobicContact CD1-CG2 4.13Å; F98-V102 HydrophobicContact CE1-CG2 3.76Å; F98-V102 HydrophobicContact CE2-CG2 4.2Å; F98-V102 HydrophobicContact CZ-CG2 3.79Å; F98-V102 WeakPolarHBondContact O-CB 3.4Å; F98-V102 WeakPolarHBondContact O-CG2 3.35Å; F98-V102 PolarHBondContact O-N 3.28Å
99	E	72	Confident	68	Low	113 Å²	113	86.6 Å²	86.6	53%	0.528	43%	0.434	S	S	.	.	H	α-helix	trans	-57.4	-42.5	175.5	-76.7	176.2	174.6	0	0	111.3	I95 Q96 T103	I95-E99 HydrophobicContact CG2-CG 4.35Å; I95-E99 WeakPolarHBondContact O-CB 3.42Å; I95-E99 WeakPolarHBondContact O-CG 3.39Å; I95-E99 PolarHBondContact O-N 3.21Å; Q96-E99 PolarHBondContact O-N 3.4Å; E99-T103 WeakPolarHBondContact O-CB 3.13Å; E99-T103 PolarHBondContact O-N 2.8Å; E99-T103 PolarHBondContact O-OG1 2.97Å
100	K	77.2	Confident	68.6	Low	134 Å²	134	84.1 Å²	84.1	58%	0.583	43%	0.427	S	S	*	.	H	α-helix	trans	-64.6	-44.9	177.5	-173.4	178.1	179.6	-178.5	0	112.1	Q96 D97 F98 T103 D104	Q96-K100 VanDerWaalsContact O-CB 3.31Å; Q96-K100 WeakPolarHBondContact O-CB 3.27Å; Q96-K100 PolarHBondContact O-N 3.12Å; D97-K100 PolarHBondContact O-N 2.89Å; F98-K100 VanDerWaalsContact C-N 3.27Å; F98-K100 PolarHBondContact O-N 2.79Å; K100-T103 PolarHBondContact O-N 2.72Å; K100-D104 WeakPolarHBondContact O-CB 3.24Å; K100-D104 PolarHBondContact O-N 3.26Å
101	T	72.6	Confident	69.4	Low	34 Å²	34	85 Å²	85	21%	0.209	44%	0.439	C	S	.	.	H	α-helix	trans	-67.8	-39.4	179.6	50.2	0	0	0	0	112.5	D97 F98 M105	D97-T101 WeakPolarHBondContact O-CG2 3.44Å; D97-T101 PolarHBondContact O-N 2.87Å; D97-T101 PolarHBondContact O-OG1 2.93Å; F98-T101 WeakPolarHBondContact CA-OG1 3.44Å; F98-T101 PolarHBondContact O-N 2.95Å; F98-T101 PolarHBondContact O-OG1 3.49Å; T101-M105 VanDerWaalsContact O-CB 3.23Å; T101-M105 WeakPolarHBondContact O-CB 3.29Å; T101-M105 PolarHBondContact O-N 3.35Å
102	V	71.1	Confident	69.4	Low	48 Å²	48	83.7 Å²	83.7	29%	0.291	43%	0.431	S	S	.	.	H	α-helix	trans	-64	-45.5	172.4	173.1	0	0	0	0	110.3	L69 F98 D104 M105 C106	L69-V102 HydrophobicContact CD2-CG2 4.41Å; F98-V102 HydrophobicContact CD1-CG2 4.13Å; F98-V102 HydrophobicContact CE1-CG2 3.76Å; F98-V102 HydrophobicContact CE2-CG2 4.2Å; F98-V102 HydrophobicContact CZ-CG2 3.79Å; F98-V102 WeakPolarHBondContact O-CB 3.4Å; F98-V102 WeakPolarHBondContact O-CG2 3.35Å; F98-V102 PolarHBondContact O-N 3.28Å; V102-D104 PolarHBondContact O-N 3.42Å; V102-M105 WeakPolarHBondContact O-CB 3.4Å; V102-M105 PolarHBondContact O-N 2.91Å; V102-C106 WeakPolarHBondContact O-CB 3.47Å; V102-C106 PolarHBondContact O-N 3.26Å; V102-C106 PolarHBondContact O-SG 2.88Å
103	T	73.3	Confident	69.1	Low	67 Å²	67	83.1 Å²	83.1	41%	0.411	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-45	178.5	-58.8	0	0	0	0	112	E99 K100 M105 C106 K107	E99-T103 WeakPolarHBondContact O-CB 3.13Å; E99-T103 PolarHBondContact O-N 2.8Å; E99-T103 PolarHBondContact O-OG1 2.97Å; K100-T103 PolarHBondContact O-N 2.72Å; T103-M105 VanDerWaalsContact C-N 3.28Å; T103-M105 PolarHBondContact O-N 3.13Å; T103-C106 PolarHBondContact O-N 3.37Å; T103-K107 HydrophobicContact CG2-CD 4.43Å; T103-K107 WeakPolarHBondContact O-CG 3.21Å; T103-K107 PolarHBondContact O-N 3.35Å
104	D	76.4	Confident	68.5	Low	71 Å²	71	83.4 Å²	83.4	38%	0.38	43%	0.429	S	S	.	.	H	α-helix	trans	-64.1	-35.9	176.4	-83.4	-4.8	0	0	0	111.6	K100 V102 K107 Q108	K100-D104 WeakPolarHBondContact O-CB 3.24Å; K100-D104 PolarHBondContact O-N 3.26Å; V102-D104 PolarHBondContact O-N 3.42Å; D104-K107 PolarHBondContact O-N 2.94Å; D104-Q108 WeakPolarHBondContact O-CB 3.43Å; D104-Q108 VanDerWaalsContact O-CG 3.31Å; D104-Q108 WeakPolarHBondContact O-CG 3.44Å; D104-Q108 PolarHBondContact O-N 3.44Å
105	M	66.5	Low	68.2	Low	53 Å²	53	87.9 Å²	87.9	26%	0.261	45%	0.447	S	S	.	.	H	α-helix	trans	-68.5	-43.6	174.6	-172.8	-163.1	-46.7	0	0	111.8	A65 L69 T101 V102 T103 K107 Q108 Y109	A65-M105 HydrophobicContact CB-CE 3.58Å; A65-M105 HydrophobicContact CB-CG 4.18Å; A65-M105 HydrophobicContact CB-SD 3.28Å; A65-M105 WeakPolarHBondContact CB-SD 3.38Å; L69-M105 HydrophobicContact CD1-CE 3.99Å; L69-M105 HydrophobicContact CD2-CE 4.44Å; L69-M105 HydrophobicContact CG-CE 4.12Å; T101-M105 VanDerWaalsContact O-CB 3.23Å; T101-M105 WeakPolarHBondContact O-CB 3.29Å; T101-M105 PolarHBondContact O-N 3.35Å; V102-M105 WeakPolarHBondContact O-CB 3.4Å; V102-M105 PolarHBondContact O-N 2.91Å; T103-M105 VanDerWaalsContact C-N 3.28Å; T103-M105 PolarHBondContact O-N 3.13Å; M105-K107 VanDerWaalsContact C-N 3.3Å; M105-K107 PolarHBondContact O-N 3.47Å; M105-Q108 PolarHBondContact O-N 2.9Å; M105-Y109 WeakPolarHBondContact O-CB 3.18Å; M105-Y109 PolarHBondContact O-N 3.48Å
106	C	69	Low	67.4	Low	69 Å²	69	86.8 Å²	86.8	47%	0.466	45%	0.45	S	S	.	.	H	α-helix	trans	-59.4	-42.4	172.6	-71.5	0	0	0	0	110.7	V102 T103 Y109 S110	V102-C106 WeakPolarHBondContact O-CB 3.47Å; V102-C106 PolarHBondContact O-N 3.26Å; V102-C106 PolarHBondContact O-SG 2.88Å; T103-C106 PolarHBondContact O-N 3.37Å; C106-Y109 PolarHBondContact O-N 2.84Å; C106-S110 WeakPolarHBondContact O-CB 3.25Å; C106-S110 PolarHBondContact O-N 3.29Å; C106-S110 PolarHBondContact O-OG 2.91Å; C106-S110 VanDerWaalsContact O-OG 3.06Å
107	K	76.2	Confident	65.9	Low	126 Å²	126	90.7 Å²	90.7	55%	0.548	46%	0.46	S	S	.	.	H	α-helix	trans	-62.7	-44.6	173.4	-73.3	173.7	-178	173.3	0	112	T103 D104 M105 Y109 S110 V111	T103-K107 HydrophobicContact CG2-CD 4.43Å; T103-K107 WeakPolarHBondContact O-CG 3.21Å; T103-K107 PolarHBondContact O-N 3.35Å; D104-K107 PolarHBondContact O-N 2.94Å; M105-K107 VanDerWaalsContact C-N 3.3Å; M105-K107 PolarHBondContact O-N 3.47Å; K107-Y109 VanDerWaalsContact C-N 3.32Å; K107-Y109 PolarHBondContact O-N 3.44Å; K107-S110 PolarHBondContact O-N 3.06Å; K107-V111 WeakPolarHBondContact O-CB 3.4Å; K107-V111 VanDerWaalsContact O-CG2 3.24Å; K107-V111 WeakPolarHBondContact O-CG2 3.46Å; K107-V111 PolarHBondContact O-N 3Å
108	Q	73.1	Confident	64.5	Low	118 Å²	118	91.8 Å²	91.8	55%	0.551	47%	0.466	S	S	*	.	H	α-helix	trans	-62.7	-39.8	175.5	-76	-179.2	26.9	0	0	111.9	D104 M105 V111 Q112	D104-Q108 WeakPolarHBondContact O-CB 3.43Å; D104-Q108 VanDerWaalsContact O-CG 3.31Å; D104-Q108 WeakPolarHBondContact O-CG 3.44Å; D104-Q108 PolarHBondContact O-N 3.44Å; M105-Q108 PolarHBondContact O-N 2.9Å; Q108-V111 PolarHBondContact O-N 2.75Å; Q108-Q112 WeakPolarHBondContact O-CB 3.27Å; Q108-Q112 VanDerWaalsContact O-CG 3.31Å; Q108-Q112 WeakPolarHBondContact O-CG 3.3Å; Q108-Q112 PolarHBondContact O-N 3.19Å
109	Y	66.7	Low	63.2	Low	124 Å²	124	92.7 Å²	92.7	49%	0.486	47%	0.472	S	S	.	.	H	α-helix	trans	-65.4	-47.2	175.1	-175.1	-100	0	0	0	110.7	M105 C106 K107 V111 Q112 V113	M105-Y109 WeakPolarHBondContact O-CB 3.18Å; M105-Y109 PolarHBondContact O-N 3.48Å; C106-Y109 PolarHBondContact O-N 2.84Å; K107-Y109 VanDerWaalsContact C-N 3.32Å; K107-Y109 PolarHBondContact O-N 3.44Å; Y109-V111 VanDerWaalsContact C-N 3.31Å; Y109-V111 PolarHBondContact O-N 3.22Å; Y109-Q112 CarbonylContact O-C 2.94Å; Y109-Q112 PolarHBondContact O-N 3.33Å; Y109-Q112 VanDerWaalsContact O-N 3.09Å; Y109-V113 HydrophobicContact CD1-CG2 3.79Å; Y109-V113 HydrophobicContact CD2-CG2 4.41Å; Y109-V113 HydrophobicContact CE1-CG2 3.41Å; Y109-V113 VanDerWaalsContact CE1-CG2 3.41Å; Y109-V113 HydrophobicContact CE2-CG2 4.08Å; Y109-V113 HydrophobicContact CG-CG2 4.28Å; Y109-V113 WeakPolarHBondContact O-CB 3.36Å; Y109-V113 VanDerWaalsContact O-CG2 3.29Å; Y109-V113 WeakPolarHBondContact O-CG2 3.44Å; Y109-V113 PolarHBondContact O-N 3.2Å
110	S	69	Low	61.6	Low	70 Å²	70	92.8 Å²	92.8	49%	0.49	48%	0.482	S	S	.	.	H	α-helix	trans	-59.2	-40.7	174	-64.8	0	0	0	0	111.8	C106 K107 S114	C106-S110 WeakPolarHBondContact O-CB 3.25Å; C106-S110 PolarHBondContact O-N 3.29Å; C106-S110 PolarHBondContact O-OG 2.91Å; C106-S110 VanDerWaalsContact O-OG 3.06Å; K107-S110 PolarHBondContact O-N 3.06Å; S110-S114 WeakPolarHBondContact O-CB 3.42Å; S110-S114 PolarHBondContact O-N 3.12Å; S110-S114 PolarHBondContact O-OG 2.82Å
111	V	70.3	Confident	59.9	Low	76 Å²	76	91 Å²	91	46%	0.461	49%	0.486	S	S	.	.	H	α-helix	trans	-67.3	-37.8	174.4	170.5	0	0	0	0	111.3	K107 Q108 Y109 S114 K115	K107-V111 WeakPolarHBondContact O-CB 3.4Å; K107-V111 VanDerWaalsContact O-CG2 3.24Å; K107-V111 WeakPolarHBondContact O-CG2 3.46Å; K107-V111 PolarHBondContact O-N 3Å; Q108-V111 PolarHBondContact O-N 2.75Å; Y109-V111 VanDerWaalsContact C-N 3.31Å; Y109-V111 PolarHBondContact O-N 3.22Å; V111-S114 CarbonylContact O-C 3.59Å; V111-S114 PolarHBondContact O-N 3.3Å; V111-K115 HydrophobicContact CG1-CD 4.27Å; V111-K115 HydrophobicContact CG1-CG 4.49Å; V111-K115 WeakPolarHBondContact O-CB 3.17Å; V111-K115 VanDerWaalsContact O-CG 3.28Å; V111-K115 WeakPolarHBondContact O-CG 3.06Å; V111-K115 PolarHBondContact O-N 2.76Å
112	Q	58.5	Low	58.4	Low	63 Å²	63	93.8 Å²	93.8	29%	0.294	50%	0.499	S	S	.	.	H	α-helix	trans	-72.8	-37.9	176.9	-78	-166.6	50.7	0	0	112.7	H57 Q108 Y109 S114 K115 A116	H57-Q112 PolarHBondContact NE2-OE1 3.2Å; Q108-Q112 WeakPolarHBondContact O-CB 3.27Å; Q108-Q112 VanDerWaalsContact O-CG 3.31Å; Q108-Q112 WeakPolarHBondContact O-CG 3.3Å; Q108-Q112 PolarHBondContact O-N 3.19Å; Y109-Q112 CarbonylContact O-C 2.94Å; Y109-Q112 PolarHBondContact O-N 3.33Å; Y109-Q112 VanDerWaalsContact O-N 3.09Å; Q112-S114 VanDerWaalsContact C-N 3.33Å; Q112-K115 CarbonylContact O-C 3.57Å; Q112-K115 PolarHBondContact O-N 3.12Å; Q112-A116 VanDerWaalsContact O-CB 3.26Å; Q112-A116 WeakPolarHBondContact O-CB 3.36Å; Q112-A116 PolarHBondContact O-N 2.78Å
113	V	57.3	Low	57.1	Low	65 Å²	65	94.1 Å²	94.1	39%	0.394	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-41.4	170.5	171.3	0	0	0	0	109.4	Y109 A116 R117	Y109-V113 HydrophobicContact CD1-CG2 3.79Å; Y109-V113 HydrophobicContact CD2-CG2 4.41Å; Y109-V113 HydrophobicContact CE1-CG2 3.41Å; Y109-V113 VanDerWaalsContact CE1-CG2 3.41Å; Y109-V113 HydrophobicContact CE2-CG2 4.08Å; Y109-V113 HydrophobicContact CG-CG2 4.28Å; Y109-V113 WeakPolarHBondContact O-CB 3.36Å; Y109-V113 VanDerWaalsContact O-CG2 3.29Å; Y109-V113 WeakPolarHBondContact O-CG2 3.44Å; Y109-V113 PolarHBondContact O-N 3.2Å; V113-A116 CarbonylContact O-C 3.58Å; V113-A116 PolarHBondContact O-N 3.26Å; V113-R117 WeakPolarHBondContact O-CB 3.49Å; V113-R117 PolarHBondContact O-N 3.41Å
114	S	53	Low	56.1	Low	57 Å²	57	94.7 Å²	94.7	40%	0.399	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-38	171.9	-67.9	0	0	0	0	112	S110 V111 Q112 R117 N118	S110-S114 WeakPolarHBondContact O-CB 3.42Å; S110-S114 PolarHBondContact O-N 3.12Å; S110-S114 PolarHBondContact O-OG 2.82Å; V111-S114 CarbonylContact O-C 3.59Å; V111-S114 PolarHBondContact O-N 3.3Å; Q112-S114 VanDerWaalsContact C-N 3.33Å; S114-R117 CarbonylContact O-C 3.58Å; S114-R117 PolarHBondContact O-N 3.13Å; S114-N118 WeakPolarHBondContact O-CB 3.06Å; S114-N118 PolarHBondContact O-N 3.2Å; S114-N118 PolarHBondContact O-ND2 3.25Å; S114-N118 PolarHBondContact O-OD1 2.79Å
115	K	53.8	Low	55.3	Low	136 Å²	136	91.6 Å²	91.6	59%	0.591	49%	0.494	S	S	*	.	H	α-helix	trans	-68.4	-33.7	171.9	-77.3	176.8	-178.6	-176.7	0	112.1	V111 Q112 R117 N118 H119	V111-K115 HydrophobicContact CG1-CD 4.27Å; V111-K115 HydrophobicContact CG1-CG 4.49Å; V111-K115 WeakPolarHBondContact O-CB 3.17Å; V111-K115 VanDerWaalsContact O-CG 3.28Å; V111-K115 WeakPolarHBondContact O-CG 3.06Å; V111-K115 PolarHBondContact O-N 2.76Å; Q112-K115 CarbonylContact O-C 3.57Å; Q112-K115 PolarHBondContact O-N 3.12Å; K115-R117 VanDerWaalsContact C-N 3.33Å; K115-N118 CarbonylContact O-C 3.54Å; K115-N118 PolarHBondContact O-N 2.88Å; K115-H119 PolarHBondContact O-N 3.15Å
116	A	51.5	Low	55.3	Low	62 Å²	62	95.2 Å²	95.2	51%	0.512	51%	0.508	S	S	.	.	H	α-helix	trans	-72.5	-29.7	173.4	0	0	0	0	0	111.9	Q112 V113	Q112-A116 VanDerWaalsContact O-CB 3.26Å; Q112-A116 WeakPolarHBondContact O-CB 3.36Å; Q112-A116 PolarHBondContact O-N 2.78Å; V113-A116 CarbonylContact O-C 3.58Å; V113-A116 PolarHBondContact O-N 3.26Å
117	R	42.4	Very low	55	Low	205 Å²	205	92.2 Å²	92.2	77%	0.774	49%	0.487	S	S	*	.	H	α-helix	trans	-78	-29.6	171.6	-166.4	177.2	-170.9	-178.3	2.2	112.2	V113 S114 K115	V113-R117 WeakPolarHBondContact O-CB 3.49Å; V113-R117 PolarHBondContact O-N 3.41Å; S114-R117 CarbonylContact O-C 3.58Å; S114-R117 PolarHBondContact O-N 3.13Å; K115-R117 VanDerWaalsContact C-N 3.33Å
118	N	39.9	Very low	54.4	Low	124 Å²	124	86.3 Å²	86.3	66%	0.663	46%	0.462	S	S	*	.	S	Bend	trans	-91.5	-3.9	174.8	-65.2	-11.4	0	0	0	112.7	S114 K115 P120	S114-N118 WeakPolarHBondContact O-CB 3.06Å; S114-N118 PolarHBondContact O-N 3.2Å; S114-N118 PolarHBondContact O-ND2 3.25Å; S114-N118 PolarHBondContact O-OD1 2.79Å; K115-N118 CarbonylContact O-C 3.54Å; K115-N118 PolarHBondContact O-N 2.88Å; N118-P120 VanDerWaalsContact O-N 3.11Å
119	H	37	Very low	54	Low	132 Å²	132	83.5 Å²	83.5	61%	0.611	46%	0.456	S	S	*	.	S	Bend	trans	-56.4	119.5	148.9	-77.5	-50.7	0	0	0	103.6	K115 S121	K115-H119 PolarHBondContact O-N 3.15Å; H119-S121 PolarHBondContact O-N 3.11Å
120	P	38.3	Very low	53.9	Low	115 Å²	115	77.7 Å²	77.7	75%	0.747	43%	0.433	S	S	*	.			trans	-48.3	112.3	-172.3	19.3	-31.2	0	0	0	105.5	N118 L122	N118-P120 VanDerWaalsContact O-N 3.11Å; P120-L122 PolarHBondContact O-N 3.47Å
121	S	41.9	Very low	53.7	Low	96 Å²	96	75.2 Å²	75.2	67%	0.671	41%	0.413	S	S	*	.			trans	-14.9	101.4	179.4	43.6	0	0	0	0	108.5	H119 S123	H119-S121 PolarHBondContact O-N 3.11Å; S121-S123 VanDerWaalsContact C-N 3.34Å; S121-S123 WeakPolarHBondContact O-CA 3.36Å; S121-S123 PolarHBondContact O-N 3.2Å
122	L	41.7	Very low	53.3	Low	93 Å²	93	73 Å²	73	49%	0.487	40%	0.403	S	S	.	.			trans	-31.8	105.2	177.2	-89.9	155.4	0	0	0	105.9	P120 S124 L275	P120-L122 PolarHBondContact O-N 3.47Å; L122-S124 VanDerWaalsContact C-N 3.3Å; L122-S124 WeakPolarHBondContact O-CA 3.36Å; L122-S124 PolarHBondContact O-N 3.07Å; L122-L275 HydrophobicContact CB-CD1 4.4Å; L122-L275 HydrophobicContact CD1-CD1 3.82Å
123	S	43.2	Very low	53.7	Low	55 Å²	55	71.7 Å²	71.7	39%	0.385	40%	0.396	S	S	.	.			trans	-49	102.5	-159.3	52.5	0	0	0	0	106.9	S121 I125 Q272	S121-S123 VanDerWaalsContact C-N 3.34Å; S121-S123 WeakPolarHBondContact O-CA 3.36Å; S121-S123 PolarHBondContact O-N 3.2Å; S123-I125 PolarHBondContact O-N 3.16Å; S123-Q272 PolarHBondContact O-OE1 2.9Å
124	S	52.7	Low	53.9	Low	78 Å²	78	68.9 Å²	68.9	55%	0.545	38%	0.379	S	S	.	.			trans	-67.6	114.6	-171	56.2	0	0	0	0	103	L122 K126	L122-S124 VanDerWaalsContact C-N 3.3Å; L122-S124 WeakPolarHBondContact O-CA 3.36Å; L122-S124 PolarHBondContact O-N 3.07Å; S124-K126 PolarHBondContact O-N 3.02Å
125	I	59.6	Low	54.4	Low	7 Å²	7	72 Å²	72	4%	0.036	38%	0.382	C	S	.	.			trans	-55.7	110.7	176.3	-71	171.7	0	0	0	105.6	S123 L127 V130 L243 I253 L269 Q272 V273 A276	S123-I125 PolarHBondContact O-N 3.16Å; I125-L127 HydrophobicContact CG2-CD2 4.27Å; I125-L127 PolarHBondContact O-N 2.91Å; I125-V130 HydrophobicContact CG2-CG2 3.37Å; I125-L243 HydrophobicContact CD1-CD1 4.45Å; I125-I253 HydrophobicContact CB-CD1 4.29Å; I125-I253 HydrophobicContact CD1-CD1 4.12Å; I125-I253 HydrophobicContact CD1-CG2 4.1Å; I125-I253 HydrophobicContact CG1-CD1 3.9Å; I125-I253 HydrophobicContact CG1-CG1 4.12Å; I125-I253 HydrophobicContact CG1-CG2 4.11Å; I125-I253 HydrophobicContact CG2-CD1 3.54Å; I125-I253 HydrophobicContact CG2-CG1 4.29Å; I125-L269 HydrophobicContact CD1-CD1 3.44Å; I125-L269 VanDerWaalsContact CD1-CD1 3.44Å; I125-Q272 HydrophobicContact CD1-CB 3.85Å; I125-Q272 HydrophobicContact CG1-CB 4.18Å; I125-V273 HydrophobicContact CD1-CG2 4.21Å; I125-A276 VanDerWaalsContact O-CB 3.31Å; I125-A276 WeakPolarHBondContact O-CB 3.41Å
126	K	65.5	Low	54.8	Low	128 Å²	128	71 Å²	71	56%	0.557	38%	0.38	S	S	*	.			trans	-66.1	99.9	172.5	-72.1	-171.2	177.4	-173.4	0	106.4	S124 G128 S129 V130	S124-K126 PolarHBondContact O-N 3.02Å; K126-G128 PolarHBondContact O-N 2.89Å; K126-S129 WeakPolarHBondContact CB-OG 3.28Å; K126-S129 PolarHBondContact O-N 3.03Å; K126-V130 WeakPolarHBondContact O-CG2 3.32Å; K126-V130 PolarHBondContact O-N 3.44Å
127	L	64.3	Low	54.9	Low	6 Å²	6	75 Å²	75	3%	0.031	39%	0.388	C	S	.	.	H	α-helix	trans	-61.5	-28.9	-177.5	-69.9	169.9	0	0	0	110.2	I125 V130 Y131 L162 L165 A276 I277 E571	I125-L127 HydrophobicContact CG2-CD2 4.27Å; I125-L127 PolarHBondContact O-N 2.91Å; L127-V130 PolarHBondContact O-N 3.3Å; L127-Y131 WeakPolarHBondContact O-CB 3.36Å; L127-Y131 PolarHBondContact O-N 3.36Å; L127-L162 HydrophobicContact CD2-CD2 3.79Å; L127-L165 HydrophobicContact CD1-CD2 3.99Å; L127-A276 HydrophobicContact CD1-CB 3.81Å; L127-A276 HydrophobicContact CD2-CB 4.48Å; L127-A276 HydrophobicContact CG-CB 3.86Å; L127-I277 HydrophobicContact CD1-CG1 4.16Å; L127-E571 PolarHBondContact N-OE1 2.91Å; L127-E571 VanDerWaalsContact N-OE1 3.16Å
128	G	63.2	Low	55.2	Low	2 Å²	2	68 Å²	68	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-59.6	-49.2	169.6	0	0	0	0	0	113.1	K126 V130 Y131 A132 E571	K126-G128 PolarHBondContact O-N 2.89Å; G128-V130 PolarHBondContact O-N 2.85Å; G128-Y131 PolarHBondContact O-N 3.4Å; G128-A132 WeakPolarHBondContact O-CB 3.23Å; G128-A132 PolarHBondContact O-N 3.14Å; G128-E571 PolarHBondContact N-OE1 2.86Å; G128-E571 VanDerWaalsContact N-OE1 3.16Å
129	S	64.6	Low	55.5	Low	60 Å²	60	65.5 Å²	65.5	42%	0.42	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-37.9	177.2	-53.8	0	0	0	0	112.3	K126 Y131 A132 W133	K126-S129 WeakPolarHBondContact CB-OG 3.28Å; K126-S129 PolarHBondContact O-N 3.03Å; S129-Y131 VanDerWaalsContact C-N 3.32Å; S129-Y131 PolarHBondContact O-N 2.96Å; S129-A132 PolarHBondContact O-N 3.15Å; S129-W133 WeakPolarHBondContact O-CB 3.1Å; S129-W133 PolarHBondContact O-N 3.32Å
130	V	64.3	Low	56	Low	2 Å²	2	61.3 Å²	61.3	1%	0.012	36%	0.362	C	S	.	.	H	α-helix	trans	-61.5	-42.4	173.8	176.9	0	0	0	0	111.6	I125 K126 L127 G128 A134 L158 L162 L243 I250 I253	I125-V130 HydrophobicContact CG2-CG2 3.37Å; K126-V130 WeakPolarHBondContact O-CG2 3.32Å; K126-V130 PolarHBondContact O-N 3.44Å; L127-V130 PolarHBondContact O-N 3.3Å; G128-V130 PolarHBondContact O-N 2.85Å; V130-A134 WeakPolarHBondContact O-CB 3.15Å; V130-A134 PolarHBondContact O-N 2.67Å; V130-L158 HydrophobicContact CG1-CD2 3.59Å; V130-L158 HydrophobicContact CG1-CG 4.22Å; V130-L162 HydrophobicContact CB-CD1 4.41Å; V130-L162 HydrophobicContact CG1-CD1 3.91Å; V130-L243 HydrophobicContact CG1-CD2 4.11Å; V130-I250 HydrophobicContact CG1-CD1 4.39Å; V130-I250 HydrophobicContact CG2-CG2 4.38Å; V130-I253 HydrophobicContact CG2-CD1 3.44Å; V130-I253 VanDerWaalsContact CG2-CD1 3.44Å; V130-I253 HydrophobicContact CG2-CG1 4.48Å
131	Y	65.5	Low	56.2	Low	17 Å²	17	62.9 Å²	62.9	7%	0.067	36%	0.364	C	S	.	.	H	α-helix	trans	-70.3	-42.7	177.7	178.6	-91.9	0	0	0	112.4	L127 G128 S129 W133 A134 R135 C159 L162 W578	L127-Y131 WeakPolarHBondContact O-CB 3.36Å; L127-Y131 PolarHBondContact O-N 3.36Å; G128-Y131 PolarHBondContact O-N 3.4Å; S129-Y131 VanDerWaalsContact C-N 3.32Å; S129-Y131 PolarHBondContact O-N 2.96Å; Y131-W133 VanDerWaalsContact C-N 3.31Å; Y131-W133 PolarHBondContact O-N 2.94Å; Y131-A134 CarbonylContact O-C 3.58Å; Y131-A134 PolarHBondContact O-N 2.91Å; Y131-A134 VanDerWaalsContact O-N 3.14Å; Y131-R135 HydrophobicContact CE1-CB 4.42Å; Y131-R135 VanDerWaalsContact O-CB 3.23Å; Y131-R135 WeakPolarHBondContact O-CB 3.5Å; Y131-R135 PolarHBondContact O-N 3.36Å; Y131-C159 HydrophobicContact CD2-CB 4.35Å; Y131-C159 HydrophobicContact CE2-CB 4.08Å; Y131-L162 HydrophobicContact CD2-CB 4.18Å; Y131-L162 HydrophobicContact CD2-CD1 4.41Å; Y131-W578 AromaticContact CD1-CD2 3.7Å; Y131-W578 HydrophobicContact CD1-CD2 3.7Å; Y131-W578 AromaticContact CD1-CE2 3.08Å; Y131-W578 HydrophobicContact CD1-CE3 4.18Å; Y131-W578 HydrophobicContact CD1-CG 4.43Å; Y131-W578 AromaticContact CD1-CH2 3.83Å; Y131-W578 HydrophobicContact CD1-CH2 3.83Å; Y131-W578 AromaticContact CD1-CZ2 3.21Å; Y131-W578 HydrophobicContact CD1-CZ2 3.21Å; Y131-W578 HydrophobicContact CD1-CZ3 4.24Å; Y131-W578 AromaticContact CD1-NE1 3.3Å; Y131-W578 VanDerWaalsContact CD1-NE1 3.3Å; Y131-W578 AromaticContact CD2-CD2 3.8Å; Y131-W578 HydrophobicContact CD2-CD2 3.8Å; Y131-W578 AromaticContact CD2-CE2 3.86Å; Y131-W578 AromaticContact CD2-CE3 3.42Å; Y131-W578 HydrophobicContact CD2-CE3 3.42Å; Y131-W578 VanDerWaalsContact CD2-CE3 3.42Å; Y131-W578 AromaticContact CD2-CH2 3.39Å; Y131-W578 HydrophobicContact CD2-CH2 3.39Å; Y131-W578 AromaticContact CD2-CZ2 3.72Å; Y131-W578 HydrophobicContact CD2-CZ2 3.72Å; Y131-W578 AromaticContact CD2-CZ3 3.2Å; Y131-W578 HydrophobicContact CD2-CZ3 3.2Å; Y131-W578 AromaticContact CE1-CD1 3.66Å; Y131-W578 AromaticContact CE1-CD2 3.49Å; Y131-W578 HydrophobicContact CE1-CD2 3.49Å; Y131-W578 VanDerWaalsContact CE1-CD2 3.49Å; Y131-W578 AromaticContact CE1-CE2 3.31Å; Y131-W578 HydrophobicContact CE1-CE3 4.11Å; Y131-W578 AromaticContact CE1-CG 3.84Å; Y131-W578 HydrophobicContact CE1-CG 3.84Å; Y131-W578 AromaticContact CE1-CZ2 3.93Å; Y131-W578 HydrophobicContact CE1-CZ2 3.93Å; Y131-W578 AromaticContact CE1-NE1 3.23Å; Y131-W578 AromaticContact CE2-CD2 3.6Å; Y131-W578 HydrophobicContact CE2-CD2 3.6Å; Y131-W578 AromaticContact CE2-CE3 3.32Å; Y131-W578 HydrophobicContact CE2-CE3 3.32Å; Y131-W578 HydrophobicContact CE2-CG 4.36Å; Y131-W578 HydrophobicContact CE2-CH2 4.19Å; Y131-W578 HydrophobicContact CE2-CZ2 4.36Å; Y131-W578 AromaticContact CE2-CZ3 3.66Å; Y131-W578 HydrophobicContact CE2-CZ3 3.66Å; Y131-W578 AromaticContact CG-CD2 3.83Å; Y131-W578 HydrophobicContact CG-CD2 3.83Å; Y131-W578 AromaticContact CG-CE2 3.37Å; Y131-W578 AromaticContact CG-CE3 3.84Å; Y131-W578 HydrophobicContact CG-CE3 3.84Å; Y131-W578 AromaticContact CG-CH2 3.15Å; Y131-W578 HydrophobicContact CG-CH2 3.15Å; Y131-W578 AromaticContact CG-CZ2 3.06Å; Y131-W578 HydrophobicContact CG-CZ2 3.06Å; Y131-W578 AromaticContact CG-CZ3 3.53Å; Y131-W578 HydrophobicContact CG-CZ3 3.53Å; Y131-W578 AromaticContact CZ-CD2 3.42Å; Y131-W578 VanDerWaalsContact CZ-CD2 3.42Å; Y131-W578 AromaticContact CZ-CE2 3.77Å; Y131-W578 AromaticContact CZ-CE3 3.69Å; Y131-W578 AromaticContact CZ-CG 3.79Å; Y131-W578 AromaticContact CZ-NE1 3.97Å
132	A	61.6	Low	56.3	Low	31 Å²	31	64.3 Å²	64.3	26%	0.256	36%	0.359	S	S	.	.	H	α-helix	trans	-56.5	-49.1	174.3	0	0	0	0	0	110.2	G128 S129 A134 R135 E136	G128-A132 WeakPolarHBondContact O-CB 3.23Å; G128-A132 PolarHBondContact O-N 3.14Å; S129-A132 PolarHBondContact O-N 3.15Å; A132-A134 PolarHBondContact O-N 2.8Å; A132-R135 PolarHBondContact O-N 3.12Å; A132-E136 WeakPolarHBondContact O-CG 3.48Å; A132-E136 PolarHBondContact O-N 3.31Å
133	W	67.1	Low	56.8	Low	34 Å²	34	66.7 Å²	66.7	13%	0.129	37%	0.372	C	S	.	.	H	α-helix	trans	-60.4	-42.6	173.9	178.4	85.2	0	0	0	112.3	S129 Y131 R135 L151 R155 I246 L249 I250	S129-W133 WeakPolarHBondContact O-CB 3.1Å; S129-W133 PolarHBondContact O-N 3.32Å; Y131-W133 VanDerWaalsContact C-N 3.31Å; Y131-W133 PolarHBondContact O-N 2.94Å; W133-R135 VanDerWaalsContact C-N 3.29Å; W133-R135 PolarHBondContact O-N 3.15Å; W133-L151 HydrophobicContact CH2-CD1 4.32Å; W133-R155 HydrophobicContact CH2-CG 3.75Å; W133-R155 HydrophobicContact CZ3-CG 3.61Å; W133-R155 PolarHBondContact O-NH2 3.43Å; W133-I246 HydrophobicContact CH2-CG2 3.22Å; W133-I246 HydrophobicContact CZ2-CG2 4.21Å; W133-I246 HydrophobicContact CZ3-CG2 3.53Å; W133-L249 HydrophobicContact CH2-CB 4.27Å; W133-L249 HydrophobicContact CZ2-CB 3.81Å; W133-L249 PolarHBondContact NE1-O 2.8Å; W133-L249 VanDerWaalsContact NE1-O 3.16Å; W133-I250 HydrophobicContact CD2-CG1 3.94Å; W133-I250 HydrophobicContact CD2-CG2 4.5Å; W133-I250 HydrophobicContact CE3-CD1 4.26Å; W133-I250 HydrophobicContact CE3-CG1 3.72Å; W133-I250 HydrophobicContact CG-CG2 4.41Å; W133-I250 HydrophobicContact CH2-CG1 4.15Å; W133-I250 HydrophobicContact CZ2-CG1 4.34Å; W133-I250 HydrophobicContact CZ3-CD1 4.26Å; W133-I250 HydrophobicContact CZ3-CG1 3.81Å
134	A	61.7	Low	56.9	Low	6 Å²	6	69.9 Å²	69.9	5%	0.05	38%	0.384	C	S	.	.	H	α-helix	trans	-70.8	-25.7	179.6	0	0	0	0	0	112.9	V130 Y131 A132 R155 L158 C159	V130-A134 WeakPolarHBondContact O-CB 3.15Å; V130-A134 PolarHBondContact O-N 2.67Å; Y131-A134 CarbonylContact O-C 3.58Å; Y131-A134 PolarHBondContact O-N 2.91Å; Y131-A134 VanDerWaalsContact O-N 3.14Å; A132-A134 PolarHBondContact O-N 2.8Å; A134-R155 HydrophobicContact CB-CB 4.45Å; A134-L158 HydrophobicContact CB-CD2 4.17Å; A134-C159 WeakPolarHBondContact CB-SG 3.46Å
135	R	62.7	Low	56.6	Low	123 Å²	123	73.5 Å²	73.5	46%	0.464	40%	0.397	S	S	.	.	H	α-helix	trans	-81.6	-35.1	177	-179.2	173.7	175.1	158	-9.7	112.6	Y131 A132 W133 Q137	Y131-R135 HydrophobicContact CE1-CB 4.42Å; Y131-R135 VanDerWaalsContact O-CB 3.23Å; Y131-R135 WeakPolarHBondContact O-CB 3.5Å; Y131-R135 PolarHBondContact O-N 3.36Å; A132-R135 PolarHBondContact O-N 3.12Å; W133-R135 VanDerWaalsContact C-N 3.29Å; W133-R135 PolarHBondContact O-N 3.15Å; R135-Q137 PolarHBondContact O-N 2.85Å
136	E	63	Low	56.4	Low	116 Å²	116	80.5 Å²	80.5	54%	0.542	43%	0.429	S	S	.	.	S	Bend	trans	-53.6	112.8	176	-83.2	-176.9	-176	0	0	109.4	A132 S138 R155	A132-E136 WeakPolarHBondContact O-CG 3.48Å; A132-E136 PolarHBondContact O-N 3.31Å; E136-S138 PolarHBondContact O-N 3.01Å; E136-R155 PolarHBondContact O-NH1 2.83Å; E136-R155 PolarHBondContact O-NH2 3.33Å
137	Q	53.5	Low	55.5	Low	145 Å²	145	81 Å²	81	68%	0.678	44%	0.436	S	S	*	.			trans	-73.6	74.3	166.2	-62.5	-65.5	-22.8	0	0	106.3	R135 G139	R135-Q137 PolarHBondContact O-N 2.85Å; Q137-G139 PolarHBondContact O-N 3.36Å
138	S	49	Very low	54.9	Low	57 Å²	57	81.9 Å²	81.9	40%	0.399	44%	0.442	S	S	.	.			trans	-55	111.9	179.1	-168.1	0	0	0	0	107.1	E136 A140	E136-S138 PolarHBondContact O-N 3.01Å; S138-A140 PolarHBondContact O-N 2.77Å; S138-A140 WeakPolarHBondContact OG-CB 3.5Å
139	G	45.9	Very low	54.9	Low	73 Å²	73	83.8 Å²	83.8	75%	0.753	46%	0.455	S	S	*	.			trans	-68.3	20.2	167.4	0	0	0	0	0	112	Q137 N141	Q137-G139 PolarHBondContact O-N 3.36Å; G139-N141 PolarHBondContact O-N 3.24Å
140	A	46.9	Very low	55.1	Low	43 Å²	43	84.5 Å²	84.5	36%	0.355	45%	0.454	S	S	.	.			trans	-59.6	111.6	168.6	0	0	0	0	0	108.1	S138 F142	S138-A140 PolarHBondContact O-N 2.77Å; S138-A140 WeakPolarHBondContact OG-CB 3.5Å; A140-F142 HydrophobicContact CB-CD2 3.61Å; A140-F142 HydrophobicContact CB-CE2 3.2Å; A140-F142 HydrophobicContact CB-CG 4.48Å; A140-F142 HydrophobicContact CB-CZ 3.76Å; A140-F142 WeakPolarHBondContact O-CD2 3.33Å; A140-F142 PolarHBondContact O-N 3.1Å
141	N	42.9	Very low	55.3	Low	148 Å²	148	86.1 Å²	86.1	79%	0.791	46%	0.462	S	S	*	.			trans	-60	76.2	170.2	-80.1	-30.1	0	0	0	109.9	G139 N143	G139-N141 PolarHBondContact O-N 3.24Å; N141-N143 PolarHBondContact O-N 3.04Å
142	F	44.4	Very low	55.4	Low	127 Å²	127	92.4 Å²	92.4	56%	0.557	49%	0.486	S	S	*	.			trans	-85.1	97.3	167.6	-66.2	-68.4	0	0	0	106.7	A140 D144 C148	A140-F142 HydrophobicContact CB-CD2 3.61Å; A140-F142 HydrophobicContact CB-CE2 3.2Å; A140-F142 HydrophobicContact CB-CG 4.48Å; A140-F142 HydrophobicContact CB-CZ 3.76Å; A140-F142 WeakPolarHBondContact O-CD2 3.33Å; A140-F142 PolarHBondContact O-N 3.1Å; F142-D144 PolarHBondContact O-N 2.84Å; F142-C148 WeakPolarHBondContact CB-SG 3.34Å; F142-C148 PolarHBondContact O-SG 3.35Å
143	N	50.5	Low	56	Low	142 Å²	142	96 Å²	96	76%	0.759	50%	0.496	S	S	*	.			trans	-71.8	10.3	-176.7	-82.9	-26.3	0	0	0	114.7	N141	N141-N143 PolarHBondContact O-N 3.04Å
144	D	46.9	Very low	56.2	Low	122 Å²	122	96 Å²	96	65%	0.652	50%	0.498	S	S	*	.			trans	-101.5	84.8	173.4	-69.2	-32	0	0	0	110.7	F142 Q146 M147 C148	F142-D144 PolarHBondContact O-N 2.84Å; D144-Q146 PolarHBondContact O-N 3.16Å; D144-M147 HydrophobicContact CB-CB 4.42Å; D144-M147 PolarHBondContact O-N 3.46Å; D144-C148 WeakPolarHBondContact O-CB 3.41Å; D144-C148 PolarHBondContact O-N 3.26Å; D144-C148 PolarHBondContact O-SG 3.44Å
145	L	46.1	Very low	56.7	Low	154 Å²	154	96.9 Å²	96.9	81%	0.806	50%	0.5	S	S	*	.	H	α-helix	trans	-49.3	-33.9	-172.4	-77.6	101	0	0	0	114.6	S149	L145-S149 PolarHBondContact O-N 3.46Å
146	Q	54.5	Low	57.1	Low	154 Å²	154	95.7 Å²	95.7	72%	0.72	50%	0.503	S	S	*	.	H	α-helix	trans	-78.6	-48.7	-174.8	-162.6	158.5	1.7	0	0	112.4	D144 C148 S149 D150	D144-Q146 PolarHBondContact O-N 3.16Å; Q146-C148 PolarHBondContact O-N 2.92Å; Q146-S149 PolarHBondContact O-N 3.13Å; Q146-S149 PolarHBondContact O-OG 3Å; Q146-D150 PolarHBondContact O-N 2.99Å
147	M	47.6	Very low	57.8	Low	140 Å²	140	96.5 Å²	96.5	69%	0.69	50%	0.501	S	S	*	.	H	α-helix	trans	-61.1	-34.5	172.8	-72.3	-66.9	135.5	0	0	111.5	D144 L151	D144-M147 HydrophobicContact CB-CB 4.42Å; D144-M147 PolarHBondContact O-N 3.46Å; M147-L151 VanDerWaalsContact O-CB 3.25Å; M147-L151 WeakPolarHBondContact O-CB 3.49Å; M147-L151 PolarHBondContact O-N 3.19Å
148	C	50.7	Low	58.8	Low	23 Å²	23	89.6 Å²	89.6	16%	0.155	47%	0.469	C	S	.	.	H	α-helix	trans	-66.2	-38.1	177.1	-68.7	0	0	0	0	113.4	F142 D144 Q146 R152	F142-C148 WeakPolarHBondContact CB-SG 3.34Å; F142-C148 PolarHBondContact O-SG 3.35Å; D144-C148 WeakPolarHBondContact O-CB 3.41Å; D144-C148 PolarHBondContact O-N 3.26Å; D144-C148 PolarHBondContact O-SG 3.44Å; Q146-C148 PolarHBondContact O-N 2.92Å; C148-R152 WeakPolarHBondContact O-CB 3.4Å; C148-R152 PolarHBondContact O-N 3.2Å
149	S	63.2	Low	60	Low	43 Å²	43	87.8 Å²	87.8	30%	0.301	46%	0.455	S	S	.	.	H	α-helix	trans	-67.7	-41.6	-178.9	80.6	0	0	0	0	111.5	L145 Q146 K153	L145-S149 PolarHBondContact O-N 3.46Å; Q146-S149 PolarHBondContact O-N 3.13Å; Q146-S149 PolarHBondContact O-OG 3Å; S149-K153 WeakPolarHBondContact O-CB 3.2Å; S149-K153 WeakPolarHBondContact O-CD 3.25Å; S149-K153 WeakPolarHBondContact O-CG 3.45Å; S149-K153 PolarHBondContact O-N 3.36Å
150	D	68.5	Low	61.3	Low	74 Å²	74	89.6 Å²	89.6	40%	0.396	45%	0.445	S	S	.	.	H	α-helix	trans	-74.8	-38.3	180	-68.5	-24.5	0	0	0	111.4	Q146 K153 N154	Q146-D150 PolarHBondContact O-N 2.99Å; D150-K153 PolarHBondContact O-N 3.36Å; D150-K153 IonicContact OD1-NZ 2.88Å; D150-N154 VanDerWaalsContact O-CB 3.3Å; D150-N154 WeakPolarHBondContact O-CB 3.32Å; D150-N154 PolarHBondContact O-N 3.45Å; D150-N154 PolarHBondContact O-ND2 3.44Å
151	L	69	Low	62.7	Low	36 Å²	36	90.1 Å²	90.1	19%	0.188	44%	0.439	C	S	.	.	H	α-helix	trans	-61.8	-46.7	171.8	-176.7	63.2	0	0	0	111.4	W133 M147 K153 N154 R155 I246 L249	W133-L151 HydrophobicContact CH2-CD1 4.32Å; M147-L151 VanDerWaalsContact O-CB 3.25Å; M147-L151 WeakPolarHBondContact O-CB 3.49Å; M147-L151 PolarHBondContact O-N 3.19Å; L151-K153 PolarHBondContact O-N 2.9Å; L151-N154 PolarHBondContact O-N 3.36Å; L151-R155 HydrophobicContact CD1-CG 4.46Å; L151-R155 WeakPolarHBondContact O-CB 3.45Å; L151-R155 VanDerWaalsContact O-CG 3.25Å; L151-R155 WeakPolarHBondContact O-CG 3.33Å; L151-R155 PolarHBondContact O-N 2.99Å; L151-I246 HydrophobicContact CD1-CD1 3.88Å; L151-I246 HydrophobicContact CD1-CG1 3.82Å; L151-I246 HydrophobicContact CD1-CG2 4Å; L151-L249 HydrophobicContact CD1-CD1 3.56Å; L151-L249 HydrophobicContact CD2-CD1 3.71Å; L151-L249 HydrophobicContact CG-CD1 4.3Å
152	R	68.5	Low	64.2	Low	149 Å²	149	83.1 Å²	83.1	56%	0.562	40%	0.401	S	S	*	.	H	α-helix	trans	-63	-42.4	177.8	-171.4	-179	-76.5	130.2	-3.7	111.5	C148 R155 L156	C148-R152 WeakPolarHBondContact O-CB 3.4Å; C148-R152 PolarHBondContact O-N 3.2Å; R152-R155 PolarHBondContact O-N 3.46Å; R152-L156 PolarHBondContact O-N 2.92Å
153	K	73.2	Confident	65.4	Low	107 Å²	107	78 Å²	78	47%	0.465	38%	0.381	S	S	.	.	H	α-helix	trans	-61.4	-44.1	173.5	-74.8	168	-168.3	164.3	0	111.5	S149 D150 L151 L156 R157	S149-K153 WeakPolarHBondContact O-CB 3.2Å; S149-K153 WeakPolarHBondContact O-CD 3.25Å; S149-K153 WeakPolarHBondContact O-CG 3.45Å; S149-K153 PolarHBondContact O-N 3.36Å; D150-K153 PolarHBondContact O-N 3.36Å; D150-K153 IonicContact OD1-NZ 2.88Å; L151-K153 PolarHBondContact O-N 2.9Å; K153-L156 PolarHBondContact O-N 2.88Å; K153-R157 WeakPolarHBondContact O-CB 3.34Å; K153-R157 VanDerWaalsContact O-CG 3.29Å; K153-R157 WeakPolarHBondContact O-CG 3.5Å; K153-R157 PolarHBondContact O-N 3.27Å
154	N	72.1	Confident	66.5	Low	33 Å²	33	78.2 Å²	78.2	18%	0.176	37%	0.372	C	S	.	.	H	α-helix	trans	-69.2	-38	-179.9	-71.1	-22.4	0	0	0	112.2	D150 L151 R157 L158 L242 I246	D150-N154 VanDerWaalsContact O-CB 3.3Å; D150-N154 WeakPolarHBondContact O-CB 3.32Å; D150-N154 PolarHBondContact O-N 3.45Å; D150-N154 PolarHBondContact O-ND2 3.44Å; L151-N154 PolarHBondContact O-N 3.36Å; N154-R157 PolarHBondContact O-N 3.12Å; N154-L158 VanDerWaalsContact O-CB 3.32Å; N154-L158 WeakPolarHBondContact O-CB 3.36Å; N154-L158 PolarHBondContact O-N 2.97Å; N154-L242 HydrophobicContact CB-CD2 4.44Å; N154-I246 HydrophobicContact CB-CD1 3.46Å; N154-I246 VanDerWaalsContact CB-CD1 3.46Å
155	R	72.3	Confident	67.8	Low	25 Å²	25	72.6 Å²	72.6	9%	0.094	34%	0.341	C	S	.	.	H	α-helix	trans	-59.5	-46.4	171.3	-72.6	172.2	83.9	-156.3	11.6	111.4	W133 A134 E136 L151 R152 R157 L158 C159	W133-R155 HydrophobicContact CH2-CG 3.75Å; W133-R155 HydrophobicContact CZ3-CG 3.61Å; W133-R155 PolarHBondContact O-NH2 3.43Å; A134-R155 HydrophobicContact CB-CB 4.45Å; E136-R155 PolarHBondContact O-NH1 2.83Å; E136-R155 PolarHBondContact O-NH2 3.33Å; L151-R155 HydrophobicContact CD1-CG 4.46Å; L151-R155 WeakPolarHBondContact O-CB 3.45Å; L151-R155 VanDerWaalsContact O-CG 3.25Å; L151-R155 WeakPolarHBondContact O-CG 3.33Å; L151-R155 PolarHBondContact O-N 2.99Å; R152-R155 PolarHBondContact O-N 3.46Å; R155-R157 PolarHBondContact O-N 2.92Å; R155-L158 WeakPolarHBondContact O-CB 3.3Å; R155-L158 PolarHBondContact O-N 3.21Å; R155-C159 PolarHBondContact O-N 3.47Å; R155-C159 PolarHBondContact O-SG 2.99Å
156	L	71.3	Confident	68.9	Low	99 Å²	99	65.6 Å²	65.6	52%	0.518	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-43.3	176.5	-166	77	0	0	0	112	R152 K153 L158 C159 Q160	R152-L156 PolarHBondContact O-N 2.92Å; K153-L156 PolarHBondContact O-N 2.88Å; L156-L158 VanDerWaalsContact C-N 3.31Å; L156-L158 PolarHBondContact O-N 2.88Å; L156-C159 PolarHBondContact O-N 2.86Å; L156-Q160 WeakPolarHBondContact O-CG 3.44Å; L156-Q160 PolarHBondContact O-N 3.32Å
157	R	76.5	Confident	69.5	Low	133 Å²	133	65.8 Å²	65.8	50%	0.502	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-39.9	175	-75.1	173.4	175.5	-178	-2	111.6	K153 N154 R155 Q160 K161 L242	K153-R157 WeakPolarHBondContact O-CB 3.34Å; K153-R157 VanDerWaalsContact O-CG 3.29Å; K153-R157 WeakPolarHBondContact O-CG 3.5Å; K153-R157 PolarHBondContact O-N 3.27Å; N154-R157 PolarHBondContact O-N 3.12Å; R155-R157 PolarHBondContact O-N 2.92Å; R157-Q160 PolarHBondContact O-N 3.05Å; R157-K161 WeakPolarHBondContact O-CG 3.49Å; R157-K161 PolarHBondContact O-N 2.7Å; R157-L242 HydrophobicContact CB-CD1 3.93Å; R157-L242 HydrophobicContact CB-CD2 4.33Å
158	L	75.4	Confident	70.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-49.1	176.1	-175.3	61.9	0	0	0	110.8	V130 A134 N154 R155 L156 Q160 K161 L162 I239 L243	V130-L158 HydrophobicContact CG1-CD2 3.59Å; V130-L158 HydrophobicContact CG1-CG 4.22Å; A134-L158 HydrophobicContact CB-CD2 4.17Å; N154-L158 VanDerWaalsContact O-CB 3.32Å; N154-L158 WeakPolarHBondContact O-CB 3.36Å; N154-L158 PolarHBondContact O-N 2.97Å; R155-L158 WeakPolarHBondContact O-CB 3.3Å; R155-L158 PolarHBondContact O-N 3.21Å; L156-L158 VanDerWaalsContact C-N 3.31Å; L156-L158 PolarHBondContact O-N 2.88Å; L158-Q160 VanDerWaalsContact C-N 3.31Å; L158-Q160 PolarHBondContact O-N 2.92Å; L158-K161 PolarHBondContact O-N 2.92Å; L158-K161 VanDerWaalsContact O-N 3.14Å; L158-L162 HydrophobicContact CD1-CD1 4.07Å; L158-L162 HydrophobicContact CD1-CG 4.16Å; L158-L162 HydrophobicContact CG-CD1 3.88Å; L158-L162 HydrophobicContact CG-CG 4.37Å; L158-L162 WeakPolarHBondContact O-CB 3.21Å; L158-L162 VanDerWaalsContact O-CG 3.32Å; L158-L162 WeakPolarHBondContact O-CG 3.31Å; L158-L162 PolarHBondContact O-N 3.23Å; L158-I239 HydrophobicContact CD1-CG2 4.16Å; L158-L243 HydrophobicContact CD1-CD2 4.29Å; L158-L243 HydrophobicContact CD1-CG 4.34Å; L158-L243 HydrophobicContact CD2-CD2 3.82Å
159	C	73.3	Confident	71	Confident	18 Å²	18	59.8 Å²	59.8	12%	0.122	27%	0.269	C	S	.	.	H	α-helix	trans	-56.1	-42.6	173.9	-70.6	0	0	0	0	112.8	Y131 A134 R155 L156 S163	Y131-C159 HydrophobicContact CD2-CB 4.35Å; Y131-C159 HydrophobicContact CE2-CB 4.08Å; A134-C159 WeakPolarHBondContact CB-SG 3.46Å; R155-C159 PolarHBondContact O-N 3.47Å; R155-C159 PolarHBondContact O-SG 2.99Å; L156-C159 PolarHBondContact O-N 2.86Å; C159-S163 WeakPolarHBondContact O-CB 3.47Å; C159-S163 PolarHBondContact O-N 3.34Å; C159-S163 PolarHBondContact O-OG 2.91Å
160	Q	72.8	Confident	71.1	Confident	112 Å²	112	61.9 Å²	61.9	52%	0.523	27%	0.272	S	S	.	.	H	α-helix	trans	-66.2	-38.1	177.8	-73	175.3	-0.5	0	0	112.5	L156 R157 L158 S163 R164	L156-Q160 WeakPolarHBondContact O-CG 3.44Å; L156-Q160 PolarHBondContact O-N 3.32Å; R157-Q160 PolarHBondContact O-N 3.05Å; L158-Q160 VanDerWaalsContact C-N 3.31Å; L158-Q160 PolarHBondContact O-N 2.92Å; Q160-S163 WeakPolarHBondContact CA-OG 3.34Å; Q160-S163 PolarHBondContact O-OG 3.39Å; Q160-R164 WeakPolarHBondContact O-CB 3.44Å; Q160-R164 PolarHBondContact O-N 3.29Å
161	K	76.4	Confident	70.5	Confident	53 Å²	53	60.7 Å²	60.7	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-74	-40.7	177.4	-72	-173.5	-165.6	-69.8	0	112.3	R157 L158 R164 L165 Q238 I239 L242	R157-K161 WeakPolarHBondContact O-CG 3.49Å; R157-K161 PolarHBondContact O-N 2.7Å; L158-K161 PolarHBondContact O-N 2.92Å; L158-K161 VanDerWaalsContact O-N 3.14Å; K161-R164 CarbonylContact O-C 3.4Å; K161-R164 WeakPolarHBondContact O-CB 3.49Å; K161-R164 PolarHBondContact O-N 2.91Å; K161-L165 PolarHBondContact O-N 3.5Å; K161-Q238 HydrophobicContact CD-CB 3.83Å; K161-I239 HydrophobicContact CB-CG1 4.27Å; K161-L242 HydrophobicContact CD-CD1 3.65Å; K161-L242 VanDerWaalsContact CE-CD1 3.5Å
162	L	74.6	Confident	70.2	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-65.3	-41.6	175.3	-66.3	174.3	0	0	0	111	L127 V130 Y131 L158 R164 L165 V166 I239 W578	L127-L162 HydrophobicContact CD2-CD2 3.79Å; V130-L162 HydrophobicContact CB-CD1 4.41Å; V130-L162 HydrophobicContact CG1-CD1 3.91Å; Y131-L162 HydrophobicContact CD2-CB 4.18Å; Y131-L162 HydrophobicContact CD2-CD1 4.41Å; L158-L162 HydrophobicContact CD1-CD1 4.07Å; L158-L162 HydrophobicContact CD1-CG 4.16Å; L158-L162 HydrophobicContact CG-CD1 3.88Å; L158-L162 HydrophobicContact CG-CG 4.37Å; L158-L162 WeakPolarHBondContact O-CB 3.21Å; L158-L162 VanDerWaalsContact O-CG 3.32Å; L158-L162 WeakPolarHBondContact O-CG 3.31Å; L158-L162 PolarHBondContact O-N 3.23Å; L162-R164 VanDerWaalsContact C-N 3.3Å; L162-R164 PolarHBondContact O-N 2.82Å; L162-L165 WeakPolarHBondContact O-CB 3.4Å; L162-L165 PolarHBondContact O-N 3.44Å; L162-L165 VanDerWaalsContact O-N 3.16Å; L162-V166 WeakPolarHBondContact O-CG2 3.2Å; L162-V166 PolarHBondContact O-N 2.82Å; L162-I239 HydrophobicContact CD2-CD1 3.66Å; L162-I239 HydrophobicContact CD2-CG1 4.48Å; L162-W578 HydrophobicContact CB-CH2 4.11Å; L162-W578 HydrophobicContact CB-CZ3 3.55Å
163	S	70.7	Confident	69.7	Low	20 Å²	20	53.9 Å²	53.9	14%	0.14	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-28.5	171.9	61.6	0	0	0	0	113.6	C159 Q160 R167	C159-S163 WeakPolarHBondContact O-CB 3.47Å; C159-S163 PolarHBondContact O-N 3.34Å; C159-S163 PolarHBondContact O-OG 2.91Å; Q160-S163 WeakPolarHBondContact CA-OG 3.34Å; Q160-S163 PolarHBondContact O-OG 3.39Å; S163-R167 WeakPolarHBondContact O-CB 3.46Å; S163-R167 WeakPolarHBondContact O-CG 3.34Å; S163-R167 PolarHBondContact O-N 2.85Å; S163-R167 VanDerWaalsContact O-N 3.14Å; S163-R167 PolarHBondContact O-NE 3.46Å
164	R	72.7	Confident	68.9	Low	147 Å²	147	54.9 Å²	54.9	56%	0.555	25%	0.25	S	C	*	.	H	α-helix	trans	-70.1	-40.2	170.2	-175.6	175.2	177.9	142.9	-0.1	111.3	Q160 K161 L162 R167 L168 L235	Q160-R164 WeakPolarHBondContact O-CB 3.44Å; Q160-R164 PolarHBondContact O-N 3.29Å; K161-R164 CarbonylContact O-C 3.4Å; K161-R164 WeakPolarHBondContact O-CB 3.49Å; K161-R164 PolarHBondContact O-N 2.91Å; L162-R164 VanDerWaalsContact C-N 3.3Å; L162-R164 PolarHBondContact O-N 2.82Å; R164-R167 PolarHBondContact O-N 3.39Å; R164-L168 HydrophobicContact CG-CD1 4.02Å; R164-L168 HydrophobicContact CG-CG 4.26Å; R164-L168 WeakPolarHBondContact O-CB 3.22Å; R164-L168 VanDerWaalsContact O-CG 3.28Å; R164-L168 WeakPolarHBondContact O-CG 3.3Å; R164-L168 PolarHBondContact O-N 3.46Å; R164-L235 HydrophobicContact CB-CD1 4.39Å; R164-L235 HydrophobicContact CG-CD1 4.23Å
165	L	74.2	Confident	68	Low	3 Å²	3	59.1 Å²	59.1	2%	0.016	27%	0.269	C	S	.	.	H	α-helix	trans	-57	-52.1	173.8	178	72	0	0	0	110.6	L127 K161 L162 R167 L168 S169 F232 L235 I277	L127-L165 HydrophobicContact CD1-CD2 3.99Å; K161-L165 PolarHBondContact O-N 3.5Å; L162-L165 WeakPolarHBondContact O-CB 3.4Å; L162-L165 PolarHBondContact O-N 3.44Å; L162-L165 VanDerWaalsContact O-N 3.16Å; L165-R167 VanDerWaalsContact C-N 3.32Å; L165-R167 PolarHBondContact O-N 2.95Å; L165-L168 PolarHBondContact O-N 2.88Å; L165-L168 VanDerWaalsContact O-N 3.13Å; L165-S169 PolarHBondContact O-N 3.37Å; L165-S169 PolarHBondContact O-OG 2.92Å; L165-S169 VanDerWaalsContact O-OG 3.08Å; L165-F232 HydrophobicContact CD1-CD1 3.55Å; L165-F232 HydrophobicContact CD1-CE1 3.5Å; L165-F232 VanDerWaalsContact CD1-CE1 3.5Å; L165-L235 HydrophobicContact CB-CD1 4.33Å; L165-L235 HydrophobicContact CB-CD2 3.8Å; L165-L235 HydrophobicContact CD1-CD2 3.65Å; L165-L235 HydrophobicContact CG-CD2 4.18Å; L165-I277 HydrophobicContact CD1-CD1 4.3Å; L165-I277 HydrophobicContact CD1-CG1 4.08Å; L165-I277 HydrophobicContact CD1-CG2 3.91Å; L165-I277 HydrophobicContact CD2-CG1 3.83Å
166	V	69.2	Low	67.1	Low	8 Å²	8	59.7 Å²	59.7	5%	0.048	28%	0.276	C	S	.	.	H	α-helix	trans	-57.1	-45.6	178.1	174.9	0	0	0	0	111.2	L162 S169 K170 F280 M575 W578	L162-V166 WeakPolarHBondContact O-CG2 3.2Å; L162-V166 PolarHBondContact O-N 2.82Å; V166-S169 PolarHBondContact O-N 3.34Å; V166-K170 HydrophobicContact CG1-CD 4.34Å; V166-K170 WeakPolarHBondContact O-CB 3.41Å; V166-K170 WeakPolarHBondContact O-CG 3.29Å; V166-K170 PolarHBondContact O-N 2.68Å; V166-F280 HydrophobicContact CB-CZ 4.36Å; V166-F280 HydrophobicContact CG1-CZ 4.4Å; V166-F280 HydrophobicContact CG2-CE2 3.97Å; V166-F280 HydrophobicContact CG2-CZ 3.94Å; V166-M575 HydrophobicContact CG2-CG 4.19Å; V166-M575 HydrophobicContact CG2-SD 4.14Å; V166-W578 HydrophobicContact CG2-CD2 4.44Å; V166-W578 HydrophobicContact CG2-CE3 3.79Å; V166-W578 HydrophobicContact CG2-CH2 4.49Å; V166-W578 HydrophobicContact CG2-CZ3 3.8Å
167	R	67.5	Low	66.2	Low	158 Å²	158	59 Å²	59	60%	0.596	27%	0.27	S	S	*	.	H	α-helix	trans	-63.4	-42.1	176.2	-81.4	-177.1	-72	169.2	-6	113	S163 R164 L165 K170 S171	S163-R167 WeakPolarHBondContact O-CB 3.46Å; S163-R167 WeakPolarHBondContact O-CG 3.34Å; S163-R167 PolarHBondContact O-N 2.85Å; S163-R167 VanDerWaalsContact O-N 3.14Å; S163-R167 PolarHBondContact O-NE 3.46Å; R164-R167 PolarHBondContact O-N 3.39Å; L165-R167 VanDerWaalsContact C-N 3.32Å; L165-R167 PolarHBondContact O-N 2.95Å; R167-K170 PolarHBondContact O-N 2.9Å; R167-S171 VanDerWaalsContact O-CB 3.3Å; R167-S171 WeakPolarHBondContact O-CB 3.43Å; R167-S171 PolarHBondContact O-N 3.46Å; R167-S171 PolarHBondContact O-OG 3.43Å
168	L	65.5	Low	64.8	Low	28 Å²	28	57.3 Å²	57.3	15%	0.147	28%	0.278	C	S	.	.	H	α-helix	trans	-63.4	-44.7	177.9	-75.1	172.9	0	0	0	110.6	R164 L165 S171 S172 L228 V231 F232 L235	R164-L168 HydrophobicContact CG-CD1 4.02Å; R164-L168 HydrophobicContact CG-CG 4.26Å; R164-L168 WeakPolarHBondContact O-CB 3.22Å; R164-L168 VanDerWaalsContact O-CG 3.28Å; R164-L168 WeakPolarHBondContact O-CG 3.3Å; R164-L168 PolarHBondContact O-N 3.46Å; L165-L168 PolarHBondContact O-N 2.88Å; L165-L168 VanDerWaalsContact O-N 3.13Å; L168-S171 WeakPolarHBondContact CA-OG 3.34Å; L168-S171 PolarHBondContact O-N 2.79Å; L168-S171 PolarHBondContact O-OG 2.84Å; L168-S172 WeakPolarHBondContact O-CB 3.33Å; L168-S172 PolarHBondContact O-N 3.32Å; L168-L228 HydrophobicContact CD2-CD1 4.15Å; L168-V231 HydrophobicContact CD1-CG1 3.73Å; L168-F232 HydrophobicContact CB-CE1 4.35Å; L168-F232 HydrophobicContact CB-CZ 4.47Å; L168-L235 HydrophobicContact CD1-CD1 4.06Å
169	S	64.1	Low	63.4	Low	9 Å²	9	61.2 Å²	61.2	6%	0.063	30%	0.296	C	S	.	.	H	α-helix	trans	-62.1	-46.1	175.3	-56.5	0	0	0	0	112.3	L165 V166 S171 S172 K173 F280	L165-S169 PolarHBondContact O-N 3.37Å; L165-S169 PolarHBondContact O-OG 2.92Å; L165-S169 VanDerWaalsContact O-OG 3.08Å; V166-S169 PolarHBondContact O-N 3.34Å; S169-S171 VanDerWaalsContact C-N 3.34Å; S169-S171 PolarHBondContact O-N 3.25Å; S169-S172 PolarHBondContact O-N 3.39Å; S169-K173 PolarHBondContact O-N 2.89Å; S169-K173 VanDerWaalsContact O-N 3.15Å; S169-F280 WeakPolarHBondContact OG-CE1 3.13Å
170	K	64.8	Low	62.5	Low	86 Å²	86	65 Å²	65	37%	0.374	32%	0.321	S	S	.	.	H	α-helix	trans	-59.8	-42.1	174	-74.3	-173.1	177	-174.1	0	111.4	V166 R167 K173 Q174 D576	V166-K170 HydrophobicContact CG1-CD 4.34Å; V166-K170 WeakPolarHBondContact O-CB 3.41Å; V166-K170 WeakPolarHBondContact O-CG 3.29Å; V166-K170 PolarHBondContact O-N 2.68Å; R167-K170 PolarHBondContact O-N 2.9Å; K170-K173 PolarHBondContact O-N 3.39Å; K170-Q174 WeakPolarHBondContact O-CG 3.25Å; K170-Q174 PolarHBondContact O-N 2.74Å; K170-D576 IonicContact NZ-OD1 3.54Å; K170-D576 PolarHBondContact NZ-OD1 2.91Å
171	S	56.7	Low	61.6	Low	50 Å²	50	65.4 Å²	65.4	35%	0.35	33%	0.326	S	S	.	.	H	α-helix	trans	-71.1	-38.9	179.8	70.4	0	0	0	0	113.9	R167 L168 S169 K173 Q174 Q175	R167-S171 VanDerWaalsContact O-CB 3.3Å; R167-S171 WeakPolarHBondContact O-CB 3.43Å; R167-S171 PolarHBondContact O-N 3.46Å; R167-S171 PolarHBondContact O-OG 3.43Å; L168-S171 WeakPolarHBondContact CA-OG 3.34Å; L168-S171 PolarHBondContact O-N 2.79Å; L168-S171 PolarHBondContact O-OG 2.84Å; S169-S171 VanDerWaalsContact C-N 3.34Å; S169-S171 PolarHBondContact O-N 3.25Å; S171-K173 PolarHBondContact O-N 2.87Å; S171-Q174 PolarHBondContact O-N 2.9Å; S171-Q175 WeakPolarHBondContact O-CB 3.29Å; S171-Q175 PolarHBondContact O-N 2.88Å
172	S	61.4	Low	60.7	Low	2 Å²	2	67 Å²	67	1%	0.014	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-40.8	174.4	-169.8	0	0	0	0	110.6	L168 S169 Q175 S176 L228	L168-S172 WeakPolarHBondContact O-CB 3.33Å; L168-S172 PolarHBondContact O-N 3.32Å; S169-S172 PolarHBondContact O-N 3.39Å; S172-Q175 PolarHBondContact O-N 3.34Å; S172-S176 PolarHBondContact O-N 2.87Å; S172-L228 WeakPolarHBondContact OG-CD2 3.25Å
173	K	59.1	Low	60.3	Low	40 Å²	40	70.6 Å²	70.6	17%	0.174	36%	0.358	C	S	.	.	H	α-helix	trans	-71.8	-39.3	177.5	-164.3	177.6	-176.8	-174.5	0	112.6	S169 K170 S171 Q175 S176 Q177 F284 S288	S169-K173 PolarHBondContact O-N 2.89Å; S169-K173 VanDerWaalsContact O-N 3.15Å; K170-K173 PolarHBondContact O-N 3.39Å; S171-K173 PolarHBondContact O-N 2.87Å; K173-Q175 PolarHBondContact O-N 3.21Å; K173-S176 WeakPolarHBondContact CA-OG 3.47Å; K173-S176 PolarHBondContact O-N 3.26Å; K173-S176 PolarHBondContact O-OG 3.48Å; K173-Q177 HydrophobicContact CG-CG 4.48Å; K173-Q177 WeakPolarHBondContact O-CB 3.45Å; K173-Q177 VanDerWaalsContact O-CG 3.3Å; K173-Q177 WeakPolarHBondContact O-CG 3.42Å; K173-Q177 PolarHBondContact O-N 2.9Å; K173-F284 PolarHBondContact NZ-O 2.93Å; K173-S288 VanDerWaalsContact NZ-CB 3.28Å
174	Q	55.4	Low	59.8	Low	127 Å²	127	72.2 Å²	72.2	59%	0.593	37%	0.369	S	S	*	.	H	α-helix	trans	-59.4	-39.3	170.5	-75.2	178.6	-9.1	0	0	111	K170 S171 Q177 C178	K170-Q174 WeakPolarHBondContact O-CG 3.25Å; K170-Q174 PolarHBondContact O-N 2.74Å; S171-Q174 PolarHBondContact O-N 2.9Å; Q174-Q177 PolarHBondContact O-N 2.83Å; Q174-C178 VanDerWaalsContact O-CB 3.25Å; Q174-C178 WeakPolarHBondContact O-CB 3.49Å; Q174-C178 PolarHBondContact O-N 3.33Å; Q174-C178 PolarHBondContact O-SG 3.3Å
175	Q	53.2	Low	59.4	Low	123 Å²	123	69.8 Å²	69.8	58%	0.575	37%	0.367	S	S	*	.	H	α-helix	trans	-71	-35.9	178.5	-167.2	164.7	8.2	0	0	113	S171 S172 K173 H179	S171-Q175 WeakPolarHBondContact O-CB 3.29Å; S171-Q175 PolarHBondContact O-N 2.88Å; S172-Q175 PolarHBondContact O-N 3.34Å; K173-Q175 PolarHBondContact O-N 3.21Å; Q175-H179 PolarHBondContact O-N 2.9Å
176	S	53.7	Low	59	Low	36 Å²	36	76.7 Å²	76.7	25%	0.252	39%	0.392	S	S	.	.	H	α-helix	trans	-70.3	-39.2	172.5	66.5	0	0	0	0	112.1	S172 K173 H179 L182	S172-S176 PolarHBondContact O-N 2.87Å; K173-S176 WeakPolarHBondContact CA-OG 3.47Å; K173-S176 PolarHBondContact O-N 3.26Å; K173-S176 PolarHBondContact O-OG 3.48Å; S176-H179 PolarHBondContact O-N 2.63Å; S176-L182 VanDerWaalsContact O-CD1 3.27Å; S176-L182 WeakPolarHBondContact O-CD1 3.32Å
177	Q	53.3	Low	59.1	Low	84 Å²	84	81.1 Å²	81.1	39%	0.393	41%	0.412	S	S	.	.	H	α-helix	trans	-68.3	-31.7	175.1	-73.8	-179.7	-7.1	0	0	113.2	K173 Q174 H179 V183	K173-Q177 HydrophobicContact CG-CG 4.48Å; K173-Q177 WeakPolarHBondContact O-CB 3.45Å; K173-Q177 VanDerWaalsContact O-CG 3.3Å; K173-Q177 WeakPolarHBondContact O-CG 3.42Å; K173-Q177 PolarHBondContact O-N 2.9Å; Q174-Q177 PolarHBondContact O-N 2.83Å; Q177-H179 VanDerWaalsContact C-N 3.34Å; Q177-V183 WeakPolarHBondContact O-CG2 3.37Å
178	C	47.5	Very low	59.3	Low	99 Å²	99	77 Å²	77	67%	0.669	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	0.8	177.5	-67.5	0	0	0	0	113.7	Q174 P180	Q174-C178 VanDerWaalsContact O-CB 3.25Å; Q174-C178 WeakPolarHBondContact O-CB 3.49Å; Q174-C178 PolarHBondContact O-N 3.33Å; Q174-C178 PolarHBondContact O-SG 3.3Å; C178-P180 WeakPolarHBondContact O-CD 3.43Å
179	H	46.1	Very low	59.7	Low	82 Å²	82	80.6 Å²	80.6	38%	0.38	42%	0.421	S	S	.	.			trans	-69.8	119.7	178.4	-163.5	-81.6	0	0	0	109.5	Q175 S176 Q177 L181 L182 V183	Q175-H179 PolarHBondContact O-N 2.9Å; S176-H179 PolarHBondContact O-N 2.63Å; Q177-H179 VanDerWaalsContact C-N 3.34Å; H179-L181 PolarHBondContact ND1-N 3.48Å; H179-L181 PolarHBondContact O-N 2.68Å; H179-L181 VanDerWaalsContact O-N 3.13Å; H179-L182 HydrophobicContact CB-CB 4.25Å; H179-L182 HydrophobicContact CB-CD1 4.11Å; H179-L182 HydrophobicContact CB-CG 4.28Å; H179-L182 PolarHBondContact O-N 3.35Å; H179-V183 WeakPolarHBondContact O-CG2 3.37Å; H179-V183 PolarHBondContact O-N 3.3Å
180	P	54.5	Low	60.4	Low	98 Å²	98	84.3 Å²	84.3	64%	0.636	44%	0.439	S	S	*	.	H	α-helix	trans	-57.9	-35	-170.9	20.5	-31.9	0	0	0	113	C178 V183 S184	C178-P180 WeakPolarHBondContact O-CD 3.43Å; P180-V183 PolarHBondContact O-N 3.07Å; P180-S184 WeakPolarHBondContact O-CB 3.26Å; P180-S184 PolarHBondContact O-N 2.83Å; P180-S184 PolarHBondContact O-OG 3.45Å
181	L	53.2	Low	60.9	Low	120 Å²	120	84.6 Å²	84.6	63%	0.628	44%	0.44	S	S	*	.	H	α-helix	trans	-68.4	-35	175.3	-61.4	178.7	0	0	0	113.7	H179 S184 L185	H179-L181 PolarHBondContact ND1-N 3.48Å; H179-L181 PolarHBondContact O-N 2.68Å; H179-L181 VanDerWaalsContact O-N 3.13Å; L181-S184 WeakPolarHBondContact CA-OG 3.25Å; L181-S184 PolarHBondContact O-OG 2.8Å; L181-L185 VanDerWaalsContact O-CB 3.24Å; L181-L185 WeakPolarHBondContact O-CB 3.09Å; L181-L185 PolarHBondContact O-N 3.44Å
182	L	57	Low	61.6	Low	86 Å²	86	86.9 Å²	86.9	45%	0.45	45%	0.447	S	S	.	.	H	α-helix	trans	-76.5	-34.3	177.2	-71.8	174.6	0	0	0	110.6	S176 H179 R186	S176-L182 VanDerWaalsContact O-CD1 3.27Å; S176-L182 WeakPolarHBondContact O-CD1 3.32Å; H179-L182 HydrophobicContact CB-CB 4.25Å; H179-L182 HydrophobicContact CB-CD1 4.11Å; H179-L182 HydrophobicContact CB-CG 4.28Å; H179-L182 PolarHBondContact O-N 3.35Å; L182-R186 WeakPolarHBondContact O-CB 3.4Å; L182-R186 PolarHBondContact O-N 2.82Å
183	V	65.7	Low	62.1	Low	76 Å²	76	95.9 Å²	95.9	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-63.7	-44.5	171.4	178.3	0	0	0	0	110.7	Q177 H179 P180 R186 H187	Q177-V183 WeakPolarHBondContact O-CG2 3.37Å; H179-V183 WeakPolarHBondContact O-CG2 3.37Å; H179-V183 PolarHBondContact O-N 3.3Å; P180-V183 PolarHBondContact O-N 3.07Å; V183-R186 PolarHBondContact O-N 2.87Å; V183-H187 WeakPolarHBondContact O-CB 3.47Å; V183-H187 PolarHBondContact O-N 3.39Å
184	S	61.2	Low	62.6	Low	54 Å²	54	97.5 Å²	97.5	38%	0.378	50%	0.497	S	S	.	.	H	α-helix	trans	-65.9	-46	176.8	69.4	0	0	0	0	111.6	P180 L181 R186 H187 D188	P180-S184 WeakPolarHBondContact O-CB 3.26Å; P180-S184 PolarHBondContact O-N 2.83Å; P180-S184 PolarHBondContact O-OG 3.45Å; L181-S184 WeakPolarHBondContact CA-OG 3.25Å; L181-S184 PolarHBondContact O-OG 2.8Å; S184-R186 VanDerWaalsContact C-N 3.33Å; S184-R186 PolarHBondContact O-N 3.01Å; S184-H187 CarbonylContact O-C 3.59Å; S184-H187 WeakPolarHBondContact O-CB 3.5Å; S184-H187 PolarHBondContact O-N 3.2Å; S184-H187 VanDerWaalsContact O-N 3.15Å; S184-D188 WeakPolarHBondContact O-CB 3.22Å; S184-D188 PolarHBondContact O-N 3.37Å
185	L	64.3	Low	63.2	Low	96 Å²	96	100 Å²	100	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-42.5	176.5	-175	71.4	0	0	0	111.6	L181 H187 D188 L189	L181-L185 VanDerWaalsContact O-CB 3.24Å; L181-L185 WeakPolarHBondContact O-CB 3.09Å; L181-L185 PolarHBondContact O-N 3.44Å; L185-H187 VanDerWaalsContact C-N 3.34Å; L185-D188 PolarHBondContact O-N 2.95Å; L185-L189 HydrophobicContact CG-CD1 4.23Å; L185-L189 WeakPolarHBondContact O-CB 3.26Å; L185-L189 WeakPolarHBondContact O-CG 3.49Å; L185-L189 PolarHBondContact O-N 2.85Å
186	R	65.6	Low	63.8	Low	148 Å²	148	98.3 Å²	98.3	56%	0.558	50%	0.499	S	S	*	.	H	α-helix	trans	-64	-40.5	175.4	-174	176.4	179.6	146.2	1.8	111.3	L182 V183 S184 D188 M190	L182-R186 WeakPolarHBondContact O-CB 3.4Å; L182-R186 PolarHBondContact O-N 2.82Å; V183-R186 PolarHBondContact O-N 2.87Å; S184-R186 VanDerWaalsContact C-N 3.33Å; S184-R186 PolarHBondContact O-N 3.01Å; R186-D188 VanDerWaalsContact C-N 3.34Å; R186-M190 VanDerWaalsContact O-CB 3.29Å; R186-M190 WeakPolarHBondContact O-CB 3.46Å; R186-M190 PolarHBondContact O-N 3.22Å
187	H	70.2	Confident	64.1	Low	101 Å²	101	100.7 Å²	100.7	47%	0.468	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-41.3	173.5	-171.5	-34.3	0	0	0	111.2	V183 S184 L185 M190 K191	V183-H187 WeakPolarHBondContact O-CB 3.47Å; V183-H187 PolarHBondContact O-N 3.39Å; S184-H187 CarbonylContact O-C 3.59Å; S184-H187 WeakPolarHBondContact O-CB 3.5Å; S184-H187 PolarHBondContact O-N 3.2Å; S184-H187 VanDerWaalsContact O-N 3.15Å; L185-H187 VanDerWaalsContact C-N 3.34Å; H187-M190 PolarHBondContact O-N 3.36Å; H187-K191 WeakPolarHBondContact CE1-CE 3.21Å; H187-K191 WeakPolarHBondContact ND1-CE 3.04Å; H187-K191 PolarHBondContact O-N 3.32Å
188	D	72.3	Confident	63.8	Low	73 Å²	73	99.3 Å²	99.3	39%	0.39	52%	0.52	S	S	.	.	H	α-helix	trans	-72.4	-40.3	-178.7	-70.4	-23.3	0	0	0	111.9	S184 L185 R186 M190 K191 I192	S184-D188 WeakPolarHBondContact O-CB 3.22Å; S184-D188 PolarHBondContact O-N 3.37Å; L185-D188 PolarHBondContact O-N 2.95Å; R186-D188 VanDerWaalsContact C-N 3.34Å; D188-M190 VanDerWaalsContact C-N 3.3Å; D188-M190 PolarHBondContact O-N 3.43Å; D188-K191 WeakPolarHBondContact O-CB 3.35Å; D188-K191 PolarHBondContact O-N 3.48Å; D188-K191 IonicContact OD1-NZ 3.24Å; D188-K191 PolarHBondContact OD1-NZ 2.81Å; D188-I192 VanDerWaalsContact O-CG1 3.26Å; D188-I192 WeakPolarHBondContact O-CG1 3.49Å; D188-I192 PolarHBondContact O-N 3.38Å
189	L	75	Confident	63.8	Low	103 Å²	103	102.9 Å²	102.9	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-60.3	-40.5	169.1	-78	169.8	0	0	0	111.6	L185 I192 R193	L185-L189 HydrophobicContact CG-CD1 4.23Å; L185-L189 WeakPolarHBondContact O-CB 3.26Å; L185-L189 WeakPolarHBondContact O-CG 3.49Å; L185-L189 PolarHBondContact O-N 2.85Å; L189-I192 PolarHBondContact O-N 3.27Å; L189-R193 WeakPolarHBondContact O-CB 3.43Å; L189-R193 PolarHBondContact O-N 3.05Å
190	M	77.3	Confident	63.6	Low	87 Å²	87	103.8 Å²	103.8	43%	0.429	54%	0.536	S	S	.	.	H	α-helix	trans	-66.3	-41.2	175	-168.9	145	68.4	0	0	111.6	R186 H187 D188 I192 R193 S194	R186-M190 VanDerWaalsContact O-CB 3.29Å; R186-M190 WeakPolarHBondContact O-CB 3.46Å; R186-M190 PolarHBondContact O-N 3.22Å; H187-M190 PolarHBondContact O-N 3.36Å; D188-M190 VanDerWaalsContact C-N 3.3Å; D188-M190 PolarHBondContact O-N 3.43Å; M190-I192 VanDerWaalsContact C-N 3.32Å; M190-I192 PolarHBondContact O-N 2.91Å; M190-R193 PolarHBondContact O-N 2.89Å; M190-S194 WeakPolarHBondContact O-CB 3.23Å; M190-S194 PolarHBondContact O-N 3.2Å; M190-S194 PolarHBondContact O-OG 2.77Å
191	K	76.4	Confident	62.6	Low	91 Å²	91	107.6 Å²	107.6	40%	0.396	54%	0.542	S	S	.	.	H	α-helix	trans	-59.3	-42.1	171.2	-80.6	170.4	179.8	152.8	0	111.7	H187 D188 R195	H187-K191 WeakPolarHBondContact CE1-CE 3.21Å; H187-K191 WeakPolarHBondContact ND1-CE 3.04Å; H187-K191 PolarHBondContact O-N 3.32Å; D188-K191 WeakPolarHBondContact O-CB 3.35Å; D188-K191 PolarHBondContact O-N 3.48Å; D188-K191 IonicContact OD1-NZ 3.24Å; D188-K191 PolarHBondContact OD1-NZ 2.81Å; K191-R195 WeakPolarHBondContact O-CB 3.35Å; K191-R195 WeakPolarHBondContact O-CG 3.37Å; K191-R195 PolarHBondContact O-N 3.46Å
192	I	71.5	Confident	61.7	Low	98 Å²	98	108.1 Å²	108.1	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-61.5	-48.9	176.1	-68.7	163.4	0	0	0	109	D188 L189 M190 S194 R195 V196	D188-I192 VanDerWaalsContact O-CG1 3.26Å; D188-I192 WeakPolarHBondContact O-CG1 3.49Å; D188-I192 PolarHBondContact O-N 3.38Å; L189-I192 PolarHBondContact O-N 3.27Å; M190-I192 VanDerWaalsContact C-N 3.32Å; M190-I192 PolarHBondContact O-N 2.91Å; I192-S194 PolarHBondContact O-N 3.46Å; I192-R195 PolarHBondContact O-N 3.29Å; I192-V196 HydrophobicContact CG2-CG2 4.32Å; I192-V196 VanDerWaalsContact O-CG2 3.25Å; I192-V196 WeakPolarHBondContact O-CG2 3.38Å; I192-V196 PolarHBondContact O-N 3.3Å
193	R	72.3	Confident	60.4	Low	192 Å²	192	112.5 Å²	112.5	73%	0.725	57%	0.569	S	S	*	*	H	α-helix	trans	-60.1	-47.1	177.9	-162.3	174.8	-174.8	174.5	0.7	111.8	L189 M190 R195 V196 T197	L189-R193 WeakPolarHBondContact O-CB 3.43Å; L189-R193 PolarHBondContact O-N 3.05Å; M190-R193 PolarHBondContact O-N 2.89Å; R193-R195 VanDerWaalsContact C-N 3.32Å; R193-R195 PolarHBondContact O-N 2.85Å; R193-V196 PolarHBondContact O-N 3.11Å; R193-T197 PolarHBondContact O-N 3.44Å; R193-T197 PolarHBondContact O-OG1 3.19Å
194	S	68.7	Low	58.7	Low	73 Å²	73	118.2 Å²	118.2	51%	0.51	59%	0.587	S	S	.	*	H	α-helix	trans	-62.1	-36.5	176.1	-53.7	0	0	0	0	112.7	M190 I192 G198	M190-S194 WeakPolarHBondContact O-CB 3.23Å; M190-S194 PolarHBondContact O-N 3.2Å; M190-S194 PolarHBondContact O-OG 2.77Å; I192-S194 PolarHBondContact O-N 3.46Å; S194-G198 WeakPolarHBondContact O-CA 3.3Å; S194-G198 PolarHBondContact O-N 2.77Å
195	R	68.5	Low	57.3	Low	180 Å²	180	121.4 Å²	121.4	68%	0.679	61%	0.607	S	S	*	*	H	α-helix	trans	-70.9	-36.5	175.1	-75.4	173.5	-178.8	-159.8	0.5	112.3	K191 I192 R193 K199	K191-R195 WeakPolarHBondContact O-CB 3.35Å; K191-R195 WeakPolarHBondContact O-CG 3.37Å; K191-R195 PolarHBondContact O-N 3.46Å; I192-R195 PolarHBondContact O-N 3.29Å; R193-R195 VanDerWaalsContact C-N 3.32Å; R193-R195 PolarHBondContact O-N 2.85Å; R195-K199 WeakPolarHBondContact O-CB 3.42Å; R195-K199 WeakPolarHBondContact O-CG 3.35Å; R195-K199 PolarHBondContact O-N 3.45Å
196	V	64.4	Low	55.7	Low	88 Å²	88	122.9 Å²	122.9	53%	0.533	62%	0.62	S	S	.	*	H	α-helix	trans	-67.7	-50.1	175.1	172.4	0	0	0	0	109.3	I192 R193 G198 K199 V200	I192-V196 HydrophobicContact CG2-CG2 4.32Å; I192-V196 VanDerWaalsContact O-CG2 3.25Å; I192-V196 WeakPolarHBondContact O-CG2 3.38Å; I192-V196 PolarHBondContact O-N 3.3Å; R193-V196 PolarHBondContact O-N 3.11Å; V196-G198 PolarHBondContact O-N 2.93Å; V196-K199 PolarHBondContact O-N 3.41Å; V196-V200 WeakPolarHBondContact O-CG2 3.34Å; V196-V200 PolarHBondContact O-N 2.86Å
197	T	61.8	Low	54.1	Low	85 Å²	85	123 Å²	123	52%	0.521	63%	0.63	S	S	.	*	H	α-helix	trans	-64.1	-38.5	177.4	-49.6	0	0	0	0	112.4	R193 K199 V200	R193-T197 PolarHBondContact O-N 3.44Å; R193-T197 PolarHBondContact O-OG1 3.19Å; T197-K199 VanDerWaalsContact C-N 3.31Å; T197-K199 PolarHBondContact O-N 3.39Å; T197-V200 PolarHBondContact O-N 2.58Å
198	G	46.4	Very low	52.2	Low	55 Å²	55	126.5 Å²	126.5	57%	0.567	65%	0.649	S	S	*	*	H	α-helix	trans	-72.2	-16.1	178.9	0	0	0	0	0	115.2	S194 V196	S194-G198 WeakPolarHBondContact O-CA 3.3Å; S194-G198 PolarHBondContact O-N 2.77Å; V196-G198 PolarHBondContact O-N 2.93Å
199	K	47.3	Very low	50	Low	174 Å²	174	128.9 Å²	128.9	76%	0.757	67%	0.666	S	S	*	*	H	α-helix	trans	-98.7	-4.1	175.4	-77.4	-174	174.8	-170.4	0	114	R195 V196 T197 F201	R195-K199 WeakPolarHBondContact O-CB 3.42Å; R195-K199 WeakPolarHBondContact O-CG 3.35Å; R195-K199 PolarHBondContact O-N 3.45Å; V196-K199 PolarHBondContact O-N 3.41Å; T197-K199 VanDerWaalsContact C-N 3.31Å; T197-K199 PolarHBondContact O-N 3.39Å; K199-F201 VanDerWaalsContact C-N 3.31Å; K199-F201 PolarHBondContact O-N 2.98Å
200	V	41.4	Very low	47.8	Very low	102 Å²	102	131.2 Å²	131.2	62%	0.618	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	22.4	-174	174.3	0	0	0	0	112.4	V196 T197	V196-V200 WeakPolarHBondContact O-CG2 3.34Å; V196-V200 PolarHBondContact O-N 2.86Å; T197-V200 PolarHBondContact O-N 2.58Å
201	F	34.7	Very low	45.5	Very low	177 Å²	177	131.9 Å²	131.9	78%	0.776	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	10.9	177.3	-78	-70.4	0	0	0	115.8	K199	K199-F201 VanDerWaalsContact C-N 3.31Å; K199-F201 PolarHBondContact O-N 2.98Å
202	T	33.8	Very low	43.3	Very low	131 Å²	131	133 Å²	133	80%	0.804	71%	0.709	S	S	*	*	S	Bend	trans	-132	10	179.1	60	0	0	0	0	117.2
203	E	28.7	Very low	41.3	Very low	178 Å²	178	135 Å²	135	83%	0.832	72%	0.72	S	S	*	*	S	Bend	trans	-138.4	127.3	172.2	-103.2	175.6	164.4	0	0	112.2
204	K	31.3	Very low	39.1	Very low	196 Å²	196	129.7 Å²	129.7	85%	0.852	71%	0.713	S	S	*	*			trans	-51.1	139.4	175.3	-82.8	173.3	173.2	175	0	110.2	V206	K204-V206 PolarHBondContact O-N 3.44Å
205	P	31.2	Very low	37.3	Very low	122 Å²	122	132.2 Å²	132.2	79%	0.792	73%	0.725	S	S	*	*			trans	-70.9	99.5	-171.2	29.6	-33.4	0	0	0	109.9	I207	P205-I207 PolarHBondContact O-N 2.99Å
206	V	30.1	Very low	35.4	Very low	127 Å²	127	131.2 Å²	131.2	77%	0.77	73%	0.726	S	S	*	*			trans	-69.6	116	157.6	177.1	0	0	0	0	105.7	K204 M208	K204-V206 PolarHBondContact O-N 3.44Å; V206-M208 PolarHBondContact O-N 2.93Å
207	I	32.6	Very low	33.7	Very low	151 Å²	151	132.7 Å²	132.7	77%	0.774	74%	0.735	S	S	*	*			trans	-55.7	90.6	172.5	-60.8	164.2	0	0	0	106.9	P205 T209	P205-I207 PolarHBondContact O-N 2.99Å; I207-T209 VanDerWaalsContact C-N 3.31Å; I207-T209 PolarHBondContact O-N 3.34Å
208	M	30.6	Very low	32.1	Very low	173 Å²	173	133.8 Å²	133.8	85%	0.852	75%	0.746	S	S	*	*			trans	-73.1	97.7	164.5	-85.1	-174.1	68	0	0	106	V206 L210	V206-M208 PolarHBondContact O-N 2.93Å; M208-L210 VanDerWaalsContact C-N 3.33Å; M208-L210 PolarHBondContact O-N 2.98Å
209	T	26.9	Very low	31.3	Very low	124 Å²	124	140.2 Å²	140.2	76%	0.761	76%	0.758	S	S	*	*			trans	-45.5	98.1	162.8	-34.4	0	0	0	0	108.3	I207 P211	I207-T209 VanDerWaalsContact C-N 3.31Å; I207-T209 PolarHBondContact O-N 3.34Å; T209-P211 WeakPolarHBondContact O-CD 3.43Å
210	L	28.2	Very low	30.4	Very low	152 Å²	152	138.7 Å²	138.7	80%	0.796	75%	0.754	S	S	*	*			trans	-63.7	122.8	169.6	-168.2	68.7	0	0	0	106.2	M208 S212	M208-L210 VanDerWaalsContact C-N 3.33Å; M208-L210 PolarHBondContact O-N 2.98Å; L210-S212 PolarHBondContact O-N 2.8Å; L210-S212 VanDerWaalsContact O-N 3.12Å
211	P	28.7	Very low	30.1	Very low	101 Å²	101	142.4 Å²	142.4	66%	0.656	76%	0.762	S	S	*	*			trans	-64.2	118.1	178.9	-14.7	27.7	0	0	0	108.5	T209 D213	T209-P211 WeakPolarHBondContact O-CD 3.43Å; P211-D213 PolarHBondContact O-N 3.07Å
212	S	31.4	Very low	30.3	Very low	115 Å²	115	135.2 Å²	135.2	80%	0.804	73%	0.733	S	S	*	*			trans	-69.1	55.1	165.4	-60.4	0	0	0	0	110.7	L210	L210-S212 PolarHBondContact O-N 2.8Å; L210-S212 VanDerWaalsContact O-N 3.12Å
213	D	28.5	Very low	30.4	Very low	139 Å²	139	134.9 Å²	134.9	74%	0.743	73%	0.725	S	S	*	*			trans	-105.5	71.6	160.7	-81	-23.9	0	0	0	106.7	P211 T215	P211-D213 PolarHBondContact O-N 3.07Å; D213-T215 PolarHBondContact O-N 2.93Å
214	S	26.5	Very low	31.1	Very low	81 Å²	81	128.2 Å²	128.2	57%	0.566	70%	0.697	S	S	*	*			trans	-67.8	69.1	160.9	57.2	0	0	0	0	108.7	F216	S214-F216 WeakPolarHBondContact O-CD2 3.23Å; S214-F216 PolarHBondContact O-N 3.46Å; S214-F216 WeakPolarHBondContact OG-CE2 3.4Å
215	T	30.6	Very low	31.8	Very low	125 Å²	125	122 Å²	122	77%	0.767	67%	0.671	S	S	*	*			trans	-65.9	77.2	148.8	-51.7	0	0	0	0	104.5	D213 V217	D213-T215 PolarHBondContact O-N 2.93Å; T215-V217 PolarHBondContact O-N 3.49Å
216	F	29.5	Very low	32.6	Very low	159 Å²	159	121 Å²	121	70%	0.697	67%	0.666	S	S	*	*			trans	-52.8	108.4	179	-86.5	-82.7	0	0	0	106.3	S214 S218	S214-F216 WeakPolarHBondContact O-CD2 3.23Å; S214-F216 PolarHBondContact O-N 3.46Å; S214-F216 WeakPolarHBondContact OG-CE2 3.4Å; F216-S218 PolarHBondContact O-N 3.33Å
217	V	28	Very low	33.8	Very low	119 Å²	119	123.5 Å²	123.5	72%	0.721	67%	0.667	S	S	*	*			trans	-30.2	111.1	163.1	174.9	0	0	0	0	106.1	T215 F219	T215-V217 PolarHBondContact O-N 3.49Å; V217-F219 PolarHBondContact O-N 2.9Å
218	S	27.4	Very low	34.8	Very low	108 Å²	108	117.5 Å²	117.5	76%	0.755	64%	0.636	S	S	*	*			trans	-43.6	115.7	174.8	-66.2	0	0	0	0	106	F216 E220	F216-S218 PolarHBondContact O-N 3.33Å; S218-E220 VanDerWaalsContact C-N 3.29Å; S218-E220 PolarHBondContact O-N 3.25Å
219	F	29.9	Very low	36.1	Very low	190 Å²	190	110.6 Å²	110.6	83%	0.833	61%	0.607	S	S	*	*			trans	-46.5	104.4	179.8	-82.2	-88.9	0	0	0	106.7	V217 K221	V217-F219 PolarHBondContact O-N 2.9Å; F219-K221 PolarHBondContact O-N 3.01Å
220	E	29.4	Very low	37.9	Very low	143 Å²	143	107.8 Å²	107.8	67%	0.668	59%	0.589	S	S	*	*			trans	-45.5	121.5	164.1	-88.3	179	130.6	0	0	103.3	S218 P222	S218-E220 VanDerWaalsContact C-N 3.29Å; S218-E220 PolarHBondContact O-N 3.25Å; E220-P222 VanDerWaalsContact C-N 3.31Å; E220-P222 WeakPolarHBondContact O-CD 3.36Å
221	K	33.9	Very low	39.5	Very low	180 Å²	180	103 Å²	103	78%	0.783	57%	0.566	S	S	*	*			trans	-40.4	112.6	154.8	-74.6	172.9	177.2	175	0	103.7	F219 I223	F219-K221 PolarHBondContact O-N 3.01Å; K221-I223 PolarHBondContact O-N 3.37Å
222	P	39.6	Very low	41.2	Very low	26 Å²	26	99 Å²	99	17%	0.169	54%	0.538	C	S	.	.			trans	-50.9	130	-177	15	-26.2	0	0	0	104.6	E220 V224 H278 Y281	E220-P222 VanDerWaalsContact C-N 3.31Å; E220-P222 WeakPolarHBondContact O-CD 3.36Å; P222-V224 PolarHBondContact O-N 3.44Å; P222-H278 WeakPolarHBondContact CD-NE2 3.29Å; P222-H278 WeakPolarHBondContact CG-NE2 3.19Å; P222-Y281 HydrophobicContact CB-CD1 3.75Å; P222-Y281 HydrophobicContact CB-CE1 3.72Å; P222-Y281 HydrophobicContact CG-CD1 4.15Å
223	I	36.5	Very low	43	Very low	124 Å²	124	98.5 Å²	98.5	64%	0.636	52%	0.523	S	S	*	.			trans	-65	74.8	-179.2	-56.3	168	0	0	0	105.8	K221 Q225	K221-I223 PolarHBondContact O-N 3.37Å; I223-Q225 VanDerWaalsContact C-N 3.26Å; I223-Q225 PolarHBondContact O-N 3.15Å
224	V	42.3	Very low	45.1	Very low	38 Å²	38	100 Å²	100	23%	0.23	52%	0.519	C	S	.	.			trans	-65	103.4	160.8	-177.2	0	0	0	0	101.1	P222 S226 L228 A229 F232	P222-V224 PolarHBondContact O-N 3.44Å; V224-S226 PolarHBondContact O-N 3.44Å; V224-S226 VanDerWaalsContact O-N 3.11Å; V224-L228 HydrophobicContact CG1-CB 4.33Å; V224-A229 HydrophobicContact CB-CB 4.23Å; V224-A229 VanDerWaalsContact CG1-CA 3.44Å; V224-A229 HydrophobicContact CG1-CB 3.73Å; V224-F232 HydrophobicContact CG1-CD2 3.58Å; V224-F232 HydrophobicContact CG1-CE2 3.92Å
225	Q	45.5	Very low	47.2	Very low	66 Å²	66	96.4 Å²	96.4	31%	0.308	49%	0.493	S	S	.	.			trans	-40.3	127	176.4	-71.1	-179.5	-7.1	0	0	107.8	I223 K227 L228 A229	I223-Q225 VanDerWaalsContact C-N 3.26Å; I223-Q225 PolarHBondContact O-N 3.15Å; Q225-K227 PolarHBondContact O-N 2.8Å; Q225-L228 WeakPolarHBondContact O-CA 3.42Å; Q225-L228 PolarHBondContact O-N 3.03Å; Q225-A229 PolarHBondContact O-N 2.99Å; Q225-A229 VanDerWaalsContact O-N 3.09Å
226	S	48.8	Very low	49.1	Very low	100 Å²	100	90.5 Å²	90.5	70%	0.699	46%	0.457	S	S	*	.	H	α-helix	trans	-50.2	-30.2	-169.2	54.5	0	0	0	0	113.6	V224	V224-S226 PolarHBondContact O-N 3.44Å; V224-S226 VanDerWaalsContact O-N 3.11Å
227	K	54.6	Low	51.2	Low	180 Å²	180	84.8 Å²	84.8	78%	0.783	43%	0.433	S	S	*	.	H	α-helix	trans	-67.2	-36.1	174.7	-63.4	-176	-179.8	178.5	0	113.7	Q225	Q225-K227 PolarHBondContact O-N 2.8Å
228	L	54.3	Low	53.4	Low	25 Å²	25	83.2 Å²	83.2	13%	0.131	42%	0.418	C	S	.	.	H	α-helix	trans	-87.2	-25.5	-179.8	-164.3	69.8	0	0	0	112.3	L168 S172 V224 Q225 V230 V231 F232	L168-L228 HydrophobicContact CD2-CD1 4.15Å; S172-L228 WeakPolarHBondContact OG-CD2 3.25Å; V224-L228 HydrophobicContact CG1-CB 4.33Å; Q225-L228 WeakPolarHBondContact O-CA 3.42Å; Q225-L228 PolarHBondContact O-N 3.03Å; L228-V230 VanDerWaalsContact C-N 3.31Å; L228-V230 PolarHBondContact O-N 2.89Å; L228-V231 HydrophobicContact CD1-CB 4.22Å; L228-V231 CarbonylContact O-C 3.57Å; L228-V231 WeakPolarHBondContact O-CA 3.17Å; L228-V231 WeakPolarHBondContact O-CB 3.4Å; L228-V231 PolarHBondContact O-N 3.31Å; L228-F232 HydrophobicContact CB-CD2 4.43Å; L228-F232 HydrophobicContact CB-CE2 4.39Å; L228-F232 HydrophobicContact CD1-CE2 4.45Å; L228-F232 HydrophobicContact CD2-CD2 4Å; L228-F232 HydrophobicContact CD2-CE2 3.2Å; L228-F232 HydrophobicContact CD2-CZ 3.77Å; L228-F232 HydrophobicContact CG-CD2 3.67Å; L228-F232 HydrophobicContact CG-CE2 3.4Å; L228-F232 VanDerWaalsContact CG-CE2 3.4Å; L228-F232 HydrophobicContact CG-CZ 4.17Å; L228-F232 VanDerWaalsContact O-CD2 3.32Å; L228-F232 WeakPolarHBondContact O-CD2 3.13Å; L228-F232 PolarHBondContact O-N 3.03Å
229	A	57.3	Low	55.6	Low	28 Å²	28	78.1 Å²	78.1	23%	0.231	38%	0.383	C	S	.	.	H	α-helix	trans	-56	-46.8	176.2	0	0	0	0	0	111.3	V224 Q225 V231 F232 E233	V224-A229 HydrophobicContact CB-CB 4.23Å; V224-A229 VanDerWaalsContact CG1-CA 3.44Å; V224-A229 HydrophobicContact CG1-CB 3.73Å; Q225-A229 PolarHBondContact O-N 2.99Å; Q225-A229 VanDerWaalsContact O-N 3.09Å; A229-V231 VanDerWaalsContact C-N 3.25Å; A229-V231 PolarHBondContact O-N 2.81Å; A229-F232 PolarHBondContact O-N 2.83Å; A229-E233 WeakPolarHBondContact O-CG 3.24Å; A229-E233 PolarHBondContact O-N 3.36Å
230	V	64.6	Low	57.5	Low	65 Å²	65	69 Å²	69	39%	0.394	34%	0.343	S	S	.	.	H	α-helix	trans	-61.1	-35.4	175.5	-177.5	0	0	0	0	111.8	L228 R234	L228-V230 VanDerWaalsContact C-N 3.31Å; L228-V230 PolarHBondContact O-N 2.89Å; V230-R234 WeakPolarHBondContact O-CB 3.06Å; V230-R234 VanDerWaalsContact O-CG 3.23Å; V230-R234 WeakPolarHBondContact O-CG 3.49Å; V230-R234 PolarHBondContact O-N 3.3Å
231	V	61.4	Low	59.6	Low	52 Å²	52	65.9 Å²	65.9	32%	0.315	33%	0.33	S	S	.	.	H	α-helix	trans	-71.7	-40.3	178.1	-178.7	0	0	0	0	110.9	L168 L228 A229 L235	L168-V231 HydrophobicContact CD1-CG1 3.73Å; L228-V231 HydrophobicContact CD1-CB 4.22Å; L228-V231 CarbonylContact O-C 3.57Å; L228-V231 WeakPolarHBondContact O-CA 3.17Å; L228-V231 WeakPolarHBondContact O-CB 3.4Å; L228-V231 PolarHBondContact O-N 3.31Å; A229-V231 VanDerWaalsContact C-N 3.25Å; A229-V231 PolarHBondContact O-N 2.81Å; V231-L235 WeakPolarHBondContact O-CB 3.4Å; V231-L235 PolarHBondContact O-N 3.49Å
232	F	65.9	Low	61.3	Low	16 Å²	16	58.2 Å²	58.2	7%	0.07	30%	0.298	C	S	.	.	H	α-helix	trans	-66.5	-41.9	174.9	-78.3	-61.8	0	0	0	112.1	L165 L168 V224 L228 A229 L235 A236 I277 Y281	L165-F232 HydrophobicContact CD1-CD1 3.55Å; L165-F232 HydrophobicContact CD1-CE1 3.5Å; L165-F232 VanDerWaalsContact CD1-CE1 3.5Å; L168-F232 HydrophobicContact CB-CE1 4.35Å; L168-F232 HydrophobicContact CB-CZ 4.47Å; V224-F232 HydrophobicContact CG1-CD2 3.58Å; V224-F232 HydrophobicContact CG1-CE2 3.92Å; L228-F232 HydrophobicContact CB-CD2 4.43Å; L228-F232 HydrophobicContact CB-CE2 4.39Å; L228-F232 HydrophobicContact CD1-CE2 4.45Å; L228-F232 HydrophobicContact CD2-CD2 4Å; L228-F232 HydrophobicContact CD2-CE2 3.2Å; L228-F232 HydrophobicContact CD2-CZ 3.77Å; L228-F232 HydrophobicContact CG-CD2 3.67Å; L228-F232 HydrophobicContact CG-CE2 3.4Å; L228-F232 VanDerWaalsContact CG-CE2 3.4Å; L228-F232 HydrophobicContact CG-CZ 4.17Å; L228-F232 VanDerWaalsContact O-CD2 3.32Å; L228-F232 WeakPolarHBondContact O-CD2 3.13Å; L228-F232 PolarHBondContact O-N 3.03Å; A229-F232 PolarHBondContact O-N 2.83Å; F232-L235 PolarHBondContact O-N 2.97Å; F232-A236 VanDerWaalsContact O-CB 3.3Å; F232-A236 WeakPolarHBondContact O-CB 3.24Å; F232-A236 PolarHBondContact O-N 3.23Å; F232-I277 HydrophobicContact CD1-CG2 4.11Å; F232-Y281 HydrophobicContact CZ-CD2 4.49Å
233	E	68.1	Low	62.8	Low	105 Å²	105	57 Å²	57	49%	0.491	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-48	175.1	-74.7	-179.1	171.2	0	0	111.5	A229 L235 A236 D237	A229-E233 WeakPolarHBondContact O-CG 3.24Å; A229-E233 PolarHBondContact O-N 3.36Å; E233-L235 VanDerWaalsContact C-N 3.28Å; E233-L235 PolarHBondContact O-N 2.92Å; E233-A236 WeakPolarHBondContact O-CB 3.48Å; E233-A236 PolarHBondContact O-N 3.21Å; E233-D237 PolarHBondContact O-N 3.3Å
234	R	72.2	Confident	64.4	Low	170 Å²	170	53 Å²	53	64%	0.642	27%	0.27	S	S	*	.	H	α-helix	trans	-61.2	-38.1	175.6	-73.9	176.3	-175.6	-172.2	3.3	112.3	V230 Q238	V230-R234 WeakPolarHBondContact O-CB 3.06Å; V230-R234 VanDerWaalsContact O-CG 3.23Å; V230-R234 WeakPolarHBondContact O-CG 3.49Å; V230-R234 PolarHBondContact O-N 3.3Å; R234-Q238 WeakPolarHBondContact O-CB 3.19Å; R234-Q238 WeakPolarHBondContact O-CG 3.36Å; R234-Q238 PolarHBondContact O-N 3.22Å
235	L	71.5	Confident	65.4	Low	5 Å²	5	54.7 Å²	54.7	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-71.9	-36.9	178.4	-173.1	146.5	0	0	0	111.1	R164 L165 L168 V231 F232 E233 Q238 I239	R164-L235 HydrophobicContact CB-CD1 4.39Å; R164-L235 HydrophobicContact CG-CD1 4.23Å; L165-L235 HydrophobicContact CB-CD1 4.33Å; L165-L235 HydrophobicContact CB-CD2 3.8Å; L165-L235 HydrophobicContact CD1-CD2 3.65Å; L165-L235 HydrophobicContact CG-CD2 4.18Å; L168-L235 HydrophobicContact CD1-CD1 4.06Å; V231-L235 WeakPolarHBondContact O-CB 3.4Å; V231-L235 PolarHBondContact O-N 3.49Å; F232-L235 PolarHBondContact O-N 2.97Å; E233-L235 VanDerWaalsContact C-N 3.28Å; E233-L235 PolarHBondContact O-N 2.92Å; L235-Q238 PolarHBondContact O-N 3.47Å; L235-I239 HydrophobicContact CD2-CD1 3.39Å; L235-I239 HydrophobicContact CD2-CG1 4.18Å; L235-I239 HydrophobicContact CG-CD1 4.38Å; L235-I239 WeakPolarHBondContact O-CG1 3.18Å; L235-I239 PolarHBondContact O-N 2.67Å
236	A	71.3	Confident	66.2	Low	1 Å²	1	51.7 Å²	51.7	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-61.3	-49.9	172.6	0	0	0	0	0	110.4	F232 E233 Q238 I239 T240 V273 I274 I277	F232-A236 VanDerWaalsContact O-CB 3.3Å; F232-A236 WeakPolarHBondContact O-CB 3.24Å; F232-A236 PolarHBondContact O-N 3.23Å; E233-A236 WeakPolarHBondContact O-CB 3.48Å; E233-A236 PolarHBondContact O-N 3.21Å; A236-Q238 VanDerWaalsContact C-N 3.31Å; A236-Q238 PolarHBondContact O-N 2.87Å; A236-I239 PolarHBondContact O-N 3.31Å; A236-I239 VanDerWaalsContact O-N 3.13Å; A236-T240 WeakPolarHBondContact O-CB 3.4Å; A236-T240 PolarHBondContact O-N 2.83Å; A236-T240 PolarHBondContact O-OG1 2.96Å; A236-V273 HydrophobicContact CB-CG1 4.13Å; A236-I274 HydrophobicContact CB-CG1 3.94Å; A236-I277 HydrophobicContact CB-CD1 3.7Å
237	D	73.7	Confident	66.8	Low	39 Å²	39	47.4 Å²	47.4	21%	0.209	24%	0.237	C	C	.	.	H	α-helix	trans	-56.4	-44.3	175.3	-77.4	-46.4	0	0	0	111.8	E233 I239 T240 D241 R266 R270	E233-D237 PolarHBondContact O-N 3.3Å; D237-I239 PolarHBondContact O-N 2.86Å; D237-T240 PolarHBondContact O-N 3.03Å; D237-D241 WeakPolarHBondContact O-CB 3.45Å; D237-D241 PolarHBondContact O-N 3.47Å; D237-R266 IonicContact OD1-CZ 2.81Å; D237-R266 IonicContact OD1-NH1 3.31Å; D237-R266 IonicContact OD1-NH2 3.84Å; D237-R266 PolarHBondContact OD1-NH2 2.84Å; D237-R270 WeakPolarHBondContact OD1-CD 3.16Å; D237-R270 IonicContact OD1-CZ 3.9Å; D237-R270 IonicContact OD1-NE 3.82Å; D237-R270 PolarHBondContact OD1-NE 3.03Å; D237-R270 IonicContact OD1-NH2 3.79Å; D237-R270 IonicContact OD2-NH2 2.84Å
238	Q	74.2	Confident	67	Low	87 Å²	87	45.1 Å²	45.1	41%	0.407	23%	0.229	S	C	.	.	H	α-helix	trans	-67.2	-33.9	177.9	-72.7	172.4	10.3	0	0	113.8	K161 R234 L235 A236 L242	K161-Q238 HydrophobicContact CD-CB 3.83Å; R234-Q238 WeakPolarHBondContact O-CB 3.19Å; R234-Q238 WeakPolarHBondContact O-CG 3.36Å; R234-Q238 PolarHBondContact O-N 3.22Å; L235-Q238 PolarHBondContact O-N 3.47Å; A236-Q238 VanDerWaalsContact C-N 3.31Å; A236-Q238 PolarHBondContact O-N 2.87Å; Q238-L242 VanDerWaalsContact O-CG 3.3Å; Q238-L242 WeakPolarHBondContact O-CG 3.32Å; Q238-L242 PolarHBondContact O-N 3.12Å
239	I	73.5	Confident	67.1	Low	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-70.1	-46.1	173.7	-72.9	173	0	0	0	109.3	L158 K161 L162 L235 A236 D237 D241 L242 L243 V273	L158-I239 HydrophobicContact CD1-CG2 4.16Å; K161-I239 HydrophobicContact CB-CG1 4.27Å; L162-I239 HydrophobicContact CD2-CD1 3.66Å; L162-I239 HydrophobicContact CD2-CG1 4.48Å; L235-I239 HydrophobicContact CD2-CD1 3.39Å; L235-I239 HydrophobicContact CD2-CG1 4.18Å; L235-I239 HydrophobicContact CG-CD1 4.38Å; L235-I239 WeakPolarHBondContact O-CG1 3.18Å; L235-I239 PolarHBondContact O-N 2.67Å; A236-I239 PolarHBondContact O-N 3.31Å; A236-I239 VanDerWaalsContact O-N 3.13Å; D237-I239 PolarHBondContact O-N 2.86Å; I239-D241 VanDerWaalsContact C-N 3.32Å; I239-D241 PolarHBondContact O-N 2.85Å; I239-L242 PolarHBondContact O-N 3.46Å; I239-L243 HydrophobicContact CG2-CD1 3.57Å; I239-L243 HydrophobicContact CG2-CG 4.08Å; I239-L243 WeakPolarHBondContact O-CB 3.44Å; I239-L243 VanDerWaalsContact O-CG 3.3Å; I239-L243 WeakPolarHBondContact O-CG 3.42Å; I239-L243 PolarHBondContact O-N 3.34Å; I239-V273 HydrophobicContact CB-CG1 4.13Å; I239-V273 HydrophobicContact CG2-CG1 3.86Å; I239-V273 HydrophobicContact CG2-CG2 4Å
240	T	69.9	Low	67.1	Low	0 Å²	0	46 Å²	46	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.3	-46.4	176	-60.1	0	0	0	0	111.3	A236 D237 L242 L243 L244 R266 L269 R270	A236-T240 WeakPolarHBondContact O-CB 3.4Å; A236-T240 PolarHBondContact O-N 2.83Å; A236-T240 PolarHBondContact O-OG1 2.96Å; D237-T240 PolarHBondContact O-N 3.03Å; T240-L242 VanDerWaalsContact C-N 3.33Å; T240-L242 PolarHBondContact O-N 2.85Å; T240-L243 PolarHBondContact O-N 3.32Å; T240-L244 PolarHBondContact O-N 2.76Å; T240-R266 HydrophobicContact CG2-CG 3.87Å; T240-R266 WeakPolarHBondContact CG2-O 3.28Å; T240-L269 HydrophobicContact CG2-CB 4.06Å; T240-L269 HydrophobicContact CG2-CD2 4.07Å; T240-L269 HydrophobicContact CG2-CG 3.94Å; T240-L269 WeakPolarHBondContact O-CD2 3.46Å; T240-R270 HydrophobicContact CG2-CB 3.96Å; T240-R270 WeakPolarHBondContact OG1-CA 3.3Å
241	D	72.6	Confident	66.4	Low	76 Å²	76	47.6 Å²	47.6	41%	0.406	24%	0.242	S	C	.	.	H	α-helix	trans	-67	-32.1	179.9	-66.7	-19.8	0	0	0	112.3	D237 I239 P245 R266	D237-D241 WeakPolarHBondContact O-CB 3.45Å; D237-D241 PolarHBondContact O-N 3.47Å; I239-D241 VanDerWaalsContact C-N 3.32Å; I239-D241 PolarHBondContact O-N 2.85Å; D241-P245 VanDerWaalsContact O-CD 3.3Å; D241-P245 WeakPolarHBondContact O-CD 3.39Å; D241-R266 IonicContact OD1-CZ 3.72Å; D241-R266 IonicContact OD1-NE 3.97Å; D241-R266 PolarHBondContact OD1-NE 3.09Å; D241-R266 IonicContact OD1-NH2 3.54Å; D241-R266 PolarHBondContact OD1-NH2 3.22Å; D241-R266 IonicContact OD2-NH2 2.98Å
242	L	70.5	Confident	65.9	Low	20 Å²	20	48.6 Å²	48.6	11%	0.105	26%	0.263	C	S	.	.	H	α-helix	trans	-77.4	-29.8	173.8	-74.6	176.2	0	0	0	113.2	N154 R157 K161 Q238 I239 T240 P245 I246	N154-L242 HydrophobicContact CB-CD2 4.44Å; R157-L242 HydrophobicContact CB-CD1 3.93Å; R157-L242 HydrophobicContact CB-CD2 4.33Å; K161-L242 HydrophobicContact CD-CD1 3.65Å; K161-L242 VanDerWaalsContact CE-CD1 3.5Å; Q238-L242 VanDerWaalsContact O-CG 3.3Å; Q238-L242 WeakPolarHBondContact O-CG 3.32Å; Q238-L242 PolarHBondContact O-N 3.12Å; I239-L242 PolarHBondContact O-N 3.46Å; T240-L242 VanDerWaalsContact C-N 3.33Å; T240-L242 PolarHBondContact O-N 2.85Å; L242-P245 WeakPolarHBondContact O-CD 3.25Å; L242-I246 WeakPolarHBondContact O-CD1 3.43Å
243	L	69.6	Low	65.1	Low	1 Å²	1	48.2 Å²	48.2	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-79.9	-26.2	177.5	-74.7	177.3	0	0	0	111.8	I125 V130 L158 I239 T240 I246 S247 I250 L269 V273	I125-L243 HydrophobicContact CD1-CD1 4.45Å; V130-L243 HydrophobicContact CG1-CD2 4.11Å; L158-L243 HydrophobicContact CD1-CD2 4.29Å; L158-L243 HydrophobicContact CD1-CG 4.34Å; L158-L243 HydrophobicContact CD2-CD2 3.82Å; I239-L243 HydrophobicContact CG2-CD1 3.57Å; I239-L243 HydrophobicContact CG2-CG 4.08Å; I239-L243 WeakPolarHBondContact O-CB 3.44Å; I239-L243 VanDerWaalsContact O-CG 3.3Å; I239-L243 WeakPolarHBondContact O-CG 3.42Å; I239-L243 PolarHBondContact O-N 3.34Å; T240-L243 PolarHBondContact O-N 3.32Å; L243-I246 CarbonylContact O-C 3.51Å; L243-I246 PolarHBondContact O-N 2.97Å; L243-S247 WeakPolarHBondContact O-CA 3.4Å; L243-S247 WeakPolarHBondContact O-CB 3.46Å; L243-S247 PolarHBondContact O-N 2.74Å; L243-I250 HydrophobicContact CD2-CD1 3.38Å; L243-L269 HydrophobicContact CB-CD1 4.27Å; L243-L269 HydrophobicContact CB-CD2 3.69Å; L243-L269 HydrophobicContact CB-CG 4.33Å; L243-L269 HydrophobicContact CD1-CD1 4.19Å; L243-V273 HydrophobicContact CD1-CG2 3.81Å
244	L	71.5	Confident	64	Low	39 Å²	39	47.9 Å²	47.9	20%	0.204	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-42.6	-177.7	-156.4	74.5	0	0	0	114	T240 V262 R265 R266 L269	T240-L244 PolarHBondContact O-N 2.76Å; L244-V262 HydrophobicContact CD2-CG1 4.04Å; L244-R265 HydrophobicContact CD1-CB 4.45Å; L244-R265 HydrophobicContact CD1-CG 4.18Å; L244-R266 HydrophobicContact CD1-CB 4.06Å; L244-L269 HydrophobicContact CB-CD2 4.4Å; L244-L269 HydrophobicContact CD1-CD2 4.01Å
245	P	61.6	Low	62.9	Low	73 Å²	73	41 Å²	41	47%	0.474	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-23.1	175.6	-13.2	30.2	0	0	0	113	D241 L242 H248	D241-P245 VanDerWaalsContact O-CD 3.3Å; D241-P245 WeakPolarHBondContact O-CD 3.39Å; L242-P245 WeakPolarHBondContact O-CD 3.25Å; P245-H248 PolarHBondContact O-CE1 2.72Å; P245-H248 PolarHBondContact O-ND1 3.02Å; P245-H248 VanDerWaalsContact O-ND1 3.15Å
246	I	63.7	Low	61.4	Low	3 Å²	3	45.7 Å²	45.7	2%	0.015	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-12.4	-165.6	-57.6	176.7	0	0	0	112.2	W133 L151 N154 L242 L243 H248 L249 I250	W133-I246 HydrophobicContact CH2-CG2 3.22Å; W133-I246 HydrophobicContact CZ2-CG2 4.21Å; W133-I246 HydrophobicContact CZ3-CG2 3.53Å; L151-I246 HydrophobicContact CD1-CD1 3.88Å; L151-I246 HydrophobicContact CD1-CG1 3.82Å; L151-I246 HydrophobicContact CD1-CG2 4Å; N154-I246 HydrophobicContact CB-CD1 3.46Å; N154-I246 VanDerWaalsContact CB-CD1 3.46Å; L242-I246 WeakPolarHBondContact O-CD1 3.43Å; L243-I246 CarbonylContact O-C 3.51Å; L243-I246 PolarHBondContact O-N 2.97Å; I246-H248 PolarHBondContact O-N 2.98Å; I246-L249 HydrophobicContact CG2-CB 4.22Å; I246-L249 HydrophobicContact CG2-CD1 4.36Å; I246-L249 WeakPolarHBondContact O-CA 3.37Å; I246-L249 WeakPolarHBondContact O-CB 3.28Å; I246-L249 PolarHBondContact O-N 3.3Å; I246-I250 HydrophobicContact CG2-CD1 4.14Å; I246-I250 HydrophobicContact CG2-CG1 4.04Å
247	S	60.2	Low	60.1	Low	10 Å²	10	55.1 Å²	55.1	7%	0.07	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-51.2	-36.4	-171.7	63.1	0	0	0	0	113.2	L243 L249 I250	L243-S247 WeakPolarHBondContact O-CA 3.4Å; L243-S247 WeakPolarHBondContact O-CB 3.46Å; L243-S247 PolarHBondContact O-N 2.74Å; S247-L249 VanDerWaalsContact C-N 3.26Å; S247-L249 PolarHBondContact O-N 2.93Å; S247-I250 PolarHBondContact O-N 2.9Å
248	H	59.5	Low	58.5	Low	133 Å²	133	57 Å²	57	62%	0.616	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-70.8	-13.4	178.5	68.2	-82.8	0	0	0	115.2	P245 I246	P245-H248 PolarHBondContact O-CE1 2.72Å; P245-H248 PolarHBondContact O-ND1 3.02Å; P245-H248 VanDerWaalsContact O-ND1 3.15Å; I246-H248 PolarHBondContact O-N 2.98Å
249	L	57.2	Low	57.4	Low	63 Å²	63	57.6 Å²	57.6	33%	0.33	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-100	-10.3	-178.5	-61.5	171.4	0	0	0	113.2	W133 L151 I246 S247 P251	W133-L249 HydrophobicContact CH2-CB 4.27Å; W133-L249 HydrophobicContact CZ2-CB 3.81Å; W133-L249 PolarHBondContact NE1-O 2.8Å; W133-L249 VanDerWaalsContact NE1-O 3.16Å; L151-L249 HydrophobicContact CD1-CD1 3.56Å; L151-L249 HydrophobicContact CD2-CD1 3.71Å; L151-L249 HydrophobicContact CG-CD1 4.3Å; I246-L249 HydrophobicContact CG2-CB 4.22Å; I246-L249 HydrophobicContact CG2-CD1 4.36Å; I246-L249 WeakPolarHBondContact O-CA 3.37Å; I246-L249 WeakPolarHBondContact O-CB 3.28Å; I246-L249 PolarHBondContact O-N 3.3Å; S247-L249 VanDerWaalsContact C-N 3.26Å; S247-L249 PolarHBondContact O-N 2.93Å; L249-P251 WeakPolarHBondContact O-CD 3.4Å
250	I	56.8	Low	56.2	Low	8 Å²	8	61.8 Å²	61.8	4%	0.041	37%	0.373	C	S	.	.	S	Bend	trans	-93.1	114.6	-176.7	-56.6	171.6	0	0	0	108.4	V130 W133 L243 I246 S247 G252 I253	V130-I250 HydrophobicContact CG1-CD1 4.39Å; V130-I250 HydrophobicContact CG2-CG2 4.38Å; W133-I250 HydrophobicContact CD2-CG1 3.94Å; W133-I250 HydrophobicContact CD2-CG2 4.5Å; W133-I250 HydrophobicContact CE3-CD1 4.26Å; W133-I250 HydrophobicContact CE3-CG1 3.72Å; W133-I250 HydrophobicContact CG-CG2 4.41Å; W133-I250 HydrophobicContact CH2-CG1 4.15Å; W133-I250 HydrophobicContact CZ2-CG1 4.34Å; W133-I250 HydrophobicContact CZ3-CD1 4.26Å; W133-I250 HydrophobicContact CZ3-CG1 3.81Å; L243-I250 HydrophobicContact CD2-CD1 3.38Å; I246-I250 HydrophobicContact CG2-CD1 4.14Å; I246-I250 HydrophobicContact CG2-CG1 4.04Å; S247-I250 PolarHBondContact O-N 2.9Å; I250-G252 PolarHBondContact O-N 3.15Å; I250-I253 HydrophobicContact CB-CB 4.24Å; I250-I253 HydrophobicContact CB-CD1 4.07Å; I250-I253 HydrophobicContact CB-CG1 4.19Å; I250-I253 HydrophobicContact CD1-CD1 3.89Å; I250-I253 HydrophobicContact CG2-CB 4.37Å; I250-I253 HydrophobicContact CG2-CD1 3.69Å; I250-I253 HydrophobicContact CG2-CG1 3.8Å; I250-I253 PolarHBondContact O-N 3.03Å; I250-I253 VanDerWaalsContact O-N 3.15Å
251	P	49.2	Very low	55.9	Low	99 Å²	99	67 Å²	67	64%	0.643	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	127.7	172.5	-22.3	34.1	0	0	0	110.2	L249	L249-P251 WeakPolarHBondContact O-CD 3.4Å
252	G	50.9	Low	55.6	Low	73 Å²	73	67.5 Å²	67.5	75%	0.753	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	-8.9	-179.6	0	0	0	0	0	115.9	I250	I250-G252 PolarHBondContact O-N 3.15Å
253	I	49.2	Very low	55.5	Low	7 Å²	7	69.6 Å²	69.6	4%	0.036	43%	0.427	C	S	.	.			trans	-108.8	67.9	168.3	-48	-179.1	0	0	0	108.6	I125 V130 I250 I255	I125-I253 HydrophobicContact CB-CD1 4.29Å; I125-I253 HydrophobicContact CD1-CD1 4.12Å; I125-I253 HydrophobicContact CD1-CG2 4.1Å; I125-I253 HydrophobicContact CG1-CD1 3.9Å; I125-I253 HydrophobicContact CG1-CG1 4.12Å; I125-I253 HydrophobicContact CG1-CG2 4.11Å; I125-I253 HydrophobicContact CG2-CD1 3.54Å; I125-I253 HydrophobicContact CG2-CG1 4.29Å; V130-I253 HydrophobicContact CG2-CD1 3.44Å; V130-I253 VanDerWaalsContact CG2-CD1 3.44Å; V130-I253 HydrophobicContact CG2-CG1 4.48Å; I250-I253 HydrophobicContact CB-CB 4.24Å; I250-I253 HydrophobicContact CB-CD1 4.07Å; I250-I253 HydrophobicContact CB-CG1 4.19Å; I250-I253 HydrophobicContact CD1-CD1 3.89Å; I250-I253 HydrophobicContact CG2-CB 4.37Å; I250-I253 HydrophobicContact CG2-CD1 3.69Å; I250-I253 HydrophobicContact CG2-CG1 3.8Å; I250-I253 PolarHBondContact O-N 3.03Å; I250-I253 VanDerWaalsContact O-N 3.15Å; I253-I255 HydrophobicContact CG2-CG1 3.93Å; I253-I255 PolarHBondContact O-N 3.07Å
254	S	45.6	Very low	55.4	Low	98 Å²	98	75.5 Å²	75.5	69%	0.685	45%	0.452	S	S	*	.			trans	-75.9	82.3	163.9	55.8	0	0	0	0	107.9	V256	S254-V256 VanDerWaalsContact C-N 3.25Å; S254-V256 PolarHBondContact O-N 2.87Å
255	I	49.3	Very low	55	Low	26 Å²	26	77.4 Å²	77.4	13%	0.133	46%	0.457	C	S	.	.			trans	-59.5	108.6	154.7	-51.3	179.3	0	0	0	103.9	I253 K257 R265 L269	I253-I255 HydrophobicContact CG2-CG1 3.93Å; I253-I255 PolarHBondContact O-N 3.07Å; I255-K257 PolarHBondContact O-N 3.02Å; I255-K257 VanDerWaalsContact O-N 3.14Å; I255-R265 HydrophobicContact CG2-CG 3.95Å; I255-L269 HydrophobicContact CD1-CB 4.1Å; I255-L269 HydrophobicContact CD1-CD1 3.74Å; I255-L269 HydrophobicContact CD1-CD2 3.92Å; I255-L269 HydrophobicContact CD1-CG 4.13Å
256	V	40.3	Very low	55.6	Low	103 Å²	103	77.4 Å²	77.4	62%	0.624	45%	0.448	S	S	*	.			trans	-44	128	176.1	-179.2	0	0	0	0	106.3	S254 C258	S254-V256 VanDerWaalsContact C-N 3.25Å; S254-V256 PolarHBondContact O-N 2.87Å; V256-C258 HydrophobicContact CG1-CB 4.43Å; V256-C258 VanDerWaalsContact CG1-SG 3.59Å; V256-C258 PolarHBondContact O-N 2.98Å
257	K	42.5	Very low	55.9	Low	199 Å²	199	82 Å²	82	87%	0.865	47%	0.469	S	S	*	.			trans	-63.9	54.4	166.7	-74	-179.2	176.4	175.7	0	109.1	I255 A259	I255-K257 PolarHBondContact O-N 3.02Å; I255-K257 VanDerWaalsContact O-N 3.14Å; K257-A259 PolarHBondContact O-N 2.9Å
258	C	41.9	Very low	56.3	Low	80 Å²	80	84.8 Å²	84.8	54%	0.541	48%	0.483	S	S	.	.			trans	-67.7	120.1	163.1	-84.4	0	0	0	0	105.2	V256 D260	V256-C258 HydrophobicContact CG1-CB 4.43Å; V256-C258 VanDerWaalsContact CG1-SG 3.59Å; V256-C258 PolarHBondContact O-N 2.98Å; C258-D260 PolarHBondContact O-N 2.99Å
259	A	49.8	Very low	56.7	Low	99 Å²	99	78.5 Å²	78.5	82%	0.818	45%	0.454	S	S	*	.			trans	-64.3	15.4	-176.3	0	0	0	0	0	114.1	K257	K257-A259 PolarHBondContact O-N 2.9Å
260	D	47.7	Very low	57.3	Low	87 Å²	87	78 Å²	78	47%	0.465	45%	0.447	S	S	.	.			trans	-95.1	129.5	-174.8	-85.2	16.3	0	0	0	111	C258 K264	C258-D260 PolarHBondContact O-N 2.99Å; D260-K264 HydrophobicContact CB-CD 4.15Å; D260-K264 IonicContact OD2-NZ 3.87Å; D260-K264 PolarHBondContact OD2-NZ 3.46Å
261	D	64.9	Low	57.8	Low	109 Å²	109	79.3 Å²	79.3	58%	0.583	46%	0.46	S	S	*	.			trans	20.1	120.9	161.7	-141.6	-15.6	0	0	0	117.1	A263 K264 R265	D261-A263 PolarHBondContact O-N 2.84Å; D261-K264 HydrophobicContact CB-CG 4.24Å; D261-K264 PolarHBondContact O-N 3.33Å; D261-R265 PolarHBondContact O-N 3.28Å
262	V	65.8	Low	58.8	Low	88 Å²	88	75 Å²	75	53%	0.533	43%	0.431	S	S	.	.	H	α-helix	trans	-50.5	-32.9	178.1	178.9	0	0	0	0	111.3	L244 R265 R266	L244-V262 HydrophobicContact CD2-CG1 4.04Å; V262-R265 PolarHBondContact O-N 2.73Å; V262-R266 WeakPolarHBondContact O-CB 3.33Å; V262-R266 PolarHBondContact O-N 2.89Å
263	A	67.8	Low	59.6	Low	64 Å²	64	71.6 Å²	71.6	53%	0.529	40%	0.395	S	S	.	.	H	α-helix	trans	-62.6	-47.2	174.6	0	0	0	0	0	113.6	D261 R265 R266 E267	D261-A263 PolarHBondContact O-N 2.84Å; A263-R265 VanDerWaalsContact C-N 3.33Å; A263-R265 PolarHBondContact O-N 2.83Å; A263-R266 PolarHBondContact O-N 2.95Å; A263-E267 PolarHBondContact O-N 2.87Å
264	K	68.9	Low	60.5	Low	125 Å²	125	74.1 Å²	74.1	54%	0.543	41%	0.408	S	S	.	.	H	α-helix	trans	-65.6	-38.2	178.4	-67.6	-169.5	-159.5	170.4	0	111.4	D260 D261 E267 N268	D260-K264 HydrophobicContact CB-CD 4.15Å; D260-K264 IonicContact OD2-NZ 3.87Å; D260-K264 PolarHBondContact OD2-NZ 3.46Å; D261-K264 HydrophobicContact CB-CG 4.24Å; D261-K264 PolarHBondContact O-N 3.33Å; K264-E267 PolarHBondContact O-N 3.45Å; K264-N268 PolarHBondContact O-N 2.82Å
265	R	63.1	Low	61.4	Low	79 Å²	79	73.6 Å²	73.6	30%	0.298	40%	0.398	S	S	.	.	H	α-helix	trans	-63.1	-45	176	-166.6	-178.2	-58.4	128.9	10.4	111.5	L244 I255 D261 V262 A263 E267 L269	L244-R265 HydrophobicContact CD1-CB 4.45Å; L244-R265 HydrophobicContact CD1-CG 4.18Å; I255-R265 HydrophobicContact CG2-CG 3.95Å; D261-R265 PolarHBondContact O-N 3.28Å; V262-R265 PolarHBondContact O-N 2.73Å; A263-R265 VanDerWaalsContact C-N 3.33Å; A263-R265 PolarHBondContact O-N 2.83Å; R265-E267 VanDerWaalsContact C-N 3.34Å; R265-L269 WeakPolarHBondContact O-CB 3.48Å; R265-L269 PolarHBondContact O-N 3.47Å
266	R	73.1	Confident	62.2	Low	73 Å²	73	73 Å²	73	28%	0.275	40%	0.396	S	S	.	.	H	α-helix	trans	-59.7	-45.6	175.7	-174.6	-179.3	-179.6	-79.7	-6.6	111	D237 T240 D241 L244 V262 A263 L269 R270	D237-R266 IonicContact OD1-CZ 2.81Å; D237-R266 IonicContact OD1-NH1 3.31Å; D237-R266 IonicContact OD1-NH2 3.84Å; D237-R266 PolarHBondContact OD1-NH2 2.84Å; T240-R266 HydrophobicContact CG2-CG 3.87Å; T240-R266 WeakPolarHBondContact CG2-O 3.28Å; D241-R266 IonicContact OD1-CZ 3.72Å; D241-R266 IonicContact OD1-NE 3.97Å; D241-R266 PolarHBondContact OD1-NE 3.09Å; D241-R266 IonicContact OD1-NH2 3.54Å; D241-R266 PolarHBondContact OD1-NH2 3.22Å; D241-R266 IonicContact OD2-NH2 2.98Å; L244-R266 HydrophobicContact CD1-CB 4.06Å; V262-R266 WeakPolarHBondContact O-CB 3.33Å; V262-R266 PolarHBondContact O-N 2.89Å; A263-R266 PolarHBondContact O-N 2.95Å; R266-L269 PolarHBondContact O-N 3.47Å; R266-R270 VanDerWaalsContact O-CB 3.24Å; R266-R270 WeakPolarHBondContact O-CB 3.14Å; R266-R270 PolarHBondContact O-N 3.41Å
267	E	69.5	Low	63.4	Low	98 Å²	98	68.8 Å²	68.8	46%	0.458	37%	0.37	S	S	.	.	H	α-helix	trans	-67.1	-41.7	-178.1	-168.9	56.2	-148.9	0	0	112.7	A263 K264 R265 L269 R270 A271	A263-E267 PolarHBondContact O-N 2.87Å; K264-E267 PolarHBondContact O-N 3.45Å; R265-E267 VanDerWaalsContact C-N 3.34Å; E267-L269 PolarHBondContact O-N 2.91Å; E267-R270 WeakPolarHBondContact O-CB 3.28Å; E267-R270 PolarHBondContact O-N 3.44Å; E267-A271 WeakPolarHBondContact O-CB 3.29Å; E267-A271 PolarHBondContact O-N 3.42Å
268	N	68.9	Low	64.2	Low	69 Å²	69	63.2 Å²	63.2	37%	0.369	35%	0.347	S	S	.	.	H	α-helix	trans	-62.3	-45.8	175.5	-171.2	-18.3	0	0	0	111.1	K264 R270 A271 Q272	K264-N268 PolarHBondContact O-N 2.82Å; N268-R270 VanDerWaalsContact C-N 3.31Å; N268-R270 PolarHBondContact O-N 2.85Å; N268-A271 PolarHBondContact O-N 2.97Å; N268-Q272 WeakPolarHBondContact O-CG 3.47Å; N268-Q272 PolarHBondContact O-N 2.92Å; N268-Q272 PolarHBondContact OD1-NE2 3.24Å
269	L	68.1	Low	65	Low	1 Å²	1	60.7 Å²	60.7	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-63.2	-38.7	175.9	-176	56.9	0	0	0	112.1	I125 T240 L243 L244 I255 R265 R266 E267 Q272 V273	I125-L269 HydrophobicContact CD1-CD1 3.44Å; I125-L269 VanDerWaalsContact CD1-CD1 3.44Å; T240-L269 HydrophobicContact CG2-CB 4.06Å; T240-L269 HydrophobicContact CG2-CD2 4.07Å; T240-L269 HydrophobicContact CG2-CG 3.94Å; T240-L269 WeakPolarHBondContact O-CD2 3.46Å; L243-L269 HydrophobicContact CB-CD1 4.27Å; L243-L269 HydrophobicContact CB-CD2 3.69Å; L243-L269 HydrophobicContact CB-CG 4.33Å; L243-L269 HydrophobicContact CD1-CD1 4.19Å; L244-L269 HydrophobicContact CB-CD2 4.4Å; L244-L269 HydrophobicContact CD1-CD2 4.01Å; I255-L269 HydrophobicContact CD1-CB 4.1Å; I255-L269 HydrophobicContact CD1-CD1 3.74Å; I255-L269 HydrophobicContact CD1-CD2 3.92Å; I255-L269 HydrophobicContact CD1-CG 4.13Å; R265-L269 WeakPolarHBondContact O-CB 3.48Å; R265-L269 PolarHBondContact O-N 3.47Å; R266-L269 PolarHBondContact O-N 3.47Å; E267-L269 PolarHBondContact O-N 2.91Å; L269-Q272 PolarHBondContact O-N 2.84Å; L269-V273 HydrophobicContact CD1-CG2 4.33Å; L269-V273 WeakPolarHBondContact O-CB 3.47Å; L269-V273 VanDerWaalsContact O-CG2 3.22Å; L269-V273 WeakPolarHBondContact O-CG2 3.38Å; L269-V273 PolarHBondContact O-N 3.28Å
270	R	71.1	Confident	65.3	Low	52 Å²	52	56.9 Å²	56.9	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-61	-47.8	174.3	-169.9	178.7	-176.6	-87.6	-5.8	111.2	D237 T240 R266 E267 N268 Q272 V273 I274	D237-R270 WeakPolarHBondContact OD1-CD 3.16Å; D237-R270 IonicContact OD1-CZ 3.9Å; D237-R270 IonicContact OD1-NE 3.82Å; D237-R270 PolarHBondContact OD1-NE 3.03Å; D237-R270 IonicContact OD1-NH2 3.79Å; D237-R270 IonicContact OD2-NH2 2.84Å; T240-R270 HydrophobicContact CG2-CB 3.96Å; T240-R270 WeakPolarHBondContact OG1-CA 3.3Å; R266-R270 VanDerWaalsContact O-CB 3.24Å; R266-R270 WeakPolarHBondContact O-CB 3.14Å; R266-R270 PolarHBondContact O-N 3.41Å; E267-R270 WeakPolarHBondContact O-CB 3.28Å; E267-R270 PolarHBondContact O-N 3.44Å; N268-R270 VanDerWaalsContact C-N 3.31Å; N268-R270 PolarHBondContact O-N 2.85Å; R270-Q272 PolarHBondContact O-N 3.17Å; R270-V273 PolarHBondContact O-N 3.25Å; R270-I274 HydrophobicContact CG-CD1 3.85Å; R270-I274 HydrophobicContact CG-CG1 4.48Å; R270-I274 WeakPolarHBondContact O-CB 3.49Å; R270-I274 VanDerWaalsContact O-CG1 3.27Å; R270-I274 WeakPolarHBondContact O-CG1 3.39Å; R270-I274 PolarHBondContact O-N 2.92Å
271	A	66.1	Low	65.6	Low	36 Å²	36	54.4 Å²	54.4	30%	0.298	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-44.3	176.9	0	0	0	0	0	111.6	E267 N268 I274 L275	E267-A271 WeakPolarHBondContact O-CB 3.29Å; E267-A271 PolarHBondContact O-N 3.42Å; N268-A271 PolarHBondContact O-N 2.97Å; A271-I274 PolarHBondContact O-N 3.35Å; A271-L275 WeakPolarHBondContact O-CB 3.29Å; A271-L275 VanDerWaalsContact O-CG 3.26Å; A271-L275 WeakPolarHBondContact O-CG 3.4Å; A271-L275 PolarHBondContact O-N 3.18Å
272	Q	69.3	Low	65	Low	10 Å²	10	51.4 Å²	51.4	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-42.8	176.4	-70.2	177.8	29.9	0	0	112.7	S123 I125 N268 L269 R270 L275 A276	S123-Q272 PolarHBondContact O-OE1 2.9Å; I125-Q272 HydrophobicContact CD1-CB 3.85Å; I125-Q272 HydrophobicContact CG1-CB 4.18Å; N268-Q272 WeakPolarHBondContact O-CG 3.47Å; N268-Q272 PolarHBondContact O-N 2.92Å; N268-Q272 PolarHBondContact OD1-NE2 3.24Å; L269-Q272 PolarHBondContact O-N 2.84Å; R270-Q272 PolarHBondContact O-N 3.17Å; Q272-L275 PolarHBondContact O-N 2.8Å; Q272-A276 WeakPolarHBondContact O-CB 3.47Å; Q272-A276 PolarHBondContact O-N 2.84Å
273	V	68.4	Low	64	Low	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-43	177.1	169.4	0	0	0	0	110.8	I125 A236 I239 L243 L269 R270 A276 I277	I125-V273 HydrophobicContact CD1-CG2 4.21Å; A236-V273 HydrophobicContact CB-CG1 4.13Å; I239-V273 HydrophobicContact CB-CG1 4.13Å; I239-V273 HydrophobicContact CG2-CG1 3.86Å; I239-V273 HydrophobicContact CG2-CG2 4Å; L243-V273 HydrophobicContact CD1-CG2 3.81Å; L269-V273 HydrophobicContact CD1-CG2 4.33Å; L269-V273 WeakPolarHBondContact O-CB 3.47Å; L269-V273 VanDerWaalsContact O-CG2 3.22Å; L269-V273 WeakPolarHBondContact O-CG2 3.38Å; L269-V273 PolarHBondContact O-N 3.28Å; R270-V273 PolarHBondContact O-N 3.25Å; V273-A276 PolarHBondContact O-N 3.43Å; V273-I277 HydrophobicContact CG1-CD1 3.66Å; V273-I277 HydrophobicContact CG1-CG1 4.33Å; V273-I277 WeakPolarHBondContact O-CB 3.41Å; V273-I277 WeakPolarHBondContact O-CG1 3.31Å; V273-I277 PolarHBondContact O-N 3.26Å
274	I	68.9	Low	62.9	Low	60 Å²	60	51.4 Å²	51.4	31%	0.308	25%	0.253	S	S	.	.	H	α-helix	trans	-63.7	-45	176.8	-70.4	170.8	0	0	0	110.6	A236 R270 A271 A276 I277 H278	A236-I274 HydrophobicContact CB-CG1 3.94Å; R270-I274 HydrophobicContact CG-CD1 3.85Å; R270-I274 HydrophobicContact CG-CG1 4.48Å; R270-I274 WeakPolarHBondContact O-CB 3.49Å; R270-I274 VanDerWaalsContact O-CG1 3.27Å; R270-I274 WeakPolarHBondContact O-CG1 3.39Å; R270-I274 PolarHBondContact O-N 2.92Å; A271-I274 PolarHBondContact O-N 3.35Å; I274-A276 VanDerWaalsContact C-N 3.33Å; I274-A276 PolarHBondContact O-N 3.41Å; I274-I277 PolarHBondContact O-N 3.42Å; I274-H278 VanDerWaalsContact O-CB 3.26Å; I274-H278 WeakPolarHBondContact O-CB 3.38Å; I274-H278 PolarHBondContact O-N 2.89Å
275	L	64.8	Low	61.6	Low	88 Å²	88	49.9 Å²	49.9	46%	0.461	25%	0.251	S	S	.	.	H	α-helix	trans	-61	-41.6	175.9	-75.3	171	0	0	0	111.7	L122 A271 Q272 H278 G279	L122-L275 HydrophobicContact CB-CD1 4.4Å; L122-L275 HydrophobicContact CD1-CD1 3.82Å; A271-L275 WeakPolarHBondContact O-CB 3.29Å; A271-L275 VanDerWaalsContact O-CG 3.26Å; A271-L275 WeakPolarHBondContact O-CG 3.4Å; A271-L275 PolarHBondContact O-N 3.18Å; Q272-L275 PolarHBondContact O-N 2.8Å; L275-H278 PolarHBondContact O-N 3.43Å; L275-G279 PolarHBondContact O-N 3.31Å
276	A	65.7	Low	60.4	Low	13 Å²	13	53.1 Å²	53.1	11%	0.107	27%	0.27	C	S	.	.	H	α-helix	trans	-67.4	-40.6	176.6	0	0	0	0	0	112.4	I125 L127 Q272 V273 I274 H278 G279 F280	I125-A276 VanDerWaalsContact O-CB 3.31Å; I125-A276 WeakPolarHBondContact O-CB 3.41Å; L127-A276 HydrophobicContact CD1-CB 3.81Å; L127-A276 HydrophobicContact CD2-CB 4.48Å; L127-A276 HydrophobicContact CG-CB 3.86Å; Q272-A276 WeakPolarHBondContact O-CB 3.47Å; Q272-A276 PolarHBondContact O-N 2.84Å; V273-A276 PolarHBondContact O-N 3.43Å; I274-A276 VanDerWaalsContact C-N 3.33Å; I274-A276 PolarHBondContact O-N 3.41Å; A276-H278 VanDerWaalsContact C-N 3.33Å; A276-G279 PolarHBondContact O-N 2.91Å; A276-F280 VanDerWaalsContact O-CB 3.31Å; A276-F280 WeakPolarHBondContact O-CB 3.21Å; A276-F280 PolarHBondContact O-N 2.91Å
277	I	64.6	Low	58.7	Low	14 Å²	14	53.8 Å²	53.8	7%	0.072	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-40.6	173.9	-69.9	167.4	0	0	0	110.8	L127 L165 F232 A236 V273 I274 F280 Y281	L127-I277 HydrophobicContact CD1-CG1 4.16Å; L165-I277 HydrophobicContact CD1-CD1 4.3Å; L165-I277 HydrophobicContact CD1-CG1 4.08Å; L165-I277 HydrophobicContact CD1-CG2 3.91Å; L165-I277 HydrophobicContact CD2-CG1 3.83Å; F232-I277 HydrophobicContact CD1-CG2 4.11Å; A236-I277 HydrophobicContact CB-CD1 3.7Å; V273-I277 HydrophobicContact CG1-CD1 3.66Å; V273-I277 HydrophobicContact CG1-CG1 4.33Å; V273-I277 WeakPolarHBondContact O-CB 3.41Å; V273-I277 WeakPolarHBondContact O-CG1 3.31Å; V273-I277 PolarHBondContact O-N 3.26Å; I274-I277 PolarHBondContact O-N 3.42Å; I277-F280 WeakPolarHBondContact O-CB 3.24Å; I277-F280 PolarHBondContact O-N 2.94Å; I277-Y281 PolarHBondContact O-N 3.5Å
278	H	60.1	Low	57.3	Low	83 Å²	83	50.7 Å²	50.7	38%	0.384	27%	0.267	S	S	.	.	H	α-helix	trans	-68.8	-45	178	-172.3	-79.2	0	0	0	111.4	P222 I274 L275 A276 F280 Y281 C282	P222-H278 WeakPolarHBondContact CD-NE2 3.29Å; P222-H278 WeakPolarHBondContact CG-NE2 3.19Å; I274-H278 VanDerWaalsContact O-CB 3.26Å; I274-H278 WeakPolarHBondContact O-CB 3.38Å; I274-H278 PolarHBondContact O-N 2.89Å; L275-H278 PolarHBondContact O-N 3.43Å; A276-H278 VanDerWaalsContact C-N 3.33Å; H278-F280 VanDerWaalsContact C-N 3.29Å; H278-F280 PolarHBondContact O-N 2.88Å; H278-Y281 PolarHBondContact O-N 3.11Å; H278-Y281 VanDerWaalsContact O-N 3.11Å; H278-C282 PolarHBondContact CE1-SG 2.71Å; H278-C282 PolarHBondContact O-N 3.44Å; H278-C282 PolarHBondContact O-SG 3.42Å; H278-C282 VanDerWaalsContact O-SG 3.39Å
279	G	58	Low	55.8	Low	26 Å²	26	55 Å²	55	27%	0.268	29%	0.285	S	S	.	.	H	α-helix	trans	-57	-43.6	172.7	0	0	0	0	0	111.6	L275 A276 Y281 C282 H283	L275-G279 PolarHBondContact O-N 3.31Å; A276-G279 PolarHBondContact O-N 2.91Å; G279-Y281 PolarHBondContact O-N 3.39Å; G279-C282 PolarHBondContact O-N 2.91Å; G279-H283 PolarHBondContact O-CD2 3.37Å; G279-H283 VanDerWaalsContact O-CD2 3.26Å; G279-H283 PolarHBondContact O-N 3.09Å
280	F	57.5	Low	54.2	Low	19 Å²	19	61.6 Å²	61.6	8%	0.083	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-48.8	171.8	179.8	-73.2	0	0	0	111.7	V166 S169 A276 I277 H278 C282 F284 M575	V166-F280 HydrophobicContact CB-CZ 4.36Å; V166-F280 HydrophobicContact CG1-CZ 4.4Å; V166-F280 HydrophobicContact CG2-CE2 3.97Å; V166-F280 HydrophobicContact CG2-CZ 3.94Å; S169-F280 WeakPolarHBondContact OG-CE1 3.13Å; A276-F280 VanDerWaalsContact O-CB 3.31Å; A276-F280 WeakPolarHBondContact O-CB 3.21Å; A276-F280 PolarHBondContact O-N 2.91Å; I277-F280 WeakPolarHBondContact O-CB 3.24Å; I277-F280 PolarHBondContact O-N 2.94Å; H278-F280 VanDerWaalsContact C-N 3.29Å; H278-F280 PolarHBondContact O-N 2.88Å; F280-C282 VanDerWaalsContact C-N 3.29Å; F280-C282 PolarHBondContact O-N 3.31Å; F280-F284 AromaticContact CD1-CD2 3.87Å; F280-F284 HydrophobicContact CD1-CD2 3.87Å; F280-F284 HydrophobicContact CD1-CE2 4.1Å; F280-F284 HydrophobicContact CD2-CE2 4.13Å; F280-F284 AromaticContact CE1-CD2 3.45Å; F280-F284 HydrophobicContact CE1-CD2 3.45Å; F280-F284 VanDerWaalsContact CE1-CD2 3.45Å; F280-F284 AromaticContact CE1-CE2 3.42Å; F280-F284 HydrophobicContact CE1-CE2 3.42Å; F280-F284 VanDerWaalsContact CE1-CE2 3.42Å; F280-F284 HydrophobicContact CE1-CG 4.48Å; F280-F284 HydrophobicContact CE1-CZ 4.42Å; F280-F284 HydrophobicContact CE2-CD2 4.28Å; F280-F284 AromaticContact CE2-CE2 3.56Å; F280-F284 HydrophobicContact CE2-CE2 3.56Å; F280-F284 HydrophobicContact CE2-CZ 4.45Å; F280-F284 HydrophobicContact CG-CD2 4.36Å; F280-F284 HydrophobicContact CG-CE2 4.39Å; F280-F284 AromaticContact CZ-CD2 3.72Å; F280-F284 HydrophobicContact CZ-CD2 3.72Å; F280-F284 AromaticContact CZ-CE2 3.14Å; F280-F284 HydrophobicContact CZ-CE2 3.14Å; F280-F284 AromaticContact CZ-CZ 3.93Å; F280-F284 HydrophobicContact CZ-CZ 3.93Å; F280-F284 WeakPolarHBondContact O-CD2 3.3Å; F280-F284 PolarHBondContact O-N 3.31Å; F280-M575 HydrophobicContact CD2-CE 3.7Å; F280-M575 HydrophobicContact CD2-SD 4.13Å; F280-M575 HydrophobicContact CE2-CE 3.23Å; F280-M575 HydrophobicContact CE2-SD 3.49Å; F280-M575 WeakPolarHBondContact CE2-SD 3.18Å; F280-M575 HydrophobicContact CZ-CE 4.2Å
281	Y	53.6	Low	52.3	Low	35 Å²	35	66.2 Å²	66.2	14%	0.137	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-37.2	-179.6	-167.2	-93.9	0	0	0	112	P222 F232 I277 H278 G279	P222-Y281 HydrophobicContact CB-CD1 3.75Å; P222-Y281 HydrophobicContact CB-CE1 3.72Å; P222-Y281 HydrophobicContact CG-CD1 4.15Å; F232-Y281 HydrophobicContact CZ-CD2 4.49Å; I277-Y281 PolarHBondContact O-N 3.5Å; H278-Y281 PolarHBondContact O-N 3.11Å; H278-Y281 VanDerWaalsContact O-N 3.11Å; G279-Y281 PolarHBondContact O-N 3.39Å
282	C	50.9	Low	50.7	Low	46 Å²	46	68.7 Å²	68.7	31%	0.311	36%	0.36	S	S	.	.	H	α-helix	trans	-71.9	-45.3	177.8	-68.2	0	0	0	0	113.3	H278 G279 F280 F284 N285	H278-C282 PolarHBondContact CE1-SG 2.71Å; H278-C282 PolarHBondContact O-N 3.44Å; H278-C282 PolarHBondContact O-SG 3.42Å; H278-C282 VanDerWaalsContact O-SG 3.39Å; G279-C282 PolarHBondContact O-N 2.91Å; F280-C282 VanDerWaalsContact C-N 3.29Å; F280-C282 PolarHBondContact O-N 3.31Å; C282-F284 VanDerWaalsContact C-N 3.27Å; C282-F284 PolarHBondContact O-N 3.39Å; C282-N285 WeakPolarHBondContact O-CB 3.49Å; C282-N285 PolarHBondContact O-N 2.78Å
283	H	46.7	Very low	48.8	Very low	110 Å²	110	77.1 Å²	77.1	51%	0.509	39%	0.393	S	S	.	.	H	α-helix	trans	-64.6	-29.9	-178.9	-80.6	-60.8	0	0	0	113	G279 N285 E286 I287	G279-H283 PolarHBondContact O-CD2 3.37Å; G279-H283 VanDerWaalsContact O-CD2 3.26Å; G279-H283 PolarHBondContact O-N 3.09Å; H283-N285 PolarHBondContact O-N 3.47Å; H283-E286 PolarHBondContact O-N 3.06Å; H283-I287 VanDerWaalsContact O-CD1 3.3Å; H283-I287 WeakPolarHBondContact O-CD1 3.34Å; H283-I287 WeakPolarHBondContact O-CG1 3.4Å
284	F	44.2	Very low	47.2	Very low	43 Å²	43	86.3 Å²	86.3	19%	0.189	44%	0.436	C	S	.	.	H	α-helix	trans	-66.4	-14.8	172.3	-90.9	-83.7	0	0	0	113.9	K173 F280 C282 L572 M575	K173-F284 PolarHBondContact NZ-O 2.93Å; F280-F284 AromaticContact CD1-CD2 3.87Å; F280-F284 HydrophobicContact CD1-CD2 3.87Å; F280-F284 HydrophobicContact CD1-CE2 4.1Å; F280-F284 HydrophobicContact CD2-CE2 4.13Å; F280-F284 AromaticContact CE1-CD2 3.45Å; F280-F284 HydrophobicContact CE1-CD2 3.45Å; F280-F284 VanDerWaalsContact CE1-CD2 3.45Å; F280-F284 AromaticContact CE1-CE2 3.42Å; F280-F284 HydrophobicContact CE1-CE2 3.42Å; F280-F284 VanDerWaalsContact CE1-CE2 3.42Å; F280-F284 HydrophobicContact CE1-CG 4.48Å; F280-F284 HydrophobicContact CE1-CZ 4.42Å; F280-F284 HydrophobicContact CE2-CD2 4.28Å; F280-F284 AromaticContact CE2-CE2 3.56Å; F280-F284 HydrophobicContact CE2-CE2 3.56Å; F280-F284 HydrophobicContact CE2-CZ 4.45Å; F280-F284 HydrophobicContact CG-CD2 4.36Å; F280-F284 HydrophobicContact CG-CE2 4.39Å; F280-F284 AromaticContact CZ-CD2 3.72Å; F280-F284 HydrophobicContact CZ-CD2 3.72Å; F280-F284 AromaticContact CZ-CE2 3.14Å; F280-F284 HydrophobicContact CZ-CE2 3.14Å; F280-F284 AromaticContact CZ-CZ 3.93Å; F280-F284 HydrophobicContact CZ-CZ 3.93Å; F280-F284 WeakPolarHBondContact O-CD2 3.3Å; F280-F284 PolarHBondContact O-N 3.31Å; C282-F284 VanDerWaalsContact C-N 3.27Å; C282-F284 PolarHBondContact O-N 3.39Å; F284-L572 HydrophobicContact CE2-CD2 4.4Å; F284-L572 HydrophobicContact CZ-CD2 4.46Å; F284-M575 HydrophobicContact CE2-CE 4.16Å
285	N	41.8	Very low	45.2	Very low	92 Å²	92	93 Å²	93	49%	0.492	46%	0.463	S	S	.	.	H	α-helix	trans	-73.9	-33.9	173.2	-75.1	-17.6	0	0	0	112.2	C282 H283	C282-N285 WeakPolarHBondContact O-CB 3.49Å; C282-N285 PolarHBondContact O-N 2.78Å; H283-N285 PolarHBondContact O-N 3.47Å
286	E	37.7	Very low	43.6	Very low	148 Å²	148	98.2 Å²	98.2	69%	0.692	48%	0.482	S	S	*	.	H	α-helix	trans	-80.5	-38.9	-168.5	-155.4	164.7	-160.7	0	0	112.9	H283 S288	H283-E286 PolarHBondContact O-N 3.06Å; E286-S288 VanDerWaalsContact C-N 3.32Å; E286-S288 PolarHBondContact O-N 2.79Å
287	I	37.3	Very low	42	Very low	87 Å²	87	106 Å²	106	45%	0.446	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-4.5	-166.9	-32	138	0	0	0	113.7	H283 L572	H283-I287 VanDerWaalsContact O-CD1 3.3Å; H283-I287 WeakPolarHBondContact O-CD1 3.34Å; H283-I287 WeakPolarHBondContact O-CG1 3.4Å; I287-L572 HydrophobicContact CD1-CD1 3.5Å; I287-L572 VanDerWaalsContact CD1-CD1 3.5Å; I287-L572 HydrophobicContact CD1-CD2 3.87Å; I287-L572 HydrophobicContact CD1-CG 4.33Å; I287-L572 HydrophobicContact CG1-CD1 4.21Å
288	S	39.6	Very low	40.1	Very low	32 Å²	32	113.1 Å²	113.1	22%	0.224	55%	0.554	C	S	.	*	T	Hydrogen-bonded Turn	trans	-106.8	-0.6	-172.5	-173.8	0	0	0	0	114.5	K173 E286 D290 T292	K173-S288 VanDerWaalsContact NZ-CB 3.28Å; E286-S288 VanDerWaalsContact C-N 3.32Å; E286-S288 PolarHBondContact O-N 2.79Å; S288-D290 PolarHBondContact O-N 3.2Å; S288-T292 PolarHBondContact O-OG1 3.43Å
289	E	37.2	Very low	38.5	Very low	161 Å²	161	116.8 Å²	116.8	75%	0.752	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-30.3	175.9	-68.1	-162.6	157.1	0	0	111.9
290	D	34.2	Very low	37	Very low	139 Å²	139	120.4 Å²	120.4	74%	0.743	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-37.1	-178	-72.5	-26.6	0	0	0	115	S288 T292	S288-D290 PolarHBondContact O-N 3.2Å; D290-T292 PolarHBondContact O-N 3.44Å
291	N	31.3	Very low	35.5	Very low	148 Å²	148	126.2 Å²	126.2	79%	0.791	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	17.1	-167.8	-76.5	3.3	0	0	0	116.7
292	T	32.3	Very low	34.4	Very low	89 Å²	89	130.2 Å²	130.2	55%	0.546	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.3	10.1	174.7	-32.6	0	0	0	0	113.4	S288 D290	S288-T292 PolarHBondContact O-OG1 3.43Å; D290-T292 PolarHBondContact O-N 3.44Å
293	Y	30.2	Very low	33.3	Very low	187 Å²	187	134.3 Å²	134.3	73%	0.733	68%	0.675	S	S	*	*	S	Bend	trans	-104.4	67.7	176.2	-114.2	-83.5	0	0	0	111
294	E	34.3	Very low	32.3	Very low	193 Å²	193	136.3 Å²	136.3	90%	0.902	69%	0.689	S	S	*	*	S	Bend	trans	-161.6	-17.8	155.4	-117.8	175.3	-158.4	0	0	115.5	K296	E294-K296 PolarHBondContact O-N 2.84Å
295	F	27.9	Very low	31.6	Very low	200 Å²	200	142 Å²	142	88%	0.877	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	9.2	-170.6	-152.5	-103.5	0	0	0	117.5
296	K	31.2	Very low	31.5	Very low	197 Å²	197	142.2 Å²	142.2	86%	0.857	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.1	47.5	-179.3	-72.3	-162.4	177.8	-178.2	0	116.6	E294	E294-K296 PolarHBondContact O-N 2.84Å
297	Q	30.8	Very low	31.2	Very low	178 Å²	178	143.9 Å²	143.9	83%	0.832	74%	0.738	S	S	*	*	S	Bend	trans	-140.8	74	152.5	-75.2	-171.2	19.4	0	0	109.7
298	N	26.4	Very low	30.8	Very low	162 Å²	162	147.9 Å²	147.9	87%	0.866	76%	0.761	S	S	*	*	S	Bend	trans	-159.3	33.2	160.2	-92.2	-21	0	0	0	112
299	N	25.9	Very low	30.2	Very low	161 Å²	161	149.6 Å²	149.6	86%	0.861	78%	0.783	S	S	*	*			trans	-134.2	52.1	163.3	-90.8	-29.6	0	0	0	108.3
300	S	25.8	Very low	29.5	Very low	101 Å²	101	147.3 Å²	147.3	71%	0.706	79%	0.785	S	S	*	*			trans	-86.3	107.4	155.1	-176.3	0	0	0	0	106.1	V302	S300-V302 PolarHBondContact O-N 3.42Å
301	I	25.3	Very low	29.2	Very low	142 Å²	142	150.1 Å²	150.1	73%	0.728	79%	0.791	S	S	*	*			trans	-63.8	88.6	167	-65.7	158	0	0	0	105.6
302	V	30.7	Very low	28.8	Very low	119 Å²	119	149.3 Å²	149.3	72%	0.721	79%	0.786	S	S	*	*			trans	-89.2	106.9	158	178.4	0	0	0	0	104.6	S300 D304	S300-V302 PolarHBondContact O-N 3.42Å; V302-D304 PolarHBondContact O-N 2.84Å
303	N	27.7	Very low	28.7	Very low	132 Å²	132	153.2 Å²	153.2	71%	0.706	80%	0.803	S	S	*	*			trans	-56.5	115.9	169.1	-59.8	-65.4	0	0	0	107.7	D305	N303-D305 PolarHBondContact O-N 3.32Å
304	D	27	Very low	28.4	Very low	151 Å²	151	149.2 Å²	149.2	81%	0.807	80%	0.802	S	S	*	*			trans	-64.3	109.2	149.7	-73.1	-40.4	0	0	0	106.7	V302	V302-D304 PolarHBondContact O-N 2.84Å
305	D	28.2	Very low	27.8	Very low	162 Å²	162	147.1 Å²	147.1	87%	0.866	80%	0.797	S	S	*	*			trans	-98.7	112.1	145.4	-128.2	-19.5	0	0	0	106.3	N303	N303-D305 PolarHBondContact O-N 3.32Å
306	P	40.6	Very low	28.1	Very low	97 Å²	97	141.3 Å²	141.3	63%	0.63	79%	0.794	S	S	*	*			trans	-87.3	148.9	-169.7	35.2	-32.7	0	0	0	110.3
307	M	32.2	Very low	27.8	Very low	184 Å²	184	135.9 Å²	135.9	91%	0.906	78%	0.781	S	S	*	*			trans	117.7	62.5	170.8	-63.3	-64.8	-172.1	0	0	114.2
308	N	28.3	Very low	27.5	Very low	171 Å²	171	136.1 Å²	136.1	91%	0.914	78%	0.782	S	S	*	*			trans	-151.4	109.1	148.6	-127.3	9.6	0	0	0	103.7
309	G	26.4	Very low	27.8	Very low	68 Å²	68	134.3 Å²	134.3	70%	0.701	78%	0.782	S	S	*	*			cis	127.8	108.8	39.6	0	0	0	0	0	104.1
310	S	22.9	Very low	27.6	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	78%	0.78	S	S	*	*			trans	-52.7	130	178.9	54.1	0	0	0	0	113.2
311	F	27.8	Very low	28.2	Very low	198 Å²	198	130.9 Å²	130.9	87%	0.868	78%	0.783	S	S	*	*			trans	-156.6	99.7	148	-89.9	-80.7	0	0	0	103.8
312	D	23.5	Very low	28.6	Very low	131 Å²	131	131.5 Å²	131.5	70%	0.701	79%	0.788	S	S	*	*				36.1	95.2	78.7	-161.3	13.7	0	0	0	113.2
313	L	29.7	Very low	28.6	Very low	171 Å²	171	132.9 Å²	132.9	90%	0.895	79%	0.791	S	S	*	*			trans	-146.3	77.5	151.9	-72.6	-178.1	0	0	0	106.7
314	S	23	Very low	28.6	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	80%	0.796	S	S	*	*			trans	-69.7	148.2	145.2	-76.2	0	0	0	0	109.6
315	D	23.6	Very low	28.9	Very low	149 Å²	149	134.2 Å²	134.2	80%	0.797	80%	0.798	S	S	*	*			trans	87	124.6	163.6	-150.4	9.5	0	0	0	117.8	S317	D315-S317 PolarHBondContact OD1-OG 2.91Å
316	G	32.2	Very low	28.9	Very low	78 Å²	78	133.7 Å²	133.7	80%	0.804	79%	0.793	S	S	*	*			trans	174.8	59.4	-169.8	0	0	0	0	0	108.6
317	S	25.8	Very low	28.5	Very low	83 Å²	83	136.4 Å²	136.4	58%	0.58	81%	0.807	S	S	*	*			trans	-65.4	150	179.8	-10.7	0	0	0	0	112.4	D315	D315-S317 PolarHBondContact OD1-OG 2.91Å
318	E	24.5	Very low	28.3	Very low	184 Å²	184	131.2 Å²	131.2	86%	0.86	80%	0.801	S	S	*	*			trans	59.7	108.8	143.3	-60.9	-176	-176.6	0	0	121.5
319	S	32.3	Very low	28.5	Very low	124 Å²	124	125.9 Å²	125.9	87%	0.867	78%	0.781	S	S	*	*			trans	169.2	109.3	134.4	-77.5	0	0	0	0	106.3
320	G	22	Very low	28.9	Very low	79 Å²	79	131.5 Å²	131.5	81%	0.814	79%	0.786	S	S	*	*				83.1	95.1	57.7	0	0	0	0	0	109.3
321	S	37.7	Very low	29.2	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	79%	0.788	S	S	*	*			trans	172.8	123.4	149.1	-169.9	0	0	0	0	112.7
322	D	34.8	Very low	29.6	Very low	155 Å²	155	130.9 Å²	130.9	83%	0.829	78%	0.781	S	S	*	*			trans	62.9	103.3	150.6	-81.5	-14.2	0	0	0	121.7
323	D	30.5	Very low	30.6	Very low	148 Å²	148	129.6 Å²	129.6	79%	0.791	78%	0.778	S	S	*	*			trans	-66.4	134.3	147.9	-72.3	-49.3	0	0	0	111.6
324	N	28.2	Very low	31.3	Very low	149 Å²	149	129.6 Å²	129.6	80%	0.797	77%	0.773	S	S	*	*				168.3	117.6	121.8	-86.6	-39.6	0	0	0	110.1
325	D	33.3	Very low	32.4	Very low	162 Å²	162	130.9 Å²	130.9	87%	0.866	77%	0.771	S	S	*	*			trans	164.7	83.9	137.4	-86.2	-17.8	0	0	0	109.6
326	M	28.4	Very low	33.9	Very low	151 Å²	151	126 Å²	126	74%	0.744	75%	0.748	S	S	*	*			trans	-133.6	72.1	168.2	-91.8	-66.6	-172.7	0	0	111.6	A329	M326-A329 HydrophobicContact CE-CB 3.35Å; M326-A329 HydrophobicContact SD-CB 3.31Å; M326-A329 WeakPolarHBondContact SD-CB 3.45Å
327	T	31.1	Very low	35.8	Very low	153 Å²	153	127.3 Å²	127.3	94%	0.939	74%	0.743	S	S	*	*	S	Bend	trans	-128.5	88.3	145.3	48.5	0	0	0	0	108.1
328	G	28.3	Very low	37.6	Very low	75 Å²	75	126.9 Å²	126.9	77%	0.773	74%	0.744	S	S	*	*	S	Bend	trans	158.1	-11.1	174.6	0	0	0	0	0	117.4	K330	G328-K330 PolarHBondContact O-N 3.26Å; G328-K330 VanDerWaalsContact O-N 3.15Å
329	A	31.8	Very low	39.9	Very low	60 Å²	60	122.9 Å²	122.9	50%	0.496	73%	0.728	S	S	.	*			trans	-81.9	102.5	170.6	0	0	0	0	0	109.2	M326 L331	M326-A329 HydrophobicContact CE-CB 3.35Å; M326-A329 HydrophobicContact SD-CB 3.31Å; M326-A329 WeakPolarHBondContact SD-CB 3.45Å; A329-L331 PolarHBondContact O-N 2.79Å; A329-L331 VanDerWaalsContact O-N 3.13Å
330	K	34.6	Very low	41.9	Very low	185 Å²	185	119.8 Å²	119.8	80%	0.804	70%	0.704	S	S	*	*			trans	-25.9	119.9	154.1	-76.4	172.1	173.2	177.1	0	109.3	G328 I332	G328-K330 PolarHBondContact O-N 3.26Å; G328-K330 VanDerWaalsContact O-N 3.15Å; K330-I332 HydrophobicContact CB-CG1 4.5Å; K330-I332 PolarHBondContact O-N 2.92Å
331	L	30.3	Very low	44.1	Very low	156 Å²	156	121.8 Å²	121.8	82%	0.817	69%	0.692	S	S	*	*			trans	-55.7	82.2	164	-71.1	166.3	0	0	0	108.2	A329 T333	A329-L331 PolarHBondContact O-N 2.79Å; A329-L331 VanDerWaalsContact O-N 3.13Å; L331-T333 HydrophobicContact CD2-CG2 4.41Å; L331-T333 PolarHBondContact O-N 2.8Å
332	I	35.6	Very low	45.6	Very low	142 Å²	142	118.4 Å²	118.4	73%	0.728	67%	0.671	S	S	*	*			trans	-81.3	60.7	149.6	-50.3	171.4	0	0	0	103.5	K330 Q334	K330-I332 HydrophobicContact CB-CG1 4.5Å; K330-I332 PolarHBondContact O-N 2.92Å; I332-Q334 HydrophobicContact CG2-CG 4.44Å; I332-Q334 PolarHBondContact O-N 3.35Å
333	T	45	Very low	47	Very low	103 Å²	103	114.2 Å²	114.2	63%	0.632	65%	0.653	S	S	*	*			trans	-62.5	94.1	153.9	20.4	0	0	0	0	103.5	L331 L335	L331-T333 HydrophobicContact CD2-CG2 4.41Å; L331-T333 PolarHBondContact O-N 2.8Å; T333-L335 PolarHBondContact O-N 3.4Å
334	Q	44.8	Very low	49	Very low	172 Å²	172	111.5 Å²	111.5	80%	0.804	64%	0.638	S	S	*	*			trans	-50.1	97.9	164.8	-90.2	-170.5	-5.2	0	0	106	I332 S336	I332-Q334 HydrophobicContact CG2-CG 4.44Å; I332-Q334 PolarHBondContact O-N 3.35Å; Q334-S336 PolarHBondContact O-N 3.14Å
335	L	46.3	Very low	51.1	Low	130 Å²	130	108.3 Å²	108.3	68%	0.681	62%	0.621	S	S	*	*			trans	-52.6	114.7	163.6	-89.6	145.4	0	0	0	105.4	T333 P337 V340	T333-L335 PolarHBondContact O-N 3.4Å; L335-P337 WeakPolarHBondContact O-CD 3.35Å; L335-P337 VanDerWaalsContact O-N 3.16Å; L335-V340 HydrophobicContact CB-CG2 3.91Å; L335-V340 HydrophobicContact CD2-CG2 4.33Å
336	S	53.6	Low	53	Low	45 Å²	45	109.6 Å²	109.6	32%	0.315	61%	0.614	S	S	.	*			trans	-57.8	127.9	-179	99.2	0	0	0	0	107.1	Q334 A338 I339 V340	Q334-S336 PolarHBondContact O-N 3.14Å; S336-A338 PolarHBondContact O-N 3.33Å; S336-I339 PolarHBondContact O-N 2.91Å; S336-I339 WeakPolarHBondContact OG-CD1 3.37Å; S336-I339 VanDerWaalsContact OG-CG1 3.23Å; S336-I339 WeakPolarHBondContact OG-CG1 3.35Å; S336-I339 PolarHBondContact OG-N 3.42Å; S336-I339 VanDerWaalsContact OG-N 3.13Å; S336-V340 PolarHBondContact O-N 3.5Å; S336-V340 VanDerWaalsContact O-N 3.16Å
337	P	72.7	Confident	54.9	Low	107 Å²	107	108.2 Å²	108.2	70%	0.695	60%	0.604	S	S	*	*	H	α-helix	trans	-55.4	-28.3	-179.9	-27.9	34.6	0	0	0	112.2	L335 V340 Q341	L335-P337 WeakPolarHBondContact O-CD 3.35Å; L335-P337 VanDerWaalsContact O-N 3.16Å; P337-V340 PolarHBondContact O-N 3.48Å; P337-Q341 VanDerWaalsContact O-CB 3.28Å; P337-Q341 WeakPolarHBondContact O-CB 3.17Å; P337-Q341 PolarHBondContact O-N 2.85Å
338	A	63.4	Low	57	Low	73 Å²	73	105.9 Å²	105.9	60%	0.603	59%	0.586	S	S	*	*	H	α-helix	trans	-65.8	-39	175	0	0	0	0	0	113.1	S336 A342	S336-A338 PolarHBondContact O-N 3.33Å; A338-A342 WeakPolarHBondContact O-CB 3.28Å; A338-A342 PolarHBondContact O-N 2.96Å
339	I	72.3	Confident	59.2	Low	100 Å²	100	107.4 Å²	107.4	51%	0.513	57%	0.573	S	S	.	*	H	α-helix	trans	-69.9	-40.7	175.9	-67.9	162.5	0	0	0	110.3	S336 A342 S343	S336-I339 PolarHBondContact O-N 2.91Å; S336-I339 WeakPolarHBondContact OG-CD1 3.37Å; S336-I339 VanDerWaalsContact OG-CG1 3.23Å; S336-I339 WeakPolarHBondContact OG-CG1 3.35Å; S336-I339 PolarHBondContact OG-N 3.42Å; S336-I339 VanDerWaalsContact OG-N 3.13Å; I339-A342 PolarHBondContact O-N 2.86Å; I339-S343 WeakPolarHBondContact O-CB 3.18Å; I339-S343 PolarHBondContact O-N 2.75Å; I339-S343 PolarHBondContact O-OG 2.7Å
340	V	74.4	Confident	61.1	Low	59 Å²	59	110 Å²	110	36%	0.358	57%	0.573	S	S	.	*	H	α-helix	trans	-62.4	-47.3	175.8	178.8	0	0	0	0	110.2	L335 S336 P337 S343 L344	L335-V340 HydrophobicContact CB-CG2 3.91Å; L335-V340 HydrophobicContact CD2-CG2 4.33Å; S336-V340 PolarHBondContact O-N 3.5Å; S336-V340 VanDerWaalsContact O-N 3.16Å; P337-V340 PolarHBondContact O-N 3.48Å; V340-S343 PolarHBondContact O-N 2.96Å; V340-L344 HydrophobicContact CG1-CD1 4.04Å; V340-L344 WeakPolarHBondContact O-CG 3.09Å; V340-L344 PolarHBondContact O-N 3.24Å
341	Q	69.7	Low	62.8	Low	122 Å²	122	104.6 Å²	104.6	57%	0.57	55%	0.553	S	S	*	*	H	α-helix	trans	-64.3	-42.7	178	-167.2	64.7	29.7	0	0	111.8	P337 S343 L344 D345	P337-Q341 VanDerWaalsContact O-CB 3.28Å; P337-Q341 WeakPolarHBondContact O-CB 3.17Å; P337-Q341 PolarHBondContact O-N 2.85Å; Q341-S343 VanDerWaalsContact C-N 3.27Å; Q341-S343 PolarHBondContact O-N 3.41Å; Q341-L344 PolarHBondContact O-N 2.96Å; Q341-D345 VanDerWaalsContact O-CB 3.3Å; Q341-D345 WeakPolarHBondContact O-CB 3.49Å; Q341-D345 PolarHBondContact O-N 3.46Å
342	A	68	Low	64.5	Low	40 Å²	40	104.6 Å²	104.6	33%	0.331	54%	0.542	S	S	.	.	H	α-helix	trans	-64.2	-33.3	176.1	0	0	0	0	0	112.2	A338 I339 R346	A338-A342 WeakPolarHBondContact O-CB 3.28Å; A338-A342 PolarHBondContact O-N 2.96Å; I339-A342 PolarHBondContact O-N 2.86Å; A342-R346 WeakPolarHBondContact O-CB 3.41Å; A342-R346 WeakPolarHBondContact O-CG 3.31Å; A342-R346 PolarHBondContact O-N 3.29Å
343	S	64.2	Low	66.3	Low	66 Å²	66	102.4 Å²	102.4	46%	0.462	53%	0.532	S	S	.	.	H	α-helix	trans	-72.6	-41	176.2	-57.4	0	0	0	0	111.6	I339 V340 Q341 R346 F347	I339-S343 WeakPolarHBondContact O-CB 3.18Å; I339-S343 PolarHBondContact O-N 2.75Å; I339-S343 PolarHBondContact O-OG 2.7Å; V340-S343 PolarHBondContact O-N 2.96Å; Q341-S343 VanDerWaalsContact C-N 3.27Å; Q341-S343 PolarHBondContact O-N 3.41Å; S343-R346 PolarHBondContact O-N 2.98Å; S343-F347 WeakPolarHBondContact O-CB 3.21Å; S343-F347 PolarHBondContact O-N 3.3Å
344	L	72.9	Confident	67.4	Low	91 Å²	91	102.5 Å²	102.5	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-63.5	-44	173.2	-74.1	169.4	0	0	0	111.6	V340 Q341 R346 F347 D348	V340-L344 HydrophobicContact CG1-CD1 4.04Å; V340-L344 WeakPolarHBondContact O-CG 3.09Å; V340-L344 PolarHBondContact O-N 3.24Å; Q341-L344 PolarHBondContact O-N 2.96Å; L344-R346 PolarHBondContact O-N 3.05Å; L344-F347 WeakPolarHBondContact O-CB 3.23Å; L344-F347 PolarHBondContact O-N 2.85Å; L344-F347 VanDerWaalsContact O-N 3.12Å; L344-D348 PolarHBondContact O-N 2.84Å
345	D	73.1	Confident	68.6	Low	82 Å²	82	100.5 Å²	100.5	44%	0.439	51%	0.514	S	S	.	.	H	α-helix	trans	-66.3	-38.1	179.1	-153.6	40	0	0	0	111.3	Q341 F347 D348 H349	Q341-D345 VanDerWaalsContact O-CB 3.3Å; Q341-D345 WeakPolarHBondContact O-CB 3.49Å; Q341-D345 PolarHBondContact O-N 3.46Å; D345-F347 VanDerWaalsContact C-N 3.35Å; D345-F347 PolarHBondContact O-N 3Å; D345-D348 PolarHBondContact O-N 2.81Å; D345-H349 WeakPolarHBondContact O-CB 3.36Å; D345-H349 PolarHBondContact O-CD2 3.47Å; D345-H349 PolarHBondContact O-N 2.88Å; D345-H349 IonicContact OD2-NE2 2.81Å
346	R	71.6	Confident	69.6	Low	190 Å²	190	100.1 Å²	100.1	72%	0.717	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-40.1	170.4	-75.1	176.4	-150.3	-157.6	7.2	112.1	A342 S343 L344 F350	A342-R346 WeakPolarHBondContact O-CB 3.41Å; A342-R346 WeakPolarHBondContact O-CG 3.31Å; A342-R346 PolarHBondContact O-N 3.29Å; S343-R346 PolarHBondContact O-N 2.98Å; L344-R346 PolarHBondContact O-N 3.05Å; R346-F350 WeakPolarHBondContact O-CB 3.42Å; R346-F350 PolarHBondContact O-N 3.3Å
347	F	69.8	Low	69.8	Low	122 Å²	122	104.6 Å²	104.6	54%	0.535	52%	0.523	S	S	.	.	H	α-helix	trans	-67.1	-43.8	178.2	-174.7	-99.7	0	0	0	111.8	S343 L344 D345 F350 N351	S343-F347 WeakPolarHBondContact O-CB 3.21Å; S343-F347 PolarHBondContact O-N 3.3Å; L344-F347 WeakPolarHBondContact O-CB 3.23Å; L344-F347 PolarHBondContact O-N 2.85Å; L344-F347 VanDerWaalsContact O-N 3.12Å; D345-F347 VanDerWaalsContact C-N 3.35Å; D345-F347 PolarHBondContact O-N 3Å; F347-F350 WeakPolarHBondContact O-CB 3.42Å; F347-F350 PolarHBondContact O-N 3.38Å; F347-N351 WeakPolarHBondContact CE1-ND2 3.05Å; F347-N351 PolarHBondContact O-N 2.86Å
348	D	74.6	Confident	69.2	Low	104 Å²	104	108.1 Å²	108.1	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-63.6	-43.3	175.1	-86.5	-4.3	0	0	0	111.8	L344 D345 F350 N351 W352	L344-D348 PolarHBondContact O-N 2.84Å; D345-D348 PolarHBondContact O-N 2.81Å; D348-F350 VanDerWaalsContact C-N 3.32Å; D348-F350 PolarHBondContact O-N 3.18Å; D348-N351 PolarHBondContact O-N 2.93Å; D348-W352 VanDerWaalsContact O-CB 3.3Å; D348-W352 WeakPolarHBondContact O-CB 3.29Å; D348-W352 PolarHBondContact O-N 3.25Å
349	H	74.5	Confident	68.7	Low	107 Å²	107	108 Å²	108	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-62	-37.8	174	-80.7	-49	0	0	0	112.8	D345 N353	D345-H349 WeakPolarHBondContact O-CB 3.36Å; D345-H349 PolarHBondContact O-CD2 3.47Å; D345-H349 PolarHBondContact O-N 2.88Å; D345-H349 IonicContact OD2-NE2 2.81Å; H349-N353 WeakPolarHBondContact O-CB 3.31Å; H349-N353 PolarHBondContact O-N 3Å
350	F	71.1	Confident	67.7	Low	114 Å²	114	106.8 Å²	106.8	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-45.2	175.7	-176.5	-100.7	0	0	0	112	R346 F347 D348 N353 K354	R346-F350 WeakPolarHBondContact O-CB 3.42Å; R346-F350 PolarHBondContact O-N 3.3Å; F347-F350 WeakPolarHBondContact O-CB 3.42Å; F347-F350 PolarHBondContact O-N 3.38Å; D348-F350 VanDerWaalsContact C-N 3.32Å; D348-F350 PolarHBondContact O-N 3.18Å; F350-N353 PolarHBondContact O-N 2.85Å; F350-K354 HydrophobicContact CD1-CD 4.47Å; F350-K354 HydrophobicContact CE1-CD 3.89Å; F350-K354 VanDerWaalsContact CE1-CE 3.46Å; F350-K354 HydrophobicContact CE1-CG 4.49Å; F350-K354 HydrophobicContact CZ-CD 4.27Å; F350-K354 VanDerWaalsContact CZ-CE 3.46Å; F350-K354 PolarHBondContact O-N 2.91Å
351	N	69.9	Low	66.6	Low	72 Å²	72	106.6 Å²	106.6	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-64.6	-42.3	175.9	-86	-24.3	0	0	0	112.1	F347 D348 N353 K354 Q355	F347-N351 WeakPolarHBondContact CE1-ND2 3.05Å; F347-N351 PolarHBondContact O-N 2.86Å; D348-N351 PolarHBondContact O-N 2.93Å; N351-N353 VanDerWaalsContact C-N 3.35Å; N351-N353 PolarHBondContact O-N 3.48Å; N351-K354 PolarHBondContact O-N 3.48Å; N351-Q355 WeakPolarHBondContact O-CB 3.42Å; N351-Q355 PolarHBondContact O-N 3.01Å
352	W	67.2	Low	65.6	Low	156 Å²	156	105.8 Å²	105.8	59%	0.591	52%	0.518	S	S	*	.	H	α-helix	trans	-60.9	-42.5	176	-176.4	-104.2	0	0	0	112.3	D348 Q355 K356	D348-W352 VanDerWaalsContact O-CB 3.3Å; D348-W352 WeakPolarHBondContact O-CB 3.29Å; D348-W352 PolarHBondContact O-N 3.25Å; W352-Q355 PolarHBondContact O-N 2.94Å; W352-K356 PolarHBondContact O-N 2.9Å
353	N	73.4	Confident	64.5	Low	95 Å²	95	113 Å²	113	51%	0.508	54%	0.537	S	S	.	.	H	α-helix	trans	-66.9	-39.4	176.1	-85.2	-16.6	0	0	0	112.4	H349 F350 N351 K356 Q357	H349-N353 WeakPolarHBondContact O-CB 3.31Å; H349-N353 PolarHBondContact O-N 3Å; F350-N353 PolarHBondContact O-N 2.85Å; N351-N353 VanDerWaalsContact C-N 3.35Å; N351-N353 PolarHBondContact O-N 3.48Å; N353-K356 PolarHBondContact O-N 3.24Å; N353-Q357 PolarHBondContact O-N 2.84Å
354	K	68.6	Low	63.6	Low	105 Å²	105	113 Å²	113	46%	0.457	54%	0.537	S	S	.	.	H	α-helix	trans	-61.9	-41.9	171.8	-85.8	-169.1	173.8	179	0	112.1	F350 N351 Q357 R358	F350-K354 HydrophobicContact CD1-CD 4.47Å; F350-K354 HydrophobicContact CE1-CD 3.89Å; F350-K354 VanDerWaalsContact CE1-CE 3.46Å; F350-K354 HydrophobicContact CE1-CG 4.49Å; F350-K354 HydrophobicContact CZ-CD 4.27Å; F350-K354 VanDerWaalsContact CZ-CE 3.46Å; F350-K354 PolarHBondContact O-N 2.91Å; N351-K354 PolarHBondContact O-N 3.48Å; K354-Q357 PolarHBondContact O-N 3.29Å; K354-R358 WeakPolarHBondContact O-CG 3.37Å; K354-R358 PolarHBondContact O-N 3.47Å
355	Q	69.5	Low	62.4	Low	131 Å²	131	115.7 Å²	115.7	61%	0.612	55%	0.545	S	S	*	.	H	α-helix	trans	-65.2	-39.8	177	-169.3	127.4	-2.5	0	0	111.9	N351 W352 R358 S359	N351-Q355 WeakPolarHBondContact O-CB 3.42Å; N351-Q355 PolarHBondContact O-N 3.01Å; W352-Q355 PolarHBondContact O-N 2.94Å; Q355-R358 PolarHBondContact O-N 3.34Å; Q355-S359 WeakPolarHBondContact O-CB 3.47Å; Q355-S359 PolarHBondContact O-N 3.28Å; Q355-S359 PolarHBondContact O-OG 3.34Å
356	K	68.2	Low	60.9	Low	121 Å²	121	118.2 Å²	118.2	53%	0.526	55%	0.554	S	S	.	*	H	α-helix	trans	-63.2	-44.5	172.5	-93.6	-172.1	174.1	-177.4	0	112.4	W352 N353 R358 S359 S360	W352-K356 PolarHBondContact O-N 2.9Å; N353-K356 PolarHBondContact O-N 3.24Å; K356-R358 VanDerWaalsContact C-N 3.35Å; K356-R358 PolarHBondContact O-N 3.31Å; K356-S359 CarbonylContact O-C 3.56Å; K356-S359 PolarHBondContact O-N 2.84Å; K356-S359 VanDerWaalsContact O-N 3.15Å; K356-S360 PolarHBondContact O-N 3.08Å; K356-S360 PolarHBondContact O-OG 3.31Å
357	Q	57.9	Low	59.6	Low	139 Å²	139	115.7 Å²	115.7	65%	0.65	55%	0.55	S	S	*	*	H	α-helix	trans	-62.4	-40.4	177	-77.9	-168.4	-4.5	0	0	112.4	N353 K354 S359 S360 S361	N353-Q357 PolarHBondContact O-N 2.84Å; K354-Q357 PolarHBondContact O-N 3.29Å; Q357-S359 VanDerWaalsContact C-N 3.32Å; Q357-S359 PolarHBondContact O-N 3.13Å; Q357-S360 WeakPolarHBondContact CA-OG 3.5Å; Q357-S360 PolarHBondContact O-N 3.35Å; Q357-S360 PolarHBondContact O-OG 3.16Å; Q357-S361 VanDerWaalsContact O-CB 3.3Å; Q357-S361 WeakPolarHBondContact O-CB 3.43Å; Q357-S361 PolarHBondContact O-N 2.93Å
358	R	58.9	Low	58.3	Low	182 Å²	182	114.6 Å²	114.6	69%	0.687	55%	0.553	S	S	*	*	H	α-helix	trans	-61.4	-42.4	172.4	-72.8	177.8	176.2	-168	-1.7	111.4	K354 Q355 K356 S361 N362	K354-R358 WeakPolarHBondContact O-CG 3.37Å; K354-R358 PolarHBondContact O-N 3.47Å; Q355-R358 PolarHBondContact O-N 3.34Å; K356-R358 VanDerWaalsContact C-N 3.35Å; K356-R358 PolarHBondContact O-N 3.31Å; R358-S361 PolarHBondContact O-N 3.37Å; R358-N362 PolarHBondContact O-N 2.91Å; R358-N362 VanDerWaalsContact O-N 3.15Å; R358-N362 PolarHBondContact O-ND2 3.36Å
359	S	52.7	Low	56.6	Low	70 Å²	70	116.7 Å²	116.7	49%	0.49	56%	0.562	S	S	.	*	H	α-helix	trans	-69.1	-36	179.6	-54.6	0	0	0	0	113	Q355 K356 Q357 R363	Q355-S359 WeakPolarHBondContact O-CB 3.47Å; Q355-S359 PolarHBondContact O-N 3.28Å; Q355-S359 PolarHBondContact O-OG 3.34Å; K356-S359 CarbonylContact O-C 3.56Å; K356-S359 PolarHBondContact O-N 2.84Å; K356-S359 VanDerWaalsContact O-N 3.15Å; Q357-S359 VanDerWaalsContact C-N 3.32Å; Q357-S359 PolarHBondContact O-N 3.13Å; S359-R363 PolarHBondContact O-N 2.92Å
360	S	51.5	Low	54.8	Low	74 Å²	74	118 Å²	118	52%	0.517	57%	0.568	S	S	.	*	H	α-helix	trans	-74.8	-35.2	175.5	55.9	0	0	0	0	112.8	K356 Q357 N362 R363 S364	K356-S360 PolarHBondContact O-N 3.08Å; K356-S360 PolarHBondContact O-OG 3.31Å; Q357-S360 WeakPolarHBondContact CA-OG 3.5Å; Q357-S360 PolarHBondContact O-N 3.35Å; Q357-S360 PolarHBondContact O-OG 3.16Å; S360-N362 VanDerWaalsContact C-N 3.34Å; S360-R363 PolarHBondContact O-N 3.14Å; S360-S364 PolarHBondContact O-N 2.84Å
361	S	51.8	Low	53.2	Low	56 Å²	56	120 Å²	120	39%	0.392	58%	0.579	S	S	.	*	H	α-helix	trans	-66	-35.1	176.1	-174.2	0	0	0	0	112.5	Q357 R358 S364	Q357-S361 VanDerWaalsContact O-CB 3.3Å; Q357-S361 WeakPolarHBondContact O-CB 3.43Å; Q357-S361 PolarHBondContact O-N 2.93Å; R358-S361 PolarHBondContact O-N 3.37Å; S361-S364 PolarHBondContact O-OG 3.1Å
362	N	47.9	Very low	51.9	Low	104 Å²	104	124.1 Å²	124.1	56%	0.556	60%	0.596	S	S	*	*	H	α-helix	trans	-71.5	-33.4	175.6	-70	-15.1	0	0	0	112.3	R358 S360 S364 K365 E366	R358-N362 PolarHBondContact O-N 2.91Å; R358-N362 VanDerWaalsContact O-N 3.15Å; R358-N362 PolarHBondContact O-ND2 3.36Å; S360-N362 VanDerWaalsContact C-N 3.34Å; N362-S364 PolarHBondContact O-N 3Å; N362-K365 PolarHBondContact O-N 2.88Å; N362-E366 PolarHBondContact O-N 3.48Å
363	R	44.9	Very low	50.6	Low	193 Å²	193	121.7 Å²	121.7	73%	0.728	60%	0.603	S	S	*	*	H	α-helix	trans	-68.6	-29.2	179	-123.9	-180	-174.9	-174	1.5	113.8	S359 S360	S359-R363 PolarHBondContact O-N 2.92Å; S360-R363 PolarHBondContact O-N 3.14Å
364	S	44.7	Very low	49.1	Very low	66 Å²	66	123.6 Å²	123.6	46%	0.462	61%	0.612	S	S	.	*	H	α-helix	trans	-78.3	-31.4	177.1	61	0	0	0	0	112.9	S360 S361 N362 T368	S360-S364 PolarHBondContact O-N 2.84Å; S361-S364 PolarHBondContact O-OG 3.1Å; N362-S364 PolarHBondContact O-N 3Å; S364-T368 PolarHBondContact O-OG1 3.46Å; S364-T368 VanDerWaalsContact O-OG1 3.09Å
365	K	49.4	Very low	47.6	Very low	147 Å²	147	125.2 Å²	125.2	64%	0.639	63%	0.625	S	S	*	*	H	α-helix	trans	-70.6	-35.1	174.4	-73.1	-178.9	178.4	177.1	0	112.5	N362 T368 M369	N362-K365 PolarHBondContact O-N 2.88Å; K365-T368 PolarHBondContact O-N 2.79Å; K365-M369 PolarHBondContact O-N 2.82Å
366	E	41.8	Very low	45.9	Very low	135 Å²	135	126.3 Å²	126.3	63%	0.631	64%	0.635	S	S	*	*	H	α-helix	trans	-70.9	-37.3	-179	-155.1	167.1	-159.7	0	0	112.7	N362 T368 M369 E370	N362-E366 PolarHBondContact O-N 3.48Å; E366-T368 PolarHBondContact O-N 3.38Å; E366-M369 PolarHBondContact O-N 3.31Å; E366-E370 PolarHBondContact O-N 2.85Å
367	Q	43.4	Very low	44.2	Very low	137 Å²	137	128 Å²	128	64%	0.64	65%	0.649	S	S	*	*	H	α-helix	trans	-67.3	-22.8	175.3	-77.5	-173.9	-14.3	0	0	114
368	T	41.4	Very low	43	Very low	98 Å²	98	133.6 Å²	133.6	60%	0.601	66%	0.664	S	S	*	*	H	α-helix	trans	-80.1	-30.6	178.2	-48.6	0	0	0	0	111.5	S364 K365 E366	S364-T368 PolarHBondContact O-OG1 3.46Å; S364-T368 VanDerWaalsContact O-OG1 3.09Å; K365-T368 PolarHBondContact O-N 2.79Å; E366-T368 PolarHBondContact O-N 3.38Å
369	M	38.9	Very low	41.4	Very low	149 Å²	149	133.7 Å²	133.7	73%	0.734	67%	0.672	S	S	*	*	H	α-helix	trans	-78.9	-33.6	175.4	-96.5	175.6	77.1	0	0	113	K365 E366 Q371 Q372	K365-M369 PolarHBondContact O-N 2.82Å; E366-M369 PolarHBondContact O-N 3.31Å; M369-Q371 PolarHBondContact O-N 3.38Å; M369-Q372 PolarHBondContact O-N 2.93Å
370	E	36.8	Very low	40	Very low	134 Å²	134	136.4 Å²	136.4	63%	0.626	69%	0.686	S	S	*	*	H	α-helix	trans	-67.4	-30	-179.7	-97	-170.7	148.8	0	0	114	E366 Q372	E366-E370 PolarHBondContact O-N 2.85Å; E370-Q372 PolarHBondContact O-N 3.46Å
371	Q	38.2	Very low	38.9	Very low	155 Å²	155	139.5 Å²	139.5	72%	0.724	70%	0.702	S	S	*	*	H	α-helix	trans	-74.9	-21.4	179.5	-78.3	-176.5	-1.7	0	0	114	M369	M369-Q371 PolarHBondContact O-N 3.38Å
372	Q	42.2	Very low	37.6	Very low	159 Å²	159	142.2 Å²	142.2	74%	0.743	72%	0.721	S	S	*	*	H	α-helix	trans	-85.1	-21.7	-179.4	-76	-173.3	-19.3	0	0	113.7	M369 E370	M369-Q372 PolarHBondContact O-N 2.93Å; E370-Q372 PolarHBondContact O-N 3.46Å
373	S	41	Very low	36.6	Very low	106 Å²	106	141.9 Å²	141.9	74%	0.741	73%	0.727	S	S	*	*	H	α-helix	trans	-88.2	-10.7	-177.3	-64.3	0	0	0	0	115.2
374	I	40.8	Very low	35.5	Very low	134 Å²	134	143.6 Å²	143.6	69%	0.687	74%	0.735	S	S	*	*	S	Bend	trans	-89.1	-16.1	-175.2	-60.3	175.2	0	0	0	113.2	N376	I374-N376 PolarHBondContact O-N 3.15Å
375	N	37.1	Very low	34.7	Very low	139 Å²	139	146 Å²	146	74%	0.743	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	9.7	-169.6	-78.4	-10.5	0	0	0	117
376	N	34.5	Very low	33.5	Very low	154 Å²	154	148.8 Å²	148.8	82%	0.824	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	10.3	-174.9	-93.5	-13.8	0	0	0	117.6	I374	I374-N376 PolarHBondContact O-N 3.15Å
377	I	32.8	Very low	32.6	Very low	158 Å²	158	147 Å²	147	81%	0.81	76%	0.761	S	S	*	*	S	Bend	trans	-141.2	78.4	175.6	-48.9	176.3	0	0	0	111.7
378	R	31.8	Very low	31.7	Very low	255 Å²	255	145.9 Å²	145.9	96%	0.962	77%	0.768	S	S	*	*			trans	-170.8	127.1	143	-107.8	172	-173.9	-147.8	1.4	112.2
379	Q	25	Very low	30.8	Very low	184 Å²	184	147.5 Å²	147.5	86%	0.86	77%	0.773	S	S	*	*			trans	-74.3	143.7	178.7	-71.8	172.1	-35.4	0	0	113.4
380	T	23.7	Very low	30.4	Very low	127 Å²	127	146.7 Å²	146.7	78%	0.779	77%	0.77	S	S	*	*			trans	31.8	108.2	139.8	61.7	0	0	0	0	121
381	T	28.6	Very low	29.8	Very low	139 Å²	139	147.6 Å²	147.6	85%	0.853	78%	0.779	S	S	*	*				-165.1	108.8	124.6	35.6	0	0	0	0	106.7
382	S	25.6	Very low	29.4	Very low	114 Å²	114	147.8 Å²	147.8	80%	0.797	78%	0.78	S	S	*	*				35.5	125.2	103.1	-174.6	0	0	0	0	114.1
383	S	26	Very low	28.9	Very low	97 Å²	97	148.7 Å²	148.7	68%	0.678	78%	0.782	S	S	*	*			cis	-164.4	135.9	4.1	45.4	0	0	0	0	107.6
384	Y	22.8	Very low	28	Very low	229 Å²	229	152.5 Å²	152.5	90%	0.898	79%	0.79	S	S	*	*			trans	-153.8	98	141	-141.4	-98	0	0	0	108.2
385	V	26.4	Very low	27.4	Very low	115 Å²	115	155.7 Å²	155.7	70%	0.697	80%	0.799	S	S	*	*			trans	-72.1	120	172.4	169.9	0	0	0	0	107.7	S387	V385-S387 WeakPolarHBondContact CG1-OG 3.28Å
386	K	25.8	Very low	26.6	Very low	207 Å²	207	156.5 Å²	156.5	90%	0.9	80%	0.803	S	S	*	*			trans	-116.7	95.8	154.8	-160.9	170	-174	178.6	0	107.1
387	S	21.9	Very low	26.2	Very low	98 Å²	98	155.2 Å²	155.2	69%	0.685	80%	0.801	S	S	*	*			trans	-76.7	132.2	173.3	-35.3	0	0	0	0	110.5	V385	V385-S387 WeakPolarHBondContact CG1-OG 3.28Å
388	S	24.4	Very low	25.6	Very low	112 Å²	112	157.1 Å²	157.1	78%	0.783	81%	0.806	S	S	*	*			trans	163.2	134	150.8	-106.2	0	0	0	0	106.1
389	N	23.6	Very low	25.4	Very low	132 Å²	132	150.6 Å²	150.6	71%	0.706	80%	0.799	S	S	*	*			cis	-172	155	10	-152.4	-1.9	0	0	0	109
390	I	29.8	Very low	25.2	Very low	132 Å²	132	147.6 Å²	147.6	68%	0.677	79%	0.794	S	S	*	*			trans	67.9	99	155.3	-56.8	142.9	0	0	0	116.9
391	N	24.2	Very low	25.3	Very low	153 Å²	153	149.2 Å²	149.2	82%	0.818	80%	0.795	S	S	*	*				58.2	105.5	85	-75.5	-14.2	0	0	0	115.4
392	E	30.1	Very low	25.2	Very low	160 Å²	160	150.4 Å²	150.4	75%	0.748	80%	0.795	S	S	*	*				-160.7	126.7	125.2	-115.6	-164.7	141.2	0	0	113.3
393	K	30.4	Very low	25.1	Very low	177 Å²	177	151.8 Å²	151.8	77%	0.77	79%	0.794	S	S	*	*			trans	78.2	92.1	151	-72.3	166.7	174.5	149.2	0	121
394	M	22.2	Very low	25.3	Very low	186 Å²	186	150.7 Å²	150.7	92%	0.916	80%	0.798	S	S	*	*			trans	-59.7	147.3	148.7	-73.7	178.5	160	0	0	114.3
395	K	29	Very low	25.4	Very low	202 Å²	202	147.3 Å²	147.3	88%	0.878	80%	0.795	S	S	*	*				170.6	104.3	125	-103.7	-178.4	171.4	-177.1	0	107.4
396	L	20.3	Very low	25.5	Very low	156 Å²	156	147.6 Å²	147.6	82%	0.817	80%	0.797	S	S	*	*				48.5	103.4	78.1	-156.6	80.7	0	0	0	113.7
397	T	25.8	Very low	25.6	Very low	127 Å²	127	146 Å²	146	78%	0.779	79%	0.793	S	S	*	*				179	133	105.4	34.4	0	0	0	0	110.9
398	Q	20.8	Very low	25.6	Very low	198 Å²	198	150.8 Å²	150.8	93%	0.925	80%	0.801	S	S	*	*			trans	-74.2	127.4	167.9	-174.3	174.4	18.2	0	0	108.9
399	S	27	Very low	25.7	Very low	117 Å²	117	152.8 Å²	152.8	82%	0.818	80%	0.803	S	S	*	*			trans	-126.5	114	166.5	64.2	0	0	0	0	111
400	T	21.3	Very low	25.9	Very low	122 Å²	122	153.1 Å²	153.1	75%	0.748	80%	0.803	S	S	*	*			trans	-37	137.9	167.1	-52.9	0	0	0	0	117
401	M	25.4	Very low	25.7	Very low	161 Å²	161	155.1 Å²	155.1	79%	0.793	81%	0.809	S	S	*	*			trans	24.2	126.8	149.1	-50.3	-147	-60.4	0	0	120.3
402	D	26.5	Very low	25.7	Very low	163 Å²	163	153.3 Å²	153.3	87%	0.872	80%	0.804	S	S	*	*			trans	-134.9	123.4	140.5	-144.7	-7.2	0	0	0	109.4
403	N	23.4	Very low	25.5	Very low	143 Å²	143	152.6 Å²	152.6	77%	0.765	81%	0.805	S	S	*	*			trans	-113.3	107.7	179.2	-106.2	-0.8	0	0	0	106.7
404	G	30.5	Very low	25.4	Very low	74 Å²	74	151.2 Å²	151.2	76%	0.763	81%	0.812	S	S	*	*			trans	-117.2	111.5	154.7	0	0	0	0	0	106.3
405	N	24	Very low	25.6	Very low	158 Å²	158	150.2 Å²	150.2	85%	0.845	80%	0.804	S	S	*	*			cis	47.9	106	49.6	-102.3	25.7	0	0	0	112.4
406	V	30	Very low	25.7	Very low	122 Å²	122	147.8 Å²	147.8	74%	0.739	80%	0.801	S	S	*	*				-179.4	119.9	119.6	157.6	0	0	0	0	109.2
407	E	27.4	Very low	25.8	Very low	173 Å²	173	147.9 Å²	147.9	81%	0.808	80%	0.798	S	S	*	*			trans	40.8	114.1	143.3	-61.5	171.2	139.5	0	0	119
408	K	22.4	Very low	25.7	Very low	198 Å²	198	149.2 Å²	149.2	86%	0.861	79%	0.793	S	S	*	*				52	101.3	65.3	-158.3	-174.4	-173	-174.7	0	114.5
409	L	26.5	Very low	26.2	Very low	154 Å²	154	147.6 Å²	147.6	81%	0.806	79%	0.791	S	S	*	*			trans	-163.4	115.8	143	-133.9	95.8	0	0	0	111.6
410	I	25.9	Very low	26	Very low	139 Å²	139	148.8 Å²	148.8	71%	0.713	79%	0.788	S	S	*	*			trans	62	101.9	140.4	-59.7	168.7	0	0	0	117.6
411	E	26.4	Very low	26.2	Very low	174 Å²	174	149.9 Å²	149.9	81%	0.813	79%	0.789	S	S	*	*				49.4	117.3	86.5	-82.2	-179.2	-165.6	0	0	113.2
412	T	25.2	Very low	26.3	Very low	115 Å²	115	148.8 Å²	148.8	71%	0.706	79%	0.785	S	S	*	*			cis	-168.5	159.4	35.9	33	0	0	0	0	110.2
413	N	25.5	Very low	26.2	Very low	145 Å²	145	145.6 Å²	145.6	78%	0.775	78%	0.775	S	S	*	*			trans	70.2	111.6	159.7	-64.8	-13.6	0	0	0	120
414	V	27.6	Very low	26.6	Very low	149 Å²	149	145.5 Å²	145.5	90%	0.903	77%	0.772	S	S	*	*			trans	-86.1	107.4	157.2	177.5	0	0	0	0	106.9
415	E	25.6	Very low	26.4	Very low	164 Å²	164	149.4 Å²	149.4	77%	0.766	77%	0.77	S	S	*	*			trans	-94.9	167.8	157.2	-99	166.3	151	0	0	108.6
416	D	33.1	Very low	26.7	Very low	152 Å²	152	147.3 Å²	147.3	81%	0.813	77%	0.768	S	S	*	*			trans	90.9	111.3	-174.7	-51.8	-25.2	0	0	0	114
417	Q	22.2	Very low	26.3	Very low	158 Å²	158	148.8 Å²	148.8	74%	0.738	77%	0.772	S	S	*	*			cis	37.9	103.8	4.5	-89.6	-163.1	5.1	0	0	119.9
418	F	23.5	Very low	26.6	Very low	154 Å²	154	145.5 Å²	145.5	68%	0.675	77%	0.768	S	S	*	*			trans	64	107.7	144.8	-59.8	-64.5	0	0	0	116.7
419	N	30.9	Very low	26.8	Very low	165 Å²	165	144.5 Å²	144.5	88%	0.882	77%	0.766	S	S	*	*				-157.8	101.3	114	-82	-34.2	0	0	0	108.7
420	N	22.8	Very low	26.6	Very low	141 Å²	141	144.6 Å²	144.6	75%	0.754	77%	0.766	S	S	*	*			trans	-64.9	141.7	149.2	-76.8	-24.8	0	0	0	107.2
421	D	26.4	Very low	26.8	Very low	146 Å²	146	144.8 Å²	144.8	78%	0.781	77%	0.767	S	S	*	*			trans	167.1	141.9	144.5	-87.2	-5.3	0	0	0	108.5
422	I	26.7	Very low	26.7	Very low	138 Å²	138	147 Å²	147	71%	0.708	77%	0.768	S	S	*	*			cis	-175.2	139.1	-12.1	-117.1	168.3	0	0	0	104
423	S	25.1	Very low	26.6	Very low	95 Å²	95	145.7 Å²	145.7	66%	0.664	76%	0.76	S	S	*	*			trans	77.3	157.5	141	-160.7	0	0	0	0	121.9
424	M	30.4	Very low	26.6	Very low	141 Å²	141	145.9 Å²	145.9	70%	0.695	76%	0.756	S	S	*	*			trans	101.6	121	160.3	-47.7	-54	-81.8	0	0	113.5
425	E	27.7	Very low	26.4	Very low	157 Å²	157	145.8 Å²	145.8	73%	0.734	75%	0.746	S	S	*	*			cis	-179.4	156	-2.4	-164.2	168.6	-169.1	0	0	105.9
426	S	28.9	Very low	26.5	Very low	113 Å²	113	144 Å²	144	79%	0.79	74%	0.742	S	S	*	*			trans	111	131.1	157.1	-49.1	0	0	0	0	119.3
427	D	23	Very low	26	Very low	154 Å²	154	144.1 Å²	144.1	82%	0.824	74%	0.737	S	S	*	*			trans	-60.7	166.2	166.8	-56.6	-60.6	0	0	0	114.7
428	S	33	Very low	26.1	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	73%	0.73	S	S	*	*			trans	157.1	112.4	133.8	-66.1	0	0	0	0	110
429	E	26.8	Very low	26.1	Very low	176 Å²	176	142 Å²	142	82%	0.822	73%	0.732	S	S	*	*				60.8	111.1	105	-77.4	-175.6	147.9	0	0	115
430	I	22.8	Very low	25.8	Very low	156 Å²	156	141.3 Å²	141.3	80%	0.8	72%	0.723	S	S	*	*				57.6	123.2	80.8	-59.7	177.1	0	0	0	114.3
431	I	28.4	Very low	26	Very low	144 Å²	144	142.7 Å²	142.7	74%	0.738	72%	0.723	S	S	*	*			trans	150.1	109.3	152.1	-79.5	162.7	0	0	0	106.1
432	R	24.3	Very low	25.9	Very low	220 Å²	220	144.6 Å²	144.6	83%	0.83	73%	0.727	S	S	*	*				60.8	143.8	94.3	-74.2	-174.8	173	149.5	-2.7	111.9
433	T	23.8	Very low	25.9	Very low	87 Å²	87	142 Å²	142	53%	0.534	73%	0.734	S	S	.	*			cis	178.2	157.7	13.6	17.5	0	0	0	0	104.6
434	E	25.7	Very low	25.9	Very low	150 Å²	150	140.8 Å²	140.8	70%	0.701	74%	0.737	S	S	*	*			trans	68	151.3	143	-67.2	152.2	-150.2	0	0	116.1
435	E	23.9	Very low	25.7	Very low	147 Å²	147	142.5 Å²	142.5	69%	0.687	74%	0.743	S	S	*	*			cis	-175.5	172.8	1.6	-113.9	167.5	179.7	0	0	104.7
436	D	26.5	Very low	25.5	Very low	127 Å²	127	141.9 Å²	141.9	68%	0.679	75%	0.745	S	S	*	*			trans	77.1	108.5	152.5	-64.1	-9.7	0	0	0	119.1
437	E	23.9	Very low	25.6	Very low	154 Å²	154	142.8 Å²	142.8	72%	0.72	74%	0.741	S	S	*	*				94.9	120.6	66.1	-91.5	-158.2	154.1	0	0	112
438	I	23.9	Very low	25.8	Very low	115 Å²	115	143.1 Å²	143.1	59%	0.59	74%	0.737	S	S	*	*				86.9	130	129.3	-68.6	179.3	0	0	0	120.3
439	Q	23.1	Very low	25.4	Very low	151 Å²	151	142.2 Å²	142.2	71%	0.706	73%	0.731	S	S	*	*			trans	94.9	113.1	143.8	-90.6	159.1	34	0	0	122.1
440	E	24.1	Very low	25.2	Very low	151 Å²	151	141 Å²	141	71%	0.706	73%	0.73	S	S	*	*				62.8	121.7	118.9	-74.2	-179.6	-174.3	0	0	120.1
441	K	27.6	Very low	25.2	Very low	170 Å²	170	138.7 Å²	138.7	74%	0.739	72%	0.723	S	S	*	*				172	117.9	101	-89.3	-171.1	-179.8	178.6	0	108.5
442	E	23.8	Very low	25.1	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.874	73%	0.726	S	S	*	*				66.6	128.3	90.7	-82.7	-164.8	152.9	0	0	115.6
443	G	27.3	Very low	25.4	Very low	83 Å²	83	136.4 Å²	136.4	86%	0.856	72%	0.724	S	S	*	*			trans	125.1	109.4	169.8	0	0	0	0	0	110.9
444	G	24.1	Very low	25.4	Very low	70 Å²	70	139.1 Å²	139.1	72%	0.722	73%	0.73	S	S	*	*			cis	144.7	128.4	14.1	0	0	0	0	0	107.9
445	E	27.3	Very low	25.7	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	74%	0.74	S	S	*	*			trans	69.6	111.6	152.9	-55.5	-174.4	161.4	0	0	118.7
446	N	24.2	Very low	25.8	Very low	144 Å²	144	143.6 Å²	143.6	77%	0.77	74%	0.741	S	S	*	*				81	143.6	61.3	-79.4	-16.3	0	0	0	115
447	N	29.2	Very low	25.9	Very low	131 Å²	131	144.3 Å²	144.3	70%	0.701	75%	0.745	S	S	*	*			trans	97.3	127.8	162.6	-51.1	-32.9	0	0	0	114.9
448	Q	27.3	Very low	26.1	Very low	162 Å²	162	145.7 Å²	145.7	76%	0.757	75%	0.748	S	S	*	*			cis	-174	147	-3	-131.4	169	-44.9	0	0	108.4
449	S	24.6	Very low	26.1	Very low	85 Å²	85	145.9 Å²	145.9	59%	0.594	76%	0.755	S	S	*	*			trans	27.4	121.6	138.9	58.6	0	0	0	0	120
450	D	23.2	Very low	26.6	Very low	150 Å²	150	144.7 Å²	144.7	80%	0.802	76%	0.758	S	S	*	*				77.8	135.2	72.1	-96.3	-23.5	0	0	0	116.3
451	T	24.1	Very low	26.7	Very low	107 Å²	107	145.3 Å²	145.3	66%	0.656	76%	0.761	S	S	*	*			trans	77.3	117.8	148.1	48.4	0	0	0	0	121.5
452	D	24.6	Very low	26.9	Very low	147 Å²	147	146.3 Å²	146.3	79%	0.786	77%	0.768	S	S	*	*				57.9	119.8	124	-57.5	-24.7	0	0	0	120.2
453	E	30.8	Very low	26.8	Very low	169 Å²	169	142.1 Å²	142.1	79%	0.79	76%	0.759	S	S	*	*				-166.5	119.7	117.7	-92	-132	159	0	0	111.8
454	E	24.7	Very low	26.8	Very low	144 Å²	144	145.7 Å²	145.7	67%	0.673	76%	0.759	S	S	*	*				13.7	124.2	127.7	-161.2	169.3	-159.7	0	0	118.3
455	R	32.3	Very low	26.9	Very low	242 Å²	242	151.8 Å²	151.8	91%	0.913	77%	0.766	S	S	*	*			trans	-159.4	114.6	138.3	-109.2	164.4	-158.1	-144.3	6.2	112.7
456	Q	24.4	Very low	26.8	Very low	149 Å²	149	148.4 Å²	148.4	70%	0.696	76%	0.761	S	S	*	*			trans	-59.1	148.2	162	-56.3	-174.7	0.4	0	0	111.5
457	N	29.3	Very low	27.2	Very low	142 Å²	142	147.7 Å²	147.7	76%	0.759	76%	0.762	S	S	*	*			trans	171.3	109.5	137	-87.9	-33.7	0	0	0	108.4
458	K	28.2	Very low	27.1	Very low	183 Å²	183	150.5 Å²	150.5	80%	0.796	77%	0.768	S	S	*	*				96.6	123	82	-116.3	-179.9	-175.8	173.1	0	112.2
459	T	24.8	Very low	27.1	Very low	119 Å²	119	146 Å²	146	73%	0.73	76%	0.755	S	S	*	*			trans	73.2	110	147	-47	0	0	0	0	117.2
460	T	32.9	Very low	27.5	Very low	126 Å²	126	149.6 Å²	149.6	77%	0.773	76%	0.762	S	S	*	*				-162	126.1	109	-65.7	0	0	0	0	109.2
461	Q	26.4	Very low	27.7	Very low	165 Å²	165	146.3 Å²	146.3	77%	0.771	75%	0.751	S	S	*	*			trans	-64.4	140.6	172.7	-67.5	174.1	-23.6	0	0	110.8
462	H	31	Very low	27.8	Very low	191 Å²	191	148 Å²	148	88%	0.884	76%	0.756	S	S	*	*			trans	-149.6	105.8	136.3	-92.9	-61.9	0	0	0	109.6
463	S	21.5	Very low	27.9	Very low	99 Å²	99	146 Å²	146	69%	0.692	75%	0.753	S	S	*	*			trans	-74.2	140.3	169.4	-50.3	0	0	0	0	110.2
464	N	27.6	Very low	27.6	Very low	157 Å²	157	143.1 Å²	143.1	84%	0.84	75%	0.751	S	S	*	*			trans	-156.6	122.5	148.6	-91.8	-31.6	0	0	0	111.9
465	K	27	Very low	27.6	Very low	199 Å²	199	145.7 Å²	145.7	87%	0.865	76%	0.76	S	S	*	*			trans	47.4	110.3	154.7	-88	171.4	168.8	172.4	0	119.7
466	S	25.2	Very low	27.2	Very low	106 Å²	106	139.9 Å²	139.9	74%	0.741	75%	0.752	S	S	*	*				66.1	107.7	87	-164.1	0	0	0	0	113.2
467	T	31.4	Very low	27.3	Very low	128 Å²	128	137.7 Å²	137.7	79%	0.785	75%	0.753	S	S	*	*				-157.3	125.4	82.9	32.7	0	0	0	0	113.5
468	K	27.6	Very low	27.1	Very low	191 Å²	191	136 Å²	136	83%	0.83	75%	0.752	S	S	*	*			trans	33.4	135.9	131.8	-88.9	-167.3	154.9	167	0	119.2
469	S	26.6	Very low	27.2	Very low	68 Å²	68	132.8 Å²	132.8	48%	0.476	75%	0.753	S	S	.	*			cis	177.8	140.1	25.8	-108.6	0	0	0	0	110.7
470	H	33	Very low	27.3	Very low	160 Å²	160	130.2 Å²	130.2	74%	0.741	75%	0.75	S	S	*	*			trans	67.9	142	141.8	-54.8	-43.9	0	0	0	120.1
471	S	29.1	Very low	27.2	Very low	81 Å²	81	133.6 Å²	133.6	57%	0.566	75%	0.754	S	S	*	*			cis	-175.4	139.8	-9.9	-89.2	0	0	0	0	106.8
472	N	25.4	Very low	27.5	Very low	143 Å²	143	131.2 Å²	131.2	77%	0.765	75%	0.751	S	S	*	*			trans	52.5	115.9	133	-58	-10.2	0	0	0	119.8
473	S	25.8	Very low	27.3	Very low	104 Å²	104	132.7 Å²	132.7	73%	0.727	75%	0.749	S	S	*	*				90.3	156.2	72.2	93.4	0	0	0	0	113.5
474	S	26.3	Very low	27.9	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	76%	0.756	S	S	*	*			trans	84.1	107.7	177.8	73.4	0	0	0	0	114.8
475	K	23.1	Very low	28.1	Very low	198 Å²	198	137.4 Å²	137.4	86%	0.861	75%	0.752	S	S	*	*				71	134.2	51.3	-155.7	179.8	-169.9	177.1	0	110.2
476	V	25.2	Very low	28.4	Very low	120 Å²	120	134.4 Å²	134.4	73%	0.727	75%	0.75	S	S	*	*			trans	124.5	122.7	148.1	178.6	0	0	0	0	115.6
477	S	26.5	Very low	28.7	Very low	104 Å²	104	136 Å²	136	73%	0.727	75%	0.75	S	S	*	*			trans	77.4	117.9	150.7	-68.7	0	0	0	0	119.4
478	S	24.6	Very low	28.5	Very low	107 Å²	107	141.5 Å²	141.5	75%	0.748	76%	0.757	S	S	*	*				84.4	131.3	59.4	175.6	0	0	0	0	113
479	S	30.6	Very low	28.8	Very low	115 Å²	115	138.2 Å²	138.2	80%	0.804	76%	0.758	S	S	*	*			trans	94.5	119.7	161.6	82.3	0	0	0	0	118.9
480	G	27.4	Very low	28.9	Very low	65 Å²	65	142.9 Å²	142.9	67%	0.67	78%	0.776	S	S	*	*				98.7	106.9	122.1	0	0	0	0	0	119.3
481	F	29.3	Very low	29	Very low	197 Å²	197	145.6 Å²	145.6	86%	0.864	78%	0.78	S	S	*	*			trans	77	115.4	139.8	-78.1	-92.8	0	0	0	122.1
482	T	32.4	Very low	29.2	Very low	115 Å²	115	149.2 Å²	149.2	71%	0.706	79%	0.792	S	S	*	*			trans	67.5	103.1	138.9	56	0	0	0	0	120.5	K484	T482-K484 PolarHBondContact O-N 3.43Å; T482-K484 VanDerWaalsContact O-N 3.1Å
483	R	28.5	Very low	29.8	Very low	222 Å²	222	152.9 Å²	152.9	84%	0.838	80%	0.796	S	S	*	*			trans	-15.2	96.7	142.9	-172	-176.9	-75.9	-129.1	1.9	114.2
484	K	34.2	Very low	30.2	Very low	192 Å²	192	156 Å²	156	84%	0.835	80%	0.798	S	S	*	*			trans	-130.2	123.3	150.3	-75.6	-167.4	178.1	-179.3	0	109.5	T482 T486	T482-K484 PolarHBondContact O-N 3.43Å; T482-K484 VanDerWaalsContact O-N 3.1Å; K484-T486 PolarHBondContact O-N 3.43Å
485	H	31.9	Very low	30.5	Very low	163 Å²	163	156.3 Å²	156.3	76%	0.755	80%	0.8	S	S	*	*			trans	-59.7	119.7	177.9	-64.8	-89.4	0	0	0	110.4
486	T	32.3	Very low	31	Very low	135 Å²	135	158.7 Å²	158.7	83%	0.828	80%	0.804	S	S	*	*			trans	-135.9	124.6	156.6	158.4	0	0	0	0	107.5	K484	K484-T486 PolarHBondContact O-N 3.43Å
487	N	30.7	Very low	31.4	Very low	140 Å²	140	158.8 Å²	158.8	75%	0.749	81%	0.805	S	S	*	*			trans	-76.5	150.2	-168.2	-74.7	-60.4	0	0	0	112
488	R	27.2	Very low	31.9	Very low	244 Å²	244	159.8 Å²	159.8	92%	0.921	81%	0.809	S	S	*	*			trans	79	109.2	156.7	-65.6	166.2	161.7	-142.6	-6.3	117.7
489	S	34.3	Very low	32.1	Very low	122 Å²	122	160 Å²	160	85%	0.853	81%	0.81	S	S	*	*				-164.5	145.4	88.1	-163	0	0	0	0	112
490	L	29.6	Very low	32.1	Very low	165 Å²	165	162.5 Å²	162.5	86%	0.864	81%	0.814	S	S	*	*			trans	-64	128.3	-177.5	-68.8	150.7	0	0	0	111.3
491	R	35.4	Very low	32.1	Very low	218 Å²	218	163.6 Å²	163.6	82%	0.823	82%	0.817	S	S	*	*			trans	-111.9	97.8	158.1	-161.3	173.9	175.8	97.6	0.4	108.7	R493	R491-R493 PolarHBondContact O-N 2.73Å
492	L	32.2	Very low	32.4	Very low	157 Å²	157	160.3 Å²	160.3	82%	0.822	82%	0.819	S	S	*	*			trans	-57.5	118	161.6	-71.2	158.1	0	0	0	107.8
493	R	38.5	Very low	32.2	Very low	220 Å²	220	161.2 Å²	161.2	83%	0.83	83%	0.828	S	S	*	*			trans	-110.7	129.1	159.8	-85.4	-173.3	145.7	178.8	-4.8	107.8	R491	R491-R493 PolarHBondContact O-N 2.73Å
494	H	34.4	Very low	32.3	Very low	170 Å²	170	155.9 Å²	155.9	79%	0.787	83%	0.825	S	S	*	*			trans	-61.6	145.2	-176.2	-64.1	-91.8	0	0	0	112.8
495	S	32.2	Very low	32.1	Very low	113 Å²	113	156.3 Å²	156.3	79%	0.79	83%	0.83	S	S	*	*			trans	44.4	96	144.8	60.2	0	0	0	0	118.2
496	R	34.6	Very low	32.1	Very low	249 Å²	249	151.9 Å²	151.9	94%	0.94	83%	0.828	S	S	*	*			trans	-136	110.3	134.1	-100.2	180	163.4	151.1	-5	107.4
497	T	32.8	Very low	32.1	Very low	121 Å²	121	154.7 Å²	154.7	74%	0.742	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-58.2	126.9	165.8	41.5	0	0	0	0	108.5	S499	T497-S499 PolarHBondContact O-N 3.3Å
498	P	36.8	Very low	32.1	Very low	126 Å²	126	153.6 Å²	153.6	82%	0.818	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-67	120.2	162.8	-9.7	26.2	0	0	0	107.1
499	S	29.7	Very low	32.4	Very low	110 Å²	110	149.9 Å²	149.9	77%	0.769	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-69.7	136.9	175.7	-56.6	0	0	0	0	110.4	T497 A501	T497-S499 PolarHBondContact O-N 3.3Å; S499-A501 PolarHBondContact O-N 3.24Å
500	D	29	Very low	32	Very low	168 Å²	168	148.5 Å²	148.5	90%	0.898	82%	0.818	S	S	*	*	S	Bend	trans	-61.4	103.4	162.5	-70.1	-45.1	0	0	0	109.6
501	A	28.1	Very low	32.2	Very low	88 Å²	88	147.1 Å²	147.1	73%	0.727	81%	0.811	S	S	*	*			trans	176	98.5	153.1	0	0	0	0	0	109.8	S499	S499-A501 PolarHBondContact O-N 3.24Å
502	S	36.1	Very low	32.1	Very low	129 Å²	129	142.3 Å²	142.3	90%	0.902	81%	0.807	S	S	*	*			trans	-166.1	112.4	153.3	-77.8	0	0	0	0	109.1
503	C	28.1	Very low	32	Very low	134 Å²	134	143 Å²	143	91%	0.905	81%	0.805	S	S	*	*			trans	-85.3	150.2	173	-56.6	0	0	0	0	111
504	S	30.9	Very low	31.8	Very low	110 Å²	110	140.8 Å²	140.8	77%	0.769	81%	0.805	S	S	*	*			trans	-177.3	103.4	150.3	56.8	0	0	0	0	105.5
505	E	29	Very low	31.6	Very low	200 Å²	200	137.9 Å²	137.9	94%	0.935	80%	0.795	S	S	*	*				37.7	111.8	72.2	-159.2	168.9	-171	0	0	112.2
506	G	31.8	Very low	31.8	Very low	70 Å²	70	141.3 Å²	141.3	72%	0.722	80%	0.798	S	S	*	*			trans	-168.3	87.2	-173.7	0	0	0	0	0	111.9
507	E	32.7	Very low	31.4	Very low	195 Å²	195	136 Å²	136	91%	0.911	79%	0.789	S	S	*	*			trans	71.7	106.6	141.9	-66.2	-178.4	161.9	0	0	121.2
508	V	30.6	Very low	31.6	Very low	116 Å²	116	138.1 Å²	138.1	70%	0.703	79%	0.794	S	S	*	*			trans	-59.6	136.8	154.7	-171.4	0	0	0	0	110.7	S510	V508-S510 VanDerWaalsContact CG1-OG 3.25Å; V508-S510 WeakPolarHBondContact CG1-OG 3.41Å
509	L	33.5	Very low	31.2	Very low	167 Å²	167	137.1 Å²	137.1	87%	0.874	79%	0.786	S	S	*	*			trans	-123.6	120.6	151	-70.6	177.4	0	0	0	107.5
510	S	25.9	Very low	31.2	Very low	92 Å²	92	138 Å²	138	64%	0.643	78%	0.782	S	S	*	*			trans	-124.3	123.4	-179.2	-62.9	0	0	0	0	107.1	V508	V508-S510 VanDerWaalsContact CG1-OG 3.25Å; V508-S510 WeakPolarHBondContact CG1-OG 3.41Å
511	D	34.1	Very low	31.1	Very low	136 Å²	136	136.1 Å²	136.1	73%	0.727	77%	0.772	S	S	*	*			trans	-151.8	79.4	174.4	-47.5	56.9	0	0	0	106.1
512	T	32.5	Very low	31.3	Very low	118 Å²	118	138.7 Å²	138.7	72%	0.724	77%	0.773	S	S	*	*				48	108.9	98.7	52.9	0	0	0	0	113.7
513	E	29.7	Very low	30.8	Very low	170 Å²	170	139.3 Å²	139.3	79%	0.794	77%	0.765	S	S	*	*				76.8	125.2	81.6	-175.3	166.8	-168.1	0	0	111.9
514	E	35.8	Very low	31.2	Very low	175 Å²	175	139.4 Å²	139.4	82%	0.818	76%	0.762	S	S	*	*			trans	171.2	108	132	-155.8	162.7	-157.3	0	0	111.3
515	D	29.4	Very low	31.2	Very low	109 Å²	109	140.6 Å²	140.6	58%	0.583	76%	0.759	S	S	*	*			trans	31	135.1	138.3	-58.2	-20.9	0	0	0	123
516	H	36.4	Very low	31.8	Very low	184 Å²	184	140.7 Å²	140.7	85%	0.852	76%	0.76	S	S	*	*				-170.8	126.4	104.7	-88.9	-51.9	0	0	0	113.8
517	D	27.5	Very low	31.7	Very low	139 Å²	139	145.5 Å²	145.5	74%	0.743	76%	0.761	S	S	*	*			trans	-61.2	145.7	164.8	-59.1	-62.4	0	0	0	113.7
518	L	35.6	Very low	31.6	Very low	164 Å²	164	143.2 Å²	143.2	86%	0.859	76%	0.755	S	S	*	*			trans	-160.7	98.6	137	-73.4	-171.3	0	0	0	108.2
519	T	29.8	Very low	31.9	Very low	105 Å²	105	146 Å²	146	64%	0.644	76%	0.764	S	S	*	*				63.2	119.5	91.8	49.7	0	0	0	0	118.4
520	D	28	Very low	32	Very low	130 Å²	130	143.4 Å²	143.4	70%	0.695	76%	0.755	S	S	*	*			trans	86.8	109.1	134.1	-65.7	-19.1	0	0	0	122.8
521	N	27.2	Very low	32.9	Very low	128 Å²	128	143.2 Å²	143.2	68%	0.684	76%	0.759	S	S	*	*				54.1	118.8	119.4	-54.8	-35.1	0	0	0	120.1
522	D	31.8	Very low	33.2	Very low	141 Å²	141	142.9 Å²	142.9	75%	0.754	76%	0.761	S	S	*	*				174.6	119	103	-94.8	-23.9	0	0	0	113.3
523	I	26.6	Very low	33.4	Very low	143 Å²	143	145.4 Å²	145.4	73%	0.733	77%	0.765	S	S	*	*				30.2	127.8	124.6	-51.2	169.2	0	0	0	118.8
524	V	36.1	Very low	33.7	Very low	136 Å²	136	143 Å²	143	82%	0.824	75%	0.754	S	S	*	*				179	133.5	114	160.5	0	0	0	0	111
525	D	31.6	Very low	33.8	Very low	135 Å²	135	142.8 Å²	142.8	72%	0.722	75%	0.75	S	S	*	*			trans	-57.4	152.3	174	-69.6	-65.4	0	0	0	116.2
526	E	40.8	Very low	34.3	Very low	201 Å²	201	143.1 Å²	143.1	94%	0.939	76%	0.756	S	S	*	*				-152.8	128.9	126.2	-135.3	173	-169.5	0	0	112.5
527	K	29.4	Very low	34.5	Very low	172 Å²	172	141 Å²	141	75%	0.748	74%	0.744	S	S	*	*			trans	-86.2	171.8	-176.1	-82.1	170	171.7	164.8	0	112.3
528	D	32.2	Very low	34.9	Very low	146 Å²	146	138.6 Å²	138.6	78%	0.781	73%	0.731	S	S	*	*			trans	89.4	62.7	150.8	-67.9	-16.9	0	0	0	120.2
529	I	35.4	Very low	34.9	Very low	175 Å²	175	136.9 Å²	136.9	90%	0.897	72%	0.721	S	S	*	*	S	Bend	trans	-147.2	30.2	145.4	-25	167.7	0	0	0	114.2
530	V	36.7	Very low	35.4	Very low	113 Å²	113	135.6 Å²	135.6	69%	0.685	72%	0.717	S	S	*	*			trans	-101	-5.9	-173.1	177.3	0	0	0	0	115.3	V532	V530-V532 PolarHBondContact O-N 3.26Å
531	A	43.9	Very low	36.2	Very low	88 Å²	88	135.2 Å²	135.2	73%	0.727	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-1.7	-168.5	0	0	0	0	0	117.2
532	V	41.5	Very low	37.1	Very low	129 Å²	129	134.2 Å²	134.2	78%	0.782	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	-18.7	-177.6	-175	0	0	0	0	114	V530	V530-V532 PolarHBondContact O-N 3.26Å
533	Q	35.4	Very low	37.8	Very low	171 Å²	171	132.4 Å²	132.4	80%	0.799	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-13.4	172.7	-84.3	-168.6	-2.6	0	0	114.1	K537	Q533-K537 PolarHBondContact O-N 3.46Å
534	E	37.3	Very low	38.6	Very low	120 Å²	120	127.1 Å²	127.1	56%	0.561	68%	0.676	S	S	*	*	H	α-helix	trans	-69.8	-34.1	-178.5	-164.9	173.5	-171.2	0	0	113	V536 K537 L538	E534-V536 PolarHBondContact O-N 2.74Å; E534-K537 PolarHBondContact O-N 2.71Å; E534-L538 PolarHBondContact O-N 3.16Å
535	K	37.6	Very low	39.2	Very low	170 Å²	170	125.5 Å²	125.5	74%	0.739	66%	0.662	S	S	*	*	H	α-helix	trans	-75.3	-21.6	-179.4	-83.1	-171.4	175.3	-174.9	0	115.2
536	V	40.6	Very low	40.1	Very low	116 Å²	116	124.8 Å²	124.8	70%	0.703	65%	0.654	S	S	*	*	H	α-helix	trans	-86.7	-24.7	174.9	-177.9	0	0	0	0	110.7	E534	E534-V536 PolarHBondContact O-N 2.74Å
537	K	39	Very low	40.5	Very low	140 Å²	140	120 Å²	120	61%	0.609	64%	0.635	S	S	*	*	H	α-helix	trans	-75	-31.1	175	-155.1	178.2	-178.1	-163.3	0	113.1	Q533 E534 I539 S540 E541	Q533-K537 PolarHBondContact O-N 3.46Å; E534-K537 PolarHBondContact O-N 2.71Å; K537-I539 VanDerWaalsContact C-N 3.28Å; K537-I539 PolarHBondContact O-N 2.8Å; K537-S540 PolarHBondContact O-N 3.07Å; K537-S540 PolarHBondContact O-OG 2.98Å; K537-E541 PolarHBondContact O-N 2.97Å
538	L	36.8	Very low	41.8	Very low	88 Å²	88	117.9 Å²	117.9	46%	0.461	63%	0.628	S	S	.	*	H	α-helix	trans	-65	-23.9	176.9	-84.3	159.2	0	0	0	114.5	E534 I542	E534-L538 PolarHBondContact O-N 3.16Å; L538-I542 WeakPolarHBondContact O-CG1 3.32Å
539	I	36.3	Very low	43	Very low	127 Å²	127	114.8 Å²	114.8	65%	0.651	61%	0.611	S	S	*	*	H	α-helix	trans	-80.4	-29.2	176.7	-58.8	174.2	0	0	0	110.9	K537	K537-I539 VanDerWaalsContact C-N 3.28Å; K537-I539 PolarHBondContact O-N 2.8Å
540	S	39.8	Very low	43.9	Very low	79 Å²	79	111.3 Å²	111.3	55%	0.552	59%	0.594	S	S	*	*	H	α-helix	trans	-80	-17.9	175.6	46	0	0	0	0	114.5	K537	K537-S540 PolarHBondContact O-N 3.07Å; K537-S540 PolarHBondContact O-OG 2.98Å
541	E	44.6	Very low	44.9	Very low	121 Å²	121	110.7 Å²	110.7	57%	0.565	59%	0.59	S	S	*	*	H	α-helix	trans	-88.4	-30.8	-175.7	-161.1	158.5	-158.4	0	0	112.5	K537 D543 G544 D545	K537-E541 PolarHBondContact O-N 2.97Å; E541-D543 VanDerWaalsContact C-N 3.35Å; E541-D543 PolarHBondContact O-N 2.74Å; E541-G544 PolarHBondContact O-N 3.34Å; E541-D545 PolarHBondContact O-N 3.3Å
542	I	46.1	Very low	45.3	Very low	107 Å²	107	113.8 Å²	113.8	55%	0.549	58%	0.583	S	S	.	*	H	α-helix	trans	-69	-32.6	177	-62.1	169.5	0	0	0	111.8	L538 G544 H546	L538-I542 WeakPolarHBondContact O-CG1 3.32Å; I542-G544 VanDerWaalsContact C-N 3.34Å; I542-H546 PolarHBondContact O-N 3.32Å
543	D	46.2	Very low	45.9	Very low	103 Å²	103	113 Å²	113	55%	0.551	57%	0.574	S	S	*	*	H	α-helix	trans	-78.5	-16.8	176.7	-78.5	-20.7	0	0	0	113.3	E541 N547	E541-D543 VanDerWaalsContact C-N 3.35Å; E541-D543 PolarHBondContact O-N 2.74Å; D543-N547 WeakPolarHBondContact O-CB 3.39Å; D543-N547 PolarHBondContact O-N 3.38Å; D543-N547 PolarHBondContact O-ND2 3.44Å
544	G	43.8	Very low	46.8	Very low	33 Å²	33	108.9 Å²	108.9	34%	0.34	56%	0.56	S	S	.	*	H	α-helix	trans	-70.8	-49.2	172.2	0	0	0	0	0	111.3	E541 I542 H546 N547 E548	E541-G544 PolarHBondContact O-N 3.34Å; I542-G544 VanDerWaalsContact C-N 3.34Å; G544-H546 PolarHBondContact O-N 2.72Å; G544-N547 PolarHBondContact O-N 3.37Å; G544-E548 PolarHBondContact O-N 2.88Å
545	D	48.7	Very low	47.3	Very low	101 Å²	101	108.2 Å²	108.2	54%	0.54	56%	0.557	S	S	.	*	H	α-helix	trans	-69.6	-32.2	-179.6	-92.4	-14.2	0	0	0	113.2	E541 N549	E541-D545 PolarHBondContact O-N 3.3Å; D545-N549 WeakPolarHBondContact O-CB 3.43Å; D545-N549 VanDerWaalsContact O-CG 3.22Å; D545-N549 PolarHBondContact O-N 3.26Å; D545-N549 PolarHBondContact O-ND2 3.02Å
546	H	50.8	Low	47.6	Very low	121 Å²	121	103.9 Å²	103.9	56%	0.56	54%	0.542	S	S	*	.	H	α-helix	trans	-70.7	-34.4	173.5	-92.1	-29.3	0	0	0	112.8	I542 G544 L550	I542-H546 PolarHBondContact O-N 3.32Å; G544-H546 PolarHBondContact O-N 2.72Å; H546-L550 VanDerWaalsContact O-CB 3.29Å; H546-L550 WeakPolarHBondContact O-CB 3.44Å; H546-L550 WeakPolarHBondContact O-CG 3.26Å; H546-L550 PolarHBondContact O-N 2.98Å
547	N	48	Very low	47.8	Very low	100 Å²	100	101.3 Å²	101.3	54%	0.535	53%	0.529	S	S	.	.	H	α-helix	trans	-73.3	-40.2	174.7	-77.8	-39.5	0	0	0	111.9	D543 G544 L550 V551	D543-N547 WeakPolarHBondContact O-CB 3.39Å; D543-N547 PolarHBondContact O-N 3.38Å; D543-N547 PolarHBondContact O-ND2 3.44Å; G544-N547 PolarHBondContact O-N 3.37Å; N547-L550 PolarHBondContact O-N 3.39Å; N547-V551 WeakPolarHBondContact O-CB 3.26Å; N547-V551 WeakPolarHBondContact O-CG2 3.34Å; N547-V551 PolarHBondContact O-N 3.32Å
548	E	57.1	Low	48	Very low	127 Å²	127	100.1 Å²	100.1	59%	0.593	53%	0.529	S	S	*	.	H	α-helix	trans	-68.9	-38.2	174.1	-72.2	-164.6	-177.2	0	0	112.1	G544 L550 V551 R552	G544-E548 PolarHBondContact O-N 2.88Å; E548-L550 VanDerWaalsContact C-N 3.34Å; E548-V551 PolarHBondContact O-N 3.42Å; E548-R552 VanDerWaalsContact O-CB 3.24Å; E548-R552 WeakPolarHBondContact O-CB 3.31Å; E548-R552 VanDerWaalsContact O-CG 3.25Å; E548-R552 WeakPolarHBondContact O-CG 3.39Å; E548-R552 PolarHBondContact O-N 2.8Å
549	N	56.6	Low	48.3	Very low	82 Å²	82	102 Å²	102	44%	0.439	54%	0.535	S	S	.	.	H	α-helix	trans	-66.8	-34.5	172.3	-77.5	-48.1	0	0	0	112	D545 L553	D545-N549 WeakPolarHBondContact O-CB 3.43Å; D545-N549 VanDerWaalsContact O-CG 3.22Å; D545-N549 PolarHBondContact O-N 3.26Å; D545-N549 PolarHBondContact O-ND2 3.02Å; N549-L553 WeakPolarHBondContact O-CA 3.29Å; N549-L553 WeakPolarHBondContact O-CB 3.45Å; N549-L553 PolarHBondContact O-N 3.27Å
550	L	56	Low	48.4	Very low	101 Å²	101	99.7 Å²	99.7	53%	0.529	54%	0.535	S	S	.	.	H	α-helix	trans	-67.2	-44	171.4	-89.7	161.7	0	0	0	111.7	H546 N547 E548 L553 V554	H546-L550 VanDerWaalsContact O-CB 3.29Å; H546-L550 WeakPolarHBondContact O-CB 3.44Å; H546-L550 WeakPolarHBondContact O-CG 3.26Å; H546-L550 PolarHBondContact O-N 2.98Å; N547-L550 PolarHBondContact O-N 3.39Å; E548-L550 VanDerWaalsContact C-N 3.34Å; L550-L553 PolarHBondContact O-N 2.92Å; L550-V554 WeakPolarHBondContact O-CB 3.43Å; L550-V554 WeakPolarHBondContact O-CG2 3.31Å; L550-V554 PolarHBondContact O-N 2.99Å
551	V	57.7	Low	48.4	Very low	101 Å²	101	102.3 Å²	102.3	61%	0.612	54%	0.543	S	S	*	.	H	α-helix	trans	-64.8	-42.6	177.2	171.1	0	0	0	0	110.6	N547 E548 V554 H555	N547-V551 WeakPolarHBondContact O-CB 3.26Å; N547-V551 WeakPolarHBondContact O-CG2 3.34Å; N547-V551 PolarHBondContact O-N 3.32Å; E548-V551 PolarHBondContact O-N 3.42Å; V551-V554 PolarHBondContact O-N 3.18Å; V551-H555 VanDerWaalsContact O-CB 3.23Å; V551-H555 WeakPolarHBondContact O-CB 3.49Å; V551-H555 PolarHBondContact O-N 3Å
552	R	52	Low	48	Very low	153 Å²	153	101 Å²	101	58%	0.577	54%	0.543	S	S	*	.	H	α-helix	trans	-67.4	-38.9	173.7	-73	178.3	75.9	-163.1	4.2	111.8	E548 H555 N556	E548-R552 VanDerWaalsContact O-CB 3.24Å; E548-R552 WeakPolarHBondContact O-CB 3.31Å; E548-R552 VanDerWaalsContact O-CG 3.25Å; E548-R552 WeakPolarHBondContact O-CG 3.39Å; E548-R552 PolarHBondContact O-N 2.8Å; R552-H555 PolarHBondContact O-N 3.21Å; R552-N556 WeakPolarHBondContact O-CA 3.23Å; R552-N556 WeakPolarHBondContact O-CB 3.2Å; R552-N556 PolarHBondContact O-N 3.36Å; R552-N556 PolarHBondContact O-ND2 3.48Å
553	L	52.6	Low	47.2	Very low	112 Å²	112	101 Å²	101	59%	0.586	55%	0.55	S	S	*	.	H	α-helix	trans	-66.6	-39.8	176.7	-171.7	71.2	0	0	0	111.1	N549 L550 S557	N549-L553 WeakPolarHBondContact O-CA 3.29Å; N549-L553 WeakPolarHBondContact O-CB 3.45Å; N549-L553 PolarHBondContact O-N 3.27Å; L550-L553 PolarHBondContact O-N 2.92Å; L553-S557 WeakPolarHBondContact O-CB 3.28Å; L553-S557 PolarHBondContact O-N 3.25Å; L553-S557 PolarHBondContact O-OG 2.77Å
554	V	55.6	Low	46.4	Very low	84 Å²	84	104.6 Å²	104.6	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-66	-46.5	174.4	170.1	0	0	0	0	110.4	L550 V551 S557 L558	L550-V554 WeakPolarHBondContact O-CB 3.43Å; L550-V554 WeakPolarHBondContact O-CG2 3.31Å; L550-V554 PolarHBondContact O-N 2.99Å; V551-V554 PolarHBondContact O-N 3.18Å; V554-S557 PolarHBondContact O-N 2.87Å; V554-L558 HydrophobicContact CG1-CD1 3.82Å; V554-L558 WeakPolarHBondContact O-CB 3.38Å; V554-L558 WeakPolarHBondContact O-CD1 3.16Å; V554-L558 VanDerWaalsContact O-CG 3.28Å; V554-L558 WeakPolarHBondContact O-CG 3.42Å; V554-L558 PolarHBondContact O-N 2.88Å
555	H	47.5	Very low	45.8	Very low	106 Å²	106	107.6 Å²	107.6	49%	0.491	58%	0.583	S	S	.	*	H	α-helix	trans	-68.8	-39.8	-179.4	-161.9	-86.7	0	0	0	112.4	V551 R552 L558 Q559	V551-H555 VanDerWaalsContact O-CB 3.23Å; V551-H555 WeakPolarHBondContact O-CB 3.49Å; V551-H555 PolarHBondContact O-N 3Å; R552-H555 PolarHBondContact O-N 3.21Å; H555-L558 PolarHBondContact O-N 3.05Å; H555-Q559 PolarHBondContact CE1-NE2 2.76Å; H555-Q559 VanDerWaalsContact CE1-NE2 3.31Å; H555-Q559 PolarHBondContact O-N 2.81Å
556	N	43.2	Very low	45.1	Very low	80 Å²	80	110.4 Å²	110.4	43%	0.428	60%	0.598	S	S	.	*	H	α-helix	trans	-72.9	-34.9	176.5	-67.1	-13.4	0	0	0	111.7	R552 L558 Q559 A560	R552-N556 WeakPolarHBondContact O-CA 3.23Å; R552-N556 WeakPolarHBondContact O-CB 3.2Å; R552-N556 PolarHBondContact O-N 3.36Å; R552-N556 PolarHBondContact O-ND2 3.48Å; N556-L558 VanDerWaalsContact C-N 3.33Å; N556-Q559 PolarHBondContact O-N 2.86Å; N556-A560 WeakPolarHBondContact O-CB 3.26Å; N556-A560 PolarHBondContact O-N 3.38Å
557	S	44.5	Very low	44.6	Very low	62 Å²	62	110.3 Å²	110.3	43%	0.434	61%	0.606	S	S	.	*	H	α-helix	trans	-69.5	-32.3	173.5	-62.1	0	0	0	0	112.1	L553 V554	L553-S557 WeakPolarHBondContact O-CB 3.28Å; L553-S557 PolarHBondContact O-N 3.25Å; L553-S557 PolarHBondContact O-OG 2.77Å; V554-S557 PolarHBondContact O-N 2.87Å
558	L	43.2	Very low	44.1	Very low	114 Å²	114	113.1 Å²	113.1	60%	0.597	62%	0.621	S	S	*	*	H	α-helix	trans	-69.7	-34.5	172.1	-79.6	160.7	0	0	0	112	V554 H555 N556 T562	V554-L558 HydrophobicContact CG1-CD1 3.82Å; V554-L558 WeakPolarHBondContact O-CB 3.38Å; V554-L558 WeakPolarHBondContact O-CD1 3.16Å; V554-L558 VanDerWaalsContact O-CG 3.28Å; V554-L558 WeakPolarHBondContact O-CG 3.42Å; V554-L558 PolarHBondContact O-N 2.88Å; H555-L558 PolarHBondContact O-N 3.05Å; N556-L558 VanDerWaalsContact C-N 3.33Å; L558-T562 PolarHBondContact O-OG1 3Å
559	Q	43.2	Very low	43.1	Very low	128 Å²	128	111.7 Å²	111.7	60%	0.598	62%	0.617	S	S	*	*	H	α-helix	trans	-80.9	-38.1	176.6	-80.4	-176.5	-10.4	0	0	113.8	H555 N556 N561	H555-Q559 PolarHBondContact CE1-NE2 2.76Å; H555-Q559 VanDerWaalsContact CE1-NE2 3.31Å; H555-Q559 PolarHBondContact O-N 2.81Å; N556-Q559 PolarHBondContact O-N 2.86Å; Q559-N561 PolarHBondContact O-N 3.38Å
560	A	39.1	Very low	42.7	Very low	78 Å²	78	111.7 Å²	111.7	65%	0.645	62%	0.62	S	S	*	*	H	α-helix	trans	-77	-22.2	-171	0	0	0	0	0	114.3	N556	N556-A560 WeakPolarHBondContact O-CB 3.26Å; N556-A560 PolarHBondContact O-N 3.38Å
561	N	39.1	Very low	42.2	Very low	134 Å²	134	110.7 Å²	110.7	72%	0.717	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	10.4	-175.6	-69.8	-29.6	0	0	0	114.7	Q559 P563	Q559-N561 PolarHBondContact O-N 3.38Å; N561-P563 VanDerWaalsContact O-CD 3.27Å; N561-P563 WeakPolarHBondContact O-CD 3.42Å
562	T	36.5	Very low	41.3	Very low	95 Å²	95	108.6 Å²	108.6	58%	0.583	60%	0.598	S	S	*	*	S	Bend	trans	-103.9	96.9	170.9	-40	0	0	0	0	107.9	L558 I564	L558-T562 PolarHBondContact O-OG1 3Å; T562-I564 PolarHBondContact O-N 3.49Å; T562-I564 VanDerWaalsContact O-N 3.15Å
563	P	28.8	Very low	41.1	Very low	105 Å²	105	107.3 Å²	107.3	68%	0.682	60%	0.598	S	S	*	*			trans	-57.9	125.6	174.6	22.9	-31	0	0	0	108.4	N561 S565	N561-P563 VanDerWaalsContact O-CD 3.27Å; N561-P563 WeakPolarHBondContact O-CD 3.42Å; P563-S565 PolarHBondContact O-N 3.02Å
564	I	30.2	Very low	40.7	Very low	179 Å²	179	104.9 Å²	104.9	92%	0.918	59%	0.585	S	S	*	*			trans	-57.6	90.5	171.1	-57.9	159.1	0	0	0	106.7	T562	T562-I564 PolarHBondContact O-N 3.49Å; T562-I564 VanDerWaalsContact O-N 3.15Å
565	S	31.6	Very low	40.3	Very low	96 Å²	96	101.2 Å²	101.2	67%	0.671	56%	0.562	S	S	*	*			trans	-108.8	112.7	169.3	55.5	0	0	0	0	106.5	P563 V567	P563-S565 PolarHBondContact O-N 3.02Å; S565-V567 PolarHBondContact O-N 3.38Å; S565-V567 VanDerWaalsContact O-N 3.1Å
566	D	34.5	Very low	40.3	Very low	160 Å²	160	101.4 Å²	101.4	86%	0.856	57%	0.567	S	S	*	*	S	Bend	trans	-38.6	113	164.3	-78.1	-36.9	0	0	0	110.4
567	V	40.6	Very low	40.2	Very low	119 Å²	119	104.1 Å²	104.1	72%	0.721	58%	0.577	S	S	*	*			trans	155.4	65.4	150.3	169.7	0	0	0	0	108.6	S565	S565-V567 PolarHBondContact O-N 3.38Å; S565-V567 VanDerWaalsContact O-N 3.1Å
568	D	37.1	Very low	40.2	Very low	159 Å²	159	102.3 Å²	102.3	85%	0.85	56%	0.561	S	S	*	*			trans	-107.8	51.1	156.8	-77.8	-30.3	0	0	0	109.3	T570	D568-T570 PolarHBondContact O-N 3.18Å
569	L	36.5	Very low	39.8	Very low	97 Å²	97	98.8 Å²	98.8	51%	0.508	55%	0.553	S	S	.	*			trans	-65.4	102	148.2	-70.8	174.6	0	0	0	104.6	E571 E573 I574	L569-E571 PolarHBondContact O-N 2.94Å; L569-E573 VanDerWaalsContact CD2-OE2 3.26Å; L569-E573 WeakPolarHBondContact CD2-OE2 3.49Å; L569-I574 HydrophobicContact CB-CD1 3.98Å; L569-I574 HydrophobicContact CB-CG1 4.03Å; L569-I574 HydrophobicContact CD1-CD1 4.41Å; L569-I574 HydrophobicContact CD1-CG1 4.31Å
570	T	47	Very low	39.5	Very low	83 Å²	83	97.9 Å²	97.9	51%	0.509	56%	0.558	S	S	.	*			trans	-49.6	141.6	175.1	54.3	0	0	0	0	108.2	D568 L572 E573	D568-T570 PolarHBondContact O-N 3.18Å; T570-L572 PolarHBondContact O-N 3.41Å; T570-E573 PolarHBondContact O-N 3.31Å
571	E	44.8	Very low	39.3	Very low	79 Å²	79	99.9 Å²	99.9	37%	0.369	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-48.6	-17.6	179	-169.8	172.7	-168.4	0	0	113.2	L127 G128 L569 M575	L127-E571 PolarHBondContact N-OE1 2.91Å; L127-E571 VanDerWaalsContact N-OE1 3.16Å; G128-E571 PolarHBondContact N-OE1 2.86Å; G128-E571 VanDerWaalsContact N-OE1 3.16Å; L569-E571 PolarHBondContact O-N 2.94Å; E571-M575 VanDerWaalsContact O-CB 3.23Å; E571-M575 WeakPolarHBondContact O-CB 3.17Å
572	L	39.7	Very low	38.9	Very low	58 Å²	58	99.9 Å²	99.9	30%	0.304	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81	-40.2	179.9	-60.5	167.8	0	0	0	114.2	F284 I287 T570 M575 D576	F284-L572 HydrophobicContact CE2-CD2 4.4Å; F284-L572 HydrophobicContact CZ-CD2 4.46Å; I287-L572 HydrophobicContact CD1-CD1 3.5Å; I287-L572 VanDerWaalsContact CD1-CD1 3.5Å; I287-L572 HydrophobicContact CD1-CD2 3.87Å; I287-L572 HydrophobicContact CD1-CG 4.33Å; I287-L572 HydrophobicContact CG1-CD1 4.21Å; T570-L572 PolarHBondContact O-N 3.41Å; L572-M575 HydrophobicContact CD2-CE 4.27Å; L572-M575 WeakPolarHBondContact O-CA 3.12Å; L572-M575 PolarHBondContact O-N 3.46Å; L572-D576 PolarHBondContact O-N 2.88Å; L572-D576 VanDerWaalsContact O-N 3.16Å
573	E	47	Very low	38.4	Very low	125 Å²	125	100.6 Å²	100.6	58%	0.584	58%	0.578	S	S	*	*	H	α-helix	trans	-69.4	-40.7	-178.5	-171.2	178.7	177.9	0	0	111.2	L569 T570 M575	L569-E573 VanDerWaalsContact CD2-OE2 3.26Å; L569-E573 WeakPolarHBondContact CD2-OE2 3.49Å; T570-E573 PolarHBondContact O-N 3.31Å; E573-M575 PolarHBondContact O-N 2.87Å; E573-M575 VanDerWaalsContact O-N 3.07Å
574	I	45.8	Very low	38.5	Very low	61 Å²	61	100 Å²	100	31%	0.313	58%	0.582	S	S	.	*	H	α-helix	trans	-62.1	-19.1	171.8	-54	173.5	0	0	0	110.6	L569 W578	L569-I574 HydrophobicContact CB-CD1 3.98Å; L569-I574 HydrophobicContact CB-CG1 4.03Å; L569-I574 HydrophobicContact CD1-CD1 4.41Å; L569-I574 HydrophobicContact CD1-CG1 4.31Å; I574-W578 PolarHBondContact O-NE1 3.33Å
575	M	47.1	Very low	38.4	Very low	7 Å²	7	98.8 Å²	98.8	3%	0.034	58%	0.577	C	S	.	*	H	α-helix	trans	-99.8	-22.3	-168.4	-159.8	153.5	58.9	0	0	117.2	V166 F280 F284 E571 L572 E573 E577 W578	V166-M575 HydrophobicContact CG2-CG 4.19Å; V166-M575 HydrophobicContact CG2-SD 4.14Å; F280-M575 HydrophobicContact CD2-CE 3.7Å; F280-M575 HydrophobicContact CD2-SD 4.13Å; F280-M575 HydrophobicContact CE2-CE 3.23Å; F280-M575 HydrophobicContact CE2-SD 3.49Å; F280-M575 WeakPolarHBondContact CE2-SD 3.18Å; F280-M575 HydrophobicContact CZ-CE 4.2Å; F284-M575 HydrophobicContact CE2-CE 4.16Å; E571-M575 VanDerWaalsContact O-CB 3.23Å; E571-M575 WeakPolarHBondContact O-CB 3.17Å; L572-M575 HydrophobicContact CD2-CE 4.27Å; L572-M575 WeakPolarHBondContact O-CA 3.12Å; L572-M575 PolarHBondContact O-N 3.46Å; E573-M575 PolarHBondContact O-N 2.87Å; E573-M575 VanDerWaalsContact O-N 3.07Å; M575-E577 PolarHBondContact O-N 3.35Å; M575-W578 VanDerWaalsContact C-CD1 3.46Å; M575-W578 VanDerWaalsContact CA-NE1 3.31Å; M575-W578 HydrophobicContact CB-CZ2 4.49Å; M575-W578 HydrophobicContact CG-CD2 4.03Å; M575-W578 HydrophobicContact CG-CG 4.22Å; M575-W578 HydrophobicContact CG-CH2 4.42Å; M575-W578 HydrophobicContact CG-CZ2 3.84Å; M575-W578 WeakPolarHBondContact O-CB 3.46Å; M575-W578 VanDerWaalsContact O-CG 3.28Å; M575-W578 PolarHBondContact O-N 2.91Å; M575-W578 HydrophobicContact SD-CH2 4.11Å; M575-W578 HydrophobicContact SD-CZ2 3.87Å
576	D	46.4	Very low	38.1	Very low	111 Å²	111	105 Å²	105	59%	0.594	59%	0.586	S	S	*	*	H	α-helix	trans	-72.8	-18.3	171.9	-85.2	-32.6	0	0	0	113.3	K170 L572 W578	K170-D576 IonicContact NZ-OD1 3.54Å; K170-D576 PolarHBondContact NZ-OD1 2.91Å; L572-D576 PolarHBondContact O-N 2.88Å; L572-D576 VanDerWaalsContact O-N 3.16Å; D576-W578 PolarHBondContact O-N 2.84Å; D576-W578 VanDerWaalsContact O-N 3.15Å
577	E	41.9	Very low	37.8	Very low	137 Å²	137	104.9 Å²	104.9	64%	0.64	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	10.9	173.1	-66.3	-162.4	163.3	0	0	115	M575 G579	M575-E577 PolarHBondContact O-N 3.35Å; E577-G579 PolarHBondContact O-N 2.89Å
578	W	43.9	Very low	37.2	Very low	23 Å²	23	106.2 Å²	106.2	9%	0.087	59%	0.588	C	S	.	*			trans	-83.3	39.8	-174.1	-71.1	41.4	0	0	0	113.7	Y131 L162 V166 I574 M575 D576	Y131-W578 AromaticContact CD1-CD2 3.7Å; Y131-W578 HydrophobicContact CD1-CD2 3.7Å; Y131-W578 AromaticContact CD1-CE2 3.08Å; Y131-W578 HydrophobicContact CD1-CE3 4.18Å; Y131-W578 HydrophobicContact CD1-CG 4.43Å; Y131-W578 AromaticContact CD1-CH2 3.83Å; Y131-W578 HydrophobicContact CD1-CH2 3.83Å; Y131-W578 AromaticContact CD1-CZ2 3.21Å; Y131-W578 HydrophobicContact CD1-CZ2 3.21Å; Y131-W578 HydrophobicContact CD1-CZ3 4.24Å; Y131-W578 AromaticContact CD1-NE1 3.3Å; Y131-W578 VanDerWaalsContact CD1-NE1 3.3Å; Y131-W578 AromaticContact CD2-CD2 3.8Å; Y131-W578 HydrophobicContact CD2-CD2 3.8Å; Y131-W578 AromaticContact CD2-CE2 3.86Å; Y131-W578 AromaticContact CD2-CE3 3.42Å; Y131-W578 HydrophobicContact CD2-CE3 3.42Å; Y131-W578 VanDerWaalsContact CD2-CE3 3.42Å; Y131-W578 AromaticContact CD2-CH2 3.39Å; Y131-W578 HydrophobicContact CD2-CH2 3.39Å; Y131-W578 AromaticContact CD2-CZ2 3.72Å; Y131-W578 HydrophobicContact CD2-CZ2 3.72Å; Y131-W578 AromaticContact CD2-CZ3 3.2Å; Y131-W578 HydrophobicContact CD2-CZ3 3.2Å; Y131-W578 AromaticContact CE1-CD1 3.66Å; Y131-W578 AromaticContact CE1-CD2 3.49Å; Y131-W578 HydrophobicContact CE1-CD2 3.49Å; Y131-W578 VanDerWaalsContact CE1-CD2 3.49Å; Y131-W578 AromaticContact CE1-CE2 3.31Å; Y131-W578 HydrophobicContact CE1-CE3 4.11Å; Y131-W578 AromaticContact CE1-CG 3.84Å; Y131-W578 HydrophobicContact CE1-CG 3.84Å; Y131-W578 AromaticContact CE1-CZ2 3.93Å; Y131-W578 HydrophobicContact CE1-CZ2 3.93Å; Y131-W578 AromaticContact CE1-NE1 3.23Å; Y131-W578 AromaticContact CE2-CD2 3.6Å; Y131-W578 HydrophobicContact CE2-CD2 3.6Å; Y131-W578 AromaticContact CE2-CE3 3.32Å; Y131-W578 HydrophobicContact CE2-CE3 3.32Å; Y131-W578 HydrophobicContact CE2-CG 4.36Å; Y131-W578 HydrophobicContact CE2-CH2 4.19Å; Y131-W578 HydrophobicContact CE2-CZ2 4.36Å; Y131-W578 AromaticContact CE2-CZ3 3.66Å; Y131-W578 HydrophobicContact CE2-CZ3 3.66Å; Y131-W578 AromaticContact CG-CD2 3.83Å; Y131-W578 HydrophobicContact CG-CD2 3.83Å; Y131-W578 AromaticContact CG-CE2 3.37Å; Y131-W578 AromaticContact CG-CE3 3.84Å; Y131-W578 HydrophobicContact CG-CE3 3.84Å; Y131-W578 AromaticContact CG-CH2 3.15Å; Y131-W578 HydrophobicContact CG-CH2 3.15Å; Y131-W578 AromaticContact CG-CZ2 3.06Å; Y131-W578 HydrophobicContact CG-CZ2 3.06Å; Y131-W578 AromaticContact CG-CZ3 3.53Å; Y131-W578 HydrophobicContact CG-CZ3 3.53Å; Y131-W578 AromaticContact CZ-CD2 3.42Å; Y131-W578 VanDerWaalsContact CZ-CD2 3.42Å; Y131-W578 AromaticContact CZ-CE2 3.77Å; Y131-W578 AromaticContact CZ-CE3 3.69Å; Y131-W578 AromaticContact CZ-CG 3.79Å; Y131-W578 AromaticContact CZ-NE1 3.97Å; L162-W578 HydrophobicContact CB-CH2 4.11Å; L162-W578 HydrophobicContact CB-CZ3 3.55Å; V166-W578 HydrophobicContact CG2-CD2 4.44Å; V166-W578 HydrophobicContact CG2-CE3 3.79Å; V166-W578 HydrophobicContact CG2-CH2 4.49Å; V166-W578 HydrophobicContact CG2-CZ3 3.8Å; I574-W578 PolarHBondContact O-NE1 3.33Å; M575-W578 VanDerWaalsContact C-CD1 3.46Å; M575-W578 VanDerWaalsContact CA-NE1 3.31Å; M575-W578 HydrophobicContact CB-CZ2 4.49Å; M575-W578 HydrophobicContact CG-CD2 4.03Å; M575-W578 HydrophobicContact CG-CG 4.22Å; M575-W578 HydrophobicContact CG-CH2 4.42Å; M575-W578 HydrophobicContact CG-CZ2 3.84Å; M575-W578 WeakPolarHBondContact O-CB 3.46Å; M575-W578 VanDerWaalsContact O-CG 3.28Å; M575-W578 PolarHBondContact O-N 2.91Å; M575-W578 HydrophobicContact SD-CH2 4.11Å; M575-W578 HydrophobicContact SD-CZ2 3.87Å; D576-W578 PolarHBondContact O-N 2.84Å; D576-W578 VanDerWaalsContact O-N 3.15Å
579	G	35.9	Very low	36.8	Very low	41 Å²	41	104 Å²	104	42%	0.423	58%	0.58	S	S	.	*	S	Bend	trans	-68.6	147.1	160.6	0	0	0	0	0	110.3	E577	E577-G579 PolarHBondContact O-N 2.89Å
580	P	35.1	Very low	36.3	Very low	108 Å²	108	105.2 Å²	105.2	70%	0.701	60%	0.596	S	S	*	*			trans	-56.7	146.7	169.7	26.3	-32.2	0	0	0	109.2	T582	P580-T582 PolarHBondContact O-N 2.89Å
581	P	35.4	Very low	35.5	Very low	121 Å²	121	107.6 Å²	107.6	79%	0.786	61%	0.605	S	S	*	*			trans	-55.9	109.1	-175.4	22.5	-32.9	0	0	0	109.8	S583	P581-S583 PolarHBondContact O-N 3.45Å; P581-S583 VanDerWaalsContact O-N 3.1Å
582	T	30.5	Very low	34.7	Very low	133 Å²	133	106.5 Å²	106.5	82%	0.816	61%	0.609	S	S	*	*	S	Bend	trans	-63.6	111.3	169.5	-27.7	0	0	0	0	106.1	P580	P580-T582 PolarHBondContact O-N 2.89Å
583	S	27	Very low	34.2	Very low	111 Å²	111	112.6 Å²	112.6	78%	0.776	64%	0.641	S	S	*	*			trans	55.3	81.3	169.8	57.2	0	0	0	0	116.9	P581	P581-S583 PolarHBondContact O-N 3.45Å; P581-S583 VanDerWaalsContact O-N 3.1Å
584	A	30.9	Very low	33.6	Very low	92 Å²	92	111 Å²	111	76%	0.76	64%	0.643	S	S	*	*			trans	-112	125.5	143.6	0	0	0	0	0	107.7
585	N	28.7	Very low	32.7	Very low	153 Å²	153	114.6 Å²	114.6	82%	0.818	66%	0.663	S	S	*	*			trans	-49.7	145.9	-165	-70.3	-40.3	0	0	0	114.8	L587	N585-L587 PolarHBondContact O-N 2.97Å
586	R	25.4	Very low	32	Very low	226 Å²	226	121 Å²	121	85%	0.853	70%	0.697	S	S	*	*			trans	-39.1	100.4	159.2	-81.1	-179.7	166.8	-179	-7.6	109.9
587	L	27.6	Very low	30.9	Very low	159 Å²	159	121.3 Å²	121.3	83%	0.832	71%	0.707	S	S	*	*			trans	-96.7	111.6	146.5	-122.5	90.8	0	0	0	105.6	N585 T589	N585-L587 PolarHBondContact O-N 2.97Å; L587-T589 PolarHBondContact O-N 2.87Å
588	D	27	Very low	30.2	Very low	146 Å²	146	121.7 Å²	121.7	78%	0.781	71%	0.713	S	S	*	*			trans	-54.6	98.8	171	-73.2	-46.2	0	0	0	109.6
589	T	29.1	Very low	29.4	Very low	114 Å²	114	126.2 Å²	126.2	70%	0.699	75%	0.745	S	S	*	*			trans	-125.3	93.7	145.3	17.5	0	0	0	0	105.9	L587 I591	L587-T589 PolarHBondContact O-N 2.87Å; T589-I591 PolarHBondContact O-N 2.83Å
590	S	25.4	Very low	29	Very low	121 Å²	121	128.6 Å²	128.6	85%	0.846	76%	0.761	S	S	*	*			trans	-51.9	75.2	154.1	51.4	0	0	0	0	109.7
591	I	30.3	Very low	28.7	Very low	134 Å²	134	132.1 Å²	132.1	69%	0.687	77%	0.768	S	S	*	*			trans	-93.3	94.9	151.5	-59.9	173.9	0	0	0	102.7	T589 L593	T589-I591 PolarHBondContact O-N 2.83Å; I591-L593 PolarHBondContact O-N 2.96Å
592	A	27.9	Very low	28.4	Very low	55 Å²	55	135.8 Å²	135.8	46%	0.455	77%	0.771	S	S	.	*			trans	-46.9	133.1	-179.7	0	0	0	0	0	109.4	S594	A592-S594 PolarHBondContact O-N 3.46Å
593	L	30.8	Very low	28.1	Very low	187 Å²	187	137.1 Å²	137.1	98%	0.979	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	27	168.6	-71.5	166.6	0	0	0	112.3	I591	I591-L593 PolarHBondContact O-N 2.96Å
594	S	32.9	Very low	28.2	Very low	90 Å²	90	139.8 Å²	139.8	63%	0.629	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-16.5	-175.5	-57	0	0	0	0	112.8	A592	A592-S594 PolarHBondContact O-N 3.46Å
595	D	28.1	Very low	27.9	Very low	137 Å²	137	141.1 Å²	141.1	73%	0.733	77%	0.767	S	S	*	*	S	Bend	trans	-95.2	9.3	-172.4	-68.5	-13.3	0	0	0	115
596	I	31.2	Very low	27.7	Very low	143 Å²	143	140.9 Å²	140.9	73%	0.733	77%	0.765	S	S	*	*	S	Bend	trans	-108.7	83.9	162	-51.5	174.9	0	0	0	106.2	L598	I596-L598 VanDerWaalsContact C-N 3.32Å; I596-L598 PolarHBondContact O-N 3.16Å
597	S	24.5	Very low	27.9	Very low	116 Å²	116	136.1 Å²	136.1	81%	0.811	76%	0.761	S	S	*	*			trans	-54.2	98	167.2	-82	0	0	0	0	109.1
598	L	27.4	Very low	28.2	Very low	145 Å²	145	135 Å²	135	76%	0.759	76%	0.761	S	S	*	*			trans	-72.2	136.3	157.5	-73.7	164.2	0	0	0	107	I596 A600	I596-L598 VanDerWaalsContact C-N 3.32Å; I596-L598 PolarHBondContact O-N 3.16Å; L598-A600 PolarHBondContact O-N 3.16Å; L598-A600 VanDerWaalsContact O-N 3.1Å
599	P	26.2	Very low	28.3	Very low	119 Å²	119	132.4 Å²	132.4	77%	0.773	75%	0.751	S	S	*	*			trans	-58.6	122.9	167.9	24.9	-29.8	0	0	0	107.2	E601	P599-E601 PolarHBondContact O-N 3.21Å
600	A	27.3	Very low	29.1	Very low	90 Å²	90	133.3 Å²	133.3	74%	0.744	75%	0.751	S	S	*	*			trans	-41.4	128.3	178	0	0	0	0	0	109.9	L598 K602	L598-A600 PolarHBondContact O-N 3.16Å; L598-A600 VanDerWaalsContact O-N 3.1Å; A600-K602 PolarHBondContact O-N 2.93Å
601	E	29	Very low	30	Very low	183 Å²	183	131 Å²	131	86%	0.855	74%	0.735	S	S	*	*			trans	-42.9	103.5	164.4	-61.4	179.1	164.1	0	0	107.3	P599 E603	P599-E601 PolarHBondContact O-N 3.21Å; E601-E603 PolarHBondContact O-N 2.86Å
602	K	28.8	Very low	30.8	Very low	197 Å²	197	132.6 Å²	132.6	86%	0.857	74%	0.739	S	S	*	*			trans	-64	98.8	159.9	-86.6	-175.9	176.3	-179.8	0	104.2	A600 L604	A600-K602 PolarHBondContact O-N 2.93Å; K602-L604 PolarHBondContact O-N 2.89Å
603	E	24.8	Very low	31.8	Very low	161 Å²	161	136.1 Å²	136.1	75%	0.752	75%	0.75	S	S	*	*			trans	-43.5	83.8	153.9	-68.4	180	151.6	0	0	108.1	E601 N605	E601-E603 PolarHBondContact O-N 2.86Å; E603-N605 PolarHBondContact O-N 2.66Å
604	L	29.2	Very low	32.8	Very low	167 Å²	167	132.3 Å²	132.3	87%	0.874	73%	0.731	S	S	*	*			trans	-82.3	78.4	163.5	-131.9	159.4	0	0	0	104.7	K602 L606	K602-L604 PolarHBondContact O-N 2.89Å; L604-L606 PolarHBondContact O-N 2.73Å
605	N	24.3	Very low	34.1	Very low	120 Å²	120	133.8 Å²	133.8	64%	0.642	73%	0.726	S	S	*	*			trans	-53.6	123.6	171.2	-81.5	-50.3	0	0	0	109.2	E603	E603-N605 PolarHBondContact O-N 2.66Å
606	L	24.9	Very low	35.6	Very low	149 Å²	149	133.5 Å²	133.5	78%	0.78	72%	0.72	S	S	*	*				64.4	92.2	126.9	-159.6	79.8	0	0	0	116.8	L604	L604-L606 PolarHBondContact O-N 2.73Å
607	V	28.6	Very low	37.7	Very low	125 Å²	125	131.1 Å²	131.1	76%	0.758	71%	0.708	S	S	*	*				-153.4	99.5	121.5	178.4	0	0	0	0	107.3	T609	V607-T609 HydrophobicContact CG1-CG2 4.39Å; V607-T609 WeakPolarHBondContact CG1-OG1 3.43Å
608	T	33.8	Very low	39.9	Very low	137 Å²	137	132.1 Å²	132.1	84%	0.84	70%	0.7	S	S	*	*			trans	-94.7	90	163	-45.2	0	0	0	0	106.4
609	T	30.5	Very low	42.3	Very low	91 Å²	91	130.3 Å²	130.3	56%	0.558	69%	0.69	S	S	*	*			trans	-149.3	104.9	169.3	54.4	0	0	0	0	110.2	V607 S611	V607-T609 HydrophobicContact CG1-CG2 4.39Å; V607-T609 WeakPolarHBondContact CG1-OG1 3.43Å; T609-S611 PolarHBondContact O-N 2.89Å
610	D	45.7	Very low	44.7	Very low	132 Å²	132	127.8 Å²	127.8	71%	0.706	67%	0.673	S	S	*	*	S	Bend	trans	58.7	-4.1	144.7	-50.6	-26.3	0	0	0	120.9
611	S	43.7	Very low	47.2	Very low	72 Å²	72	128.3 Å²	128.3	50%	0.503	66%	0.663	S	S	.	*	H	α-helix	trans	-81.7	-18.1	-179.9	-165.4	0	0	0	0	114.4	T609 K615	T609-S611 PolarHBondContact O-N 2.89Å; S611-K615 WeakPolarHBondContact O-CG 3.3Å
612	E	46.8	Very low	49.7	Very low	168 Å²	168	124.8 Å²	124.8	79%	0.785	65%	0.65	S	S	*	*	H	α-helix	trans	-84	-29	-177.9	-72.9	-166.3	159.8	0	0	113.8	K615	E612-K615 PolarHBondContact O-N 2.77Å
613	L	49.5	Very low	52.3	Low	130 Å²	130	122.6 Å²	122.6	68%	0.681	64%	0.637	S	S	*	*	H	α-helix	trans	-68.5	-43.8	173.6	-81.5	163.4	0	0	0	110.9	K615 H616 D617	L613-K615 PolarHBondContact O-N 3.41Å; L613-H616 PolarHBondContact O-N 3.1Å; L613-H616 VanDerWaalsContact O-N 3.11Å; L613-D617 PolarHBondContact O-N 2.92Å
614	N	50.8	Low	55	Low	107 Å²	107	118.5 Å²	118.5	57%	0.572	62%	0.62	S	S	*	*	H	α-helix	trans	-62.5	-27.2	176.8	-77.1	-6	0	0	0	114	Q618	N614-Q618 WeakPolarHBondContact O-CB 3.46Å; N614-Q618 PolarHBondContact O-N 2.77Å
615	K	61.5	Low	57.7	Low	121 Å²	121	116.8 Å²	116.8	53%	0.526	61%	0.608	S	S	.	*	H	α-helix	trans	-73.9	-32.8	177.1	-76.5	-179	-177.4	-178.6	0	112.3	S611 E612 L613 I619	S611-K615 WeakPolarHBondContact O-CG 3.3Å; E612-K615 PolarHBondContact O-N 2.77Å; L613-K615 PolarHBondContact O-N 3.41Å; K615-I619 WeakPolarHBondContact O-CD1 3.48Å; K615-I619 WeakPolarHBondContact O-CG1 3.27Å; K615-I619 PolarHBondContact O-N 2.98Å; K615-I619 VanDerWaalsContact O-N 3.07Å
616	H	59.9	Low	60.4	Low	131 Å²	131	114 Å²	114	61%	0.606	60%	0.598	S	S	*	*	H	α-helix	trans	-71.6	-43.2	176	-119.2	55.2	0	0	0	110.7	L613 Q618 I619 T620	L613-H616 PolarHBondContact O-N 3.1Å; L613-H616 VanDerWaalsContact O-N 3.11Å; H616-Q618 VanDerWaalsContact C-N 3.35Å; H616-Q618 PolarHBondContact O-N 3.33Å; H616-I619 PolarHBondContact O-N 2.76Å; H616-I619 VanDerWaalsContact O-N 3.16Å; H616-T620 PolarHBondContact O-N 3.15Å; H616-T620 PolarHBondContact O-OG1 3.1Å; H616-T620 VanDerWaalsContact O-OG1 3.12Å
617	D	74.3	Confident	63	Low	92 Å²	92	111 Å²	111	49%	0.492	58%	0.582	S	S	.	*	H	α-helix	trans	-61.9	-42.8	175	-62.2	-23	0	0	0	111	L613 I619 T620 D621	L613-D617 PolarHBondContact O-N 2.92Å; D617-I619 VanDerWaalsContact C-N 3.35Å; D617-I619 PolarHBondContact O-N 3.34Å; D617-T620 PolarHBondContact O-N 2.9Å; D617-D621 WeakPolarHBondContact O-CB 3.45Å; D617-D621 PolarHBondContact O-N 3.35Å
618	Q	71.8	Confident	65.4	Low	137 Å²	137	111.1 Å²	111.1	64%	0.64	57%	0.574	S	S	*	*	H	α-helix	trans	-60.4	-38.3	172.9	-93.7	-178.5	-7.3	0	0	114.2	N614 H616 L622	N614-Q618 WeakPolarHBondContact O-CB 3.46Å; N614-Q618 PolarHBondContact O-N 2.77Å; H616-Q618 VanDerWaalsContact C-N 3.35Å; H616-Q618 PolarHBondContact O-N 3.33Å; Q618-L622 VanDerWaalsContact O-CB 3.27Å; Q618-L622 WeakPolarHBondContact O-CB 3.37Å; Q618-L622 PolarHBondContact O-N 3.33Å
619	I	76.8	Confident	67.8	Low	107 Å²	107	110.6 Å²	110.6	55%	0.549	56%	0.56	S	S	.	*	H	α-helix	trans	-71	-40.8	178.3	-70.6	164.6	0	0	0	109.9	K615 H616 D617 L622 Y623	K615-I619 WeakPolarHBondContact O-CD1 3.48Å; K615-I619 WeakPolarHBondContact O-CG1 3.27Å; K615-I619 PolarHBondContact O-N 2.98Å; K615-I619 VanDerWaalsContact O-N 3.07Å; H616-I619 PolarHBondContact O-N 2.76Å; H616-I619 VanDerWaalsContact O-N 3.16Å; D617-I619 VanDerWaalsContact C-N 3.35Å; D617-I619 PolarHBondContact O-N 3.34Å; I619-L622 PolarHBondContact O-N 3.36Å; I619-Y623 VanDerWaalsContact O-CB 3.28Å; I619-Y623 WeakPolarHBondContact O-CB 3.44Å; I619-Y623 PolarHBondContact O-N 2.85Å
620	T	77.6	Confident	69.9	Low	67 Å²	67	109.9 Å²	109.9	41%	0.411	56%	0.559	S	S	.	*	H	α-helix	trans	-65.2	-41.2	175.9	-60.8	0	0	0	0	111.3	H616 D617 Y623 N624	H616-T620 PolarHBondContact O-N 3.15Å; H616-T620 PolarHBondContact O-OG1 3.1Å; H616-T620 VanDerWaalsContact O-OG1 3.12Å; D617-T620 PolarHBondContact O-N 2.9Å; T620-Y623 PolarHBondContact O-N 3.34Å; T620-N624 WeakPolarHBondContact O-CB 3.2Å; T620-N624 PolarHBondContact O-N 3.47Å; T620-N624 PolarHBondContact O-ND2 2.94Å
621	D	80	Confident	71.6	Confident	101 Å²	101	106 Å²	106	54%	0.54	55%	0.545	S	S	.	.	H	α-helix	trans	-65.3	-44.8	176	-70.6	-18.4	0	0	0	111.4	D617 Y623 N624 E625	D617-D621 WeakPolarHBondContact O-CB 3.45Å; D617-D621 PolarHBondContact O-N 3.35Å; D621-Y623 VanDerWaalsContact C-N 3.3Å; D621-Y623 PolarHBondContact O-N 2.85Å; D621-N624 PolarHBondContact O-N 3.44Å; D621-E625 VanDerWaalsContact O-CB 3.32Å; D621-E625 WeakPolarHBondContact O-CB 3.32Å; D621-E625 PolarHBondContact O-N 2.87Å
622	L	81.1	Confident	73.3	Confident	109 Å²	109	109.1 Å²	109.1	57%	0.571	55%	0.549	S	S	*	.	H	α-helix	trans	-63.6	-36.8	176.2	-169.4	72.8	0	0	0	111.9	Q618 I619 S626	Q618-L622 VanDerWaalsContact O-CB 3.27Å; Q618-L622 WeakPolarHBondContact O-CB 3.37Å; Q618-L622 PolarHBondContact O-N 3.33Å; I619-L622 PolarHBondContact O-N 3.36Å; L622-S626 VanDerWaalsContact O-CB 3.31Å; L622-S626 WeakPolarHBondContact O-CB 3.27Å; L622-S626 PolarHBondContact O-N 3.26Å; L622-S626 PolarHBondContact O-OG 3.14Å
623	Y	83.5	Confident	74.5	Confident	150 Å²	150	106 Å²	106	59%	0.588	54%	0.535	S	S	*	.	H	α-helix	trans	-68	-43.6	175.9	-176.1	-102.3	0	0	0	111.5	I619 T620 D621 S626 L627	I619-Y623 VanDerWaalsContact O-CB 3.28Å; I619-Y623 WeakPolarHBondContact O-CB 3.44Å; I619-Y623 PolarHBondContact O-N 2.85Å; T620-Y623 PolarHBondContact O-N 3.34Å; D621-Y623 VanDerWaalsContact C-N 3.3Å; D621-Y623 PolarHBondContact O-N 2.85Å; Y623-S626 PolarHBondContact O-N 2.97Å; Y623-L627 HydrophobicContact CD1-CD1 3.76Å; Y623-L627 HydrophobicContact CE1-CD1 3.3Å; Y623-L627 HydrophobicContact CE1-CG 4.15Å; Y623-L627 PolarHBondContact O-N 3.39Å
624	N	81.8	Confident	75.9	Confident	75 Å²	75	104.9 Å²	104.9	40%	0.401	53%	0.529	S	S	.	.	H	α-helix	trans	-66.3	-41.5	176.2	-70.6	-24.8	0	0	0	111.7	T620 D621 S626 L627 E628	T620-N624 WeakPolarHBondContact O-CB 3.2Å; T620-N624 PolarHBondContact O-N 3.47Å; T620-N624 PolarHBondContact O-ND2 2.94Å; D621-N624 PolarHBondContact O-N 3.44Å; N624-S626 VanDerWaalsContact C-N 3.32Å; N624-S626 PolarHBondContact O-N 2.98Å; N624-L627 PolarHBondContact O-N 3.31Å; N624-E628 PolarHBondContact O-N 2.82Å
625	E	84.1	Confident	77.2	Confident	132 Å²	132	104.2 Å²	104.2	62%	0.617	53%	0.526	S	S	*	.	H	α-helix	trans	-60.9	-42.1	173.8	-175.4	179.1	-173.5	0	0	111.3	D621 E628 F629	D621-E625 VanDerWaalsContact O-CB 3.32Å; D621-E625 WeakPolarHBondContact O-CB 3.32Å; D621-E625 PolarHBondContact O-N 2.87Å; E625-E628 PolarHBondContact O-N 2.84Å; E625-F629 WeakPolarHBondContact O-CB 3.42Å; E625-F629 PolarHBondContact O-N 3.23Å
626	S	80.9	Confident	77.9	Confident	61 Å²	61	102.9 Å²	102.9	43%	0.427	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-39.6	176	-59.9	0	0	0	0	112.1	L622 Y623 N624 F629 C630	L622-S626 VanDerWaalsContact O-CB 3.31Å; L622-S626 WeakPolarHBondContact O-CB 3.27Å; L622-S626 PolarHBondContact O-N 3.26Å; L622-S626 PolarHBondContact O-OG 3.14Å; Y623-S626 PolarHBondContact O-N 2.97Å; N624-S626 VanDerWaalsContact C-N 3.32Å; N624-S626 PolarHBondContact O-N 2.98Å; S626-F629 PolarHBondContact O-N 3.41Å; S626-C630 WeakPolarHBondContact O-CB 3.43Å; S626-C630 PolarHBondContact O-N 3.21Å; S626-C630 PolarHBondContact O-SG 2.91Å
627	L	79.8	Confident	78.7	Confident	86 Å²	86	102 Å²	102	45%	0.45	52%	0.523	S	S	.	.	H	α-helix	trans	-65.5	-43.9	174.8	-85	171.7	0	0	0	111.7	Y623 N624 C630 A631	Y623-L627 HydrophobicContact CD1-CD1 3.76Å; Y623-L627 HydrophobicContact CE1-CD1 3.3Å; Y623-L627 HydrophobicContact CE1-CG 4.15Å; Y623-L627 PolarHBondContact O-N 3.39Å; N624-L627 PolarHBondContact O-N 3.31Å; L627-C630 PolarHBondContact O-N 2.96Å; L627-A631 WeakPolarHBondContact O-CB 3.48Å; L627-A631 PolarHBondContact O-N 3.4Å
628	E	79	Confident	78.9	Confident	127 Å²	127	101.7 Å²	101.7	59%	0.593	52%	0.521	S	S	*	.	H	α-helix	trans	-64.6	-39.1	175.9	-76.5	-164	178	0	0	112.3	N624 E625 A631 K632	N624-E628 PolarHBondContact O-N 2.82Å; E625-E628 PolarHBondContact O-N 2.84Å; E628-A631 PolarHBondContact O-N 3.18Å; E628-K632 WeakPolarHBondContact O-CB 3.46Å; E628-K632 WeakPolarHBondContact O-CG 3.45Å; E628-K632 PolarHBondContact O-N 2.86Å
629	F	85	Confident	79.1	Confident	126 Å²	126	99.4 Å²	99.4	55%	0.553	51%	0.512	S	S	*	.	H	α-helix	trans	-63.3	-45.3	175.2	-177.3	-95.8	0	0	0	111.6	E625 S626 K632 Q633	E625-F629 WeakPolarHBondContact O-CB 3.42Å; E625-F629 PolarHBondContact O-N 3.23Å; S626-F629 PolarHBondContact O-N 3.41Å; F629-K632 PolarHBondContact O-N 3.27Å; F629-Q633 HydrophobicContact CE1-CG 4.31Å; F629-Q633 HydrophobicContact CZ-CG 4.48Å; F629-Q633 PolarHBondContact O-N 3.13Å
630	C	75	Confident	78.9	Confident	77 Å²	77	99.3 Å²	99.3	52%	0.52	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-41.8	174.3	-73	0	0	0	0	111.9	S626 L627 Q633 L634	S626-C630 WeakPolarHBondContact O-CB 3.43Å; S626-C630 PolarHBondContact O-N 3.21Å; S626-C630 PolarHBondContact O-SG 2.91Å; L627-C630 PolarHBondContact O-N 2.96Å; C630-Q633 PolarHBondContact O-N 3.49Å; C630-L634 WeakPolarHBondContact O-CB 3.33Å; C630-L634 PolarHBondContact O-N 3.41Å
631	A	80.3	Confident	78.2	Confident	51 Å²	51	98.7 Å²	98.7	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-39.4	177.3	0	0	0	0	0	112	L627 E628 N635	L627-A631 WeakPolarHBondContact O-CB 3.48Å; L627-A631 PolarHBondContact O-N 3.4Å; E628-A631 PolarHBondContact O-N 3.18Å; A631-N635 WeakPolarHBondContact O-CB 3.33Å; A631-N635 PolarHBondContact O-N 3.05Å
632	K	80.5	Confident	77.5	Confident	136 Å²	136	100.4 Å²	100.4	59%	0.591	52%	0.516	S	S	*	.	H	α-helix	trans	-64.8	-48.7	172.7	-81.6	176.9	179.6	166	0	111.8	E628 F629 L634 N635 D636	E628-K632 WeakPolarHBondContact O-CB 3.46Å; E628-K632 WeakPolarHBondContact O-CG 3.45Å; E628-K632 PolarHBondContact O-N 2.86Å; F629-K632 PolarHBondContact O-N 3.27Å; K632-L634 VanDerWaalsContact C-N 3.28Å; K632-L634 PolarHBondContact O-N 3.25Å; K632-N635 CarbonylContact O-C 3.58Å; K632-N635 PolarHBondContact O-N 2.8Å; K632-N635 VanDerWaalsContact O-N 3.13Å; K632-D636 PolarHBondContact O-N 3.43Å
633	Q	70.4	Confident	76.8	Confident	102 Å²	102	99.1 Å²	99.1	48%	0.477	51%	0.51	S	S	.	.	H	α-helix	trans	-58.6	-41.6	176.4	-100	-166.7	23.2	0	0	112.2	F629 C630 D636 L637	F629-Q633 HydrophobicContact CE1-CG 4.31Å; F629-Q633 HydrophobicContact CZ-CG 4.48Å; F629-Q633 PolarHBondContact O-N 3.13Å; C630-Q633 PolarHBondContact O-N 3.49Å; Q633-D636 PolarHBondContact O-N 3Å; Q633-L637 WeakPolarHBondContact O-CB 3.37Å; Q633-L637 PolarHBondContact O-N 3.18Å
634	L	79.8	Confident	75.5	Confident	108 Å²	108	99.1 Å²	99.1	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-64.6	-43.3	176.4	-175.3	65.5	0	0	0	111.1	C630 K632 L637 I638	C630-L634 WeakPolarHBondContact O-CB 3.33Å; C630-L634 PolarHBondContact O-N 3.41Å; K632-L634 VanDerWaalsContact C-N 3.28Å; K632-L634 PolarHBondContact O-N 3.25Å; L634-L637 WeakPolarHBondContact O-CB 3.34Å; L634-L637 PolarHBondContact O-N 3.24Å; L634-I638 HydrophobicContact CG-CD1 4.01Å; L634-I638 WeakPolarHBondContact O-CB 3.37Å; L634-I638 WeakPolarHBondContact O-CG1 3.44Å; L634-I638 PolarHBondContact O-N 3.1Å
635	N	77.6	Confident	74.1	Confident	93 Å²	93	101.9 Å²	101.9	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-62	-42.2	174.2	-100.2	-37.2	0	0	0	112.3	A631 K632 L637 I638 I639	A631-N635 WeakPolarHBondContact O-CB 3.33Å; A631-N635 PolarHBondContact O-N 3.05Å; K632-N635 CarbonylContact O-C 3.58Å; K632-N635 PolarHBondContact O-N 2.8Å; K632-N635 VanDerWaalsContact O-N 3.13Å; N635-L637 VanDerWaalsContact C-N 3.33Å; N635-L637 PolarHBondContact O-N 3.02Å; N635-I638 CarbonylContact O-C 3.57Å; N635-I638 PolarHBondContact O-N 2.97Å; N635-I639 WeakPolarHBondContact O-CB 3.43Å; N635-I639 VanDerWaalsContact O-CG1 3.25Å; N635-I639 WeakPolarHBondContact O-CG1 3.36Å; N635-I639 PolarHBondContact O-N 3.43Å
636	D	77.1	Confident	72.3	Confident	92 Å²	92	100 Å²	100	49%	0.492	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-39.7	176.3	-70.1	-20.9	0	0	0	111.3	K632 Q633 I639 L640	K632-D636 PolarHBondContact O-N 3.43Å; Q633-D636 PolarHBondContact O-N 3Å; D636-I639 PolarHBondContact O-N 2.82Å; D636-L640 VanDerWaalsContact O-CB 3.31Å; D636-L640 WeakPolarHBondContact O-CB 3.31Å; D636-L640 WeakPolarHBondContact O-CG 3.26Å; D636-L640 PolarHBondContact O-N 3.44Å
637	L	75.2	Confident	70.5	Confident	112 Å²	112	101.2 Å²	101.2	59%	0.586	52%	0.519	S	S	*	.	H	α-helix	trans	-63.7	-40.8	172.3	-109.2	137.6	0	0	0	112	Q633 L634 N635 L640 A641	Q633-L637 WeakPolarHBondContact O-CB 3.37Å; Q633-L637 PolarHBondContact O-N 3.18Å; L634-L637 WeakPolarHBondContact O-CB 3.34Å; L634-L637 PolarHBondContact O-N 3.24Å; N635-L637 VanDerWaalsContact C-N 3.33Å; N635-L637 PolarHBondContact O-N 3.02Å; L637-L640 PolarHBondContact O-N 3.35Å; L637-A641 VanDerWaalsContact O-CB 3.23Å; L637-A641 WeakPolarHBondContact O-CB 3.38Å; L637-A641 PolarHBondContact O-N 2.93Å
638	I	79	Confident	68.5	Low	86 Å²	86	104 Å²	104	44%	0.441	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-42.5	175.4	-70.1	164.7	0	0	0	110.4	L634 N635 A641 K642	L634-I638 HydrophobicContact CG-CD1 4.01Å; L634-I638 WeakPolarHBondContact O-CB 3.37Å; L634-I638 WeakPolarHBondContact O-CG1 3.44Å; L634-I638 PolarHBondContact O-N 3.1Å; N635-I638 CarbonylContact O-C 3.57Å; N635-I638 PolarHBondContact O-N 2.97Å; I638-A641 PolarHBondContact O-N 3.33Å; I638-K642 WeakPolarHBondContact O-CB 3.27Å; I638-K642 PolarHBondContact O-N 3.38Å
639	I	77	Confident	66.6	Low	89 Å²	89	103.6 Å²	103.6	46%	0.456	54%	0.54	S	S	.	.	H	α-helix	trans	-64.3	-43.2	176	-68.5	164.8	0	0	0	110	N635 D636 K642 N643	N635-I639 WeakPolarHBondContact O-CB 3.43Å; N635-I639 VanDerWaalsContact O-CG1 3.25Å; N635-I639 WeakPolarHBondContact O-CG1 3.36Å; N635-I639 PolarHBondContact O-N 3.43Å; D636-I639 PolarHBondContact O-N 2.82Å; I639-K642 PolarHBondContact O-N 2.82Å; I639-N643 VanDerWaalsContact O-CB 3.28Å; I639-N643 WeakPolarHBondContact O-CB 3.41Å; I639-N643 PolarHBondContact O-N 3.41Å
640	L	71.8	Confident	64.3	Low	105 Å²	105	105.3 Å²	105.3	55%	0.55	55%	0.55	S	S	.	.	H	α-helix	trans	-63.2	-41.3	174.3	-82.2	165.6	0	0	0	112	D636 L637 K644	D636-L640 VanDerWaalsContact O-CB 3.31Å; D636-L640 WeakPolarHBondContact O-CB 3.31Å; D636-L640 WeakPolarHBondContact O-CG 3.26Å; D636-L640 PolarHBondContact O-N 3.44Å; L637-L640 PolarHBondContact O-N 3.35Å; L640-K644 WeakPolarHBondContact O-CB 3.16Å; L640-K644 WeakPolarHBondContact O-CG 3.48Å; L640-K644 PolarHBondContact O-N 2.86Å
641	A	62.9	Low	62.3	Low	54 Å²	54	107.6 Å²	107.6	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-66	-42.3	175.9	0	0	0	0	0	111.2	L637 I638 K644 Q645	L637-A641 VanDerWaalsContact O-CB 3.23Å; L637-A641 WeakPolarHBondContact O-CB 3.38Å; L637-A641 PolarHBondContact O-N 2.93Å; I638-A641 PolarHBondContact O-N 3.33Å; A641-K644 CarbonylContact O-C 3.51Å; A641-K644 PolarHBondContact O-N 3.47Å; A641-Q645 WeakPolarHBondContact O-CB 3.38Å; A641-Q645 PolarHBondContact O-N 2.84Å
642	K	66.4	Low	60.1	Low	137 Å²	137	111.4 Å²	111.4	60%	0.596	57%	0.573	S	S	*	*	H	α-helix	trans	-68.3	-39.9	177.9	-162.1	171.2	-174	177.2	0	111.7	I638 I639 Q645 N646	I638-K642 WeakPolarHBondContact O-CB 3.27Å; I638-K642 PolarHBondContact O-N 3.38Å; I639-K642 PolarHBondContact O-N 2.82Å; K642-Q645 PolarHBondContact O-N 2.78Å; K642-N646 WeakPolarHBondContact O-CB 3.32Å; K642-N646 VanDerWaalsContact O-CG 3.26Å; K642-N646 PolarHBondContact O-N 3.14Å; K642-N646 PolarHBondContact O-OD1 3.46Å
643	N	64.8	Low	57.6	Low	82 Å²	82	115.7 Å²	115.7	44%	0.439	59%	0.586	S	S	.	*	H	α-helix	trans	-65.5	-38.5	171.3	-78.4	-11.7	0	0	0	111.3	I639 N647	I639-N643 VanDerWaalsContact O-CB 3.28Å; I639-N643 WeakPolarHBondContact O-CB 3.41Å; I639-N643 PolarHBondContact O-N 3.41Å; N643-N647 WeakPolarHBondContact O-CB 3.42Å; N643-N647 PolarHBondContact O-N 2.89Å; N643-N647 PolarHBondContact O-ND2 2.83Å
644	K	56	Low	55.7	Low	151 Å²	151	118.5 Å²	118.5	66%	0.657	60%	0.604	S	S	*	*	H	α-helix	trans	-66.7	-37	172.6	-80.5	-178.4	178.8	179.5	0	112.5	L640 A641 L648	L640-K644 WeakPolarHBondContact O-CB 3.16Å; L640-K644 WeakPolarHBondContact O-CG 3.48Å; L640-K644 PolarHBondContact O-N 2.86Å; A641-K644 CarbonylContact O-C 3.51Å; A641-K644 PolarHBondContact O-N 3.47Å; K644-L648 WeakPolarHBondContact O-CB 3.45Å; K644-L648 PolarHBondContact O-N 3.24Å
645	Q	52.6	Low	53.8	Low	132 Å²	132	118.6 Å²	118.6	62%	0.617	61%	0.612	S	S	*	*	H	α-helix	trans	-67.2	-43.5	176.2	-155.5	83.7	15.6	0	0	110.9	A641 K642 L648 V649	A641-Q645 WeakPolarHBondContact O-CB 3.38Å; A641-Q645 PolarHBondContact O-N 2.84Å; K642-Q645 PolarHBondContact O-N 2.78Å; Q645-L648 PolarHBondContact O-N 3.44Å; Q645-V649 WeakPolarHBondContact O-CG2 3.42Å; Q645-V649 PolarHBondContact O-N 2.98Å
646	N	47.4	Very low	51.5	Low	94 Å²	94	122 Å²	122	50%	0.503	63%	0.629	S	S	.	*	H	α-helix	trans	-68.9	-39.6	176.2	-69	-3.9	0	0	0	111.5	K642 L648 V649 E650	K642-N646 WeakPolarHBondContact O-CB 3.32Å; K642-N646 VanDerWaalsContact O-CG 3.26Å; K642-N646 PolarHBondContact O-N 3.14Å; K642-N646 PolarHBondContact O-OD1 3.46Å; N646-L648 VanDerWaalsContact C-N 3.31Å; N646-L648 PolarHBondContact O-N 3.48Å; N646-V649 PolarHBondContact O-N 3Å; N646-E650 PolarHBondContact O-N 2.88Å; N646-E650 VanDerWaalsContact O-N 3.15Å
647	N	42.7	Very low	49.5	Very low	85 Å²	85	125.1 Å²	125.1	46%	0.455	64%	0.644	S	S	.	*	H	α-helix	trans	-67.1	-30	174.3	-77.6	-13	0	0	0	112.4	N643 V649 I651	N643-N647 WeakPolarHBondContact O-CB 3.42Å; N643-N647 PolarHBondContact O-N 2.89Å; N643-N647 PolarHBondContact O-ND2 2.83Å; N647-V649 VanDerWaalsContact C-N 3.28Å; N647-V649 PolarHBondContact O-N 2.72Å; N647-I651 HydrophobicContact CB-CD1 3.57Å; N647-I651 HydrophobicContact CB-CG1 4.33Å; N647-I651 VanDerWaalsContact O-CB 3.27Å; N647-I651 WeakPolarHBondContact O-CB 3.37Å; N647-I651 VanDerWaalsContact O-CD1 3.3Å; N647-I651 WeakPolarHBondContact O-CD1 3.35Å; N647-I651 WeakPolarHBondContact O-CG1 3.3Å; N647-I651 PolarHBondContact O-N 2.95Å; N647-I651 VanDerWaalsContact O-N 3.15Å
648	L	38.6	Very low	47.5	Very low	146 Å²	146	129.2 Å²	129.2	76%	0.764	66%	0.66	S	S	*	*	H	α-helix	trans	-70.7	-27.9	174.9	-154.2	92	0	0	0	111.7	K644 Q645 N646	K644-L648 WeakPolarHBondContact O-CB 3.45Å; K644-L648 PolarHBondContact O-N 3.24Å; Q645-L648 PolarHBondContact O-N 3.44Å; N646-L648 VanDerWaalsContact C-N 3.31Å; N646-L648 PolarHBondContact O-N 3.48Å
649	V	39	Very low	45.5	Very low	118 Å²	118	130 Å²	130	72%	0.715	67%	0.673	S	S	*	*	H	α-helix	trans	-85	-24.9	179.7	179.1	0	0	0	0	112.2	Q645 N646 N647	Q645-V649 WeakPolarHBondContact O-CG2 3.42Å; Q645-V649 PolarHBondContact O-N 2.98Å; N646-V649 PolarHBondContact O-N 3Å; N647-V649 VanDerWaalsContact C-N 3.28Å; N647-V649 PolarHBondContact O-N 2.72Å
650	E	36.8	Very low	43.8	Very low	161 Å²	161	134.9 Å²	134.9	75%	0.752	69%	0.691	S	S	*	*	H	α-helix	trans	-112.4	-8.1	-175.2	-123.2	175.7	-178.6	0	0	117.2	N646 T652	N646-E650 PolarHBondContact O-N 2.88Å; N646-E650 VanDerWaalsContact O-N 3.15Å; E650-T652 PolarHBondContact O-N 3.15Å
651	I	33.4	Very low	42.7	Very low	126 Å²	126	137 Å²	137	65%	0.646	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	18.1	-177.9	-65.7	172.7	0	0	0	114	N647 R653	N647-I651 HydrophobicContact CB-CD1 3.57Å; N647-I651 HydrophobicContact CB-CG1 4.33Å; N647-I651 VanDerWaalsContact O-CB 3.27Å; N647-I651 WeakPolarHBondContact O-CB 3.37Å; N647-I651 VanDerWaalsContact O-CD1 3.3Å; N647-I651 WeakPolarHBondContact O-CD1 3.35Å; N647-I651 WeakPolarHBondContact O-CG1 3.3Å; N647-I651 PolarHBondContact O-N 2.95Å; N647-I651 VanDerWaalsContact O-N 3.15Å; I651-R653 VanDerWaalsContact C-N 3.31Å
652	T	32.8	Very low	41.6	Very low	130 Å²	130	139.8 Å²	139.8	80%	0.798	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	13.7	166	-33.1	0	0	0	0	113.4	E650	E650-T652 PolarHBondContact O-N 3.15Å
653	R	29.3	Very low	41.4	Very low	226 Å²	226	137.7 Å²	137.7	85%	0.853	71%	0.711	S	S	*	*	S	Bend	trans	-139.3	103.8	167.4	-77.5	-168.3	174.1	102.1	-0.9	114.1	I651	I651-R653 VanDerWaalsContact C-N 3.31Å
654	N	30.3	Very low	41.6	Very low	161 Å²	161	137.1 Å²	137.1	86%	0.861	71%	0.714	S	S	*	*			trans	65.4	134.4	149.8	-83.2	-7.7	0	0	0	122.2
655	P	38.3	Very low	42.6	Very low	111 Å²	111	136.3 Å²	136.3	72%	0.721	72%	0.717	S	S	*	*			trans	-99.7	122.8	-179	36.9	-27.2	0	0	0	112.2
656	L	30.9	Very low	43.7	Very low	165 Å²	165	137.2 Å²	137.2	86%	0.864	72%	0.721	S	S	*	*			trans	-178.7	120.7	140.9	-129.9	94.6	0	0	0	107.5
657	I	34.6	Very low	45	Very low	157 Å²	157	136.9 Å²	136.9	81%	0.805	72%	0.719	S	S	*	*			trans	173	110.4	135.8	-82.2	149.5	0	0	0	106.6	S659	I657-S659 PolarHBondContact O-N 3.5Å
658	Q	33.1	Very low	47.1	Very low	198 Å²	198	137.7 Å²	137.7	93%	0.925	72%	0.719	S	S	*	*			trans	-66.4	113.4	165.5	-71.1	169.5	-20.6	0	0	108.6	K660	Q658-K660 PolarHBondContact O-N 3.15Å
659	S	37.9	Very low	49	Very low	102 Å²	102	132.5 Å²	132.5	71%	0.713	70%	0.698	S	S	*	*			trans	-94.6	91.4	166.3	50.6	0	0	0	0	109.6	I657 I661	I657-S659 PolarHBondContact O-N 3.5Å; S659-I661 PolarHBondContact O-N 3.49Å
660	K	40.3	Very low	51.2	Low	191 Å²	191	129 Å²	129	83%	0.83	68%	0.679	S	S	*	*			trans	-66.8	107.5	161	-158.9	178	-173.3	-176.2	0	106	Q658 C662	Q658-K660 PolarHBondContact O-N 3.15Å; K660-C662 PolarHBondContact O-N 3.46Å
661	I	47.9	Very low	53.4	Low	150 Å²	150	125.7 Å²	125.7	77%	0.769	67%	0.665	S	S	*	*			trans	-66.8	95	180	-59.5	168.5	0	0	0	107.3	S659	S659-I661 PolarHBondContact O-N 3.49Å
662	C	41.7	Very low	56.1	Low	113 Å²	113	125.9 Å²	125.9	76%	0.764	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-83.8	116.4	166.7	-80.8	0	0	0	0	108	K660	K660-C662 PolarHBondContact O-N 3.46Å
663	L	60.9	Low	58.6	Low	93 Å²	93	126.6 Å²	126.6	49%	0.487	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-66.5	147.5	162.8	-63.3	173.1	0	0	0	108.4	N665 L667	L663-N665 PolarHBondContact O-N 3.47Å; L663-L667 HydrophobicContact CD2-CD2 4.24Å
664	S	69.2	Low	61.3	Low	70 Å²	70	120 Å²	120	49%	0.49	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-60.6	133	170.5	160.1	0	0	0	0	109.3	E666 L667 E668	S664-E666 PolarHBondContact O-N 3.45Å; S664-E666 PolarHBondContact OG-N 3.17Å; S664-L667 WeakPolarHBondContact O-CB 3.3Å; S664-L667 PolarHBondContact O-N 3.02Å; S664-E668 PolarHBondContact O-N 2.76Å
665	N	76.7	Confident	64	Low	134 Å²	134	115.1 Å²	115.1	72%	0.717	62%	0.618	S	S	*	*	H	α-helix	trans	-52.6	-29.5	176.2	-65.6	-2.9	0	0	0	112.3	L663 A669	L663-N665 PolarHBondContact O-N 3.47Å; N665-A669 WeakPolarHBondContact O-CB 3.38Å; N665-A669 PolarHBondContact O-N 3.34Å
666	E	76.7	Confident	66.3	Low	150 Å²	150	113.5 Å²	113.5	70%	0.701	61%	0.607	S	S	*	*	H	α-helix	trans	-73.1	-37	177.7	-170.1	172.5	-164.3	0	0	112.3	S664 S670	S664-E666 PolarHBondContact O-N 3.45Å; S664-E666 PolarHBondContact OG-N 3.17Å; E666-S670 VanDerWaalsContact O-CB 3.29Å; E666-S670 WeakPolarHBondContact O-CB 3.43Å; E666-S670 PolarHBondContact O-N 2.98Å
667	L	74.7	Confident	68.9	Low	88 Å²	88	108.5 Å²	108.5	46%	0.461	59%	0.589	S	S	.	*	H	α-helix	trans	-72.1	-43.1	176.5	-176.6	67.1	0	0	0	110.9	L663 S664 S670 I671	L663-L667 HydrophobicContact CD2-CD2 4.24Å; S664-L667 WeakPolarHBondContact O-CB 3.3Å; S664-L667 PolarHBondContact O-N 3.02Å; L667-S670 WeakPolarHBondContact O-CB 3.43Å; L667-S670 PolarHBondContact O-N 3.33Å; L667-S670 VanDerWaalsContact O-N 3.14Å; L667-I671 HydrophobicContact CG-CD1 4.14Å; L667-I671 VanDerWaalsContact O-CG1 3.3Å; L667-I671 WeakPolarHBondContact O-CG1 3.43Å; L667-I671 PolarHBondContact O-N 2.97Å
668	E	85.9	Confident	71.4	Confident	101 Å²	101	107.5 Å²	107.5	47%	0.472	58%	0.579	S	S	.	*	H	α-helix	trans	-60.3	-47.9	174.7	-173.6	169.3	-161.9	0	0	110.9	S664 S670 I671 E672	S664-E668 PolarHBondContact O-N 2.76Å; E668-S670 VanDerWaalsContact C-N 3.26Å; E668-S670 PolarHBondContact O-N 3.47Å; E668-I671 PolarHBondContact O-N 2.86Å; E668-E672 PolarHBondContact O-N 3.22Å
669	A	79.1	Confident	74.2	Confident	38 Å²	38	104.3 Å²	104.3	31%	0.314	56%	0.562	S	S	.	*	H	α-helix	trans	-64.5	-28.7	174.3	0	0	0	0	0	113.1	N665 R673	N665-A669 WeakPolarHBondContact O-CB 3.38Å; N665-A669 PolarHBondContact O-N 3.34Å; A669-R673 WeakPolarHBondContact O-CB 3.22Å; A669-R673 VanDerWaalsContact O-CG 3.29Å; A669-R673 WeakPolarHBondContact O-CG 3.39Å; A669-R673 PolarHBondContact O-N 2.88Å; A669-R673 VanDerWaalsContact O-N 3.08Å; A669-R673 PolarHBondContact O-NE 3.39Å
670	S	84.7	Confident	76.6	Confident	45 Å²	45	104.5 Å²	104.5	32%	0.315	56%	0.555	S	S	.	*	H	α-helix	trans	-71.2	-40.3	174.1	-171.2	0	0	0	0	111.7	E666 L667 E668 R673 T674	E666-S670 VanDerWaalsContact O-CB 3.29Å; E666-S670 WeakPolarHBondContact O-CB 3.43Å; E666-S670 PolarHBondContact O-N 2.98Å; L667-S670 WeakPolarHBondContact O-CB 3.43Å; L667-S670 PolarHBondContact O-N 3.33Å; L667-S670 VanDerWaalsContact O-N 3.14Å; E668-S670 VanDerWaalsContact C-N 3.26Å; E668-S670 PolarHBondContact O-N 3.47Å; S670-R673 PolarHBondContact O-N 2.92Å; S670-T674 PolarHBondContact O-N 2.9Å; S670-T674 PolarHBondContact O-OG1 3.42Å; S670-T674 VanDerWaalsContact O-OG1 3.04Å
671	I	83.7	Confident	79	Confident	91 Å²	91	101.1 Å²	101.1	47%	0.467	54%	0.542	S	S	.	.	H	α-helix	trans	-65.8	-42.1	176.3	-67.7	164.4	0	0	0	110.2	L667 E668 T674 A675	L667-I671 HydrophobicContact CG-CD1 4.14Å; L667-I671 VanDerWaalsContact O-CG1 3.3Å; L667-I671 WeakPolarHBondContact O-CG1 3.43Å; L667-I671 PolarHBondContact O-N 2.97Å; E668-I671 PolarHBondContact O-N 2.86Å; I671-T674 PolarHBondContact O-N 3.24Å; I671-T674 PolarHBondContact O-OG1 3.38Å; I671-T674 VanDerWaalsContact O-OG1 3.06Å; I671-A675 VanDerWaalsContact O-CB 3.26Å; I671-A675 WeakPolarHBondContact O-CB 3.24Å; I671-A675 PolarHBondContact O-N 3.31Å
672	E	88.6	Confident	80.9	Confident	129 Å²	129	97.2 Å²	97.2	60%	0.603	52%	0.522	S	S	*	.	H	α-helix	trans	-64.1	-40.8	174.9	-77	-169.5	153.4	0	0	112.3	E668 A675 T676	E668-E672 PolarHBondContact O-N 3.22Å; E672-A675 PolarHBondContact O-N 3.46Å; E672-T676 WeakPolarHBondContact O-CB 3.42Å; E672-T676 WeakPolarHBondContact O-CG2 3.4Å; E672-T676 PolarHBondContact O-N 2.83Å; E672-T676 PolarHBondContact O-OG1 3.17Å
673	R	86.2	Confident	83.1	Confident	145 Å²	145	95.3 Å²	95.3	55%	0.547	50%	0.504	S	S	.	.	H	α-helix	trans	-64.2	-40.8	176	-81.2	-179.4	-75.9	133.2	-8.1	112.8	A669 S670 T676 A677	A669-R673 WeakPolarHBondContact O-CB 3.22Å; A669-R673 VanDerWaalsContact O-CG 3.29Å; A669-R673 WeakPolarHBondContact O-CG 3.39Å; A669-R673 PolarHBondContact O-N 2.88Å; A669-R673 VanDerWaalsContact O-N 3.08Å; A669-R673 PolarHBondContact O-NE 3.39Å; S670-R673 PolarHBondContact O-N 2.92Å; R673-T676 WeakPolarHBondContact CA-OG1 3.32Å; R673-T676 PolarHBondContact O-OG1 3.48Å; R673-A677 WeakPolarHBondContact O-CB 3.41Å; R673-A677 PolarHBondContact O-N 3.32Å
674	T	85.7	Confident	84.4	Confident	89 Å²	89	93.6 Å²	93.6	55%	0.546	50%	0.5	S	S	.	.	H	α-helix	trans	-73.1	-38.4	177.9	48.2	0	0	0	0	112	S670 I671 A677 F678	S670-T674 PolarHBondContact O-N 2.9Å; S670-T674 PolarHBondContact O-OG1 3.42Å; S670-T674 VanDerWaalsContact O-OG1 3.04Å; I671-T674 PolarHBondContact O-N 3.24Å; I671-T674 PolarHBondContact O-OG1 3.38Å; I671-T674 VanDerWaalsContact O-OG1 3.06Å; T674-A677 PolarHBondContact O-N 3.36Å; T674-F678 WeakPolarHBondContact O-CB 3.23Å; T674-F678 PolarHBondContact O-N 2.9Å
675	A	87.1	Confident	85.2	Confident	57 Å²	57	93.6 Å²	93.6	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-40.6	176.3	0	0	0	0	0	112.3	I671 E672 K679	I671-A675 VanDerWaalsContact O-CB 3.26Å; I671-A675 WeakPolarHBondContact O-CB 3.24Å; I671-A675 PolarHBondContact O-N 3.31Å; E672-A675 PolarHBondContact O-N 3.46Å; A675-K679 WeakPolarHBondContact O-CB 3.32Å; A675-K679 PolarHBondContact O-N 3.46Å
676	T	86.7	Confident	85.6	Confident	78 Å²	78	91.4 Å²	91.4	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-68.4	-44.8	175.7	46.2	0	0	0	0	112.1	E672 R673 F678 K679 D680	E672-T676 WeakPolarHBondContact O-CB 3.42Å; E672-T676 WeakPolarHBondContact O-CG2 3.4Å; E672-T676 PolarHBondContact O-N 2.83Å; E672-T676 PolarHBondContact O-OG1 3.17Å; R673-T676 WeakPolarHBondContact CA-OG1 3.32Å; R673-T676 PolarHBondContact O-OG1 3.48Å; T676-F678 VanDerWaalsContact C-N 3.31Å; T676-F678 PolarHBondContact O-N 3.19Å; T676-K679 PolarHBondContact O-N 2.87Å; T676-D680 PolarHBondContact O-N 3.02Å
677	A	85.5	Confident	85.9	Confident	60 Å²	60	88.5 Å²	88.5	50%	0.496	47%	0.474	S	S	.	.	H	α-helix	trans	-60.6	-38.9	175.4	0	0	0	0	0	112.9	R673 T674 H681	R673-A677 WeakPolarHBondContact O-CB 3.41Å; R673-A677 PolarHBondContact O-N 3.32Å; T674-A677 PolarHBondContact O-N 3.36Å; A677-H681 WeakPolarHBondContact O-CB 3.48Å; A677-H681 PolarHBondContact O-N 3.47Å
678	F	87.5	Confident	86.2	Confident	135 Å²	135	88.9 Å²	88.9	59%	0.592	48%	0.477	S	S	*	.	H	α-helix	trans	-66.6	-42.6	175.9	-176.9	-106.3	0	0	0	111.9	T674 T676 H681 I682	T674-F678 WeakPolarHBondContact O-CB 3.23Å; T674-F678 PolarHBondContact O-N 2.9Å; T676-F678 VanDerWaalsContact C-N 3.31Å; T676-F678 PolarHBondContact O-N 3.19Å; F678-H681 PolarHBondContact O-N 2.84Å; F678-I682 HydrophobicContact CD1-CD1 3.85Å; F678-I682 HydrophobicContact CE1-CD1 3.25Å; F678-I682 HydrophobicContact CE1-CG1 4.26Å; F678-I682 HydrophobicContact CE2-CD1 4.29Å; F678-I682 HydrophobicContact CZ-CD1 3.52Å; F678-I682 HydrophobicContact CZ-CG1 4.28Å; F678-I682 WeakPolarHBondContact O-CG1 3.21Å; F678-I682 PolarHBondContact O-N 3.01Å
679	K	91.5	Very high	85.8	Confident	131 Å²	131	89.5 Å²	89.5	57%	0.57	48%	0.482	S	S	*	.	H	α-helix	trans	-61.8	-47.5	175.9	-173.2	-177.1	175	-169.4	0	111.6	A675 T676 H681 I682 D683	A675-K679 WeakPolarHBondContact O-CB 3.32Å; A675-K679 PolarHBondContact O-N 3.46Å; T676-K679 PolarHBondContact O-N 2.87Å; K679-H681 VanDerWaalsContact C-N 3.26Å; K679-H681 PolarHBondContact O-N 2.76Å; K679-I682 PolarHBondContact O-N 2.61Å; K679-D683 PolarHBondContact O-N 2.63Å
680	D	88.8	Confident	85.6	Confident	107 Å²	107	93.1 Å²	93.1	57%	0.572	50%	0.496	S	S	*	.	H	α-helix	trans	-62	-35.6	177.6	-69.7	-10.3	0	0	0	111.8	T676 S684	T676-D680 PolarHBondContact O-N 3.02Å; D680-S684 VanDerWaalsContact O-CB 3.25Å; D680-S684 WeakPolarHBondContact O-CB 3.49Å; D680-S684 PolarHBondContact O-N 3Å
681	H	90.1	Very high	84.9	Confident	120 Å²	120	97 Å²	97	56%	0.556	51%	0.509	S	S	*	.	H	α-helix	trans	-65	-46.9	174.1	-177.9	64.3	0	0	0	112	A677 F678 K679 S684 V685	A677-H681 WeakPolarHBondContact O-CB 3.48Å; A677-H681 PolarHBondContact O-N 3.47Å; F678-H681 PolarHBondContact O-N 2.84Å; K679-H681 VanDerWaalsContact C-N 3.26Å; K679-H681 PolarHBondContact O-N 2.76Å; H681-S684 PolarHBondContact O-N 3.19Å; H681-V685 VanDerWaalsContact O-CG2 3.3Å; H681-V685 WeakPolarHBondContact O-CG2 3.42Å; H681-V685 PolarHBondContact O-N 2.76Å
682	I	87.9	Confident	84	Confident	68 Å²	68	96.8 Å²	96.8	35%	0.349	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-46.6	176.8	-71.7	179.8	0	0	0	110.7	F678 K679 S684 V685 L686	F678-I682 HydrophobicContact CD1-CD1 3.85Å; F678-I682 HydrophobicContact CE1-CD1 3.25Å; F678-I682 HydrophobicContact CE1-CG1 4.26Å; F678-I682 HydrophobicContact CE2-CD1 4.29Å; F678-I682 HydrophobicContact CZ-CD1 3.52Å; F678-I682 HydrophobicContact CZ-CG1 4.28Å; F678-I682 WeakPolarHBondContact O-CG1 3.21Å; F678-I682 PolarHBondContact O-N 3.01Å; K679-I682 PolarHBondContact O-N 2.61Å; I682-S684 VanDerWaalsContact C-N 3.29Å; I682-S684 PolarHBondContact O-N 3.43Å; I682-V685 PolarHBondContact O-N 3.15Å; I682-L686 HydrophobicContact CG2-CD1 3.73Å; I682-L686 HydrophobicContact CG2-CG 4.24Å; I682-L686 WeakPolarHBondContact O-CB 3.3Å; I682-L686 VanDerWaalsContact O-CG 3.3Å; I682-L686 WeakPolarHBondContact O-CG 3.29Å; I682-L686 PolarHBondContact O-N 3.27Å
683	D	87.8	Confident	82.2	Confident	72 Å²	72	94.1 Å²	94.1	39%	0.385	52%	0.516	S	S	.	.	H	α-helix	trans	-63.5	-36.6	-179.8	-71.8	-18.4	0	0	0	111.2	K679 N687	K679-D683 PolarHBondContact O-N 2.63Å; D683-N687 WeakPolarHBondContact O-CB 3.47Å; D683-N687 PolarHBondContact O-N 3.38Å
684	S	87.8	Confident	80.5	Confident	58 Å²	58	91.1 Å²	91.1	41%	0.406	52%	0.517	S	S	.	.	H	α-helix	trans	-66.4	-44.9	173	-178.6	0	0	0	0	112.8	D680 H681 I682 N687 N688	D680-S684 VanDerWaalsContact O-CB 3.25Å; D680-S684 WeakPolarHBondContact O-CB 3.49Å; D680-S684 PolarHBondContact O-N 3Å; H681-S684 PolarHBondContact O-N 3.19Å; I682-S684 VanDerWaalsContact C-N 3.29Å; I682-S684 PolarHBondContact O-N 3.43Å; S684-N687 PolarHBondContact O-N 3.42Å; S684-N688 WeakPolarHBondContact O-CB 3.33Å; S684-N688 VanDerWaalsContact O-CG 3.27Å; S684-N688 PolarHBondContact O-N 2.93Å; S684-N688 PolarHBondContact O-ND2 2.84Å; S684-N688 VanDerWaalsContact O-ND2 3.11Å
685	V	85.9	Confident	78.5	Confident	70 Å²	70	92.8 Å²	92.8	42%	0.424	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-43.8	176.7	170.8	0	0	0	0	110.7	H681 I682 N688 L689	H681-V685 VanDerWaalsContact O-CG2 3.3Å; H681-V685 WeakPolarHBondContact O-CG2 3.42Å; H681-V685 PolarHBondContact O-N 2.76Å; I682-V685 PolarHBondContact O-N 3.15Å; V685-N688 PolarHBondContact O-N 2.98Å; V685-L689 WeakPolarHBondContact O-CB 3.38Å; V685-L689 PolarHBondContact O-N 2.9Å
686	L	85.3	Confident	76.1	Confident	88 Å²	88	95.1 Å²	95.1	46%	0.461	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-42.6	177.7	-70.9	174	0	0	0	111.9	I682 L689 L690	I682-L686 HydrophobicContact CG2-CD1 3.73Å; I682-L686 HydrophobicContact CG2-CG 4.24Å; I682-L686 WeakPolarHBondContact O-CB 3.3Å; I682-L686 VanDerWaalsContact O-CG 3.3Å; I682-L686 WeakPolarHBondContact O-CG 3.29Å; I682-L686 PolarHBondContact O-N 3.27Å; L686-L689 PolarHBondContact O-N 3.32Å; L686-L690 WeakPolarHBondContact O-CB 3.45Å; L686-L690 VanDerWaalsContact O-CG 3.31Å; L686-L690 WeakPolarHBondContact O-CG 3.5Å; L686-L690 PolarHBondContact O-N 3.4Å
687	N	84.3	Confident	73.5	Confident	88 Å²	88	100.9 Å²	100.9	47%	0.471	56%	0.558	S	S	.	*	H	α-helix	trans	-64.6	-43.1	175.5	-82.4	-18.7	0	0	0	112.1	D683 S684 L689 L690 H691	D683-N687 WeakPolarHBondContact O-CB 3.47Å; D683-N687 PolarHBondContact O-N 3.38Å; S684-N687 PolarHBondContact O-N 3.42Å; N687-L689 VanDerWaalsContact C-N 3.29Å; N687-L689 PolarHBondContact O-N 3.01Å; N687-L690 PolarHBondContact O-N 2.74Å; N687-H691 WeakPolarHBondContact O-CB 3.42Å; N687-H691 PolarHBondContact O-CD2 2.83Å; N687-H691 PolarHBondContact O-N 2.95Å
688	N	79.2	Confident	70.8	Confident	97 Å²	97	103.7 Å²	103.7	52%	0.519	57%	0.574	S	S	.	*	H	α-helix	trans	-62	-38.7	175.1	-74.2	-34.4	0	0	0	111.6	S684 V685 S692	S684-N688 WeakPolarHBondContact O-CB 3.33Å; S684-N688 VanDerWaalsContact O-CG 3.27Å; S684-N688 PolarHBondContact O-N 2.93Å; S684-N688 PolarHBondContact O-ND2 2.84Å; S684-N688 VanDerWaalsContact O-ND2 3.11Å; V685-N688 PolarHBondContact O-N 2.98Å; N688-S692 VanDerWaalsContact O-CB 3.25Å; N688-S692 WeakPolarHBondContact O-CB 3.41Å; N688-S692 PolarHBondContact O-N 3.49Å; N688-S692 PolarHBondContact O-OG 3.41Å
689	L	77.6	Confident	68.3	Low	113 Å²	113	103 Å²	103	59%	0.592	59%	0.586	S	S	*	*	H	α-helix	trans	-67.9	-41.4	176.6	-166.7	68.7	0	0	0	111.8	V685 L686 N687 S692 A693	V685-L689 WeakPolarHBondContact O-CB 3.38Å; V685-L689 PolarHBondContact O-N 2.9Å; L686-L689 PolarHBondContact O-N 3.32Å; N687-L689 VanDerWaalsContact C-N 3.29Å; N687-L689 PolarHBondContact O-N 3.01Å; L689-S692 PolarHBondContact O-N 3.25Å; L689-A693 WeakPolarHBondContact O-CB 3.3Å; L689-A693 PolarHBondContact O-N 3.28Å
690	L	76.4	Confident	65.3	Low	114 Å²	114	103.7 Å²	103.7	60%	0.597	60%	0.596	S	S	*	*	H	α-helix	trans	-67.5	-39.7	176.5	-75.3	167.2	0	0	0	112.4	L686 N687 S694	L686-L690 WeakPolarHBondContact O-CB 3.45Å; L686-L690 VanDerWaalsContact O-CG 3.31Å; L686-L690 WeakPolarHBondContact O-CG 3.5Å; L686-L690 PolarHBondContact O-N 3.4Å; N687-L690 PolarHBondContact O-N 2.74Å; L690-S694 WeakPolarHBondContact O-CB 3.47Å; L690-S694 PolarHBondContact O-N 2.82Å; L690-S694 VanDerWaalsContact O-N 3.12Å; L690-S694 PolarHBondContact O-OG 2.81Å
691	H	69	Low	62.4	Low	127 Å²	127	105 Å²	105	59%	0.588	60%	0.603	S	S	*	*	H	α-helix	trans	-69.8	-35.8	174.1	-72.7	-53.8	0	0	0	112.2	N687 S694	N687-H691 WeakPolarHBondContact O-CB 3.42Å; N687-H691 PolarHBondContact O-CD2 2.83Å; N687-H691 PolarHBondContact O-N 2.95Å; H691-S694 PolarHBondContact O-OG 3.49Å
692	S	65.9	Low	59.4	Low	86 Å²	86	106.3 Å²	106.3	60%	0.601	61%	0.614	S	S	*	*	H	α-helix	trans	-70.3	-36.6	174.8	-57.4	0	0	0	0	112.3	N688 L689	N688-S692 VanDerWaalsContact O-CB 3.25Å; N688-S692 WeakPolarHBondContact O-CB 3.41Å; N688-S692 PolarHBondContact O-N 3.49Å; N688-S692 PolarHBondContact O-OG 3.41Å; L689-S692 PolarHBondContact O-N 3.25Å
693	A	50.5	Low	56.7	Low	74 Å²	74	108.9 Å²	108.9	61%	0.612	64%	0.638	S	S	*	*	H	α-helix	trans	-74.3	-25.5	179.6	0	0	0	0	0	113.4	L689	L689-A693 WeakPolarHBondContact O-CB 3.3Å; L689-A693 PolarHBondContact O-N 3.28Å
694	S	49.1	Very low	53.7	Low	82 Å²	82	115 Å²	115	57%	0.573	66%	0.661	S	S	*	*	H	α-helix	trans	-86	-8	-176.1	48.5	0	0	0	0	115.2	L690 H691	L690-S694 WeakPolarHBondContact O-CB 3.47Å; L690-S694 PolarHBondContact O-N 2.82Å; L690-S694 VanDerWaalsContact O-N 3.12Å; L690-S694 PolarHBondContact O-OG 2.81Å; H691-S694 PolarHBondContact O-OG 3.49Å
695	V	44.7	Very low	50.9	Low	124 Å²	124	117.7 Å²	117.7	75%	0.752	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-4.9	179.3	179.3	0	0	0	0	113.4
696	S	36.2	Very low	48.1	Very low	106 Å²	106	123 Å²	123	74%	0.741	70%	0.699	S	S	*	*	S	Bend	trans	-106.1	45.6	-179.5	-57.2	0	0	0	0	113.6
697	K	32.2	Very low	45.4	Very low	199 Å²	199	122.8 Å²	122.8	87%	0.865	71%	0.705	S	S	*	*	S	Bend	trans	-161.7	58.1	167.6	-145	167.5	-175.9	173.1	0	115.5
698	S	29.7	Very low	42.8	Very low	118 Å²	118	126.8 Å²	126.8	83%	0.825	72%	0.721	S	S	*	*			trans	-165.1	102.6	152.4	64.8	0	0	0	0	112.8
699	S	34	Very low	40.5	Very low	121 Å²	121	129.5 Å²	129.5	85%	0.846	73%	0.731	S	S	*	*			trans	-167.2	128.5	135.7	58.3	0	0	0	0	109.1
700	N	28.4	Very low	38.2	Very low	146 Å²	146	130.9 Å²	130.9	78%	0.781	74%	0.738	S	S	*	*			trans	-67	175.9	-175.6	-68.7	-30.2	0	0	0	114.7
701	D	28.6	Very low	36.3	Very low	134 Å²	134	131.2 Å²	131.2	72%	0.717	75%	0.75	S	S	*	*			trans	95.9	108.8	142.8	-65.3	-25.8	0	0	0	119
702	D	27.2	Very low	34.8	Very low	148 Å²	148	130.2 Å²	130.2	79%	0.791	76%	0.763	S	S	*	*				58.7	138.1	127	-76.9	-23.3	0	0	0	122
703	S	30.1	Very low	33.1	Very low	121 Å²	121	137.9 Å²	137.9	85%	0.846	78%	0.779	S	S	*	*			trans	102	122.3	148.6	74.2	0	0	0	0	119.2
704	K	25.1	Very low	32.2	Very low	202 Å²	202	146.3 Å²	146.3	88%	0.878	80%	0.795	S	S	*	*			trans	-44.8	139.4	166.8	-65.8	158.3	173.1	169	0	112.7
705	S	28.8	Very low	31.8	Very low	114 Å²	114	151.5 Å²	151.5	80%	0.797	81%	0.81	S	S	*	*				159.6	132.3	110.5	56.2	0	0	0	0	114
706	H	27.7	Very low	31.5	Very low	180 Å²	180	154.5 Å²	154.5	83%	0.833	82%	0.816	S	S	*	*			trans	51.3	116.5	138.9	-106.6	43.7	0	0	0	124
707	S	28	Very low	31.8	Very low	84 Å²	84	155.8 Å²	155.8	59%	0.587	82%	0.819	S	S	*	*				84.3	120.6	118.4	78.8	0	0	0	0	122.4
708	Q	31.3	Very low	32.3	Very low	173 Å²	173	151.9 Å²	151.9	81%	0.808	81%	0.814	S	S	*	*				90.4	108.1	120.4	-80.2	-172.3	-4.4	0	0	122.5
709	H	29	Very low	33	Very low	154 Å²	154	151 Å²	151	71%	0.713	81%	0.808	S	S	*	*				84.2	133.2	110.7	-114	-65.8	0	0	0	123.1
710	L	30.7	Very low	33.8	Very low	141 Å²	141	156.2 Å²	156.2	74%	0.738	81%	0.809	S	S	*	*			trans	94.8	118.7	144	-60.1	166.9	0	0	0	121.6
711	S	36.5	Very low	35	Very low	121 Å²	121	160.1 Å²	160.1	85%	0.846	81%	0.812	S	S	*	*				-177.7	119.6	103.7	-84	0	0	0	0	117.2
712	A	36.5	Very low	36.8	Very low	106 Å²	106	155.8 Å²	155.8	88%	0.876	80%	0.8	S	S	*	*			trans	56	109.2	136.3	0	0	0	0	0	124.4
713	R	30.5	Very low	39.1	Very low	247 Å²	247	152.4 Å²	152.4	93%	0.932	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-90.7	129.6	170.5	179.3	179.1	-178.7	-177.1	1.9	111.7
714	R	32.7	Very low	41.2	Very low	252 Å²	252	156.3 Å²	156.3	95%	0.951	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71.2	137.4	-178.6	-74.8	-178.2	179	-166.6	-0.1	113.5
715	Q	39.5	Very low	43.6	Very low	191 Å²	191	152.1 Å²	152.1	89%	0.893	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-92.2	140.8	178.7	-69.4	-178	-26.4	0	0	112.4
716	H	39	Very low	46	Very low	187 Å²	187	155.7 Å²	155.7	87%	0.866	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-91.6	123.2	179.4	-140.1	-82.4	0	0	0	110	P718	H716-P718 WeakPolarHBondContact O-CD 3.34Å
717	V	41.3	Very low	48.7	Very low	133 Å²	133	148.9 Å²	148.9	81%	0.806	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-85.6	118.1	179.8	178.7	0	0	0	0	109.7
718	P	44.5	Very low	51.4	Low	116 Å²	116	150.9 Å²	150.9	75%	0.753	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-81.3	139.6	-177.9	29	-30.7	0	0	0	113.1	H716	H716-P718 WeakPolarHBondContact O-CD 3.34Å
719	S	44.3	Very low	53.8	Low	100 Å²	100	148 Å²	148	70%	0.699	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-56.6	144.3	-174.7	-176.4	0	0	0	0	115.3	R721 G722	S719-R721 PolarHBondContact O-N 2.88Å; S719-G722 PolarHBondContact O-N 2.78Å
720	R	51.1	Low	56.4	Low	230 Å²	230	145 Å²	145	87%	0.868	73%	0.725	S	S	*	*	H	α-helix	trans	-51.4	-21	-173.8	-85.7	-178.4	168.6	-159	-1.3	116.3	S723	R720-S723 PolarHBondContact O-OG 3.15Å
721	R	53.2	Low	58.8	Low	228 Å²	228	140.9 Å²	140.9	86%	0.86	71%	0.711	S	S	*	*	H	α-helix	trans	-74.2	-32.7	178	-121.7	179.7	-173.9	-171.6	2.2	112.2	S719	S719-R721 PolarHBondContact O-N 2.88Å
722	G	66	Low	61	Low	44 Å²	44	143.6 Å²	143.6	45%	0.454	70%	0.704	S	S	.	*	H	α-helix	trans	-74.4	-27	179.3	0	0	0	0	0	113.6	S719 R724 L725 R726	S719-G722 PolarHBondContact O-N 2.78Å; G722-R724 PolarHBondContact O-N 2.67Å; G722-L725 PolarHBondContact O-N 2.97Å; G722-R726 VanDerWaalsContact O-CB 3.26Å; G722-R726 WeakPolarHBondContact O-CB 3.43Å; G722-R726 PolarHBondContact O-N 3.49Å
723	S	74.9	Confident	63.1	Low	76 Å²	76	144.4 Å²	144.4	53%	0.531	69%	0.69	S	S	.	*	H	α-helix	trans	-68.2	-33	-179.8	61.5	0	0	0	0	112.9	R720 G727	R720-S723 PolarHBondContact O-OG 3.15Å; S723-G727 PolarHBondContact O-N 2.98Å
724	R	74.4	Confident	65.5	Low	203 Å²	203	139.2 Å²	139.2	77%	0.766	68%	0.676	S	S	*	*	H	α-helix	trans	-70.5	-43	177.6	-169.1	170.3	167.9	150.3	-5.5	111.8	G722 G727 M728	G722-R724 PolarHBondContact O-N 2.67Å; R724-G727 PolarHBondContact O-N 3.31Å; R724-M728 WeakPolarHBondContact O-CG 3.45Å; R724-M728 PolarHBondContact O-N 3.21Å
725	L	76.7	Confident	67.5	Low	115 Å²	115	131.1 Å²	131.1	60%	0.602	65%	0.652	S	S	*	*	H	α-helix	trans	-65.6	-42.2	175.3	-121.9	148.9	0	0	0	111.4	G722 M728 L729	G722-L725 PolarHBondContact O-N 2.97Å; L725-M728 PolarHBondContact O-N 2.87Å; L725-L729 HydrophobicContact CD2-CD1 4.44Å; L725-L729 WeakPolarHBondContact O-CB 3.46Å; L725-L729 PolarHBondContact O-N 3.25Å
726	R	77.9	Confident	69	Low	188 Å²	188	123.7 Å²	123.7	71%	0.709	62%	0.623	S	S	*	*	H	α-helix	trans	-66.3	-38.1	174.7	-152.7	174.7	-164.7	-129.6	3.6	111.9	G722 L729 L730	G722-R726 VanDerWaalsContact O-CB 3.26Å; G722-R726 WeakPolarHBondContact O-CB 3.43Å; G722-R726 PolarHBondContact O-N 3.49Å; R726-L729 PolarHBondContact O-N 3.16Å; R726-L730 WeakPolarHBondContact O-CB 3.37Å; R726-L730 VanDerWaalsContact O-CG 3.28Å; R726-L730 WeakPolarHBondContact O-CG 3.49Å; R726-L730 PolarHBondContact O-N 3.09Å
727	G	84.8	Confident	70.7	Confident	37 Å²	37	118.3 Å²	118.3	38%	0.381	60%	0.603	S	S	.	*	H	α-helix	trans	-63.1	-41.4	172.7	0	0	0	0	0	112.6	S723 R724 A731	S723-G727 PolarHBondContact O-N 2.98Å; R724-G727 PolarHBondContact O-N 3.31Å; G727-A731 WeakPolarHBondContact O-CB 3.32Å; G727-A731 PolarHBondContact O-N 3.14Å
728	M	84.4	Confident	72	Confident	127 Å²	127	119.2 Å²	119.2	63%	0.626	60%	0.596	S	S	*	*	H	α-helix	trans	-65	-43.7	173.7	-75.4	175.3	55.4	0	0	112.3	R724 L725 A731 Y732	R724-M728 WeakPolarHBondContact O-CG 3.45Å; R724-M728 PolarHBondContact O-N 3.21Å; L725-M728 PolarHBondContact O-N 2.87Å; M728-A731 PolarHBondContact O-N 2.98Å; M728-Y732 WeakPolarHBondContact O-CB 3.25Å; M728-Y732 PolarHBondContact O-N 3Å
729	L	82	Confident	73.1	Confident	111 Å²	111	120.2 Å²	120.2	58%	0.581	59%	0.589	S	S	*	*	H	α-helix	trans	-62	-43.8	176.1	-104.9	147.2	0	0	0	112	L725 R726 Y732 Q733	L725-L729 HydrophobicContact CD2-CD1 4.44Å; L725-L729 WeakPolarHBondContact O-CB 3.46Å; L725-L729 PolarHBondContact O-N 3.25Å; R726-L729 PolarHBondContact O-N 3.16Å; L729-Y732 PolarHBondContact O-N 3.42Å; L729-Q733 WeakPolarHBondContact O-CB 3.37Å; L729-Q733 PolarHBondContact O-N 3.45Å
730	L	83.8	Confident	73.9	Confident	91 Å²	91	123.6 Å²	123.6	48%	0.476	59%	0.586	S	S	.	*	H	α-helix	trans	-66.1	-39	175.9	-73.2	171.6	0	0	0	111.9	R726 Q733 Q734	R726-L730 WeakPolarHBondContact O-CB 3.37Å; R726-L730 VanDerWaalsContact O-CG 3.28Å; R726-L730 WeakPolarHBondContact O-CG 3.49Å; R726-L730 PolarHBondContact O-N 3.09Å; L730-Q733 PolarHBondContact O-N 3.43Å; L730-Q734 WeakPolarHBondContact O-CG 3.16Å; L730-Q734 PolarHBondContact O-N 3.21Å
731	A	81.1	Confident	74.4	Confident	55 Å²	55	117.9 Å²	117.9	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-63.7	-42.7	174.5	0	0	0	0	0	111.6	G727 M728 Q734 D735	G727-A731 WeakPolarHBondContact O-CB 3.32Å; G727-A731 PolarHBondContact O-N 3.14Å; M728-A731 PolarHBondContact O-N 2.98Å; A731-Q734 PolarHBondContact O-N 3.03Å; A731-D735 WeakPolarHBondContact O-CB 3.16Å; A731-D735 PolarHBondContact O-N 2.92Å
732	Y	83	Confident	74.7	Confident	179 Å²	179	111.2 Å²	111.2	70%	0.702	56%	0.561	S	S	*	*	H	α-helix	trans	-63.9	-40.9	175.7	-169.9	-97.4	0	0	0	111.9	M728 L729 D735 A736	M728-Y732 WeakPolarHBondContact O-CB 3.25Å; M728-Y732 PolarHBondContact O-N 3Å; L729-Y732 PolarHBondContact O-N 3.42Å; Y732-D735 PolarHBondContact O-N 3.05Å; Y732-A736 WeakPolarHBondContact O-CB 3.38Å; Y732-A736 PolarHBondContact O-N 3.29Å
733	Q	80.8	Confident	74.2	Confident	123 Å²	123	112.3 Å²	112.3	58%	0.575	56%	0.561	S	S	*	*	H	α-helix	trans	-64.5	-41.1	176.3	-169.1	176.6	-8.7	0	0	111.7	L729 L730 A736 V737	L729-Q733 WeakPolarHBondContact O-CB 3.37Å; L729-Q733 PolarHBondContact O-N 3.45Å; L730-Q733 PolarHBondContact O-N 3.43Å; Q733-A736 PolarHBondContact O-N 2.99Å; Q733-V737 VanDerWaalsContact O-CG2 3.27Å; Q733-V737 WeakPolarHBondContact O-CG2 3.34Å; Q733-V737 PolarHBondContact O-N 3.37Å
734	Q	79.3	Confident	73.1	Confident	138 Å²	138	113.9 Å²	113.9	65%	0.645	56%	0.564	S	S	*	*	H	α-helix	trans	-66.3	-39.4	174.9	-73.9	-178.7	0.7	0	0	112.4	L730 A731 V737 K738	L730-Q734 WeakPolarHBondContact O-CG 3.16Å; L730-Q734 PolarHBondContact O-N 3.21Å; A731-Q734 PolarHBondContact O-N 3.03Å; Q734-V737 PolarHBondContact O-N 3.25Å; Q734-K738 WeakPolarHBondContact O-CB 3.3Å; Q734-K738 PolarHBondContact O-N 3.29Å
735	D	76	Confident	71.6	Confident	82 Å²	82	111.2 Å²	111.2	44%	0.439	57%	0.565	S	S	.	*	H	α-helix	trans	-68.8	-38.4	177.6	-155.7	49.1	0	0	0	111.4	A731 Y732 K738 K739	A731-D735 WeakPolarHBondContact O-CB 3.16Å; A731-D735 PolarHBondContact O-N 2.92Å; Y732-D735 PolarHBondContact O-N 3.05Å; D735-K738 PolarHBondContact O-N 3.49Å; D735-K739 WeakPolarHBondContact O-CB 3.4Å; D735-K739 WeakPolarHBondContact O-CG 3.49Å; D735-K739 PolarHBondContact O-N 2.74Å; D735-K739 IonicContact OD2-NZ 3.89Å
736	A	70.8	Confident	69.8	Low	35 Å²	35	110.3 Å²	110.3	29%	0.289	57%	0.568	S	S	.	*	H	α-helix	trans	-63.8	-40.4	172.9	0	0	0	0	0	112.4	Y732 Q733 R740	Y732-A736 WeakPolarHBondContact O-CB 3.38Å; Y732-A736 PolarHBondContact O-N 3.29Å; Q733-A736 PolarHBondContact O-N 2.99Å; A736-R740 WeakPolarHBondContact O-CG 3.34Å; A736-R740 PolarHBondContact O-N 3.29Å
737	V	74.2	Confident	67.9	Low	74 Å²	74	111.8 Å²	111.8	45%	0.448	59%	0.59	S	S	.	*	H	α-helix	trans	-68.8	-42.1	175.1	172	0	0	0	0	111	Q733 Q734 R740 L741	Q733-V737 VanDerWaalsContact O-CG2 3.27Å; Q733-V737 WeakPolarHBondContact O-CG2 3.34Å; Q733-V737 PolarHBondContact O-N 3.37Å; Q734-V737 PolarHBondContact O-N 3.25Å; V737-R740 PolarHBondContact O-N 3.19Å; V737-L741 HydrophobicContact CG1-CD1 3.86Å; V737-L741 HydrophobicContact CG1-CG 4.46Å; V737-L741 WeakPolarHBondContact O-CG 3.24Å; V737-L741 PolarHBondContact O-N 3.07Å
738	K	69.6	Low	67	Low	151 Å²	151	115.6 Å²	115.6	66%	0.657	60%	0.601	S	S	*	*	H	α-helix	trans	-62.7	-41.3	174.9	-93.6	-175.8	174.6	-179.4	0	112.7	Q734 D735 R740 L741 S742	Q734-K738 WeakPolarHBondContact O-CB 3.3Å; Q734-K738 PolarHBondContact O-N 3.29Å; D735-K738 PolarHBondContact O-N 3.49Å; K738-R740 VanDerWaalsContact C-N 3.3Å; K738-R740 PolarHBondContact O-N 3Å; K738-L741 PolarHBondContact O-N 3.12Å; K738-S742 PolarHBondContact O-N 3.31Å
739	K	67.9	Low	66.1	Low	137 Å²	137	114.9 Å²	114.9	60%	0.596	60%	0.599	S	S	*	*	H	α-helix	trans	-62.1	-37.5	175.3	-77.1	179.9	-177.4	175.6	0	112.1	D735 S743	D735-K739 WeakPolarHBondContact O-CB 3.4Å; D735-K739 WeakPolarHBondContact O-CG 3.49Å; D735-K739 PolarHBondContact O-N 2.74Å; D735-K739 IonicContact OD2-NZ 3.89Å; K739-S743 WeakPolarHBondContact O-CB 3.44Å; K739-S743 PolarHBondContact O-N 3.22Å; K739-S743 PolarHBondContact O-OG 3.35Å
740	R	59.8	Low	65.2	Low	171 Å²	171	115.2 Å²	115.2	65%	0.645	60%	0.6	S	S	*	*	H	α-helix	trans	-70.6	-34.4	174.2	-71.1	-179.4	-169.6	-178.8	3.4	113.3	A736 V737 K738 S743 N744	A736-R740 WeakPolarHBondContact O-CG 3.34Å; A736-R740 PolarHBondContact O-N 3.29Å; V737-R740 PolarHBondContact O-N 3.19Å; K738-R740 VanDerWaalsContact C-N 3.3Å; K738-R740 PolarHBondContact O-N 3Å; R740-S743 WeakPolarHBondContact CA-OG 3.25Å; R740-S743 PolarHBondContact O-OG 3.41Å; R740-N744 WeakPolarHBondContact O-CB 3.06Å; R740-N744 PolarHBondContact O-N 3.41Å; R740-N744 PolarHBondContact O-OD1 3.42Å
741	L	62.5	Low	64.2	Low	110 Å²	110	116.6 Å²	116.6	58%	0.576	61%	0.608	S	S	*	*	H	α-helix	trans	-76.2	-35	176.5	-71.3	167.2	0	0	0	112	V737 K738 N744	V737-L741 HydrophobicContact CG1-CD1 3.86Å; V737-L741 HydrophobicContact CG1-CG 4.46Å; V737-L741 WeakPolarHBondContact O-CG 3.24Å; V737-L741 PolarHBondContact O-N 3.07Å; K738-L741 PolarHBondContact O-N 3.12Å; L741-N744 PolarHBondContact O-N 3.06Å
742	S	58.8	Low	63.1	Low	89 Å²	89	120.4 Å²	120.4	62%	0.622	62%	0.617	S	S	*	*	H	α-helix	trans	-75.3	-26.1	175	103.1	0	0	0	0	112.6	K738	K738-S742 PolarHBondContact O-N 3.31Å
743	S	56.1	Low	61.8	Low	67 Å²	67	116.5 Å²	116.5	47%	0.469	61%	0.612	S	S	.	*	H	α-helix	trans	-73	-19	170.7	65.1	0	0	0	0	112.9	K739 R740 S746	K739-S743 WeakPolarHBondContact O-CB 3.44Å; K739-S743 PolarHBondContact O-N 3.22Å; K739-S743 PolarHBondContact O-OG 3.35Å; R740-S743 WeakPolarHBondContact CA-OG 3.25Å; R740-S743 PolarHBondContact O-OG 3.41Å; S743-S746 PolarHBondContact O-OG 3.48Å
744	N	52.3	Low	60.4	Low	109 Å²	109	116.1 Å²	116.1	58%	0.583	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	1.1	-178.8	-72.8	13.9	0	0	0	113.7	R740 L741	R740-N744 WeakPolarHBondContact O-CB 3.06Å; R740-N744 PolarHBondContact O-N 3.41Å; R740-N744 PolarHBondContact O-OD1 3.42Å; L741-N744 PolarHBondContact O-N 3.06Å
745	N	41.4	Very low	58.9	Low	146 Å²	146	114.4 Å²	114.4	78%	0.781	61%	0.612	S	S	*	*	S	Bend	trans	-106.3	12.3	172	-84	5.3	0	0	0	113	D747	N745-D747 VanDerWaalsContact C-N 3.31Å
746	S	38.9	Very low	57.5	Low	97 Å²	97	117.1 Å²	117.1	68%	0.678	63%	0.626	S	S	*	*			trans	-97.2	73.6	151.8	60.2	0	0	0	0	107.3	S743	S743-S746 PolarHBondContact O-OG 3.48Å
747	D	38.2	Very low	56.3	Low	219 Å²	219	124.5 Å²	124.5	100%	1.171	66%	0.657	S	S	*	*			trans	-58.6	0	153.9	-79.5	-36.6	0	0	0	109.6	N745	N745-D747 VanDerWaalsContact C-N 3.31Å

Retrieved 747 of 747 residues in 762.6 ms (Link to these results)

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