G4LZ89_SCHMA Loading...

Cement protein 3B variant 1, putative

AlphaFold DB , UniProt , Accession G4LZ89, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 696 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.5	Very low	48.7	Very low	109 Å²	109	89.6 Å²	89.6	54%	0.537	50%	0.501	S	S	.	.				0	112.9	0	-98.3	165.6	171	0	0	107.1	P41 E64 M95	M1-P41 HydrophobicContact CB-CG 4.44Å; M1-E64 HydrophobicContact CE-CB 3.9Å; M1-E64 HydrophobicContact CE-CG 4.38Å; M1-M95 HydrophobicContact CE-CE 3.98Å; M1-M95 HydrophobicContact SD-CE 3.92Å
2	T	53.9	Low	48.9	Very low	85 Å²	85	85.3 Å²	85.3	52%	0.521	49%	0.492	S	S	.	.			trans	-107	147.2	162.7	42.2	0	0	0	0	105.7	S4 T40	T2-S4 PolarHBondContact O-N 3.1Å; T2-T40 HydrophobicContact CG2-CG2 4.24Å
3	F	55.8	Low	49.6	Very low	4 Å²	4	80.5 Å²	80.5	2%	0.018	47%	0.467	C	S	.	.			trans	-62.2	137.9	176.5	-60.3	-62.4	0	0	0	109.9	W5 L6 I39 P41 L94 M95 G97 L102	F3-W5 HydrophobicContact CB-CD2 4.46Å; F3-W5 HydrophobicContact CB-CZ2 4.25Å; F3-W5 HydrophobicContact CG-CZ2 4.48Å; F3-L6 HydrophobicContact CB-CB 4.36Å; F3-L6 HydrophobicContact CB-CD1 3.72Å; F3-L6 HydrophobicContact CD2-CD1 3.8Å; F3-L6 HydrophobicContact CG-CD1 4.24Å; F3-L6 WeakPolarHBondContact O-CB 3.48Å; F3-L6 PolarHBondContact O-N 2.78Å; F3-I39 VanDerWaalsContact CD2-O 3.23Å; F3-I39 WeakPolarHBondContact CD2-O 3.28Å; F3-I39 HydrophobicContact CE2-CG2 4.33Å; F3-I39 WeakPolarHBondContact CE2-O 3.48Å; F3-P41 HydrophobicContact CD1-CG 4.49Å; F3-P41 HydrophobicContact CE1-CG 3.65Å; F3-P41 HydrophobicContact CZ-CG 3.82Å; F3-L94 WeakPolarHBondContact CE1-O 3.49Å; F3-M95 WeakPolarHBondContact CD1-O 3.13Å; F3-G97 VanDerWaalsContact CD1-N 3.33Å; F3-L102 HydrophobicContact CD2-CD2 4.18Å; F3-L102 HydrophobicContact CE2-CD1 4.38Å; F3-L102 HydrophobicContact CE2-CD2 3.85Å; F3-L102 HydrophobicContact CZ-CD1 4.38Å; F3-L102 HydrophobicContact CZ-CD2 4.49Å
4	S	50.6	Low	50.4	Low	87 Å²	87	86.5 Å²	86.5	61%	0.608	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-74.5	-29.3	-165	60.9	0	0	0	0	114.1	T2 L6	T2-S4 PolarHBondContact O-N 3.1Å; S4-L6 PolarHBondContact O-N 3.32Å
5	W	51.6	Low	51.4	Low	43 Å²	43	85.9 Å²	85.9	16%	0.163	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-72.1	-14.2	174.9	66.2	69.7	0	0	0	113.8	F3 E7 D8 S9 G97 E98 P99 L102	F3-W5 HydrophobicContact CB-CD2 4.46Å; F3-W5 HydrophobicContact CB-CZ2 4.25Å; F3-W5 HydrophobicContact CG-CZ2 4.48Å; W5-E7 PolarHBondContact O-N 3.05Å; W5-D8 PolarHBondContact O-N 3.11Å; W5-S9 PolarHBondContact O-OG 2.86Å; W5-G97 WeakPolarHBondContact CH2-O 3.15Å; W5-G97 VanDerWaalsContact CZ2-CA 3.41Å; W5-G97 WeakPolarHBondContact CZ3-O 2.87Å; W5-E98 WeakPolarHBondContact CH2-O 3.27Å; W5-E98 HydrophobicContact CZ3-CB 4.45Å; W5-P99 HydrophobicContact CE3-CG 3.97Å; W5-P99 HydrophobicContact CH2-CB 3.82Å; W5-P99 HydrophobicContact CH2-CG 3.65Å; W5-P99 HydrophobicContact CZ2-CB 4.43Å; W5-P99 HydrophobicContact CZ2-CG 4.42Å; W5-P99 HydrophobicContact CZ3-CB 3.98Å; W5-P99 HydrophobicContact CZ3-CG 3.25Å; W5-L102 HydrophobicContact CZ2-CD2 4.24Å
6	L	50.3	Low	52.5	Low	10 Å²	10	81.1 Å²	81.1	5%	0.052	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-72.9	-10.2	-160.8	-134.3	149.4	0	0	0	110.3	F3 S4 I36 H37	F3-L6 HydrophobicContact CB-CB 4.36Å; F3-L6 HydrophobicContact CB-CD1 3.72Å; F3-L6 HydrophobicContact CD2-CD1 3.8Å; F3-L6 HydrophobicContact CG-CD1 4.24Å; F3-L6 WeakPolarHBondContact O-CB 3.48Å; F3-L6 PolarHBondContact O-N 2.78Å; S4-L6 PolarHBondContact O-N 3.32Å; L6-I36 HydrophobicContact CD1-CG1 4.09Å; L6-I36 HydrophobicContact CD2-CB 3.91Å; L6-I36 HydrophobicContact CD2-CD1 4.37Å; L6-I36 HydrophobicContact CD2-CG1 3.79Å; L6-I36 HydrophobicContact CD2-CG2 3.34Å; L6-I36 HydrophobicContact CG-CD1 4.35Å; L6-I36 HydrophobicContact CG-CG1 4.13Å; L6-I36 HydrophobicContact CG-CG2 4.39Å; L6-H37 HydrophobicContact CD2-CB 4.17Å; L6-H37 WeakPolarHBondContact CD2-ND1 3.5Å; L6-H37 PolarHBondContact O-CE1 2.83Å
7	E	48.1	Very low	53.5	Low	156 Å²	156	77.4 Å²	77.4	73%	0.729	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-78.9	-20.1	170.7	-60.1	-171.9	164.3	0	0	113.8	W5	W5-E7 PolarHBondContact O-N 3.05Å
8	D	46.3	Very low	54.6	Low	155 Å²	155	80.9 Å²	80.9	83%	0.829	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	-6.6	-167	-78.3	-27.9	0	0	0	116.1	W5	W5-D8 PolarHBondContact O-N 3.11Å
9	S	41.5	Very low	55.4	Low	51 Å²	51	77.9 Å²	77.9	36%	0.357	42%	0.424	S	S	.	.			trans	-125.4	104.2	-170.5	58.5	0	0	0	0	114.6	W5 C11	W5-S9 PolarHBondContact O-OG 2.86Å; S9-C11 PolarHBondContact O-N 3.33Å
10	N	47.8	Very low	56.1	Low	164 Å²	164	74 Å²	74	88%	0.877	40%	0.403	S	S	*	.			trans	-80.2	7.7	171.1	-111	-8.5	0	0	0	113.8
11	C	40.6	Very low	57	Low	122 Å²	122	71.8 Å²	71.8	82%	0.824	39%	0.391	S	S	*	.	S	Bend	trans	-114	114.6	-172.3	-152.7	0	0	0	0	109.7	S9	S9-C11 PolarHBondContact O-N 3.33Å
12	G	51.8	Low	58.2	Low	38 Å²	38	70.6 Å²	70.6	39%	0.392	39%	0.387	S	S	.	.	S	Bend	trans	97.9	-3.3	-178.6	0	0	0	0	0	115.8	E14 D15 L16	G12-E14 PolarHBondContact O-N 3.3Å; G12-D15 PolarHBondContact O-N 3.11Å; G12-L16 PolarHBondContact O-N 3.23Å
13	S	58.5	Low	58.9	Low	23 Å²	23	66.5 Å²	66.5	16%	0.161	36%	0.362	C	S	.	.	H	α-helix	trans	-67.7	-35.5	-177.2	61.1	0	0	0	0	114.3	T17	S13-T17 WeakPolarHBondContact O-CB 3.41Å; S13-T17 PolarHBondContact O-N 2.93Å; S13-T17 PolarHBondContact O-OG1 3.36Å
14	E	60	Low	59.7	Low	164 Å²	164	66.8 Å²	66.8	77%	0.766	36%	0.363	S	S	*	.	H	α-helix	trans	-68.3	-40.8	178.3	-69.4	-174.2	173.9	0	0	111.7	G12 T17 R18	G12-E14 PolarHBondContact O-N 3.3Å; E14-T17 PolarHBondContact O-N 2.93Å; E14-R18 VanDerWaalsContact O-CB 3.27Å; E14-R18 WeakPolarHBondContact O-CB 3.41Å; E14-R18 PolarHBondContact O-N 3.49Å
15	D	66.3	Low	60.7	Low	78 Å²	78	64.9 Å²	64.9	42%	0.417	35%	0.35	S	S	.	.	H	α-helix	trans	-66.8	-45.3	178.8	-73.5	-39.4	0	0	0	111.4	G12 R18 I19	G12-D15 PolarHBondContact O-N 3.11Å; D15-R18 WeakPolarHBondContact O-CB 3.45Å; D15-R18 PolarHBondContact O-N 3.25Å; D15-R18 IonicContact OD1-CZ 3.31Å; D15-R18 VanDerWaalsContact OD1-CZ 3.23Å; D15-R18 IonicContact OD1-NH1 2.8Å; D15-R18 PolarHBondContact OD1-NH1 2.9Å; D15-R18 IonicContact OD1-NH2 3.68Å; D15-R18 PolarHBondContact OD1-NH2 3.48Å; D15-I19 WeakPolarHBondContact O-CD1 3.31Å; D15-I19 WeakPolarHBondContact O-CG1 3.46Å; D15-I19 PolarHBondContact O-N 2.96Å
16	L	68	Low	61.3	Low	8 Å²	8	64.9 Å²	64.9	4%	0.042	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-44.1	176	-78.3	170.4	0	0	0	112.1	G12 R18 I19 A20 I36 I39 L102 L106	G12-L16 PolarHBondContact O-N 3.23Å; L16-R18 VanDerWaalsContact C-N 3.31Å; L16-R18 PolarHBondContact O-N 3.39Å; L16-I19 PolarHBondContact O-N 2.86Å; L16-A20 WeakPolarHBondContact O-CB 3.47Å; L16-A20 PolarHBondContact O-N 3.34Å; L16-I36 HydrophobicContact CB-CD1 4.22Å; L16-I36 HydrophobicContact CD1-CD1 3.66Å; L16-I39 HydrophobicContact CB-CD1 4.22Å; L16-L102 HydrophobicContact CD2-CG 4.4Å; L16-L106 HydrophobicContact CD2-CD1 4.19Å
17	T	70.3	Confident	62	Low	19 Å²	19	64.5 Å²	64.5	12%	0.117	35%	0.351	C	S	.	.	H	α-helix	trans	-63.1	-39.8	176.3	-56.7	0	0	0	0	111	S13 E14 N21 I33	S13-T17 WeakPolarHBondContact O-CB 3.41Å; S13-T17 PolarHBondContact O-N 2.93Å; S13-T17 PolarHBondContact O-OG1 3.36Å; E14-T17 PolarHBondContact O-N 2.93Å; T17-N21 VanDerWaalsContact O-CB 3.26Å; T17-N21 WeakPolarHBondContact O-CB 3.3Å; T17-N21 VanDerWaalsContact O-CG 3.24Å; T17-N21 PolarHBondContact O-N 3.27Å; T17-N21 PolarHBondContact O-ND2 3.17Å; T17-N21 VanDerWaalsContact O-ND2 3.16Å; T17-I33 HydrophobicContact CG2-CG2 4.07Å; T17-I33 WeakPolarHBondContact CG2-O 3.13Å
18	R	72.4	Confident	62.8	Low	141 Å²	141	61.8 Å²	61.8	53%	0.532	34%	0.341	S	S	.	.	H	α-helix	trans	-64.5	-44.6	175.6	-172.4	179.3	68.6	-144.8	-9.1	111.7	E14 D15 L16 N21 N22	E14-R18 VanDerWaalsContact O-CB 3.27Å; E14-R18 WeakPolarHBondContact O-CB 3.41Å; E14-R18 PolarHBondContact O-N 3.49Å; D15-R18 WeakPolarHBondContact O-CB 3.45Å; D15-R18 PolarHBondContact O-N 3.25Å; D15-R18 IonicContact OD1-CZ 3.31Å; D15-R18 VanDerWaalsContact OD1-CZ 3.23Å; D15-R18 IonicContact OD1-NH1 2.8Å; D15-R18 PolarHBondContact OD1-NH1 2.9Å; D15-R18 IonicContact OD1-NH2 3.68Å; D15-R18 PolarHBondContact OD1-NH2 3.48Å; L16-R18 VanDerWaalsContact C-N 3.31Å; L16-R18 PolarHBondContact O-N 3.39Å; R18-N21 PolarHBondContact O-N 2.79Å; R18-N22 WeakPolarHBondContact O-CB 3.42Å; R18-N22 PolarHBondContact O-N 2.87Å; R18-N22 PolarHBondContact O-OD1 3.09Å
19	I	70.3	Confident	63.6	Low	23 Å²	23	57 Å²	57	12%	0.118	32%	0.318	C	S	.	.	H	α-helix	trans	-65.2	-45.5	178.8	-63.3	156.8	0	0	0	110.6	D15 L16 N21 N22 A23 L106 V107	D15-I19 WeakPolarHBondContact O-CD1 3.31Å; D15-I19 WeakPolarHBondContact O-CG1 3.46Å; D15-I19 PolarHBondContact O-N 2.96Å; L16-I19 PolarHBondContact O-N 2.86Å; I19-N21 VanDerWaalsContact C-N 3.33Å; I19-N21 PolarHBondContact O-N 2.96Å; I19-N22 WeakPolarHBondContact O-CB 3.42Å; I19-N22 PolarHBondContact O-N 2.63Å; I19-N22 VanDerWaalsContact O-N 3.17Å; I19-A23 PolarHBondContact O-N 3.47Å; I19-L106 HydrophobicContact CG2-CB 3.74Å; I19-V107 HydrophobicContact CD1-CG2 3.76Å; I19-V107 HydrophobicContact CG1-CG2 4.27Å; I19-V107 HydrophobicContact CG2-CG2 4.03Å
20	A	69.5	Low	64.3	Low	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-62.5	-40.3	177.2	0	0	0	0	0	112	L16 A23 L24 I33 I39 F43 L106	L16-A20 WeakPolarHBondContact O-CB 3.47Å; L16-A20 PolarHBondContact O-N 3.34Å; A20-A23 WeakPolarHBondContact O-CB 3.23Å; A20-A23 PolarHBondContact O-N 3.29Å; A20-L24 WeakPolarHBondContact O-CG 3.45Å; A20-L24 PolarHBondContact O-N 3.19Å; A20-I33 HydrophobicContact CB-CD1 3.66Å; A20-I39 HydrophobicContact CB-CD1 3.86Å; A20-I39 HydrophobicContact CB-CG1 4.25Å; A20-F43 HydrophobicContact CB-CE1 4.24Å; A20-F43 HydrophobicContact CB-CZ 4.33Å; A20-L106 HydrophobicContact CB-CD1 4.35Å
21	N	75	Confident	64.5	Low	27 Å²	27	59 Å²	59	14%	0.144	33%	0.325	C	S	.	.	H	α-helix	trans	-67.5	-34	174.2	-77.6	-28.3	0	0	0	113.1	T17 R18 I19 L24 S25 Y32 I33	T17-N21 VanDerWaalsContact O-CB 3.26Å; T17-N21 WeakPolarHBondContact O-CB 3.3Å; T17-N21 VanDerWaalsContact O-CG 3.24Å; T17-N21 PolarHBondContact O-N 3.27Å; T17-N21 PolarHBondContact O-ND2 3.17Å; T17-N21 VanDerWaalsContact O-ND2 3.16Å; R18-N21 PolarHBondContact O-N 2.79Å; I19-N21 VanDerWaalsContact C-N 3.33Å; I19-N21 PolarHBondContact O-N 2.96Å; N21-L24 PolarHBondContact O-N 2.94Å; N21-S25 VanDerWaalsContact O-CB 3.24Å; N21-S25 WeakPolarHBondContact O-CB 3.36Å; N21-S25 PolarHBondContact O-N 2.85Å; N21-Y32 HydrophobicContact CB-CD1 3.83Å; N21-Y32 VanDerWaalsContact OD1-CA 3.3Å; N21-Y32 WeakPolarHBondContact OD1-CA 3.45Å; N21-Y32 WeakPolarHBondContact OD1-CB 3.41Å; N21-I33 PolarHBondContact ND2-O 2.86Å; N21-I33 PolarHBondContact OD1-N 3.04Å; N21-I33 PolarHBondContact OD1-O 3.41Å
22	N	72.6	Confident	65.6	Low	84 Å²	84	57.8 Å²	57.8	45%	0.449	30%	0.304	S	S	.	.	H	α-helix	trans	-63.7	-44.9	171.7	-72.2	-12.6	0	0	0	110.7	R18 I19 S25 L26	R18-N22 WeakPolarHBondContact O-CB 3.42Å; R18-N22 PolarHBondContact O-N 2.87Å; R18-N22 PolarHBondContact O-OD1 3.09Å; I19-N22 WeakPolarHBondContact O-CB 3.42Å; I19-N22 PolarHBondContact O-N 2.63Å; I19-N22 VanDerWaalsContact O-N 3.17Å; N22-S25 PolarHBondContact O-N 3.27Å; N22-L26 VanDerWaalsContact O-CG 3.25Å; N22-L26 WeakPolarHBondContact O-CG 3.31Å; N22-L26 PolarHBondContact O-N 3.31Å
23	A	70.1	Confident	66.4	Low	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.1	-50.4	174.3	0	0	0	0	0	110.9	I19 A20 S25 L26 I27 L47 A110 I113	I19-A23 PolarHBondContact O-N 3.47Å; A20-A23 WeakPolarHBondContact O-CB 3.23Å; A20-A23 PolarHBondContact O-N 3.29Å; A23-S25 VanDerWaalsContact C-N 3.35Å; A23-S25 PolarHBondContact O-N 3.34Å; A23-L26 PolarHBondContact O-N 3.04Å; A23-I27 WeakPolarHBondContact O-CD1 3.28Å; A23-I27 WeakPolarHBondContact O-CG1 3.45Å; A23-I27 PolarHBondContact O-N 3.1Å; A23-L47 HydrophobicContact CB-CD2 4.3Å; A23-A110 HydrophobicContact CB-CB 4.2Å; A23-I113 HydrophobicContact CB-CD1 3.83Å
24	L	72.1	Confident	66.6	Low	9 Å²	9	65.3 Å²	65.3	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-59.7	-41.9	176.9	-72	173.2	0	0	0	113.2	A20 N21 L26 I27 N28 V29 I33 F43 L47	A20-L24 WeakPolarHBondContact O-CG 3.45Å; A20-L24 PolarHBondContact O-N 3.19Å; N21-L24 PolarHBondContact O-N 2.94Å; L24-L26 VanDerWaalsContact C-N 3.31Å; L24-L26 PolarHBondContact O-N 3.45Å; L24-I27 CarbonylContact O-C 3.53Å; L24-I27 PolarHBondContact O-N 2.96Å; L24-N28 PolarHBondContact O-N 3.21Å; L24-N28 VanDerWaalsContact O-N 3.11Å; L24-V29 HydrophobicContact CD2-CB 3.87Å; L24-V29 HydrophobicContact CD2-CG1 3.87Å; L24-V29 PolarHBondContact O-N 3.06Å; L24-I33 HydrophobicContact CD1-CD1 3.95Å; L24-I33 HydrophobicContact CD1-CG1 3.97Å; L24-F43 HydrophobicContact CD1-CE2 3.86Å; L24-F43 HydrophobicContact CD1-CZ 4.07Å; L24-F43 HydrophobicContact CD2-CE2 3.83Å; L24-F43 HydrophobicContact CD2-CZ 4.11Å; L24-F43 HydrophobicContact CG-CE2 4.04Å; L24-F43 HydrophobicContact CG-CZ 3.99Å; L24-L47 HydrophobicContact CD2-CD1 4.28Å
25	S	70.7	Confident	66.8	Low	47 Å²	47	62 Å²	62	33%	0.329	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-41.1	177.2	-163.6	0	0	0	0	111.6	N21 N22 A23 I27 N28 Y32	N21-S25 VanDerWaalsContact O-CB 3.24Å; N21-S25 WeakPolarHBondContact O-CB 3.36Å; N21-S25 PolarHBondContact O-N 2.85Å; N22-S25 PolarHBondContact O-N 3.27Å; A23-S25 VanDerWaalsContact C-N 3.35Å; A23-S25 PolarHBondContact O-N 3.34Å; S25-I27 PolarHBondContact O-N 3.04Å; S25-N28 PolarHBondContact O-N 3.4Å; S25-N28 VanDerWaalsContact O-N 3.14Å; S25-N28 PolarHBondContact O-OD1 3.35Å; S25-Y32 PolarHBondContact OG-OH 3.47Å
26	L	65.2	Low	66.6	Low	44 Å²	44	59.3 Å²	59.3	23%	0.23	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-30.1	-179.8	-73.6	167.7	0	0	0	112.3	N22 A23 L24 A110 I113 A114 R117	N22-L26 VanDerWaalsContact O-CG 3.25Å; N22-L26 WeakPolarHBondContact O-CG 3.31Å; N22-L26 PolarHBondContact O-N 3.31Å; A23-L26 PolarHBondContact O-N 3.04Å; L24-L26 VanDerWaalsContact C-N 3.31Å; L24-L26 PolarHBondContact O-N 3.45Å; L26-A110 WeakPolarHBondContact CD1-O 3.35Å; L26-I113 HydrophobicContact CB-CB 4.38Å; L26-I113 HydrophobicContact CB-CG2 3.47Å; L26-I113 VanDerWaalsContact CB-CG2 3.47Å; L26-I113 HydrophobicContact CD1-CB 4.35Å; L26-I113 HydrophobicContact CD1-CG2 4.29Å; L26-I113 HydrophobicContact CG-CG2 4.49Å; L26-A114 HydrophobicContact CD1-CB 3.99Å; L26-A114 HydrophobicContact CD2-CB 4.44Å; L26-R117 PolarHBondContact O-NH1 2.96Å
27	I	65.5	Low	66.6	Low	2 Å²	2	63.5 Å²	63.5	1%	0.01	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	4	180	-39.6	156.3	0	0	0	111.5	A23 L24 S25 V29 L47 V50 I113 L124	A23-I27 WeakPolarHBondContact O-CD1 3.28Å; A23-I27 WeakPolarHBondContact O-CG1 3.45Å; A23-I27 PolarHBondContact O-N 3.1Å; L24-I27 CarbonylContact O-C 3.53Å; L24-I27 PolarHBondContact O-N 2.96Å; S25-I27 PolarHBondContact O-N 3.04Å; I27-V29 HydrophobicContact CB-CG2 4.1Å; I27-V29 HydrophobicContact CG2-CG2 4.1Å; I27-V29 PolarHBondContact O-N 3.39Å; I27-L47 HydrophobicContact CD1-CD1 3.13Å; I27-L47 HydrophobicContact CD1-CG 4.19Å; I27-V50 HydrophobicContact CG2-CG1 3.57Å; I27-I113 HydrophobicContact CD1-CD1 3.71Å; I27-I113 HydrophobicContact CD1-CG1 4.42Å; I27-I113 HydrophobicContact CG1-CD1 3.96Å; I27-I113 HydrophobicContact CG1-CG1 4.3Å; I27-I113 HydrophobicContact CG1-CG2 3.65Å; I27-L124 HydrophobicContact CB-CD1 4.16Å; I27-L124 HydrophobicContact CG2-CD1 3.48Å; I27-L124 VanDerWaalsContact CG2-CD1 3.48Å; I27-L124 HydrophobicContact CG2-CD2 3.67Å; I27-L124 HydrophobicContact CG2-CG 4.23Å
28	N	63.9	Low	66.4	Low	98 Å²	98	66.3 Å²	66.3	52%	0.524	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	34.2	-176	-61.7	-30.4	0	0	0	113.7	L24 S25 I126	L24-N28 PolarHBondContact O-N 3.21Å; L24-N28 VanDerWaalsContact O-N 3.11Å; S25-N28 PolarHBondContact O-N 3.4Å; S25-N28 VanDerWaalsContact O-N 3.14Å; S25-N28 PolarHBondContact O-OD1 3.35Å; N28-I126 HydrophobicContact CB-CD1 3.52Å
29	V	62.6	Low	66.4	Low	55 Å²	55	59.6 Å²	59.6	33%	0.333	30%	0.296	S	S	.	.			trans	-95.1	113.9	176.9	179.3	0	0	0	0	109.5	L24 I27	L24-V29 HydrophobicContact CD2-CB 3.87Å; L24-V29 HydrophobicContact CD2-CG1 3.87Å; L24-V29 PolarHBondContact O-N 3.06Å; I27-V29 HydrophobicContact CB-CG2 4.1Å; I27-V29 HydrophobicContact CG2-CG2 4.1Å; I27-V29 PolarHBondContact O-N 3.39Å
30	E	56.6	Low	66.6	Low	152 Å²	152	59.9 Å²	59.9	71%	0.71	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-100.9	145.3	164.6	-70.3	-167.7	162.9	0	0	110.1	Y32	E30-Y32 HydrophobicContact CG-CE2 4.24Å
31	P	52	Low	66.9	Low	106 Å²	106	60.1 Å²	60.1	69%	0.688	30%	0.3	S	S	*	.	S	Bend	cis	-95.2	151.7	10.5	35	-33	0	0	0	115.1
32	Y	63.7	Low	66.9	Low	95 Å²	95	60.6 Å²	60.6	37%	0.373	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-62.2	138.6	171	-63.8	-74.4	0	0	0	112.4	N21 S25 E30 R34	N21-Y32 HydrophobicContact CB-CD1 3.83Å; N21-Y32 VanDerWaalsContact OD1-CA 3.3Å; N21-Y32 WeakPolarHBondContact OD1-CA 3.45Å; N21-Y32 WeakPolarHBondContact OD1-CB 3.41Å; S25-Y32 PolarHBondContact OG-OH 3.47Å; E30-Y32 HydrophobicContact CG-CE2 4.24Å; Y32-R34 PolarHBondContact O-N 2.92Å
33	I	69.3	Low	67.2	Low	9 Å²	9	58 Å²	58	5%	0.046	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-61.9	128.1	173.6	-68.8	161	0	0	0	109.7	T17 A20 N21 L24 N35 E38 I39 F43	T17-I33 HydrophobicContact CG2-CG2 4.07Å; T17-I33 WeakPolarHBondContact CG2-O 3.13Å; A20-I33 HydrophobicContact CB-CD1 3.66Å; N21-I33 PolarHBondContact ND2-O 2.86Å; N21-I33 PolarHBondContact OD1-N 3.04Å; N21-I33 PolarHBondContact OD1-O 3.41Å; L24-I33 HydrophobicContact CD1-CD1 3.95Å; L24-I33 HydrophobicContact CD1-CG1 3.97Å; I33-N35 WeakPolarHBondContact CG2-O 3.38Å; I33-E38 VanDerWaalsContact CA-OE2 3.26Å; I33-E38 WeakPolarHBondContact CA-OE2 3.46Å; I33-E38 HydrophobicContact CG1-CB 4.32Å; I33-E38 HydrophobicContact CG2-CB 3.79Å; I33-I39 HydrophobicContact CD1-CG1 3.94Å; I33-I39 HydrophobicContact CG2-CG1 4.24Å; I33-F43 HydrophobicContact CD1-CD1 4.29Å; I33-F43 HydrophobicContact CD1-CD2 3.95Å; I33-F43 HydrophobicContact CD1-CE1 3.79Å; I33-F43 HydrophobicContact CD1-CE2 3.41Å; I33-F43 VanDerWaalsContact CD1-CE2 3.41Å; I33-F43 HydrophobicContact CD1-CG 4.36Å; I33-F43 HydrophobicContact CD1-CZ 3.32Å; I33-F43 HydrophobicContact CG1-CE2 4.2Å
34	R	61.9	Low	67.6	Low	211 Å²	211	58 Å²	58	80%	0.796	29%	0.293	S	S	*	.			trans	-100.6	-29	-180	-65.8	-175	-178.1	-179.6	1.6	113.5	Y32 E38	Y32-R34 PolarHBondContact O-N 2.92Å; R34-E38 PolarHBondContact N-OE2 3.22Å
35	N	64	Low	68.1	Low	94 Å²	94	58.4 Å²	58.4	50%	0.503	29%	0.294	S	S	.	.	S	Bend	trans	-129.9	142.7	-178.3	-63.9	-55.4	0	0	0	109.4	I33 H37 E38	I33-N35 WeakPolarHBondContact CG2-O 3.38Å; N35-H37 PolarHBondContact O-N 3.45Å; N35-E38 WeakPolarHBondContact O-CB 3.35Å; N35-E38 PolarHBondContact O-N 3.29Å
36	I	63.9	Low	68.3	Low	21 Å²	21	59.9 Å²	59.9	11%	0.108	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-56.2	-26.9	176.4	-171.8	172.6	0	0	0	112.5	L6 L16 E38 I39	L6-I36 HydrophobicContact CD1-CG1 4.09Å; L6-I36 HydrophobicContact CD2-CB 3.91Å; L6-I36 HydrophobicContact CD2-CD1 4.37Å; L6-I36 HydrophobicContact CD2-CG1 3.79Å; L6-I36 HydrophobicContact CD2-CG2 3.34Å; L6-I36 HydrophobicContact CG-CD1 4.35Å; L6-I36 HydrophobicContact CG-CG1 4.13Å; L6-I36 HydrophobicContact CG-CG2 4.39Å; L16-I36 HydrophobicContact CB-CD1 4.22Å; L16-I36 HydrophobicContact CD1-CD1 3.66Å; I36-E38 PolarHBondContact O-N 2.94Å; I36-E38 VanDerWaalsContact O-N 3.17Å; I36-I39 HydrophobicContact CG1-CD1 4.37Å; I36-I39 WeakPolarHBondContact O-CB 3.5Å; I36-I39 PolarHBondContact O-N 2.91Å
37	H	66.2	Low	68.9	Low	96 Å²	96	58.1 Å²	58.1	44%	0.444	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-64.3	-15.8	175.5	-55	-75.5	0	0	0	114.5	L6 N35 I39	L6-H37 HydrophobicContact CD2-CB 4.17Å; L6-H37 WeakPolarHBondContact CD2-ND1 3.5Å; L6-H37 PolarHBondContact O-CE1 2.83Å; N35-H37 PolarHBondContact O-N 3.45Å; H37-I39 VanDerWaalsContact C-N 3.33Å
38	E	66.2	Low	69.4	Low	79 Å²	79	58 Å²	58	37%	0.369	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-80.9	-18.9	175.2	-61.5	167.2	-164.5	0	0	111.3	I33 R34 N35 I36 T40	I33-E38 VanDerWaalsContact CA-OE2 3.26Å; I33-E38 WeakPolarHBondContact CA-OE2 3.46Å; I33-E38 HydrophobicContact CG1-CB 4.32Å; I33-E38 HydrophobicContact CG2-CB 3.79Å; R34-E38 PolarHBondContact N-OE2 3.22Å; N35-E38 WeakPolarHBondContact O-CB 3.35Å; N35-E38 PolarHBondContact O-N 3.29Å; I36-E38 PolarHBondContact O-N 2.94Å; I36-E38 VanDerWaalsContact O-N 3.17Å; E38-T40 PolarHBondContact O-N 3.45Å
39	I	72.4	Confident	69.9	Low	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.269	C	S	.	.			trans	-75.6	94.9	169.6	-51.3	177	0	0	0	107.5	F3 L16 A20 I33 I36 H37 F43 L102 L106	F3-I39 VanDerWaalsContact CD2-O 3.23Å; F3-I39 WeakPolarHBondContact CD2-O 3.28Å; F3-I39 HydrophobicContact CE2-CG2 4.33Å; F3-I39 WeakPolarHBondContact CE2-O 3.48Å; L16-I39 HydrophobicContact CB-CD1 4.22Å; A20-I39 HydrophobicContact CB-CD1 3.86Å; A20-I39 HydrophobicContact CB-CG1 4.25Å; I33-I39 HydrophobicContact CD1-CG1 3.94Å; I33-I39 HydrophobicContact CG2-CG1 4.24Å; I36-I39 HydrophobicContact CG1-CD1 4.37Å; I36-I39 WeakPolarHBondContact O-CB 3.5Å; I36-I39 PolarHBondContact O-N 2.91Å; H37-I39 VanDerWaalsContact C-N 3.33Å; I39-F43 HydrophobicContact CG2-CD1 4.17Å; I39-L102 HydrophobicContact CG2-CD1 4.47Å; I39-L102 HydrophobicContact CG2-CD2 4.08Å; I39-L106 HydrophobicContact CD1-CD1 4.44Å; I39-L106 HydrophobicContact CG2-CD1 4.34Å
40	T	75.3	Confident	70.3	Confident	29 Å²	29	54.4 Å²	54.4	18%	0.178	27%	0.27	C	S	.	.			trans	-116.3	163.8	177.9	58.9	0	0	0	0	110.1	T2 E38 A42 F43 V44	T2-T40 HydrophobicContact CG2-CG2 4.24Å; E38-T40 PolarHBondContact O-N 3.45Å; T40-A42 PolarHBondContact O-N 3.28Å; T40-A42 VanDerWaalsContact O-N 3.15Å; T40-F43 WeakPolarHBondContact O-CA 3.34Å; T40-F43 VanDerWaalsContact O-CB 3.3Å; T40-F43 WeakPolarHBondContact O-CB 3.45Å; T40-F43 PolarHBondContact O-N 3.25Å; T40-F43 PolarHBondContact OG1-N 2.92Å; T40-V44 PolarHBondContact O-N 3.42Å; T40-V44 VanDerWaalsContact O-N 3.15Å
41	P	74.9	Confident	71	Confident	4 Å²	4	47.9 Å²	47.9	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-51.9	-37.1	170	-29.3	36.2	0	0	0	112.7	M1 F3 F43 V44 F45 F71 M95	M1-P41 HydrophobicContact CB-CG 4.44Å; F3-P41 HydrophobicContact CD1-CG 4.49Å; F3-P41 HydrophobicContact CE1-CG 3.65Å; F3-P41 HydrophobicContact CZ-CG 3.82Å; P41-F43 PolarHBondContact O-N 3.03Å; P41-V44 PolarHBondContact O-N 3.39Å; P41-F45 HydrophobicContact CB-CE2 4.09Å; P41-F45 HydrophobicContact CB-CZ 4.12Å; P41-F45 WeakPolarHBondContact O-CB 3.49Å; P41-F45 WeakPolarHBondContact O-CD1 3.35Å; P41-F45 WeakPolarHBondContact O-CD2 3.48Å; P41-F45 WeakPolarHBondContact O-CG 3.45Å; P41-F45 PolarHBondContact O-N 3Å; P41-F71 HydrophobicContact CB-CE2 3.87Å; P41-F71 HydrophobicContact CB-CZ 3.99Å; P41-F71 HydrophobicContact CG-CE2 4.29Å; P41-F71 HydrophobicContact CG-CZ 4.45Å; P41-M95 HydrophobicContact CB-SD 4.49Å; P41-M95 HydrophobicContact CG-SD 4.26Å
42	A	75.3	Confident	72.1	Confident	37 Å²	37	44.2 Å²	44.2	31%	0.306	21%	0.214	S	C	.	.	H	α-helix	trans	-62	-41.6	175.6	0	0	0	0	0	112.5	T40 V44 F45 D46	T40-A42 PolarHBondContact O-N 3.28Å; T40-A42 VanDerWaalsContact O-N 3.15Å; A42-V44 VanDerWaalsContact C-N 3.33Å; A42-V44 PolarHBondContact O-N 2.92Å; A42-F45 PolarHBondContact O-N 3.22Å; A42-D46 WeakPolarHBondContact O-CB 3.47Å; A42-D46 PolarHBondContact O-N 3.29Å
43	F	79.2	Confident	72.4	Confident	29 Å²	29	40.2 Å²	40.2	13%	0.127	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-45.1	174.2	168.2	-97.1	0	0	0	111.6	A20 L24 I33 I39 T40 P41 F45 D46 L47	A20-F43 HydrophobicContact CB-CE1 4.24Å; A20-F43 HydrophobicContact CB-CZ 4.33Å; L24-F43 HydrophobicContact CD1-CE2 3.86Å; L24-F43 HydrophobicContact CD1-CZ 4.07Å; L24-F43 HydrophobicContact CD2-CE2 3.83Å; L24-F43 HydrophobicContact CD2-CZ 4.11Å; L24-F43 HydrophobicContact CG-CE2 4.04Å; L24-F43 HydrophobicContact CG-CZ 3.99Å; I33-F43 HydrophobicContact CD1-CD1 4.29Å; I33-F43 HydrophobicContact CD1-CD2 3.95Å; I33-F43 HydrophobicContact CD1-CE1 3.79Å; I33-F43 HydrophobicContact CD1-CE2 3.41Å; I33-F43 VanDerWaalsContact CD1-CE2 3.41Å; I33-F43 HydrophobicContact CD1-CG 4.36Å; I33-F43 HydrophobicContact CD1-CZ 3.32Å; I33-F43 HydrophobicContact CG1-CE2 4.2Å; I39-F43 HydrophobicContact CG2-CD1 4.17Å; T40-F43 WeakPolarHBondContact O-CA 3.34Å; T40-F43 VanDerWaalsContact O-CB 3.3Å; T40-F43 WeakPolarHBondContact O-CB 3.45Å; T40-F43 PolarHBondContact O-N 3.25Å; T40-F43 PolarHBondContact OG1-N 2.92Å; P41-F43 PolarHBondContact O-N 3.03Å; F43-F45 VanDerWaalsContact C-N 3.35Å; F43-D46 PolarHBondContact O-N 3.42Å; F43-L47 HydrophobicContact CE1-CD2 4.24Å; F43-L47 HydrophobicContact CZ-CD2 4.31Å; F43-L47 WeakPolarHBondContact O-CB 3.48Å; F43-L47 PolarHBondContact O-N 2.97Å
44	V	78.7	Confident	72.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.7	-40.8	178	177	0	0	0	0	111.4	T40 P41 A42 L47 A48 F71 F105	T40-V44 PolarHBondContact O-N 3.42Å; T40-V44 VanDerWaalsContact O-N 3.15Å; P41-V44 PolarHBondContact O-N 3.39Å; A42-V44 VanDerWaalsContact C-N 3.33Å; A42-V44 PolarHBondContact O-N 2.92Å; V44-L47 WeakPolarHBondContact O-CB 3.3Å; V44-L47 PolarHBondContact O-N 2.87Å; V44-A48 WeakPolarHBondContact O-CB 3.48Å; V44-A48 PolarHBondContact O-N 3.46Å; V44-F71 HydrophobicContact CB-CE1 4.07Å; V44-F71 HydrophobicContact CB-CZ 4.41Å; V44-F71 HydrophobicContact CG1-CD1 4.45Å; V44-F71 HydrophobicContact CG1-CE1 3.7Å; V44-F71 HydrophobicContact CG2-CE1 4.45Å; V44-F105 HydrophobicContact CG1-CD1 4.39Å; V44-F105 HydrophobicContact CG1-CE1 3.41Å; V44-F105 VanDerWaalsContact CG1-CE1 3.41Å; V44-F105 HydrophobicContact CG1-CZ 3.92Å
45	F	82.4	Confident	73.2	Confident	18 Å²	18	38.3 Å²	38.3	8%	0.079	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-43.3	177.3	-61.7	-18	0	0	0	111.9	P41 A42 F43 L47 A48 V49 L57 C67 N70 F71 I74	P41-F45 HydrophobicContact CB-CE2 4.09Å; P41-F45 HydrophobicContact CB-CZ 4.12Å; P41-F45 WeakPolarHBondContact O-CB 3.49Å; P41-F45 WeakPolarHBondContact O-CD1 3.35Å; P41-F45 WeakPolarHBondContact O-CD2 3.48Å; P41-F45 WeakPolarHBondContact O-CG 3.45Å; P41-F45 PolarHBondContact O-N 3Å; A42-F45 PolarHBondContact O-N 3.22Å; F43-F45 VanDerWaalsContact C-N 3.35Å; F45-L47 VanDerWaalsContact C-N 3.28Å; F45-L47 PolarHBondContact O-N 3.38Å; F45-A48 PolarHBondContact O-N 2.86Å; F45-V49 WeakPolarHBondContact O-CB 3.46Å; F45-V49 VanDerWaalsContact O-CG2 3.24Å; F45-V49 WeakPolarHBondContact O-CG2 3.13Å; F45-V49 PolarHBondContact O-N 3.46Å; F45-L57 HydrophobicContact CB-CD1 3.98Å; F45-L57 HydrophobicContact CB-CD2 4.23Å; F45-L57 HydrophobicContact CD1-CD2 4.17Å; F45-L57 HydrophobicContact CG-CD2 4.2Å; F45-C67 HydrophobicContact CE2-CB 4.17Å; F45-C67 HydrophobicContact CZ-CB 3.99Å; F45-N70 HydrophobicContact CD1-CB 4.28Å; F45-N70 HydrophobicContact CE1-CB 3.68Å; F45-N70 HydrophobicContact CE2-CB 4.08Å; F45-N70 HydrophobicContact CZ-CB 3.57Å; F45-F71 HydrophobicContact CE1-CD1 4Å; F45-F71 AromaticContact CE1-CD2 3.79Å; F45-F71 HydrophobicContact CE1-CD2 3.79Å; F45-F71 HydrophobicContact CE1-CE1 4.02Å; F45-F71 AromaticContact CE1-CE2 3.81Å; F45-F71 HydrophobicContact CE1-CE2 3.81Å; F45-F71 AromaticContact CE1-CG 3.9Å; F45-F71 HydrophobicContact CE1-CG 3.9Å; F45-F71 AromaticContact CE1-CZ 3.93Å; F45-F71 HydrophobicContact CE1-CZ 3.93Å; F45-F71 AromaticContact CZ-CD2 3.84Å; F45-F71 HydrophobicContact CZ-CD2 3.84Å; F45-F71 AromaticContact CZ-CE2 3.79Å; F45-F71 HydrophobicContact CZ-CE2 3.79Å; F45-F71 HydrophobicContact CZ-CG 4.39Å; F45-F71 HydrophobicContact CZ-CZ 4.29Å; F45-I74 HydrophobicContact CD1-CD1 3.5Å; F45-I74 VanDerWaalsContact CD1-CD1 3.5Å; F45-I74 HydrophobicContact CE1-CD1 3.93Å
46	D	75.2	Confident	73.9	Confident	79 Å²	79	34.6 Å²	34.6	42%	0.422	19%	0.191	S	C	.	.	H	α-helix	trans	-60.4	-42.1	175.3	-68.1	-22.8	0	0	0	110.4	A42 F43 V49 V50	A42-D46 WeakPolarHBondContact O-CB 3.47Å; A42-D46 PolarHBondContact O-N 3.29Å; F43-D46 PolarHBondContact O-N 3.42Å; D46-V49 PolarHBondContact O-N 3.26Å; D46-V50 WeakPolarHBondContact O-CG2 3.37Å; D46-V50 PolarHBondContact O-N 3.09Å; D46-V50 VanDerWaalsContact O-N 3.09Å
47	L	77.2	Confident	74.6	Confident	6 Å²	6	35.6 Å²	35.6	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-45.1	176.2	-163.2	64.6	0	0	0	112.2	A23 L24 I27 F43 V44 F45 V49 V50 L51 L109	A23-L47 HydrophobicContact CB-CD2 4.3Å; L24-L47 HydrophobicContact CD2-CD1 4.28Å; I27-L47 HydrophobicContact CD1-CD1 3.13Å; I27-L47 HydrophobicContact CD1-CG 4.19Å; F43-L47 HydrophobicContact CE1-CD2 4.24Å; F43-L47 HydrophobicContact CZ-CD2 4.31Å; F43-L47 WeakPolarHBondContact O-CB 3.48Å; F43-L47 PolarHBondContact O-N 2.97Å; V44-L47 WeakPolarHBondContact O-CB 3.3Å; V44-L47 PolarHBondContact O-N 2.87Å; F45-L47 VanDerWaalsContact C-N 3.28Å; F45-L47 PolarHBondContact O-N 3.38Å; L47-V49 VanDerWaalsContact C-N 3.35Å; L47-V49 PolarHBondContact O-N 3.3Å; L47-V50 PolarHBondContact O-N 3.2Å; L47-L51 WeakPolarHBondContact O-CG 3.44Å; L47-L51 PolarHBondContact O-N 2.91Å; L47-L109 HydrophobicContact CD2-CD2 3.32Å; L47-L109 HydrophobicContact CD2-CG 4.44Å; L47-L109 HydrophobicContact CG-CD2 3.89Å
48	A	76.2	Confident	74.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-37.9	177.3	0	0	0	0	0	112.1	V44 F45 V50 L51 F52 I74	V44-A48 WeakPolarHBondContact O-CB 3.48Å; V44-A48 PolarHBondContact O-N 3.46Å; F45-A48 PolarHBondContact O-N 2.86Å; A48-V50 VanDerWaalsContact C-N 3.29Å; A48-V50 PolarHBondContact O-N 2.97Å; A48-L51 PolarHBondContact O-N 2.81Å; A48-L51 VanDerWaalsContact O-N 3.16Å; A48-F52 HydrophobicContact CB-CD2 4.21Å; A48-F52 WeakPolarHBondContact O-CD2 3.2Å; A48-F52 PolarHBondContact O-N 3.36Å; A48-I74 HydrophobicContact CB-CD1 3.58Å; A48-I74 HydrophobicContact CB-CG1 3.7Å; A48-I74 HydrophobicContact CB-CG2 3.98Å
49	V	74.6	Confident	75.2	Confident	19 Å²	19	36.7 Å²	36.7	12%	0.115	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-36.8	175.2	167.9	0	0	0	0	111.4	F45 D46 L47 L51 G53 I56 L57 L157	F45-V49 WeakPolarHBondContact O-CB 3.46Å; F45-V49 VanDerWaalsContact O-CG2 3.24Å; F45-V49 WeakPolarHBondContact O-CG2 3.13Å; F45-V49 PolarHBondContact O-N 3.46Å; D46-V49 PolarHBondContact O-N 3.26Å; L47-V49 VanDerWaalsContact C-N 3.35Å; L47-V49 PolarHBondContact O-N 3.3Å; V49-L51 VanDerWaalsContact C-N 3.31Å; V49-G53 WeakPolarHBondContact CA-O 3.3Å; V49-G53 CarbonylContact O-C 3.42Å; V49-G53 WeakPolarHBondContact O-CA 3.5Å; V49-G53 PolarHBondContact O-N 3.39Å; V49-I56 HydrophobicContact CG2-CG2 4.49Å; V49-L57 HydrophobicContact CG2-CD1 3.44Å; V49-L57 VanDerWaalsContact CG2-CD1 3.44Å; V49-L57 HydrophobicContact CG2-CG 3.92Å; V49-L157 HydrophobicContact CG1-CD2 3.78Å
50	V	70.7	Confident	74.8	Confident	58 Å²	58	48.7 Å²	48.7	35%	0.352	25%	0.248	S	C	.	.	H	α-helix	trans	-66.4	-34.4	174.9	173.7	0	0	0	0	111.7	I27 D46 L47 A48 L124	I27-V50 HydrophobicContact CG2-CG1 3.57Å; D46-V50 WeakPolarHBondContact O-CG2 3.37Å; D46-V50 PolarHBondContact O-N 3.09Å; D46-V50 VanDerWaalsContact O-N 3.09Å; L47-V50 PolarHBondContact O-N 3.2Å; A48-V50 VanDerWaalsContact C-N 3.29Å; A48-V50 PolarHBondContact O-N 2.97Å; V50-L124 HydrophobicContact CG1-CD2 4.06Å
51	L	71.7	Confident	74.2	Confident	16 Å²	16	48.5 Å²	48.5	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-84.5	-44.3	-176.9	-64.9	171.5	0	0	0	113.9	L47 A48 V49 L109 I113 L122	L47-L51 WeakPolarHBondContact O-CG 3.44Å; L47-L51 PolarHBondContact O-N 2.91Å; A48-L51 PolarHBondContact O-N 2.81Å; A48-L51 VanDerWaalsContact O-N 3.16Å; V49-L51 VanDerWaalsContact C-N 3.31Å; L51-L109 HydrophobicContact CD1-CD1 3.59Å; L51-L109 HydrophobicContact CD1-CD2 4.34Å; L51-L109 HydrophobicContact CD1-CG 3.89Å; L51-I113 HydrophobicContact CD1-CD1 4.03Å; L51-I113 HydrophobicContact CD1-CG1 3.74Å; L51-I113 HydrophobicContact CD2-CD1 4.41Å; L51-I113 HydrophobicContact CD2-CG1 3.64Å; L51-I113 HydrophobicContact CG-CG1 4.32Å; L51-L122 HydrophobicContact CD2-CD2 4.15Å
52	F	75.8	Confident	73.6	Confident	29 Å²	29	57.3 Å²	57.3	13%	0.127	29%	0.285	C	S	.	.	H	α-helix	trans	-108.1	-14.6	-170.9	-56.4	-67.2	0	0	0	113.5	A48 I56 I74 K77 L78 E81 F112	A48-F52 HydrophobicContact CB-CD2 4.21Å; A48-F52 WeakPolarHBondContact O-CD2 3.2Å; A48-F52 PolarHBondContact O-N 3.36Å; F52-I56 HydrophobicContact CB-CB 4.18Å; F52-I56 HydrophobicContact CB-CD1 3.55Å; F52-I56 HydrophobicContact CB-CG1 4.44Å; F52-I56 HydrophobicContact CB-CG2 4.39Å; F52-I56 HydrophobicContact CD1-CD1 4.47Å; F52-I56 HydrophobicContact CD2-CD1 3.27Å; F52-I56 HydrophobicContact CE2-CD1 4.04Å; F52-I56 HydrophobicContact CG-CD1 3.52Å; F52-I74 HydrophobicContact CE2-CG2 4.41Å; F52-K77 HydrophobicContact CB-CG 4.47Å; F52-K77 HydrophobicContact CD1-CG 3.74Å; F52-K77 HydrophobicContact CE1-CG 4.08Å; F52-K77 HydrophobicContact CG-CG 4.05Å; F52-L78 HydrophobicContact CZ-CB 4.28Å; F52-L78 HydrophobicContact CZ-CD1 3.88Å; F52-E81 HydrophobicContact CE1-CG 4.09Å; F52-F112 AromaticContact CE1-CE1 3.79Å; F52-F112 HydrophobicContact CE1-CE1 3.79Å; F52-F112 HydrophobicContact CE1-CZ 4.17Å; F52-F112 HydrophobicContact CZ-CD1 4.45Å; F52-F112 HydrophobicContact CZ-CE1 4.06Å
53	G	70.3	Confident	73.5	Confident	10 Å²	10	57.7 Å²	57.7	10%	0.103	29%	0.288	C	S	.	.			trans	99.1	169.6	-171.7	0	0	0	0	0	113.1	V49 D55 I56	V49-G53 WeakPolarHBondContact CA-O 3.3Å; V49-G53 CarbonylContact O-C 3.42Å; V49-G53 WeakPolarHBondContact O-CA 3.5Å; V49-G53 PolarHBondContact O-N 3.39Å; G53-D55 PolarHBondContact O-N 3.13Å; G53-I56 VanDerWaalsContact O-CG2 3.3Å; G53-I56 WeakPolarHBondContact O-CG2 3.33Å
54	S	73.1	Confident	73.2	Confident	58 Å²	58	62 Å²	62	41%	0.406	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-73.8	-11.4	-177.4	-62.5	0	0	0	0	114.2	I56	S54-I56 VanDerWaalsContact C-N 3.31Å
55	D	74.3	Confident	73.2	Confident	122 Å²	122	66.3 Å²	66.3	65%	0.652	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-77.1	-14.8	-178.8	56.2	-34.8	0	0	0	113.5	G53 L57	G53-D55 PolarHBondContact O-N 3.13Å; D55-L57 VanDerWaalsContact C-N 3.33Å; D55-L57 PolarHBondContact O-N 3.12Å
56	I	77.4	Confident	73.1	Confident	17 Å²	17	68.1 Å²	68.1	9%	0.087	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-70.9	-24.9	-179.9	-163.8	166.9	0	0	0	114.1	V49 F52 G53 S54 P58 A73 I74 K77	V49-I56 HydrophobicContact CG2-CG2 4.49Å; F52-I56 HydrophobicContact CB-CB 4.18Å; F52-I56 HydrophobicContact CB-CD1 3.55Å; F52-I56 HydrophobicContact CB-CG1 4.44Å; F52-I56 HydrophobicContact CB-CG2 4.39Å; F52-I56 HydrophobicContact CD1-CD1 4.47Å; F52-I56 HydrophobicContact CD2-CD1 3.27Å; F52-I56 HydrophobicContact CE2-CD1 4.04Å; F52-I56 HydrophobicContact CG-CD1 3.52Å; G53-I56 VanDerWaalsContact O-CG2 3.3Å; G53-I56 WeakPolarHBondContact O-CG2 3.33Å; S54-I56 VanDerWaalsContact C-N 3.31Å; I56-P58 WeakPolarHBondContact O-CD 3.33Å; I56-A73 WeakPolarHBondContact O-CB 3.43Å; I56-I74 HydrophobicContact CD1-CB 4.43Å; I56-I74 HydrophobicContact CD1-CG1 4.08Å; I56-I74 HydrophobicContact CG1-CG1 4.31Å; I56-K77 HydrophobicContact CD1-CB 3.51Å; I56-K77 HydrophobicContact CD1-CG 3.73Å; I56-K77 HydrophobicContact CG1-CB 4.19Å; I56-K77 HydrophobicContact CG1-CG 4.47Å
57	L	79.5	Confident	73.3	Confident	41 Å²	41	64.7 Å²	64.7	22%	0.215	33%	0.326	C	S	.	.			trans	-92.4	102.6	-175.6	-60.2	-179.8	0	0	0	110.2	F45 V49 D55 R59 N70 I74	F45-L57 HydrophobicContact CB-CD1 3.98Å; F45-L57 HydrophobicContact CB-CD2 4.23Å; F45-L57 HydrophobicContact CD1-CD2 4.17Å; F45-L57 HydrophobicContact CG-CD2 4.2Å; V49-L57 HydrophobicContact CG2-CD1 3.44Å; V49-L57 VanDerWaalsContact CG2-CD1 3.44Å; V49-L57 HydrophobicContact CG2-CG 3.92Å; D55-L57 VanDerWaalsContact C-N 3.33Å; D55-L57 PolarHBondContact O-N 3.12Å; L57-R59 PolarHBondContact O-N 3.07Å; L57-N70 HydrophobicContact CD2-CB 3.95Å; L57-I74 HydrophobicContact CD2-CD1 3.94Å; L57-I74 HydrophobicContact CD2-CG1 4.26Å
58	P	70.9	Confident	73.6	Confident	76 Å²	76	65.7 Å²	65.7	49%	0.494	33%	0.331	S	S	.	.	S	Bend	trans	-63.7	-25.9	180	25.9	-36.2	0	0	0	112.8	I56 E69 N70 A73	I56-P58 WeakPolarHBondContact O-CD 3.33Å; P58-E69 HydrophobicContact CG-CB 4.35Å; P58-N70 VanDerWaalsContact CD-OD1 3.23Å; P58-N70 WeakPolarHBondContact CD-OD1 3.42Å; P58-A73 HydrophobicContact CG-CB 4.1Å
59	R	75.1	Confident	74	Confident	123 Å²	123	69 Å²	69	46%	0.464	35%	0.346	S	S	.	.			trans	-129.4	137.4	-175.8	-58.7	-63.6	-172.4	174.5	1.7	111.8	L57 E66 E69 N70	L57-R59 PolarHBondContact O-N 3.07Å; R59-E66 HydrophobicContact CB-CB 3.78Å; R59-E66 HydrophobicContact CB-CG 4.07Å; R59-E66 HydrophobicContact CG-CB 4.19Å; R59-E66 HydrophobicContact CG-CG 4.17Å; R59-E69 HydrophobicContact CG-CB 4.42Å; R59-E69 WeakPolarHBondContact CG-OE2 3.49Å; R59-E69 IonicContact CZ-OE2 3.67Å; R59-E69 IonicContact NE-OE2 2.94Å; R59-E69 PolarHBondContact NE-OE2 3.23Å; R59-E69 IonicContact NH2-OE2 2.88Å; R59-N70 PolarHBondContact N-OD1 2.96Å; R59-N70 PolarHBondContact O-ND2 3.48Å; R59-N70 PolarHBondContact O-OD1 3.47Å; R59-N70 VanDerWaalsContact O-OD1 3.11Å
60	R	63.6	Low	74.5	Confident	251 Å²	251	68.2 Å²	68.2	95%	0.947	34%	0.342	S	S	*	.			trans	-94	-3.4	174.6	-72.9	-171.6	-179.4	-169.8	-0.8	114.3
61	G	61.4	Low	75.3	Confident	25 Å²	25	65.4 Å²	65.4	26%	0.258	33%	0.325	S	S	.	.			trans	-85.7	170	-172.7	0	0	0	0	0	112.9	E66	G61-E66 WeakPolarHBondContact CA-OE2 3.34Å
62	R	63.4	Low	76	Confident	189 Å²	189	69.1 Å²	69.1	71%	0.713	34%	0.342	S	S	*	.			trans	-108.3	11	-176.5	-65.3	-175.8	-175.2	-115.1	-1.9	111.9	E66	R62-E66 PolarHBondContact N-OE2 3.22Å; R62-E66 VanDerWaalsContact N-OE2 3.16Å
63	A	73.4	Confident	76.4	Confident	45 Å²	45	69 Å²	69	37%	0.372	35%	0.346	S	S	.	.	S	Bend	trans	-68.4	150	173	0	0	0	0	0	109.2	T65 E66 C67	A63-T65 VanDerWaalsContact C-N 3.29Å; A63-T65 PolarHBondContact O-N 2.84Å; A63-E66 HydrophobicContact CB-CB 4.36Å; A63-E66 HydrophobicContact CB-CG 4Å; A63-E66 WeakPolarHBondContact CB-OE2 3.47Å; A63-E66 PolarHBondContact N-OE2 3.37Å; A63-E66 PolarHBondContact O-N 3.1Å; A63-E66 VanDerWaalsContact O-N 3.1Å; A63-C67 PolarHBondContact O-N 2.77Å; A63-C67 PolarHBondContact O-SG 3.4Å
64	E	72.3	Confident	77.2	Confident	120 Å²	120	68.5 Å²	68.5	56%	0.561	34%	0.341	S	S	*	.	H	α-helix	trans	-56.1	-46.1	-179.3	-170.6	174.7	178.8	0	0	111.5	M1 E66 C67 I68 M95	M1-E64 HydrophobicContact CE-CB 3.9Å; M1-E64 HydrophobicContact CE-CG 4.38Å; E64-E66 VanDerWaalsContact C-N 3.32Å; E64-E66 PolarHBondContact O-N 3.49Å; E64-C67 PolarHBondContact O-N 3.29Å; E64-C67 VanDerWaalsContact O-N 3.16Å; E64-I68 HydrophobicContact CG-CD1 4.37Å; E64-I68 WeakPolarHBondContact O-CG1 3.41Å; E64-I68 PolarHBondContact O-N 2.97Å; E64-M95 HydrophobicContact CB-CE 4.34Å; E64-M95 HydrophobicContact CG-CE 3.8Å
65	T	78.4	Confident	77.8	Confident	91 Å²	91	66.4 Å²	66.4	56%	0.558	33%	0.325	S	S	*	.	H	α-helix	trans	-60.3	-38.9	176.5	55.7	0	0	0	0	113	A63 C67 I68 E69	A63-T65 VanDerWaalsContact C-N 3.29Å; A63-T65 PolarHBondContact O-N 2.84Å; T65-C67 VanDerWaalsContact C-N 3.34Å; T65-I68 PolarHBondContact O-N 2.9Å; T65-E69 WeakPolarHBondContact O-CG 3.17Å; T65-E69 PolarHBondContact O-N 2.84Å
66	E	80.3	Confident	78.3	Confident	56 Å²	56	65.7 Å²	65.7	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-71	-33.1	178.9	-66	170.8	141.7	0	0	111.7	R59 G61 R62 A63 E64 N70	R59-E66 HydrophobicContact CB-CB 3.78Å; R59-E66 HydrophobicContact CB-CG 4.07Å; R59-E66 HydrophobicContact CG-CB 4.19Å; R59-E66 HydrophobicContact CG-CG 4.17Å; G61-E66 WeakPolarHBondContact CA-OE2 3.34Å; R62-E66 PolarHBondContact N-OE2 3.22Å; R62-E66 VanDerWaalsContact N-OE2 3.16Å; A63-E66 HydrophobicContact CB-CB 4.36Å; A63-E66 HydrophobicContact CB-CG 4Å; A63-E66 WeakPolarHBondContact CB-OE2 3.47Å; A63-E66 PolarHBondContact N-OE2 3.37Å; A63-E66 PolarHBondContact O-N 3.1Å; A63-E66 VanDerWaalsContact O-N 3.1Å; E64-E66 VanDerWaalsContact C-N 3.32Å; E64-E66 PolarHBondContact O-N 3.49Å; E66-N70 WeakPolarHBondContact O-CB 3.31Å; E66-N70 VanDerWaalsContact O-CG 3.23Å; E66-N70 PolarHBondContact O-N 3.22Å; E66-N70 PolarHBondContact O-ND2 3.1Å
67	C	80.1	Confident	78.5	Confident	6 Å²	6	67.9 Å²	67.9	4%	0.041	33%	0.33	C	S	.	.	H	α-helix	trans	-73.8	-37.1	176.5	-60.8	0	0	0	0	111.2	F45 A63 E64 T65 N70 F71 M95	F45-C67 HydrophobicContact CE2-CB 4.17Å; F45-C67 HydrophobicContact CZ-CB 3.99Å; A63-C67 PolarHBondContact O-N 2.77Å; A63-C67 PolarHBondContact O-SG 3.4Å; E64-C67 PolarHBondContact O-N 3.29Å; E64-C67 VanDerWaalsContact O-N 3.16Å; T65-C67 VanDerWaalsContact C-N 3.34Å; C67-N70 WeakPolarHBondContact O-CB 3.42Å; C67-N70 PolarHBondContact O-N 3.36Å; C67-F71 WeakPolarHBondContact O-CD2 3.45Å; C67-F71 PolarHBondContact O-N 3.4Å; C67-M95 HydrophobicContact CB-CE 3.55Å; C67-M95 HydrophobicContact CB-CG 4.34Å; C67-M95 HydrophobicContact CB-SD 3.18Å; C67-M95 WeakPolarHBondContact CB-SD 3.2Å
68	I	83.7	Confident	78.7	Confident	28 Å²	28	66 Å²	66	14%	0.144	32%	0.32	C	S	.	.	H	α-helix	trans	-59.5	-50.8	171	-64.4	166.9	0	0	0	109.9	E64 T65 N70 F71 E72 P91 E92 M95	E64-I68 HydrophobicContact CG-CD1 4.37Å; E64-I68 WeakPolarHBondContact O-CG1 3.41Å; E64-I68 PolarHBondContact O-N 2.97Å; T65-I68 PolarHBondContact O-N 2.9Å; I68-N70 PolarHBondContact O-N 2.84Å; I68-F71 PolarHBondContact O-N 2.84Å; I68-E72 HydrophobicContact CG2-CG 4.45Å; I68-E72 PolarHBondContact O-N 2.78Å; I68-P91 HydrophobicContact CG2-CB 4.13Å; I68-E92 HydrophobicContact CD1-CG 4.2Å; I68-E92 HydrophobicContact CG2-CG 4.47Å; I68-M95 HydrophobicContact CG1-CB 4.17Å; I68-M95 HydrophobicContact CG1-CG 3.66Å
69	E	84.1	Confident	79.3	Confident	68 Å²	68	63.1 Å²	63.1	32%	0.318	30%	0.302	S	S	.	.	H	α-helix	trans	-56.5	-36.9	176.5	-74.9	177.9	-163	0	0	112.2	P58 R59 T65 A73	P58-E69 HydrophobicContact CG-CB 4.35Å; R59-E69 HydrophobicContact CG-CB 4.42Å; R59-E69 WeakPolarHBondContact CG-OE2 3.49Å; R59-E69 IonicContact CZ-OE2 3.67Å; R59-E69 IonicContact NE-OE2 2.94Å; R59-E69 PolarHBondContact NE-OE2 3.23Å; R59-E69 IonicContact NH2-OE2 2.88Å; T65-E69 WeakPolarHBondContact O-CG 3.17Å; T65-E69 PolarHBondContact O-N 2.84Å; E69-A73 PolarHBondContact O-N 2.85Å; E69-A73 VanDerWaalsContact O-N 3.09Å
70	N	85.4	Confident	79.7	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-69.9	-41.9	175.3	-75.9	-14.5	0	0	0	112.6	F45 L57 P58 R59 E66 C67 I68 A73 I74	F45-N70 HydrophobicContact CD1-CB 4.28Å; F45-N70 HydrophobicContact CE1-CB 3.68Å; F45-N70 HydrophobicContact CE2-CB 4.08Å; F45-N70 HydrophobicContact CZ-CB 3.57Å; L57-N70 HydrophobicContact CD2-CB 3.95Å; P58-N70 VanDerWaalsContact CD-OD1 3.23Å; P58-N70 WeakPolarHBondContact CD-OD1 3.42Å; R59-N70 PolarHBondContact N-OD1 2.96Å; R59-N70 PolarHBondContact O-ND2 3.48Å; R59-N70 PolarHBondContact O-OD1 3.47Å; R59-N70 VanDerWaalsContact O-OD1 3.11Å; E66-N70 WeakPolarHBondContact O-CB 3.31Å; E66-N70 VanDerWaalsContact O-CG 3.23Å; E66-N70 PolarHBondContact O-N 3.22Å; E66-N70 PolarHBondContact O-ND2 3.1Å; C67-N70 WeakPolarHBondContact O-CB 3.42Å; C67-N70 PolarHBondContact O-N 3.36Å; I68-N70 PolarHBondContact O-N 2.84Å; N70-A73 PolarHBondContact O-N 2.9Å; N70-I74 WeakPolarHBondContact O-CD1 3.27Å; N70-I74 WeakPolarHBondContact O-CG1 3.41Å; N70-I74 PolarHBondContact O-N 2.93Å; N70-I74 VanDerWaalsContact O-N 3.07Å
71	F	86.9	Confident	80.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-42.4	174.4	-83.3	-67.1	0	0	0	111.7	P41 V44 F45 C67 I68 A73 I74 V75 P91 L94 M95	P41-F71 HydrophobicContact CB-CE2 3.87Å; P41-F71 HydrophobicContact CB-CZ 3.99Å; P41-F71 HydrophobicContact CG-CE2 4.29Å; P41-F71 HydrophobicContact CG-CZ 4.45Å; V44-F71 HydrophobicContact CB-CE1 4.07Å; V44-F71 HydrophobicContact CB-CZ 4.41Å; V44-F71 HydrophobicContact CG1-CD1 4.45Å; V44-F71 HydrophobicContact CG1-CE1 3.7Å; V44-F71 HydrophobicContact CG2-CE1 4.45Å; F45-F71 HydrophobicContact CE1-CD1 4Å; F45-F71 AromaticContact CE1-CD2 3.79Å; F45-F71 HydrophobicContact CE1-CD2 3.79Å; F45-F71 HydrophobicContact CE1-CE1 4.02Å; F45-F71 AromaticContact CE1-CE2 3.81Å; F45-F71 HydrophobicContact CE1-CE2 3.81Å; F45-F71 AromaticContact CE1-CG 3.9Å; F45-F71 HydrophobicContact CE1-CG 3.9Å; F45-F71 AromaticContact CE1-CZ 3.93Å; F45-F71 HydrophobicContact CE1-CZ 3.93Å; F45-F71 AromaticContact CZ-CD2 3.84Å; F45-F71 HydrophobicContact CZ-CD2 3.84Å; F45-F71 AromaticContact CZ-CE2 3.79Å; F45-F71 HydrophobicContact CZ-CE2 3.79Å; F45-F71 HydrophobicContact CZ-CG 4.39Å; F45-F71 HydrophobicContact CZ-CZ 4.29Å; C67-F71 WeakPolarHBondContact O-CD2 3.45Å; C67-F71 PolarHBondContact O-N 3.4Å; I68-F71 PolarHBondContact O-N 2.84Å; F71-A73 VanDerWaalsContact C-N 3.32Å; F71-A73 PolarHBondContact O-N 3.04Å; F71-I74 PolarHBondContact O-N 3.25Å; F71-I74 VanDerWaalsContact O-N 3.15Å; F71-V75 WeakPolarHBondContact O-CG2 3.48Å; F71-V75 PolarHBondContact O-N 3.3Å; F71-P91 HydrophobicContact CB-CB 3.87Å; F71-L94 HydrophobicContact CB-CD1 4.48Å; F71-L94 HydrophobicContact CD1-CB 4.03Å; F71-L94 HydrophobicContact CD1-CD1 3.64Å; F71-L94 HydrophobicContact CD1-CG 4.49Å; F71-L94 HydrophobicContact CD2-CB 4.43Å; F71-L94 HydrophobicContact CE1-CB 4.04Å; F71-L94 HydrophobicContact CE1-CD1 4.1Å; F71-L94 HydrophobicContact CE2-CB 4.45Å; F71-L94 HydrophobicContact CG-CB 4.22Å; F71-L94 HydrophobicContact CG-CD1 4.26Å; F71-L94 HydrophobicContact CZ-CB 4.26Å; F71-M95 HydrophobicContact CD2-CG 3.58Å; F71-M95 HydrophobicContact CD2-SD 3.83Å; F71-M95 HydrophobicContact CE2-CG 3.77Å; F71-M95 HydrophobicContact CE2-SD 3.56Å; F71-M95 VanDerWaalsContact CE2-SD 3.56Å
72	E	86.8	Confident	81	Confident	94 Å²	94	57.2 Å²	57.2	44%	0.439	29%	0.285	S	S	.	.	H	α-helix	trans	-53.2	-49.1	172.7	-80.4	176.7	179	0	0	111.3	I68 I74 V75 L76 P91	I68-E72 HydrophobicContact CG2-CG 4.45Å; I68-E72 PolarHBondContact O-N 2.78Å; E72-I74 VanDerWaalsContact C-N 3.32Å; E72-I74 PolarHBondContact O-N 3.01Å; E72-V75 PolarHBondContact O-N 2.97Å; E72-L76 VanDerWaalsContact O-CB 3.27Å; E72-L76 WeakPolarHBondContact O-CB 3.48Å; E72-L76 PolarHBondContact O-N 3.43Å; E72-P91 HydrophobicContact CB-CG 4.34Å; E72-P91 HydrophobicContact CG-CB 3.87Å; E72-P91 HydrophobicContact CG-CG 3.55Å
73	A	85.3	Confident	81.5	Confident	26 Å²	26	51.4 Å²	51.4	22%	0.215	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-37.9	178.9	0	0	0	0	0	112.5	I56 P58 E69 N70 F71 K77	I56-A73 WeakPolarHBondContact O-CB 3.43Å; P58-A73 HydrophobicContact CG-CB 4.1Å; E69-A73 PolarHBondContact O-N 2.85Å; E69-A73 VanDerWaalsContact O-N 3.09Å; N70-A73 PolarHBondContact O-N 2.9Å; F71-A73 VanDerWaalsContact C-N 3.32Å; F71-A73 PolarHBondContact O-N 3.04Å; A73-K77 WeakPolarHBondContact O-CB 3.18Å; A73-K77 PolarHBondContact O-N 2.86Å
74	I	85.5	Confident	81.6	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-68.1	-46.6	177.2	-63.8	162.8	0	0	0	111.5	F45 A48 F52 I56 L57 N70 F71 E72 K77 L78 F105	F45-I74 HydrophobicContact CD1-CD1 3.5Å; F45-I74 VanDerWaalsContact CD1-CD1 3.5Å; F45-I74 HydrophobicContact CE1-CD1 3.93Å; A48-I74 HydrophobicContact CB-CD1 3.58Å; A48-I74 HydrophobicContact CB-CG1 3.7Å; A48-I74 HydrophobicContact CB-CG2 3.98Å; F52-I74 HydrophobicContact CE2-CG2 4.41Å; I56-I74 HydrophobicContact CD1-CB 4.43Å; I56-I74 HydrophobicContact CD1-CG1 4.08Å; I56-I74 HydrophobicContact CG1-CG1 4.31Å; L57-I74 HydrophobicContact CD2-CD1 3.94Å; L57-I74 HydrophobicContact CD2-CG1 4.26Å; N70-I74 WeakPolarHBondContact O-CD1 3.27Å; N70-I74 WeakPolarHBondContact O-CG1 3.41Å; N70-I74 PolarHBondContact O-N 2.93Å; N70-I74 VanDerWaalsContact O-N 3.07Å; F71-I74 PolarHBondContact O-N 3.25Å; F71-I74 VanDerWaalsContact O-N 3.15Å; E72-I74 VanDerWaalsContact C-N 3.32Å; E72-I74 PolarHBondContact O-N 3.01Å; I74-K77 PolarHBondContact O-N 3.33Å; I74-L78 VanDerWaalsContact O-CB 3.29Å; I74-L78 WeakPolarHBondContact O-CB 3.37Å; I74-L78 PolarHBondContact O-N 2.77Å; I74-F105 HydrophobicContact CG2-CE2 4.08Å; I74-F105 HydrophobicContact CG2-CZ 3.72Å
75	V	86.4	Confident	81.9	Confident	13 Å²	13	53.1 Å²	53.1	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-43.4	179.2	173.9	0	0	0	0	110.5	F71 E72 K77 L78 S79 L86 I89 L94 F105	F71-V75 WeakPolarHBondContact O-CG2 3.48Å; F71-V75 PolarHBondContact O-N 3.3Å; E72-V75 PolarHBondContact O-N 2.97Å; V75-K77 PolarHBondContact O-N 3.06Å; V75-L78 PolarHBondContact O-N 2.8Å; V75-S79 VanDerWaalsContact O-CB 3.28Å; V75-S79 WeakPolarHBondContact O-CB 3.31Å; V75-S79 PolarHBondContact O-N 2.97Å; V75-L86 HydrophobicContact CG1-CB 3.83Å; V75-L86 HydrophobicContact CG1-CD1 4.22Å; V75-I89 HydrophobicContact CG2-CG2 4.18Å; V75-L94 HydrophobicContact CG2-CD1 4.18Å; V75-F105 HydrophobicContact CG2-CD2 4.33Å; V75-F105 HydrophobicContact CG2-CE2 4.09Å
76	L	85.1	Confident	82	Confident	108 Å²	108	49.2 Å²	49.2	57%	0.565	27%	0.269	S	S	*	.	H	α-helix	trans	-60.7	-46.7	176.4	-173.7	71	0	0	0	111.1	E72 L78 S79 E80	E72-L76 VanDerWaalsContact O-CB 3.27Å; E72-L76 WeakPolarHBondContact O-CB 3.48Å; E72-L76 PolarHBondContact O-N 3.43Å; L76-L78 PolarHBondContact O-N 3.5Å; L76-S79 WeakPolarHBondContact O-CB 3.46Å; L76-S79 PolarHBondContact O-N 2.87Å; L76-E80 WeakPolarHBondContact O-CG 3.2Å; L76-E80 PolarHBondContact O-N 3.24Å
77	K	81.4	Confident	81.9	Confident	63 Å²	63	53.3 Å²	53.3	27%	0.274	29%	0.293	S	S	.	.	H	α-helix	trans	-64.6	-42.6	178.8	-167.1	73.5	-159.3	129.5	0	111.9	F52 I56 A73 I74 V75 S79 E80 E81	F52-K77 HydrophobicContact CB-CG 4.47Å; F52-K77 HydrophobicContact CD1-CG 3.74Å; F52-K77 HydrophobicContact CE1-CG 4.08Å; F52-K77 HydrophobicContact CG-CG 4.05Å; I56-K77 HydrophobicContact CD1-CB 3.51Å; I56-K77 HydrophobicContact CD1-CG 3.73Å; I56-K77 HydrophobicContact CG1-CB 4.19Å; I56-K77 HydrophobicContact CG1-CG 4.47Å; A73-K77 WeakPolarHBondContact O-CB 3.18Å; A73-K77 PolarHBondContact O-N 2.86Å; I74-K77 PolarHBondContact O-N 3.33Å; V75-K77 PolarHBondContact O-N 3.06Å; K77-S79 VanDerWaalsContact C-N 3.31Å; K77-S79 PolarHBondContact O-N 3.36Å; K77-E80 IonicContact NZ-OE2 3.19Å; K77-E80 PolarHBondContact NZ-OE2 2.63Å; K77-E80 WeakPolarHBondContact O-CB 3.45Å; K77-E80 PolarHBondContact O-N 3.45Å; K77-E81 VanDerWaalsContact CE-OE1 3.26Å; K77-E81 WeakPolarHBondContact CE-OE1 3.34Å; K77-E81 IonicContact NZ-OE1 3.04Å; K77-E81 PolarHBondContact NZ-OE1 3.45Å; K77-E81 WeakPolarHBondContact O-CG 3.47Å; K77-E81 PolarHBondContact O-N 2.82Å
78	L	84	Confident	81.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.5	-39.4	177.2	-172.4	67.9	0	0	0	111.2	F52 I74 V75 L76 E81 I82 L86 F105 L108 L109 F112	F52-L78 HydrophobicContact CZ-CB 4.28Å; F52-L78 HydrophobicContact CZ-CD1 3.88Å; I74-L78 VanDerWaalsContact O-CB 3.29Å; I74-L78 WeakPolarHBondContact O-CB 3.37Å; I74-L78 PolarHBondContact O-N 2.77Å; V75-L78 PolarHBondContact O-N 2.8Å; L76-L78 PolarHBondContact O-N 3.5Å; L78-E81 PolarHBondContact O-N 3.11Å; L78-I82 HydrophobicContact CD1-CD1 3.79Å; L78-I82 HydrophobicContact CD1-CG1 4.34Å; L78-I82 HydrophobicContact CD2-CD1 4.47Å; L78-I82 HydrophobicContact CG-CD1 3.73Å; L78-I82 HydrophobicContact CG-CG1 4.48Å; L78-I82 WeakPolarHBondContact O-CB 3.29Å; L78-I82 VanDerWaalsContact O-CG1 3.24Å; L78-I82 WeakPolarHBondContact O-CG1 3.49Å; L78-I82 PolarHBondContact O-N 3Å; L78-L86 HydrophobicContact CB-CD1 4.12Å; L78-L86 HydrophobicContact CD2-CD1 3.94Å; L78-L86 HydrophobicContact CG-CD1 4.02Å; L78-F105 HydrophobicContact CD2-CE2 4.3Å; L78-L108 HydrophobicContact CD2-CD2 3.52Å; L78-L108 HydrophobicContact CD2-CG 3.92Å; L78-L108 HydrophobicContact CG-CD2 4.25Å; L78-L109 HydrophobicContact CD1-CD1 4.27Å; L78-L109 HydrophobicContact CD2-CD1 4.49Å; L78-F112 HydrophobicContact CD1-CB 4.01Å; L78-F112 HydrophobicContact CD1-CD1 3.99Å; L78-F112 HydrophobicContact CD1-CD2 4.19Å; L78-F112 HydrophobicContact CD1-CG 3.79Å
79	S	84	Confident	81.6	Confident	17 Å²	17	57.6 Å²	57.6	12%	0.119	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-43.8	174.3	-179.8	0	0	0	0	112	V75 L76 K77 E81 G83 V84	V75-S79 VanDerWaalsContact O-CB 3.28Å; V75-S79 WeakPolarHBondContact O-CB 3.31Å; V75-S79 PolarHBondContact O-N 2.97Å; L76-S79 WeakPolarHBondContact O-CB 3.46Å; L76-S79 PolarHBondContact O-N 2.87Å; K77-S79 VanDerWaalsContact C-N 3.31Å; K77-S79 PolarHBondContact O-N 3.36Å; S79-E81 PolarHBondContact O-N 2.88Å; S79-G83 WeakPolarHBondContact O-CA 3.32Å; S79-G83 PolarHBondContact O-N 3.48Å; S79-V84 WeakPolarHBondContact CA-O 3.41Å; S79-V84 WeakPolarHBondContact CB-O 3.47Å; S79-V84 PolarHBondContact O-N 3.25Å; S79-V84 PolarHBondContact OG-O 3.4Å
80	E	81.9	Confident	81.6	Confident	118 Å²	118	56.9 Å²	56.9	55%	0.551	31%	0.312	S	S	*	.	H	α-helix	trans	-60.6	-43.1	174.7	-73.9	177.1	177.3	0	0	112.9	L76 K77	L76-E80 WeakPolarHBondContact O-CG 3.2Å; L76-E80 PolarHBondContact O-N 3.24Å; K77-E80 IonicContact NZ-OE2 3.19Å; K77-E80 PolarHBondContact NZ-OE2 2.63Å; K77-E80 WeakPolarHBondContact O-CB 3.45Å; K77-E80 PolarHBondContact O-N 3.45Å
81	E	75	Confident	81.5	Confident	96 Å²	96	57.5 Å²	57.5	45%	0.449	32%	0.316	S	S	.	.	H	α-helix	trans	-76	-32.4	-177.3	-64.2	-63.3	149.7	0	0	112.8	F52 K77 L78 S79 F112	F52-E81 HydrophobicContact CE1-CG 4.09Å; K77-E81 VanDerWaalsContact CE-OE1 3.26Å; K77-E81 WeakPolarHBondContact CE-OE1 3.34Å; K77-E81 IonicContact NZ-OE1 3.04Å; K77-E81 PolarHBondContact NZ-OE1 3.45Å; K77-E81 WeakPolarHBondContact O-CG 3.47Å; K77-E81 PolarHBondContact O-N 2.82Å; L78-E81 PolarHBondContact O-N 3.11Å; S79-E81 PolarHBondContact O-N 2.88Å; E81-F112 HydrophobicContact CB-CE2 3.7Å; E81-F112 HydrophobicContact CB-CZ 3.7Å; E81-F112 HydrophobicContact CG-CZ 4.21Å
82	I	77.8	Confident	81.3	Confident	60 Å²	60	61.6 Å²	61.6	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-82.8	-26.7	176.6	-62.4	175	0	0	0	111.2	L78 V84 L108 F112	L78-I82 HydrophobicContact CD1-CD1 3.79Å; L78-I82 HydrophobicContact CD1-CG1 4.34Å; L78-I82 HydrophobicContact CD2-CD1 4.47Å; L78-I82 HydrophobicContact CG-CD1 3.73Å; L78-I82 HydrophobicContact CG-CG1 4.48Å; L78-I82 WeakPolarHBondContact O-CB 3.29Å; L78-I82 VanDerWaalsContact O-CG1 3.24Å; L78-I82 WeakPolarHBondContact O-CG1 3.49Å; L78-I82 PolarHBondContact O-N 3Å; I82-V84 HydrophobicContact CG2-CB 4.01Å; I82-V84 HydrophobicContact CG2-CG2 3.86Å; I82-L108 HydrophobicContact CD1-CD1 3.76Å; I82-L108 HydrophobicContact CD1-CD2 4.16Å; I82-L108 HydrophobicContact CD1-CG 3.87Å; I82-F112 HydrophobicContact CD1-CD2 4.27Å; I82-F112 HydrophobicContact CG1-CD2 3.76Å; I82-F112 HydrophobicContact CG1-CE2 4.22Å
83	G	73.4	Confident	81.1	Confident	68 Å²	68	60.2 Å²	60.2	70%	0.701	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	27.2	-173.6	0	0	0	0	0	113.4	S79	S79-G83 WeakPolarHBondContact O-CA 3.32Å; S79-G83 PolarHBondContact O-N 3.48Å
84	V	75.2	Confident	80.9	Confident	78 Å²	78	59 Å²	59	47%	0.473	32%	0.321	S	S	.	.	S	Bend	trans	-130.8	131.1	-179.8	176.1	0	0	0	0	109.2	S79 I82 L86	S79-V84 WeakPolarHBondContact CA-O 3.41Å; S79-V84 WeakPolarHBondContact CB-O 3.47Å; S79-V84 PolarHBondContact O-N 3.25Å; S79-V84 PolarHBondContact OG-O 3.4Å; I82-V84 HydrophobicContact CG2-CB 4.01Å; I82-V84 HydrophobicContact CG2-CG2 3.86Å; V84-L86 PolarHBondContact O-N 3.25Å
85	D	78.7	Confident	80.6	Confident	123 Å²	123	59.8 Å²	59.8	66%	0.658	33%	0.325	S	S	*	.			trans	-67.8	122.1	175	-65.5	-30.6	0	0	0	110.3	D87	D85-D87 VanDerWaalsContact C-N 3.31Å; D85-D87 PolarHBondContact O-N 3.49Å
86	L	81.7	Confident	79.9	Confident	9 Å²	9	62.9 Å²	62.9	5%	0.047	34%	0.343	C	S	.	.			trans	-96.9	38.6	-176	-60.8	178.7	0	0	0	112.2	V75 L78 V84 H88 I89 L108	V75-L86 HydrophobicContact CG1-CB 3.83Å; V75-L86 HydrophobicContact CG1-CD1 4.22Å; L78-L86 HydrophobicContact CB-CD1 4.12Å; L78-L86 HydrophobicContact CD2-CD1 3.94Å; L78-L86 HydrophobicContact CG-CD1 4.02Å; V84-L86 PolarHBondContact O-N 3.25Å; L86-H88 PolarHBondContact O-N 3.12Å; L86-I89 PolarHBondContact O-N 2.87Å; L86-L108 HydrophobicContact CD1-CD2 3.49Å; L86-L108 VanDerWaalsContact CD1-CD2 3.49Å; L86-L108 HydrophobicContact CD2-CD2 3.48Å; L86-L108 VanDerWaalsContact CD2-CD2 3.48Å; L86-L108 HydrophobicContact CG-CD2 4.13Å
87	D	77.4	Confident	79.1	Confident	141 Å²	141	57.9 Å²	57.9	75%	0.754	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-17	-176	-65.4	-13.5	0	0	0	114.5	D85	D85-D87 VanDerWaalsContact C-N 3.31Å; D85-D87 PolarHBondContact O-N 3.49Å
88	H	77.1	Confident	78.7	Confident	119 Å²	119	57.6 Å²	57.6	55%	0.551	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-12.8	179	62.9	-76.4	0	0	0	113.6	L86	L86-H88 PolarHBondContact O-N 3.12Å
89	I	81.1	Confident	77.9	Confident	5 Å²	5	60.5 Å²	60.5	3%	0.026	34%	0.336	C	S	.	.	S	Bend	trans	-103.9	98.5	177.9	-56.9	179.4	0	0	0	108.1	V75 L86 P91 L94 F105 L108	V75-I89 HydrophobicContact CG2-CG2 4.18Å; L86-I89 PolarHBondContact O-N 2.87Å; I89-P91 WeakPolarHBondContact O-CD 3.45Å; I89-L94 HydrophobicContact CG2-CD1 3.64Å; I89-L94 HydrophobicContact CG2-CD2 4.16Å; I89-L94 HydrophobicContact CG2-CG 3.93Å; I89-F105 HydrophobicContact CD1-CB 4.27Å; I89-F105 HydrophobicContact CD1-CD2 4.36Å; I89-F105 HydrophobicContact CG2-CB 4.27Å; I89-F105 HydrophobicContact CG2-CD2 4.15Å; I89-L108 HydrophobicContact CD1-CD2 4.02Å
90	V	84.3	Confident	77.4	Confident	53 Å²	53	65.3 Å²	65.3	32%	0.321	35%	0.352	S	S	.	.			trans	-84.3	124.3	-179.9	-178.1	0	0	0	0	109.6	E92 D93 L94	V90-E92 VanDerWaalsContact C-N 3.26Å; V90-E92 HydrophobicContact CG1-CB 4.07Å; V90-E92 WeakPolarHBondContact CG1-OE2 3Å; V90-E92 PolarHBondContact O-N 3.1Å; V90-D93 HydrophobicContact CB-CB 4.06Å; V90-D93 WeakPolarHBondContact O-CB 3.32Å; V90-D93 PolarHBondContact O-N 3.28Å; V90-L94 PolarHBondContact O-N 3.5Å
91	P	83.1	Confident	77.2	Confident	17 Å²	17	59.9 Å²	59.9	11%	0.11	33%	0.327	C	S	.	.	H	α-helix	trans	-58.5	-33.3	179.8	-30.1	39.8	0	0	0	114.3	I68 F71 E72 I89 L94 M95	I68-P91 HydrophobicContact CG2-CB 4.13Å; F71-P91 HydrophobicContact CB-CB 3.87Å; E72-P91 HydrophobicContact CB-CG 4.34Å; E72-P91 HydrophobicContact CG-CB 3.87Å; E72-P91 HydrophobicContact CG-CG 3.55Å; I89-P91 WeakPolarHBondContact O-CD 3.45Å; P91-L94 PolarHBondContact O-N 2.68Å; P91-M95 WeakPolarHBondContact O-CB 3.49Å; P91-M95 PolarHBondContact O-N 2.82Å
92	E	82.8	Confident	77.4	Confident	85 Å²	85	55.3 Å²	55.3	40%	0.397	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-42.7	172.9	-67.4	81.6	174.7	0	0	111.6	I68 V90 L94 M95 V96	I68-E92 HydrophobicContact CD1-CG 4.2Å; I68-E92 HydrophobicContact CG2-CG 4.47Å; V90-E92 VanDerWaalsContact C-N 3.26Å; V90-E92 HydrophobicContact CG1-CB 4.07Å; V90-E92 WeakPolarHBondContact CG1-OE2 3Å; V90-E92 PolarHBondContact O-N 3.1Å; E92-L94 VanDerWaalsContact C-N 3.34Å; E92-M95 WeakPolarHBondContact O-CB 3.26Å; E92-M95 PolarHBondContact O-N 3.42Å; E92-M95 VanDerWaalsContact O-N 3.1Å; E92-V96 WeakPolarHBondContact O-CG2 3.38Å; E92-V96 PolarHBondContact O-N 3.25Å
93	D	82.2	Confident	77.3	Confident	66 Å²	66	54 Å²	54	35%	0.353	30%	0.302	S	S	.	.	H	α-helix	trans	-64.3	-42	176.1	-71.6	-16.4	0	0	0	110	V90 M95 G97 E98 A101	V90-D93 HydrophobicContact CB-CB 4.06Å; V90-D93 WeakPolarHBondContact O-CB 3.32Å; V90-D93 PolarHBondContact O-N 3.28Å; D93-M95 VanDerWaalsContact C-N 3.25Å; D93-M95 PolarHBondContact O-N 2.83Å; D93-G97 CarbonylContact O-C 3.56Å; D93-G97 VanDerWaalsContact O-CA 3.25Å; D93-G97 WeakPolarHBondContact O-CA 3.5Å; D93-G97 PolarHBondContact O-N 3.39Å; D93-G97 VanDerWaalsContact O-N 3.08Å; D93-E98 HydrophobicContact CB-CB 3.72Å; D93-E98 PolarHBondContact O-N 3.27Å; D93-A101 HydrophobicContact CB-CB 4.01Å
94	L	81	Confident	77.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-35.9	172.3	-68.1	178.8	0	0	0	112.6	F3 F71 V75 I89 V90 P91 E92 G97 A101 F105	F3-L94 WeakPolarHBondContact CE1-O 3.49Å; F71-L94 HydrophobicContact CB-CD1 4.48Å; F71-L94 HydrophobicContact CD1-CB 4.03Å; F71-L94 HydrophobicContact CD1-CD1 3.64Å; F71-L94 HydrophobicContact CD1-CG 4.49Å; F71-L94 HydrophobicContact CD2-CB 4.43Å; F71-L94 HydrophobicContact CE1-CB 4.04Å; F71-L94 HydrophobicContact CE1-CD1 4.1Å; F71-L94 HydrophobicContact CE2-CB 4.45Å; F71-L94 HydrophobicContact CG-CB 4.22Å; F71-L94 HydrophobicContact CG-CD1 4.26Å; F71-L94 HydrophobicContact CZ-CB 4.26Å; V75-L94 HydrophobicContact CG2-CD1 4.18Å; I89-L94 HydrophobicContact CG2-CD1 3.64Å; I89-L94 HydrophobicContact CG2-CD2 4.16Å; I89-L94 HydrophobicContact CG2-CG 3.93Å; V90-L94 PolarHBondContact O-N 3.5Å; P91-L94 PolarHBondContact O-N 2.68Å; E92-L94 VanDerWaalsContact C-N 3.34Å; L94-G97 PolarHBondContact O-N 3.31Å; L94-G97 VanDerWaalsContact O-N 3.16Å; L94-A101 HydrophobicContact CD2-CB 4.17Å; L94-A101 WeakPolarHBondContact CD2-O 3.44Å; L94-F105 HydrophobicContact CD1-CB 4.47Å; L94-F105 HydrophobicContact CD1-CD2 3.91Å; L94-F105 HydrophobicContact CD1-CE2 4.35Å; L94-F105 HydrophobicContact CD1-CG 4.07Å; L94-F105 HydrophobicContact CD2-CB 3.71Å; L94-F105 HydrophobicContact CD2-CG 4.04Å
95	M	78.9	Confident	77.9	Confident	17 Å²	17	50.1 Å²	50.1	8%	0.084	26%	0.263	C	S	.	.	H	α-helix	trans	-74	-42.4	-177.9	-93.7	-65.3	-62.8	0	0	114.5	M1 F3 P41 E64 C67 I68 F71 P91 E92 D93 G97	M1-M95 HydrophobicContact CE-CE 3.98Å; M1-M95 HydrophobicContact SD-CE 3.92Å; F3-M95 WeakPolarHBondContact CD1-O 3.13Å; P41-M95 HydrophobicContact CB-SD 4.49Å; P41-M95 HydrophobicContact CG-SD 4.26Å; E64-M95 HydrophobicContact CB-CE 4.34Å; E64-M95 HydrophobicContact CG-CE 3.8Å; C67-M95 HydrophobicContact CB-CE 3.55Å; C67-M95 HydrophobicContact CB-CG 4.34Å; C67-M95 HydrophobicContact CB-SD 3.18Å; C67-M95 WeakPolarHBondContact CB-SD 3.2Å; I68-M95 HydrophobicContact CG1-CB 4.17Å; I68-M95 HydrophobicContact CG1-CG 3.66Å; F71-M95 HydrophobicContact CD2-CG 3.58Å; F71-M95 HydrophobicContact CD2-SD 3.83Å; F71-M95 HydrophobicContact CE2-CG 3.77Å; F71-M95 HydrophobicContact CE2-SD 3.56Å; F71-M95 VanDerWaalsContact CE2-SD 3.56Å; P91-M95 WeakPolarHBondContact O-CB 3.49Å; P91-M95 PolarHBondContact O-N 2.82Å; E92-M95 WeakPolarHBondContact O-CB 3.26Å; E92-M95 PolarHBondContact O-N 3.42Å; E92-M95 VanDerWaalsContact O-N 3.1Å; D93-M95 VanDerWaalsContact C-N 3.25Å; D93-M95 PolarHBondContact O-N 2.83Å; M95-G97 PolarHBondContact O-N 3.24Å
96	V	72.4	Confident	78	Confident	78 Å²	78	44.3 Å²	44.3	47%	0.473	23%	0.231	S	C	.	.	H	α-helix	trans	-61.1	-24.1	168.6	-179.8	0	0	0	0	109.6	E92	E92-V96 WeakPolarHBondContact O-CG2 3.38Å; E92-V96 PolarHBondContact O-N 3.25Å
97	G	68.3	Low	77.9	Confident	2 Å²	2	47.2 Å²	47.2	2%	0.021	25%	0.25	C	C	.	.			trans	66.5	122.5	-146.8	0	0	0	0	0	105.7	F3 W5 D93 L94 M95	F3-G97 VanDerWaalsContact CD1-N 3.33Å; W5-G97 WeakPolarHBondContact CH2-O 3.15Å; W5-G97 VanDerWaalsContact CZ2-CA 3.41Å; W5-G97 WeakPolarHBondContact CZ3-O 2.87Å; D93-G97 CarbonylContact O-C 3.56Å; D93-G97 VanDerWaalsContact O-CA 3.25Å; D93-G97 WeakPolarHBondContact O-CA 3.5Å; D93-G97 PolarHBondContact O-N 3.39Å; D93-G97 VanDerWaalsContact O-N 3.08Å; L94-G97 PolarHBondContact O-N 3.31Å; L94-G97 VanDerWaalsContact O-N 3.16Å; M95-G97 PolarHBondContact O-N 3.24Å
98	E	72.5	Confident	78	Confident	57 Å²	57	42.4 Å²	42.4	27%	0.266	22%	0.224	S	C	.	.			trans	-117.7	120.4	156.9	-161.5	-87.5	155.1	0	0	105.7	W5 D93 R100 A101 L102	W5-E98 WeakPolarHBondContact CH2-O 3.27Å; W5-E98 HydrophobicContact CZ3-CB 4.45Å; D93-E98 HydrophobicContact CB-CB 3.72Å; D93-E98 PolarHBondContact O-N 3.27Å; E98-R100 PolarHBondContact O-N 2.87Å; E98-R100 VanDerWaalsContact O-N 3.09Å; E98-R100 WeakPolarHBondContact OE2-CB 3.3Å; E98-A101 HydrophobicContact CB-CB 3.86Å; E98-A101 PolarHBondContact O-N 3.49Å; E98-A101 WeakPolarHBondContact OE2-CB 3.48Å; E98-A101 PolarHBondContact OE2-N 3.43Å; E98-L102 PolarHBondContact O-N 3.25Å
99	P	66.5	Low	78.2	Confident	62 Å²	62	36.8 Å²	36.8	40%	0.403	20%	0.197	S	C	.	.	H	α-helix	trans	-70.4	-26.6	-151.5	-12.9	29.3	0	0	0	110	W5 S103	W5-P99 HydrophobicContact CE3-CG 3.97Å; W5-P99 HydrophobicContact CH2-CB 3.82Å; W5-P99 HydrophobicContact CH2-CG 3.65Å; W5-P99 HydrophobicContact CZ2-CB 4.43Å; W5-P99 HydrophobicContact CZ2-CG 4.42Å; W5-P99 HydrophobicContact CZ3-CB 3.98Å; W5-P99 HydrophobicContact CZ3-CG 3.25Å; P99-S103 WeakPolarHBondContact O-CB 3.39Å; P99-S103 PolarHBondContact O-N 2.96Å
100	R	73.3	Confident	77.8	Confident	117 Å²	117	37.1 Å²	37.1	44%	0.442	20%	0.201	S	C	.	.	H	α-helix	trans	-71.6	-51.1	172.1	-171.3	173.8	-176.4	-179.5	-2.8	110.9	E98 L102 S103 D104 N254	E98-R100 PolarHBondContact O-N 2.87Å; E98-R100 VanDerWaalsContact O-N 3.09Å; E98-R100 WeakPolarHBondContact OE2-CB 3.3Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 3.09Å; R100-S103 WeakPolarHBondContact O-CB 3.23Å; R100-S103 PolarHBondContact O-N 3.48Å; R100-S103 VanDerWaalsContact O-N 3.16Å; R100-D104 WeakPolarHBondContact O-CB 3.4Å; R100-D104 PolarHBondContact O-N 3.04Å; R100-N254 PolarHBondContact NH1-OD1 3.3Å
101	A	78.1	Confident	77.2	Confident	5 Å²	5	37.2 Å²	37.2	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-57.2	-44.1	174.8	0	0	0	0	0	112.4	D93 L94 E98 F105	D93-A101 HydrophobicContact CB-CB 4.01Å; L94-A101 HydrophobicContact CD2-CB 4.17Å; L94-A101 WeakPolarHBondContact CD2-O 3.44Å; E98-A101 HydrophobicContact CB-CB 3.86Å; E98-A101 PolarHBondContact O-N 3.49Å; E98-A101 WeakPolarHBondContact OE2-CB 3.48Å; E98-A101 PolarHBondContact OE2-N 3.43Å; A101-F105 WeakPolarHBondContact O-CB 3.38Å; A101-F105 PolarHBondContact O-N 3.17Å
102	L	79.8	Confident	76.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.2	-39.7	177.3	-175.9	64.4	0	0	0	111.7	F3 W5 L16 I39 E98 R100 L106	F3-L102 HydrophobicContact CD2-CD2 4.18Å; F3-L102 HydrophobicContact CE2-CD1 4.38Å; F3-L102 HydrophobicContact CE2-CD2 3.85Å; F3-L102 HydrophobicContact CZ-CD1 4.38Å; F3-L102 HydrophobicContact CZ-CD2 4.49Å; W5-L102 HydrophobicContact CZ2-CD2 4.24Å; L16-L102 HydrophobicContact CD2-CG 4.4Å; I39-L102 HydrophobicContact CG2-CD1 4.47Å; I39-L102 HydrophobicContact CG2-CD2 4.08Å; E98-L102 PolarHBondContact O-N 3.25Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 3.09Å; L102-L106 HydrophobicContact CD1-CD1 4.29Å; L102-L106 HydrophobicContact CD1-CG 4.34Å; L102-L106 HydrophobicContact CG-CD1 4.12Å; L102-L106 VanDerWaalsContact O-CB 3.31Å; L102-L106 WeakPolarHBondContact O-CB 3.46Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.43Å; L102-L106 PolarHBondContact O-N 3.34Å
103	S	76.6	Confident	76.4	Confident	31 Å²	31	33.4 Å²	33.4	22%	0.217	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-51.6	174.3	178.2	0	0	0	0	111.2	P99 R100 F105 L106 V107	P99-S103 WeakPolarHBondContact O-CB 3.39Å; P99-S103 PolarHBondContact O-N 2.96Å; R100-S103 WeakPolarHBondContact O-CB 3.23Å; R100-S103 PolarHBondContact O-N 3.48Å; R100-S103 VanDerWaalsContact O-N 3.16Å; S103-F105 VanDerWaalsContact C-N 3.3Å; S103-F105 PolarHBondContact O-N 3.04Å; S103-L106 PolarHBondContact O-N 3.22Å; S103-V107 WeakPolarHBondContact O-CB 3.32Å; S103-V107 WeakPolarHBondContact O-CG2 3.31Å; S103-V107 PolarHBondContact O-N 3.14Å
104	D	77.8	Confident	75.6	Confident	66 Å²	66	31.5 Å²	31.5	35%	0.353	18%	0.181	S	C	.	.	H	α-helix	trans	-60.4	-43.5	-179	-69.1	-13.3	0	0	0	110.1	R100 V107 L108	R100-D104 WeakPolarHBondContact O-CB 3.4Å; R100-D104 PolarHBondContact O-N 3.04Å; D104-V107 PolarHBondContact O-N 3.06Å; D104-L108 VanDerWaalsContact O-CB 3.29Å; D104-L108 WeakPolarHBondContact O-CB 3Å; D104-L108 PolarHBondContact O-N 3.25Å
105	F	82.9	Confident	75.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.5	-48.1	174.2	179.6	-94.2	0	0	0	112.8	V44 I74 V75 L78 I89 L94 A101 S103 V107 L108 L109	V44-F105 HydrophobicContact CG1-CD1 4.39Å; V44-F105 HydrophobicContact CG1-CE1 3.41Å; V44-F105 VanDerWaalsContact CG1-CE1 3.41Å; V44-F105 HydrophobicContact CG1-CZ 3.92Å; I74-F105 HydrophobicContact CG2-CE2 4.08Å; I74-F105 HydrophobicContact CG2-CZ 3.72Å; V75-F105 HydrophobicContact CG2-CD2 4.33Å; V75-F105 HydrophobicContact CG2-CE2 4.09Å; L78-F105 HydrophobicContact CD2-CE2 4.3Å; I89-F105 HydrophobicContact CD1-CB 4.27Å; I89-F105 HydrophobicContact CD1-CD2 4.36Å; I89-F105 HydrophobicContact CG2-CB 4.27Å; I89-F105 HydrophobicContact CG2-CD2 4.15Å; L94-F105 HydrophobicContact CD1-CB 4.47Å; L94-F105 HydrophobicContact CD1-CD2 3.91Å; L94-F105 HydrophobicContact CD1-CE2 4.35Å; L94-F105 HydrophobicContact CD1-CG 4.07Å; L94-F105 HydrophobicContact CD2-CB 3.71Å; L94-F105 HydrophobicContact CD2-CG 4.04Å; A101-F105 WeakPolarHBondContact O-CB 3.38Å; A101-F105 PolarHBondContact O-N 3.17Å; S103-F105 VanDerWaalsContact C-N 3.3Å; S103-F105 PolarHBondContact O-N 3.04Å; F105-V107 VanDerWaalsContact C-N 3.35Å; F105-V107 PolarHBondContact O-N 3.12Å; F105-L108 PolarHBondContact O-N 2.96Å; F105-L109 HydrophobicContact CE1-CD2 4.14Å; F105-L109 WeakPolarHBondContact O-CB 3.43Å; F105-L109 PolarHBondContact O-N 3.44Å
106	L	80.5	Confident	74.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.8	-34.9	178.6	-75.4	174.3	0	0	0	112.5	L16 I19 A20 I39 L102 S103 A110	L16-L106 HydrophobicContact CD2-CD1 4.19Å; I19-L106 HydrophobicContact CG2-CB 3.74Å; A20-L106 HydrophobicContact CB-CD1 4.35Å; I39-L106 HydrophobicContact CD1-CD1 4.44Å; I39-L106 HydrophobicContact CG2-CD1 4.34Å; L102-L106 HydrophobicContact CD1-CD1 4.29Å; L102-L106 HydrophobicContact CD1-CG 4.34Å; L102-L106 HydrophobicContact CG-CD1 4.12Å; L102-L106 VanDerWaalsContact O-CB 3.31Å; L102-L106 WeakPolarHBondContact O-CB 3.46Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.43Å; L102-L106 PolarHBondContact O-N 3.34Å; S103-L106 PolarHBondContact O-N 3.22Å; L106-A110 WeakPolarHBondContact O-CB 3.32Å; L106-A110 PolarHBondContact O-N 3.38Å
107	V	78.6	Confident	74.2	Confident	71 Å²	71	40 Å²	40	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-65	-46.7	174.2	168.2	0	0	0	0	110	I19 S103 D104 F105 L109 A110 A111	I19-V107 HydrophobicContact CD1-CG2 3.76Å; I19-V107 HydrophobicContact CG1-CG2 4.27Å; I19-V107 HydrophobicContact CG2-CG2 4.03Å; S103-V107 WeakPolarHBondContact O-CB 3.32Å; S103-V107 WeakPolarHBondContact O-CG2 3.31Å; S103-V107 PolarHBondContact O-N 3.14Å; D104-V107 PolarHBondContact O-N 3.06Å; F105-V107 VanDerWaalsContact C-N 3.35Å; F105-V107 PolarHBondContact O-N 3.12Å; V107-L109 VanDerWaalsContact C-N 3.33Å; V107-L109 PolarHBondContact O-N 3.47Å; V107-A110 PolarHBondContact O-N 3.44Å; V107-A111 WeakPolarHBondContact O-CB 3.07Å; V107-A111 PolarHBondContact O-N 3.28Å
108	L	80.7	Confident	73.9	Confident	40 Å²	40	47.5 Å²	47.5	21%	0.209	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-44.2	177.9	-172	68.4	0	0	0	111.1	L78 I82 L86 I89 D104 F105 A111 F112	L78-L108 HydrophobicContact CD2-CD2 3.52Å; L78-L108 HydrophobicContact CD2-CG 3.92Å; L78-L108 HydrophobicContact CG-CD2 4.25Å; I82-L108 HydrophobicContact CD1-CD1 3.76Å; I82-L108 HydrophobicContact CD1-CD2 4.16Å; I82-L108 HydrophobicContact CD1-CG 3.87Å; L86-L108 HydrophobicContact CD1-CD2 3.49Å; L86-L108 VanDerWaalsContact CD1-CD2 3.49Å; L86-L108 HydrophobicContact CD2-CD2 3.48Å; L86-L108 VanDerWaalsContact CD2-CD2 3.48Å; L86-L108 HydrophobicContact CG-CD2 4.13Å; I89-L108 HydrophobicContact CD1-CD2 4.02Å; D104-L108 VanDerWaalsContact O-CB 3.29Å; D104-L108 WeakPolarHBondContact O-CB 3Å; D104-L108 PolarHBondContact O-N 3.25Å; F105-L108 PolarHBondContact O-N 2.96Å; L108-A111 PolarHBondContact O-N 3.3Å; L108-F112 WeakPolarHBondContact O-CB 3.1Å; L108-F112 PolarHBondContact O-N 3.48Å
109	L	80	Confident	73.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-45.5	177.1	-162.4	70.1	0	0	0	111.4	L47 L51 L78 F105 V107 A111 F112 I113	L47-L109 HydrophobicContact CD2-CD2 3.32Å; L47-L109 HydrophobicContact CD2-CG 4.44Å; L47-L109 HydrophobicContact CG-CD2 3.89Å; L51-L109 HydrophobicContact CD1-CD1 3.59Å; L51-L109 HydrophobicContact CD1-CD2 4.34Å; L51-L109 HydrophobicContact CD1-CG 3.89Å; L78-L109 HydrophobicContact CD1-CD1 4.27Å; L78-L109 HydrophobicContact CD2-CD1 4.49Å; F105-L109 HydrophobicContact CE1-CD2 4.14Å; F105-L109 WeakPolarHBondContact O-CB 3.43Å; F105-L109 PolarHBondContact O-N 3.44Å; V107-L109 VanDerWaalsContact C-N 3.33Å; V107-L109 PolarHBondContact O-N 3.47Å; L109-A111 VanDerWaalsContact C-N 3.34Å; L109-A111 PolarHBondContact O-N 3.31Å; L109-F112 PolarHBondContact O-N 3.28Å; L109-I113 HydrophobicContact CG-CD1 4.32Å; L109-I113 WeakPolarHBondContact O-CD1 3.46Å; L109-I113 WeakPolarHBondContact O-CG1 3.28Å; L109-I113 PolarHBondContact O-N 3.03Å
110	A	74.4	Confident	72.5	Confident	13 Å²	13	51 Å²	51	11%	0.107	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-41	175.8	0	0	0	0	0	112.3	A23 L26 L106 V107 I113 A114	A23-A110 HydrophobicContact CB-CB 4.2Å; L26-A110 WeakPolarHBondContact CD1-O 3.35Å; L106-A110 WeakPolarHBondContact O-CB 3.32Å; L106-A110 PolarHBondContact O-N 3.38Å; V107-A110 PolarHBondContact O-N 3.44Å; A110-I113 PolarHBondContact O-N 2.97Å; A110-A114 WeakPolarHBondContact O-CB 3.41Å; A110-A114 PolarHBondContact O-N 2.86Å
111	A	71.9	Confident	71.6	Confident	55 Å²	55	49.7 Å²	49.7	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-65.3	-41.3	175.5	0	0	0	0	0	111.7	V107 L108 L109 A114 Y115	V107-A111 WeakPolarHBondContact O-CB 3.07Å; V107-A111 PolarHBondContact O-N 3.28Å; L108-A111 PolarHBondContact O-N 3.3Å; L109-A111 VanDerWaalsContact C-N 3.34Å; L109-A111 PolarHBondContact O-N 3.31Å; A111-A114 PolarHBondContact O-N 2.81Å; A111-Y115 WeakPolarHBondContact O-CB 3.5Å; A111-Y115 PolarHBondContact O-N 3.49Å
112	F	75.5	Confident	70.4	Confident	22 Å²	22	51.4 Å²	51.4	10%	0.096	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-45.5	174.8	-176.9	-104	0	0	0	111.6	F52 L78 E81 I82 L108 L109 A114 Y115 C116	F52-F112 AromaticContact CE1-CE1 3.79Å; F52-F112 HydrophobicContact CE1-CE1 3.79Å; F52-F112 HydrophobicContact CE1-CZ 4.17Å; F52-F112 HydrophobicContact CZ-CD1 4.45Å; F52-F112 HydrophobicContact CZ-CE1 4.06Å; L78-F112 HydrophobicContact CD1-CB 4.01Å; L78-F112 HydrophobicContact CD1-CD1 3.99Å; L78-F112 HydrophobicContact CD1-CD2 4.19Å; L78-F112 HydrophobicContact CD1-CG 3.79Å; E81-F112 HydrophobicContact CB-CE2 3.7Å; E81-F112 HydrophobicContact CB-CZ 3.7Å; E81-F112 HydrophobicContact CG-CZ 4.21Å; I82-F112 HydrophobicContact CD1-CD2 4.27Å; I82-F112 HydrophobicContact CG1-CD2 3.76Å; I82-F112 HydrophobicContact CG1-CE2 4.22Å; L108-F112 WeakPolarHBondContact O-CB 3.1Å; L108-F112 PolarHBondContact O-N 3.48Å; L109-F112 PolarHBondContact O-N 3.28Å; F112-A114 VanDerWaalsContact C-N 3.33Å; F112-A114 PolarHBondContact O-N 3.37Å; F112-Y115 WeakPolarHBondContact O-CB 3.48Å; F112-Y115 PolarHBondContact O-N 2.69Å; F112-C116 VanDerWaalsContact CZ-SG 3.58Å; F112-C116 PolarHBondContact O-N 3.13Å; F112-C116 PolarHBondContact O-SG 3.41Å
113	I	72.1	Confident	68.5	Low	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.2	-45.6	175.2	-61.5	157.7	0	0	0	110.6	A23 L26 I27 L51 L109 A110 Y115 C116 R117 L122	A23-I113 HydrophobicContact CB-CD1 3.83Å; L26-I113 HydrophobicContact CB-CB 4.38Å; L26-I113 HydrophobicContact CB-CG2 3.47Å; L26-I113 VanDerWaalsContact CB-CG2 3.47Å; L26-I113 HydrophobicContact CD1-CB 4.35Å; L26-I113 HydrophobicContact CD1-CG2 4.29Å; L26-I113 HydrophobicContact CG-CG2 4.49Å; I27-I113 HydrophobicContact CD1-CD1 3.71Å; I27-I113 HydrophobicContact CD1-CG1 4.42Å; I27-I113 HydrophobicContact CG1-CD1 3.96Å; I27-I113 HydrophobicContact CG1-CG1 4.3Å; I27-I113 HydrophobicContact CG1-CG2 3.65Å; L51-I113 HydrophobicContact CD1-CD1 4.03Å; L51-I113 HydrophobicContact CD1-CG1 3.74Å; L51-I113 HydrophobicContact CD2-CD1 4.41Å; L51-I113 HydrophobicContact CD2-CG1 3.64Å; L51-I113 HydrophobicContact CG-CG1 4.32Å; L109-I113 HydrophobicContact CG-CD1 4.32Å; L109-I113 WeakPolarHBondContact O-CD1 3.46Å; L109-I113 WeakPolarHBondContact O-CG1 3.28Å; L109-I113 PolarHBondContact O-N 3.03Å; A110-I113 PolarHBondContact O-N 2.97Å; I113-Y115 VanDerWaalsContact C-N 3.35Å; I113-Y115 PolarHBondContact O-N 2.71Å; I113-C116 PolarHBondContact O-N 2.89Å; I113-R117 WeakPolarHBondContact O-CB 3.26Å; I113-R117 PolarHBondContact O-N 3.48Å; I113-L122 HydrophobicContact CG2-CD1 4.03Å
114	A	66.7	Low	66.8	Low	25 Å²	25	58.5 Å²	58.5	21%	0.207	30%	0.303	C	S	.	.	H	α-helix	trans	-59.9	-45.8	177.9	0	0	0	0	0	111.3	L26 A110 A111 F112 C116 R117 E118	L26-A114 HydrophobicContact CD1-CB 3.99Å; L26-A114 HydrophobicContact CD2-CB 4.44Å; A110-A114 WeakPolarHBondContact O-CB 3.41Å; A110-A114 PolarHBondContact O-N 2.86Å; A111-A114 PolarHBondContact O-N 2.81Å; F112-A114 VanDerWaalsContact C-N 3.33Å; F112-A114 PolarHBondContact O-N 3.37Å; A114-C116 PolarHBondContact O-N 3.38Å; A114-R117 PolarHBondContact O-N 3.02Å; A114-E118 WeakPolarHBondContact O-CG 3.39Å; A114-E118 PolarHBondContact O-N 2.89Å
115	Y	69.5	Low	64.6	Low	141 Å²	141	64.5 Å²	64.5	55%	0.553	32%	0.321	S	S	*	.	H	α-helix	trans	-59.6	-45.7	175.9	174.7	-101.3	0	0	0	112.5	A111 F112 I113 R117 E118 S119	A111-Y115 WeakPolarHBondContact O-CB 3.5Å; A111-Y115 PolarHBondContact O-N 3.49Å; F112-Y115 WeakPolarHBondContact O-CB 3.48Å; F112-Y115 PolarHBondContact O-N 2.69Å; I113-Y115 VanDerWaalsContact C-N 3.35Å; I113-Y115 PolarHBondContact O-N 2.71Å; Y115-R117 VanDerWaalsContact C-N 3.32Å; Y115-R117 PolarHBondContact O-N 3.46Å; Y115-E118 PolarHBondContact O-N 3.3Å; Y115-S119 VanDerWaalsContact O-CB 3.25Å; Y115-S119 WeakPolarHBondContact O-CB 3.44Å; Y115-S119 PolarHBondContact O-N 3.29Å; Y115-S119 PolarHBondContact O-OG 2.91Å
116	C	66.1	Low	62.2	Low	13 Å²	13	68.6 Å²	68.6	9%	0.088	34%	0.342	C	S	.	.	H	α-helix	trans	-66.7	-33.1	178.1	-67.6	0	0	0	0	112.4	F112 I113 A114 N120 L121 L122	F112-C116 VanDerWaalsContact CZ-SG 3.58Å; F112-C116 PolarHBondContact O-N 3.13Å; F112-C116 PolarHBondContact O-SG 3.41Å; I113-C116 PolarHBondContact O-N 2.89Å; A114-C116 PolarHBondContact O-N 3.38Å; C116-N120 PolarHBondContact O-N 2.9Å; C116-L121 HydrophobicContact CB-CB 4.37Å; C116-L121 PolarHBondContact O-N 3.41Å; C116-L122 HydrophobicContact CB-CB 4.45Å; C116-L122 HydrophobicContact CB-CD1 3.31Å; C116-L122 HydrophobicContact CB-CG 3.62Å; C116-L122 PolarHBondContact O-N 2.87Å
117	R	65.5	Low	59.6	Low	119 Å²	119	72 Å²	72	45%	0.449	37%	0.366	S	S	.	.	H	α-helix	trans	-70.8	-45.3	175.3	-177.7	175.1	172.7	160.3	-5.8	111.6	L26 I113 A114 Y115 S119 N120	L26-R117 PolarHBondContact O-NH1 2.96Å; I113-R117 WeakPolarHBondContact O-CB 3.26Å; I113-R117 PolarHBondContact O-N 3.48Å; A114-R117 PolarHBondContact O-N 3.02Å; Y115-R117 VanDerWaalsContact C-N 3.32Å; Y115-R117 PolarHBondContact O-N 3.46Å; R117-S119 VanDerWaalsContact C-N 3.29Å; R117-S119 PolarHBondContact O-N 2.92Å; R117-N120 PolarHBondContact O-N 3.26Å
118	E	62.6	Low	57.1	Low	160 Å²	160	74.1 Å²	74.1	75%	0.748	38%	0.379	S	S	*	.	H	α-helix	trans	-64.6	-35.2	176.6	-73.5	-179	-179.4	0	0	112.1	A114 Y115 N120	A114-E118 WeakPolarHBondContact O-CG 3.39Å; A114-E118 PolarHBondContact O-N 2.89Å; Y115-E118 PolarHBondContact O-N 3.3Å; E118-N120 VanDerWaalsContact C-N 3.26Å; E118-N120 PolarHBondContact O-N 3.5Å
119	S	57	Low	54.3	Low	50 Å²	50	77 Å²	77	35%	0.35	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	2.7	178.8	-54.8	0	0	0	0	113.8	Y115 R117 L121	Y115-S119 VanDerWaalsContact O-CB 3.25Å; Y115-S119 WeakPolarHBondContact O-CB 3.44Å; Y115-S119 PolarHBondContact O-N 3.29Å; Y115-S119 PolarHBondContact O-OG 2.91Å; R117-S119 VanDerWaalsContact C-N 3.29Å; R117-S119 PolarHBondContact O-N 2.92Å; S119-L121 PolarHBondContact O-N 2.9Å; S119-L121 VanDerWaalsContact O-N 3.15Å
120	N	52.8	Low	51.7	Low	142 Å²	142	85.9 Å²	85.9	76%	0.759	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	25.1	-172.2	-63.6	-51.5	0	0	0	114.4	C116 R117 E118	C116-N120 PolarHBondContact O-N 2.9Å; R117-N120 PolarHBondContact O-N 3.26Å; E118-N120 VanDerWaalsContact C-N 3.26Å; E118-N120 PolarHBondContact O-N 3.5Å
121	L	53.9	Low	49.4	Very low	90 Å²	90	89 Å²	89	47%	0.471	46%	0.464	S	S	.	.			trans	-81.4	-21.2	178.4	-65.6	172.3	0	0	0	111.8	C116 S119 E123 L163	C116-L121 HydrophobicContact CB-CB 4.37Å; C116-L121 PolarHBondContact O-N 3.41Å; S119-L121 PolarHBondContact O-N 2.9Å; S119-L121 VanDerWaalsContact O-N 3.15Å; L121-E123 PolarHBondContact O-N 2.95Å; L121-L163 VanDerWaalsContact O-CD2 3.24Å; L121-L163 WeakPolarHBondContact O-CD2 3.2Å
122	L	53.8	Low	47.1	Very low	41 Å²	41	91.3 Å²	91.3	22%	0.215	48%	0.477	C	S	.	.			trans	-89	89.2	171.9	-84.1	159	0	0	0	110.6	L51 I113 C116 L124	L51-L122 HydrophobicContact CD2-CD2 4.15Å; I113-L122 HydrophobicContact CG2-CD1 4.03Å; C116-L122 HydrophobicContact CB-CB 4.45Å; C116-L122 HydrophobicContact CB-CD1 3.31Å; C116-L122 HydrophobicContact CB-CG 3.62Å; C116-L122 PolarHBondContact O-N 2.87Å; L122-L124 HydrophobicContact CB-CD1 4.32Å; L122-L124 HydrophobicContact CB-CG 4.39Å; L122-L124 HydrophobicContact CD2-CD1 4.12Å; L122-L124 HydrophobicContact CD2-CD2 4.46Å; L122-L124 HydrophobicContact CD2-CG 4.04Å; L122-L124 PolarHBondContact O-N 3.03Å
123	E	40.4	Very low	44.8	Very low	125 Å²	125	100.4 Å²	100.4	58%	0.584	52%	0.517	S	S	*	.			trans	-75.5	74.6	158.3	-95.6	-160.7	-158.8	0	0	109.2	L121 R125	L121-E123 PolarHBondContact O-N 2.95Å; E123-R125 PolarHBondContact O-N 3.34Å; E123-R125 IonicContact OE2-CZ 3.71Å; E123-R125 IonicContact OE2-NE 3.89Å; E123-R125 PolarHBondContact OE2-NE 3.31Å; E123-R125 IonicContact OE2-NH2 3.36Å; E123-R125 PolarHBondContact OE2-NH2 3.01Å
124	L	41.1	Very low	42.5	Very low	55 Å²	55	109.1 Å²	109.1	29%	0.288	56%	0.557	S	S	.	*			trans	-74.4	82.3	167.8	-74.4	159	0	0	0	108.6	I27 V50 L122 I126	I27-L124 HydrophobicContact CB-CD1 4.16Å; I27-L124 HydrophobicContact CG2-CD1 3.48Å; I27-L124 VanDerWaalsContact CG2-CD1 3.48Å; I27-L124 HydrophobicContact CG2-CD2 3.67Å; I27-L124 HydrophobicContact CG2-CG 4.23Å; V50-L124 HydrophobicContact CG1-CD2 4.06Å; L122-L124 HydrophobicContact CB-CD1 4.32Å; L122-L124 HydrophobicContact CB-CG 4.39Å; L122-L124 HydrophobicContact CD2-CD1 4.12Å; L122-L124 HydrophobicContact CD2-CD2 4.46Å; L122-L124 HydrophobicContact CD2-CG 4.04Å; L122-L124 PolarHBondContact O-N 3.03Å; L124-I126 PolarHBondContact O-N 2.8Å
125	R	31.3	Very low	40.5	Very low	193 Å²	193	113.5 Å²	113.5	73%	0.728	59%	0.585	S	S	*	*			trans	-70.6	85.4	166.4	-70.6	-167.5	-171.7	-170.1	0.6	108.8	E123 S127	E123-R125 PolarHBondContact O-N 3.34Å; E123-R125 IonicContact OE2-CZ 3.71Å; E123-R125 IonicContact OE2-NE 3.89Å; E123-R125 PolarHBondContact OE2-NE 3.31Å; E123-R125 IonicContact OE2-NH2 3.36Å; E123-R125 PolarHBondContact OE2-NH2 3.01Å; R125-S127 VanDerWaalsContact C-N 3.26Å; R125-S127 PolarHBondContact O-N 3.05Å
126	I	31.7	Very low	38.3	Very low	85 Å²	85	112.5 Å²	112.5	44%	0.436	60%	0.599	S	S	.	*			trans	-69.5	95.3	163.2	-58.3	176.8	0	0	0	106	N28 L124 T128	N28-I126 HydrophobicContact CB-CD1 3.52Å; L124-I126 PolarHBondContact O-N 2.8Å; I126-T128 VanDerWaalsContact C-N 3.28Å; I126-T128 HydrophobicContact CG2-CG2 4.45Å; I126-T128 PolarHBondContact O-N 3.47Å
127	S	25.5	Very low	36.4	Very low	72 Å²	72	115.9 Å²	115.9	50%	0.503	64%	0.635	S	S	.	*			trans	-63.6	94.1	165.3	171.4	0	0	0	0	107.3	R125 C129	R125-S127 VanDerWaalsContact C-N 3.26Å; R125-S127 PolarHBondContact O-N 3.05Å; S127-C129 PolarHBondContact O-N 3.06Å
128	T	26	Very low	34.4	Very low	115 Å²	115	113.6 Å²	113.6	71%	0.706	65%	0.649	S	S	*	*			trans	-68	83	160.1	41.4	0	0	0	0	106.9	I126 E130	I126-T128 VanDerWaalsContact C-N 3.28Å; I126-T128 HydrophobicContact CG2-CG2 4.45Å; I126-T128 PolarHBondContact O-N 3.47Å; T128-E130 PolarHBondContact O-N 3.38Å
129	C	23.6	Very low	32.6	Very low	101 Å²	101	113.3 Å²	113.3	68%	0.682	65%	0.652	S	S	*	*			trans	-72.2	72.3	167.6	-144.8	0	0	0	0	108.1	S127 S131	S127-C129 PolarHBondContact O-N 3.06Å; C129-S131 PolarHBondContact O-N 2.78Å
130	E	25	Very low	31	Very low	187 Å²	187	117.7 Å²	117.7	87%	0.874	67%	0.67	S	S	*	*			trans	-68.2	82.5	155.8	-73.3	-170.8	157.5	0	0	107.1	T128	T128-E130 PolarHBondContact O-N 3.38Å
131	S	25.5	Very low	29.6	Very low	79 Å²	79	115.2 Å²	115.2	55%	0.552	66%	0.664	S	S	*	*			trans	-131.1	89.6	159.4	57.3	0	0	0	0	109.2	C129	C129-S131 PolarHBondContact O-N 2.78Å
132	S	24.3	Very low	28.2	Very low	103 Å²	103	118 Å²	118	72%	0.72	68%	0.679	S	S	*	*			trans	45.5	93.9	141.8	62.2	0	0	0	0	117.2
133	F	26.9	Very low	26.8	Very low	213 Å²	213	121.7 Å²	121.7	93%	0.934	71%	0.708	S	S	*	*			trans	-137.1	95.7	142.4	-97.1	-79.9	0	0	0	110.3	C135	F133-C135 PolarHBondContact O-N 2.66Å
134	E	23.2	Very low	26.1	Very low	183 Å²	183	124 Å²	124	86%	0.855	72%	0.716	S	S	*	*			trans	-52.1	118.6	157.1	-65.2	175.8	142.9	0	0	109.4
135	C	24.9	Very low	25.5	Very low	117 Å²	117	129.7 Å²	129.7	79%	0.791	75%	0.746	S	S	*	*			trans	-173.3	90.5	134.1	-100.8	0	0	0	0	110.1	F133	F133-C135 PolarHBondContact O-N 2.66Å
136	S	24.3	Very low	25.3	Very low	120 Å²	120	124.2 Å²	124.2	84%	0.839	73%	0.734	S	S	*	*				41.7	102.5	115.7	-49.1	0	0	0	0	117.4
137	G	24.5	Very low	25.4	Very low	83 Å²	83	124.6 Å²	124.6	86%	0.856	75%	0.745	S	S	*	*			trans	113.2	126.7	132.1	0	0	0	0	0	116.4
138	G	24.2	Very low	25.7	Very low	72 Å²	72	129 Å²	129	74%	0.742	75%	0.754	S	S	*	*			trans	102	72.2	140.2	0	0	0	0	0	116.3
139	L	24.8	Very low	26.1	Very low	154 Å²	154	128.2 Å²	128.2	81%	0.806	75%	0.75	S	S	*	*				30.4	118.2	125.5	-66.1	173.3	0	0	0	119.4
140	I	23.9	Very low	26.5	Very low	141 Å²	141	130 Å²	130	72%	0.723	75%	0.746	S	S	*	*				81.8	126.9	124.6	-56.9	166.6	0	0	0	118.5
141	S	23.4	Very low	26.8	Very low	91 Å²	91	127.2 Å²	127.2	64%	0.636	73%	0.733	S	S	*	*			trans	88.2	115	144.1	61.7	0	0	0	0	119.8
142	N	24	Very low	27	Very low	149 Å²	149	130.7 Å²	130.7	80%	0.797	74%	0.739	S	S	*	*			trans	70.1	125.4	137.8	-58.9	-12.3	0	0	0	117.8
143	S	24.5	Very low	27.4	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	72%	0.722	S	S	*	*			trans	102	131.2	162.6	80	0	0	0	0	115.1
144	K	26.3	Very low	27.7	Very low	173 Å²	173	125.1 Å²	125.1	75%	0.752	71%	0.706	S	S	*	*			trans	76	95.6	164.8	-100.3	169.6	177.2	177.8	0	116.3	T146	K144-T146 HydrophobicContact CB-CG2 3.55Å; K144-T146 HydrophobicContact CD-CG2 3.8Å; K144-T146 HydrophobicContact CG-CG2 3.67Å; K144-T146 PolarHBondContact O-N 3.06Å; K144-T146 PolarHBondContact O-OG1 3.38Å
145	L	26.9	Very low	27.8	Very low	176 Å²	176	121.3 Å²	121.3	92%	0.921	70%	0.698	S	S	*	*			trans	-53.6	93.1	143.8	-106.3	84.9	0	0	0	107.1
146	T	27.9	Very low	28.2	Very low	77 Å²	77	119.9 Å²	119.9	47%	0.472	68%	0.68	S	S	.	*			trans	-119.6	115.1	176.9	43.3	0	0	0	0	109.4	K144 K148	K144-T146 HydrophobicContact CB-CG2 3.55Å; K144-T146 HydrophobicContact CD-CG2 3.8Å; K144-T146 HydrophobicContact CG-CG2 3.67Å; K144-T146 PolarHBondContact O-N 3.06Å; K144-T146 PolarHBondContact O-OG1 3.38Å; T146-K148 PolarHBondContact O-N 2.86Å
147	S	34.5	Very low	28.5	Very low	94 Å²	94	117.9 Å²	117.9	66%	0.657	66%	0.66	S	S	*	*	S	Bend	trans	53.2	-16.4	148.2	60.9	0	0	0	0	121.1	K150	S147-K150 PolarHBondContact O-N 3.34Å
148	K	30.6	Very low	28.6	Very low	163 Å²	163	118.7 Å²	118.7	71%	0.709	65%	0.652	S	S	*	*	H	α-helix	trans	-83.4	-21.9	-175	-77.8	-175.6	171.5	-176.1	0	114.4	T146 K150 F152	T146-K148 PolarHBondContact O-N 2.86Å; K148-K150 VanDerWaalsContact C-N 3.26Å; K148-F152 PolarHBondContact O-N 3.35Å
149	T	34.5	Very low	28.8	Very low	99 Å²	99	120.3 Å²	120.3	61%	0.607	65%	0.648	S	S	*	*	H	α-helix	trans	-70.8	-23.6	168.8	21.7	0	0	0	0	112.4	L153	T149-L153 PolarHBondContact O-N 3.05Å
150	K	32.5	Very low	29	Very low	139 Å²	139	116.3 Å²	116.3	60%	0.604	63%	0.633	S	S	*	*	H	α-helix	trans	-73.9	-42.7	176.9	-157.2	-177	179.6	-162.1	0	111.7	S147 K148 E154	S147-K150 PolarHBondContact O-N 3.34Å; K148-K150 VanDerWaalsContact C-N 3.26Å; K150-E154 WeakPolarHBondContact O-CB 3.36Å; K150-E154 PolarHBondContact O-N 3.42Å
151	E	31.8	Very low	29.3	Very low	128 Å²	128	113.6 Å²	113.6	60%	0.598	62%	0.624	S	S	*	*	H	α-helix	trans	-68.5	-31.9	175.2	-81.1	176.9	156.4	0	0	113	E154 C155	E151-E154 PolarHBondContact O-N 3.48Å; E151-C155 PolarHBondContact O-N 3.46Å
152	F	30.2	Very low	29.6	Very low	153 Å²	153	116.9 Å²	116.9	67%	0.671	63%	0.629	S	S	*	*	H	α-helix	trans	-70.1	-33.8	179.3	-153	-94.2	0	0	0	112.7	K148	K148-F152 PolarHBondContact O-N 3.35Å
153	L	31.5	Very low	30	Very low	69 Å²	69	114.3 Å²	114.3	36%	0.361	62%	0.615	S	S	.	*	H	α-helix	trans	-73.6	-43.8	170.2	-80.6	157.8	0	0	0	111	T149 C155 Q156 L157	T149-L153 PolarHBondContact O-N 3.05Å; L153-C155 PolarHBondContact O-N 3.01Å; L153-Q156 PolarHBondContact O-N 3.15Å; L153-Q156 VanDerWaalsContact O-N 3.12Å; L153-L157 HydrophobicContact CB-CD1 4.27Å; L153-L157 WeakPolarHBondContact O-CB 3.39Å; L153-L157 VanDerWaalsContact O-CD1 3.26Å; L153-L157 WeakPolarHBondContact O-CD1 3.32Å; L153-L157 WeakPolarHBondContact O-CG 3.32Å; L153-L157 PolarHBondContact O-N 3.19Å; L153-L157 VanDerWaalsContact O-N 3.13Å
154	E	32.5	Very low	30.2	Very low	129 Å²	129	113.6 Å²	113.6	60%	0.603	61%	0.608	S	S	*	*	H	α-helix	trans	-61.9	-26.7	-179.1	-135.4	160.7	-169.2	0	0	113.4	K150 E151	K150-E154 WeakPolarHBondContact O-CB 3.36Å; K150-E154 PolarHBondContact O-N 3.42Å; E151-E154 PolarHBondContact O-N 3.48Å
155	C	26.8	Very low	30.3	Very low	103 Å²	103	114.9 Å²	114.9	70%	0.696	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-16.8	175.9	-74.9	0	0	0	0	115.4	E151 L153	E151-C155 PolarHBondContact O-N 3.46Å; L153-C155 PolarHBondContact O-N 3.01Å
156	Q	33.6	Very low	30.3	Very low	87 Å²	87	113.9 Å²	113.9	41%	0.407	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.9	-20.7	174.5	-69.7	-111.1	11.6	0	0	112.2	L153 S158	L153-Q156 PolarHBondContact O-N 3.15Å; L153-Q156 VanDerWaalsContact O-N 3.12Å; Q156-S158 VanDerWaalsContact C-N 3.29Å; Q156-S158 PolarHBondContact O-N 3.11Å
157	L	28.9	Very low	30.1	Very low	79 Å²	79	115.7 Å²	115.7	41%	0.414	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	0.3	-176.4	-69.7	166.8	0	0	0	114.9	V49 L153 T159	V49-L157 HydrophobicContact CG1-CD2 3.78Å; L153-L157 HydrophobicContact CB-CD1 4.27Å; L153-L157 WeakPolarHBondContact O-CB 3.39Å; L153-L157 VanDerWaalsContact O-CD1 3.26Å; L153-L157 WeakPolarHBondContact O-CD1 3.32Å; L153-L157 WeakPolarHBondContact O-CG 3.32Å; L153-L157 PolarHBondContact O-N 3.19Å; L153-L157 VanDerWaalsContact O-N 3.13Å; L157-T159 VanDerWaalsContact C-N 3.3Å
158	S	28.2	Very low	29.7	Very low	99 Å²	99	116 Å²	116	69%	0.692	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-2.4	174.3	59.7	0	0	0	0	114.2	Q156	Q156-S158 VanDerWaalsContact C-N 3.29Å; Q156-S158 PolarHBondContact O-N 3.11Å
159	T	28	Very low	29.4	Very low	107 Å²	107	115.1 Å²	115.1	66%	0.656	62%	0.62	S	S	*	*			trans	-142.2	75.7	-179.5	45.9	0	0	0	0	110	L157	L157-T159 VanDerWaalsContact C-N 3.3Å
160	S	28.6	Very low	28.9	Very low	70 Å²	70	115.3 Å²	115.3	49%	0.49	62%	0.624	S	S	.	*			trans	-60	126.6	166.3	-102.3	0	0	0	0	109.2	E162	S160-E162 PolarHBondContact O-N 3.08Å; S160-E162 VanDerWaalsContact O-N 3.1Å
161	P	29.7	Very low	28.6	Very low	83 Å²	83	113.2 Å²	113.2	54%	0.539	63%	0.633	S	S	.	*			trans	-69.4	105.5	160.2	28.3	-26	0	0	0	106.5	L163	P161-L163 PolarHBondContact O-N 3.38Å
162	E	30.1	Very low	28.3	Very low	161 Å²	161	112.4 Å²	112.4	75%	0.752	64%	0.639	S	S	*	*			trans	-57.8	120.7	167.8	-73.1	-175.8	150.1	0	0	107.9	S160	S160-E162 PolarHBondContact O-N 3.08Å; S160-E162 VanDerWaalsContact O-N 3.1Å
163	L	32.9	Very low	28.2	Very low	94 Å²	94	112.4 Å²	112.4	49%	0.492	64%	0.643	S	S	.	*			trans	-48.7	134.6	160.1	-82.5	158.6	0	0	0	107.6	L121 P161 R165	L121-L163 VanDerWaalsContact O-CD2 3.24Å; L121-L163 WeakPolarHBondContact O-CD2 3.2Å; P161-L163 PolarHBondContact O-N 3.38Å; L163-R165 PolarHBondContact O-N 3.02Å
164	P	28.8	Very low	27.9	Very low	103 Å²	103	119.8 Å²	119.8	67%	0.669	67%	0.673	S	S	*	*			trans	-57.2	101.1	177.7	-20.5	30.4	0	0	0	109.6	H166	P164-H166 PolarHBondContact O-N 3.26Å
165	R	28.2	Very low	27.6	Very low	199 Å²	199	117.4 Å²	117.4	75%	0.751	67%	0.67	S	S	*	*			trans	-71.9	74.5	172.1	-73.5	-178	168.8	173.4	-1.1	108.2	L163 S167	L163-R165 PolarHBondContact O-N 3.02Å; R165-S167 PolarHBondContact O-N 3.47Å
166	H	26.1	Very low	27.7	Very low	155 Å²	155	118.9 Å²	118.9	72%	0.718	68%	0.676	S	S	*	*			trans	-84.7	93.1	163	-70.9	-52.7	0	0	0	108.1	P164 V168	P164-H166 PolarHBondContact O-N 3.26Å; H166-V168 HydrophobicContact CB-CG2 4.05Å; H166-V168 PolarHBondContact O-N 3.26Å
167	S	23.3	Very low	27.4	Very low	115 Å²	115	118.9 Å²	118.9	80%	0.804	69%	0.685	S	S	*	*			trans	-49.7	102.2	152.2	51	0	0	0	0	108.8	R165	R165-S167 PolarHBondContact O-N 3.47Å
168	V	26.5	Very low	27.2	Very low	101 Å²	101	123.4 Å²	123.4	61%	0.612	70%	0.702	S	S	*	*			trans	-121.4	85.7	168.7	-172.1	0	0	0	0	108.4	H166 C170	H166-V168 HydrophobicContact CB-CG2 4.05Å; H166-V168 PolarHBondContact O-N 3.26Å; V168-C170 VanDerWaalsContact C-N 3.31Å; V168-C170 HydrophobicContact CG1-CB 3.67Å; V168-C170 WeakPolarHBondContact CG1-SG 3.43Å; V168-C170 PolarHBondContact O-N 2.7Å
169	T	24.2	Very low	27.4	Very low	145 Å²	145	125.1 Å²	125.1	89%	0.89	70%	0.699	S	S	*	*			trans	-57.2	95.6	150.5	-36.1	0	0	0	0	107.7
170	C	24.6	Very low	27.4	Very low	102 Å²	102	128.1 Å²	128.1	69%	0.689	71%	0.705	S	S	*	*			trans	-145.9	84.9	168.3	-81.1	0	0	0	0	111.2	V168	V168-C170 VanDerWaalsContact C-N 3.31Å; V168-C170 HydrophobicContact CG1-CB 3.67Å; V168-C170 WeakPolarHBondContact CG1-SG 3.43Å; V168-C170 PolarHBondContact O-N 2.7Å
171	A	25.7	Very low	27.4	Very low	96 Å²	96	130.5 Å²	130.5	79%	0.793	72%	0.722	S	S	*	*			trans	-77.3	148.6	135.6	0	0	0	0	0	107.8
172	P	26.5	Very low	27.3	Very low	111 Å²	111	129.8 Å²	129.8	72%	0.721	73%	0.73	S	S	*	*				-147.8	135	111.2	33	-14.8	0	0	0	115.7
173	M	27.1	Very low	27.2	Very low	153 Å²	153	131.5 Å²	131.5	75%	0.754	74%	0.738	S	S	*	*			trans	43	116.2	133.6	-61.2	173.6	77.6	0	0	120.3	S175	M173-S175 WeakPolarHBondContact CE-OG 3.48Å
174	F	26.4	Very low	27.2	Very low	224 Å²	224	132 Å²	132	98%	0.982	75%	0.749	S	S	*	*				-110.3	113.9	128.6	-78.9	-79.1	0	0	0	109
175	S	24.8	Very low	27.2	Very low	79 Å²	79	134 Å²	134	55%	0.552	75%	0.753	S	S	*	*			trans	-90.5	144.5	-176.3	-62.4	0	0	0	0	113.7	M173	M173-S175 WeakPolarHBondContact CE-OG 3.48Å
176	T	30.5	Very low	27.3	Very low	133 Å²	133	131.9 Å²	131.9	82%	0.816	76%	0.756	S	S	*	*			trans	-158.5	89.7	132.5	52	0	0	0	0	107.9
177	S	26.1	Very low	27.3	Very low	87 Å²	87	133 Å²	133	61%	0.608	76%	0.762	S	S	*	*				68.2	110	95.2	73.5	0	0	0	0	116.4
178	F	25.4	Very low	27.8	Very low	175 Å²	175	133 Å²	133	77%	0.768	76%	0.762	S	S	*	*				161.5	136.3	102.5	-97.4	-73.9	0	0	0	115.1
179	H	33	Very low	27.9	Very low	134 Å²	134	134.8 Å²	134.8	62%	0.62	77%	0.773	S	S	*	*			trans	73.8	107.9	161.3	-64.3	-63.8	0	0	0	119.6
180	Q	27.7	Very low	28.2	Very low	170 Å²	170	133.3 Å²	133.3	79%	0.794	77%	0.766	S	S	*	*				56.1	125.2	80.7	-73.5	177.7	-18.5	0	0	110.8
181	S	27.3	Very low	28.5	Very low	121 Å²	121	134.3 Å²	134.3	85%	0.846	77%	0.769	S	S	*	*			cis	179.4	150.8	27	43.3	0	0	0	0	103.4
182	G	29	Very low	28.7	Very low	67 Å²	67	137 Å²	137	69%	0.691	76%	0.763	S	S	*	*			cis	142.7	157.6	35.9	0	0	0	0	0	107
183	Q	28.3	Very low	28.9	Very low	197 Å²	197	141.8 Å²	141.8	92%	0.921	77%	0.766	S	S	*	*			trans	75.1	133	168.1	-56.8	174.3	1	0	0	115.9
184	S	31.7	Very low	29	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	77%	0.771	S	S	*	*			cis	-172.2	133.1	4.5	42.9	0	0	0	0	109.6
185	I	28.4	Very low	29.2	Very low	147 Å²	147	136.3 Å²	136.3	75%	0.754	76%	0.762	S	S	*	*			trans	13.1	124.4	138.2	-54.7	161.9	0	0	0	117.4
186	D	30	Very low	29.5	Very low	154 Å²	154	137.6 Å²	137.6	82%	0.824	78%	0.778	S	S	*	*				-173	146.1	107.2	-114.3	-31.2	0	0	0	115.5
187	Q	27.1	Very low	29.3	Very low	177 Å²	177	135.5 Å²	135.5	83%	0.827	77%	0.768	S	S	*	*			trans	-84.3	142.9	-179.6	-61.6	172.9	-7	0	0	111.7
188	S	33.7	Very low	29.2	Very low	116 Å²	116	140.4 Å²	140.4	81%	0.811	78%	0.779	S	S	*	*			trans	178.4	110	138.6	32.5	0	0	0	0	114.7
189	T	27.7	Very low	29.4	Very low	138 Å²	138	140.3 Å²	140.3	85%	0.847	78%	0.781	S	S	*	*			trans	23.1	151.6	141.5	36.1	0	0	0	0	125.6
190	P	32.3	Very low	29.1	Very low	114 Å²	114	139.8 Å²	139.8	74%	0.74	79%	0.787	S	S	*	*			trans	-104.5	150.5	-164.7	39.9	-30.4	0	0	0	114.7
191	V	30.3	Very low	29.1	Very low	123 Å²	123	143.7 Å²	143.7	75%	0.745	80%	0.795	S	S	*	*			trans	-150.9	110.2	176.6	-178	0	0	0	0	114.1
192	K	30.4	Very low	29	Very low	153 Å²	153	145.1 Å²	145.1	67%	0.665	79%	0.793	S	S	*	*			trans	75	121.9	135.9	-72.8	172.2	-179.7	165.9	0	123.5
193	R	30.3	Very low	29.3	Very low	211 Å²	211	146.2 Å²	146.2	80%	0.796	79%	0.788	S	S	*	*				113.2	128.5	115.1	-83.8	169.3	-171.6	152.9	-4.5	118.5
194	T	28.1	Very low	29.2	Very low	140 Å²	140	147.5 Å²	147.5	86%	0.859	79%	0.786	S	S	*	*			trans	-72.7	176.2	-173.4	8.6	0	0	0	0	115.5
195	P	31.5	Very low	29.6	Very low	122 Å²	122	147.6 Å²	147.6	79%	0.792	78%	0.784	S	S	*	*			trans	-109.2	176.9	-148.3	40.5	-27.7	0	0	0	114.4
196	A	30.7	Very low	29.8	Very low	106 Å²	106	146 Å²	146	88%	0.876	78%	0.783	S	S	*	*			trans	-137.2	151.7	170.6	0	0	0	0	0	111.9
197	S	26.6	Very low	29.7	Very low	89 Å²	89	145.9 Å²	145.9	62%	0.622	78%	0.782	S	S	*	*			trans	-111.7	168.3	-153.1	50.1	0	0	0	0	115.1
198	F	24.6	Very low	30	Very low	190 Å²	190	143.7 Å²	143.7	83%	0.833	78%	0.776	S	S	*	*			trans	75.9	120.6	153.2	-65.2	-70.5	0	0	0	120.1
199	Q	28.8	Very low	29.8	Very low	174 Å²	174	144.5 Å²	144.5	81%	0.813	77%	0.771	S	S	*	*				164.7	114.8	104.5	-103.6	170.6	16.5	0	0	114.2
200	T	27	Very low	29.8	Very low	122 Å²	122	143.2 Å²	143.2	75%	0.748	76%	0.763	S	S	*	*			trans	39.1	117.4	130.1	56.3	0	0	0	0	122.4
201	R	27.6	Very low	29.5	Very low	253 Å²	253	144.9 Å²	144.9	96%	0.955	77%	0.765	S	S	*	*				162.3	133.5	108.2	-104.9	-177.5	171	167.4	-3	113.1
202	N	25.3	Very low	29.4	Very low	151 Å²	151	144.2 Å²	144.2	81%	0.807	77%	0.766	S	S	*	*			trans	-85.6	-172.7	173.6	-125.6	1	0	0	0	110.6
203	P	35.4	Very low	29.3	Very low	90 Å²	90	144.6 Å²	144.6	58%	0.584	78%	0.775	S	S	*	*				-138.9	-179.1	-52.1	29.1	-5.7	0	0	0	115.6
204	Y	26.9	Very low	29.2	Very low	224 Å²	224	142.3 Å²	142.3	88%	0.878	78%	0.778	S	S	*	*			trans	97.2	137.6	154.6	-74.9	-78.7	0	0	0	124.5
205	P	39.8	Very low	29.2	Very low	105 Å²	105	142.8 Å²	142.8	68%	0.682	77%	0.77	S	S	*	*			trans	-110.9	-172.2	-177.3	42.5	-26.7	0	0	0	113.8
206	P	31.9	Very low	29.3	Very low	114 Å²	114	145.3 Å²	145.3	74%	0.74	77%	0.769	S	S	*	*				-156.9	161.6	126.8	36.3	-16.2	0	0	0	118.9
207	L	27.5	Very low	29.2	Very low	152 Å²	152	144.3 Å²	144.3	80%	0.796	76%	0.755	S	S	*	*			trans	64.6	121.4	141.5	-97.9	71.5	0	0	0	122.2
208	D	33.4	Very low	29.4	Very low	131 Å²	131	146.5 Å²	146.5	70%	0.701	76%	0.76	S	S	*	*				168.8	136.2	101.7	-93.5	-21.9	0	0	0	116
209	N	30.7	Very low	29.5	Very low	132 Å²	132	144.3 Å²	144.3	71%	0.706	76%	0.756	S	S	*	*			trans	83.3	96.9	142.4	-70.8	-28.9	0	0	0	125.5
210	V	27	Very low	29.4	Very low	112 Å²	112	145.2 Å²	145.2	68%	0.679	76%	0.758	S	S	*	*				17.3	132	123.4	-93.5	0	0	0	0	123.4
211	N	26.4	Very low	29.3	Very low	148 Å²	148	144 Å²	144	79%	0.791	76%	0.759	S	S	*	*			trans	77.3	117.5	132.5	-67.5	-22.4	0	0	0	122.9
212	S	27.2	Very low	29.4	Very low	110 Å²	110	138.6 Å²	138.6	77%	0.769	76%	0.755	S	S	*	*			trans	139.1	130.4	136.7	70.9	0	0	0	0	108.8
213	L	29.3	Very low	29.4	Very low	160 Å²	160	140.2 Å²	140.2	84%	0.838	76%	0.757	S	S	*	*				-174.6	120.8	66.1	-158.7	83.2	0	0	0	109.4
214	L	27.4	Very low	29.3	Very low	164 Å²	164	141.7 Å²	141.7	86%	0.859	77%	0.769	S	S	*	*			trans	-63.8	139.7	156.8	-88.1	142.4	0	0	0	109.8
215	Q	29	Very low	29.2	Very low	150 Å²	150	137.8 Å²	137.8	70%	0.701	76%	0.764	S	S	*	*			trans	170.2	134	132.4	-98.4	176.7	25.7	0	0	115.5
216	K	32.2	Very low	28.6	Very low	175 Å²	175	139.9 Å²	139.9	76%	0.761	77%	0.769	S	S	*	*			trans	79.8	140	144.5	-70.3	163.8	178.5	157.4	0	119
217	S	29.5	Very low	28.5	Very low	84 Å²	84	141.6 Å²	141.6	59%	0.587	78%	0.777	S	S	*	*			cis	167.4	154.2	-16.2	45.1	0	0	0	0	108.7
218	N	31.1	Very low	28.3	Very low	135 Å²	135	143.4 Å²	143.4	72%	0.722	78%	0.779	S	S	*	*			trans	96	106.6	155.5	-50.9	-33	0	0	0	118.3
219	L	25.8	Very low	28.2	Very low	145 Å²	145	142.4 Å²	142.4	76%	0.759	78%	0.779	S	S	*	*				64.2	123.7	85.9	-80	159.7	0	0	0	113.4
220	F	27.6	Very low	27.9	Very low	193 Å²	193	141.9 Å²	141.9	85%	0.846	79%	0.786	S	S	*	*				-163	154.8	74.3	-87	-87.1	0	0	0	113.9
221	A	25.1	Very low	27.6	Very low	95 Å²	95	147.5 Å²	147.5	79%	0.785	80%	0.797	S	S	*	*			trans	-109.3	142.8	165.3	0	0	0	0	0	110.6
222	V	30.1	Very low	27.7	Very low	141 Å²	141	146.2 Å²	146.2	86%	0.855	80%	0.797	S	S	*	*			trans	-145.4	129.1	168.3	178.6	0	0	0	0	110.6
223	Q	25.3	Very low	27.5	Very low	185 Å²	185	148 Å²	148	86%	0.864	80%	0.803	S	S	*	*			trans	-76.8	154.2	174.3	-66.9	169.4	-30.8	0	0	112.7
224	S	33	Very low	27.4	Very low	120 Å²	120	144.1 Å²	144.1	84%	0.839	79%	0.793	S	S	*	*			trans	-169.6	133.3	140	53.8	0	0	0	0	113.4
225	D	24.5	Very low	27.2	Very low	142 Å²	142	141.1 Å²	141.1	76%	0.759	79%	0.786	S	S	*	*			trans	-65.5	167.7	-179	-65.3	-59.9	0	0	0	117.1
226	N	26.3	Very low	26.9	Very low	149 Å²	149	139.4 Å²	139.4	80%	0.797	79%	0.789	S	S	*	*			trans	74.6	104.4	151.2	-61.6	-40.5	0	0	0	119.2
227	V	30.9	Very low	26.6	Very low	150 Å²	150	139.5 Å²	139.5	91%	0.909	80%	0.797	S	S	*	*				-164.9	126	127.5	176.5	0	0	0	0	109.8
228	K	22.5	Very low	26.5	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.826	81%	0.807	S	S	*	*			trans	-108.8	174.1	162.6	-139.6	-175.2	-172.8	179.9	0	106.5
229	P	31	Very low	26.1	Very low	110 Å²	110	141.1 Å²	141.1	71%	0.714	81%	0.808	S	S	*	*				-117.6	170	-62.9	30.2	-12.1	0	0	0	112.4
230	S	25	Very low	26.1	Very low	122 Å²	122	143.1 Å²	143.1	85%	0.853	81%	0.811	S	S	*	*			trans	178	121.7	145.9	-89.5	0	0	0	0	112.9
231	Y	21	Very low	26.2	Very low	230 Å²	230	141.3 Å²	141.3	90%	0.902	81%	0.809	S	S	*	*			trans	-85.4	144.4	162.9	-77.2	-92.7	0	0	0	110.2
232	P	27.1	Very low	26.2	Very low	121 Å²	121	144.8 Å²	144.8	79%	0.786	81%	0.809	S	S	*	*			trans	-107.1	115.9	148.7	29.8	-16.6	0	0	0	110	A234	P232-A234 PolarHBondContact O-N 3.31Å
233	V	23.4	Very low	26.1	Very low	148 Å²	148	142.2 Å²	142.2	90%	0.897	79%	0.794	S	S	*	*			trans	-71.1	114.5	157.2	172.1	0	0	0	0	107
234	A	26.9	Very low	26.2	Very low	77 Å²	77	140.8 Å²	140.8	64%	0.636	79%	0.787	S	S	*	*			trans	-157.3	112.1	162.9	0	0	0	0	0	109.5	P232	P232-A234 PolarHBondContact O-N 3.31Å
235	S	23.2	Very low	26.2	Very low	102 Å²	102	140 Å²	140	71%	0.713	78%	0.777	S	S	*	*			trans	31.1	115.7	134	60.7	0	0	0	0	117.8
236	C	24.1	Very low	26.3	Very low	113 Å²	113	140.9 Å²	140.9	76%	0.764	78%	0.782	S	S	*	*				158.3	123.2	115.7	-82.8	0	0	0	0	109.8	S238	C236-S238 PolarHBondContact O-N 3.48Å
237	L	25.8	Very low	26.5	Very low	178 Å²	178	139.1 Å²	139.1	93%	0.932	78%	0.777	S	S	*	*			trans	-47.7	126.5	155	-70.8	159.9	0	0	0	108.8
238	S	27.4	Very low	26.3	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	77%	0.771	S	S	*	*			trans	-156.4	122.4	160	-76.4	0	0	0	0	109.3	C236	C236-S238 PolarHBondContact O-N 3.48Å
239	N	23.1	Very low	26.8	Very low	140 Å²	140	133.6 Å²	133.6	75%	0.749	77%	0.766	S	S	*	*			trans	-25.5	165.1	172.6	-60	-22.4	0	0	0	118
240	F	25.5	Very low	26.8	Very low	186 Å²	186	134 Å²	134	82%	0.816	77%	0.768	S	S	*	*			trans	99.9	96.6	160.7	-57.9	-77.8	0	0	0	116.6
241	L	28.7	Very low	27.2	Very low	155 Å²	155	132.7 Å²	132.7	81%	0.812	77%	0.765	S	S	*	*				-162	84.7	123.4	-104.6	151.8	0	0	0	108.1	V243	L241-V243 VanDerWaalsContact C-N 3.3Å; L241-V243 HydrophobicContact CB-CG2 4Å; L241-V243 HydrophobicContact CD2-CG2 3.44Å; L241-V243 VanDerWaalsContact CD2-CG2 3.44Å; L241-V243 HydrophobicContact CG-CG2 4.31Å; L241-V243 PolarHBondContact O-N 3.44Å; L241-V243 VanDerWaalsContact O-N 3.08Å
242	E	26	Very low	27.8	Very low	168 Å²	168	126.6 Å²	126.6	79%	0.785	75%	0.752	S	S	*	*			trans	-62.9	97.9	155.6	-170.7	172.1	-150.2	0	0	105.8
243	V	28.6	Very low	28	Very low	87 Å²	87	126.6 Å²	126.6	53%	0.527	75%	0.752	S	S	.	*			trans	-106.5	101.1	174.6	177.8	0	0	0	0	106.2	L241 T245	L241-V243 VanDerWaalsContact C-N 3.3Å; L241-V243 HydrophobicContact CB-CG2 4Å; L241-V243 HydrophobicContact CD2-CG2 3.44Å; L241-V243 VanDerWaalsContact CD2-CG2 3.44Å; L241-V243 HydrophobicContact CG-CG2 4.31Å; L241-V243 PolarHBondContact O-N 3.44Å; L241-V243 VanDerWaalsContact O-N 3.08Å; V243-T245 HydrophobicContact CG1-CG2 3.53Å; V243-T245 PolarHBondContact O-N 3.3Å; V243-T245 VanDerWaalsContact O-N 3.1Å
244	H	26	Very low	28.5	Very low	156 Å²	156	125.4 Å²	125.4	72%	0.722	74%	0.741	S	S	*	*			trans	-63.7	102.3	161	-69.4	-81	0	0	0	107.9
245	T	32.3	Very low	28.6	Very low	102 Å²	102	126.3 Å²	126.3	63%	0.626	75%	0.748	S	S	*	*			trans	-120.3	86.9	165.8	42.7	0	0	0	0	108.6	V243 T247	V243-T245 HydrophobicContact CG1-CG2 3.53Å; V243-T245 PolarHBondContact O-N 3.3Å; V243-T245 VanDerWaalsContact O-N 3.1Å; T245-T247 PolarHBondContact O-N 3Å
246	D	27	Very low	28.9	Very low	162 Å²	162	129.6 Å²	129.6	87%	0.866	76%	0.755	S	S	*	*			trans	-65	72.2	158.8	-70.2	-33.1	0	0	0	108.8
247	T	30.6	Very low	29.2	Very low	112 Å²	112	132.1 Å²	132.1	69%	0.687	76%	0.76	S	S	*	*			trans	-156.2	98.2	173	5.2	0	0	0	0	108.8	T245	T245-T247 PolarHBondContact O-N 3Å
248	S	27.4	Very low	29.3	Very low	112 Å²	112	126.8 Å²	126.8	78%	0.783	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-52.8	140	172.1	2.7	0	0	0	0	110.4
249	P	32.3	Very low	29.2	Very low	112 Å²	112	133.2 Å²	133.2	73%	0.727	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-64.1	144.5	176.4	26.7	-32.3	0	0	0	110.2	A251	P249-A251 PolarHBondContact O-N 3.28Å
250	P	31.5	Very low	29.5	Very low	117 Å²	117	134.1 Å²	134.1	76%	0.76	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-65.9	122.6	178.6	26.4	-31.2	0	0	0	110	T252	P250-T252 PolarHBondContact O-N 3.49Å
251	A	34.1	Very low	29.7	Very low	96 Å²	96	133.4 Å²	133.4	79%	0.793	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-57.9	133.4	173.8	0	0	0	0	0	110.8	P249	P249-A251 PolarHBondContact O-N 3.28Å
252	T	33.3	Very low	29.9	Very low	102 Å²	102	133.4 Å²	133.4	63%	0.626	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-64.3	133.2	177.7	-1	0	0	0	0	110.1	P250 N254	P250-T252 PolarHBondContact O-N 3.49Å; T252-N254 PolarHBondContact O-N 2.92Å
253	P	30.6	Very low	30	Very low	121 Å²	121	130.3 Å²	130.3	79%	0.786	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-70.6	120.1	178.8	27.4	-30.2	0	0	0	110.1	A255	P253-A255 PolarHBondContact O-N 3.43Å
254	N	33.3	Very low	29.9	Very low	122 Å²	122	131.2 Å²	131.2	65%	0.652	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-58.9	120.4	171.7	-94	-10	0	0	0	109.7	R100 T252	R100-N254 PolarHBondContact NH1-OD1 3.3Å; T252-N254 PolarHBondContact O-N 2.92Å
255	A	30.8	Very low	30.2	Very low	97 Å²	97	129.3 Å²	129.3	80%	0.802	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-76.6	138.1	174.8	0	0	0	0	0	111.2	P253	P253-A255 PolarHBondContact O-N 3.43Å
256	M	28	Very low	30	Very low	171 Å²	171	130.9 Å²	130.9	84%	0.842	77%	0.768	S	S	*	*	S	Bend	trans	88.8	76	151.4	-139.7	147.7	78	0	0	118
257	N	30.2	Very low	30.2	Very low	165 Å²	165	133 Å²	133	88%	0.882	77%	0.77	S	S	*	*	S	Bend	trans	152.5	76	132.5	-77.9	-16.1	0	0	0	111
258	G	28.8	Very low	30.3	Very low	66 Å²	66	132.5 Å²	132.5	68%	0.68	77%	0.771	S	S	*	*			trans	-166.8	98.6	172.6	0	0	0	0	0	110.6	L260	G258-L260 VanDerWaalsContact C-N 3.34Å; G258-L260 PolarHBondContact O-N 2.89Å
259	Y	25.1	Very low	30.4	Very low	249 Å²	249	134.8 Å²	134.8	98%	0.976	78%	0.775	S	S	*	*			trans	-61.4	98.7	161.6	-80.3	-96.7	0	0	0	107.4	E261	Y259-E261 PolarHBondContact O-N 3.06Å
260	L	30.3	Very low	30.4	Very low	159 Å²	159	134.2 Å²	134.2	83%	0.832	78%	0.779	S	S	*	*			trans	-90.2	94.6	166	-102.3	158.9	0	0	0	107.7	G258 I262	G258-L260 VanDerWaalsContact C-N 3.34Å; G258-L260 PolarHBondContact O-N 2.89Å; L260-I262 PolarHBondContact O-N 2.95Å; L260-I262 VanDerWaalsContact O-N 3.11Å
261	E	29	Very low	30.3	Very low	170 Å²	170	136 Å²	136	79%	0.794	78%	0.783	S	S	*	*			trans	-63.4	100.6	163.8	-169.9	175.8	-162	0	0	107.8	Y259 V263	Y259-E261 PolarHBondContact O-N 3.06Å; E261-V263 VanDerWaalsContact C-N 3.34Å; E261-V263 HydrophobicContact CG-CG2 4.45Å; E261-V263 PolarHBondContact O-N 3.39Å
262	I	31.9	Very low	30	Very low	156 Å²	156	138.5 Å²	138.5	80%	0.8	79%	0.788	S	S	*	*			trans	-75.1	94.2	172.5	-57.9	176.3	0	0	0	107.1	L260 P264	L260-I262 PolarHBondContact O-N 2.95Å; L260-I262 VanDerWaalsContact O-N 3.11Å; I262-P264 WeakPolarHBondContact O-CD 3.35Å
263	V	28.9	Very low	29.6	Very low	103 Å²	103	141.5 Å²	141.5	62%	0.624	80%	0.799	S	S	*	*			trans	-66.9	121.8	166.9	177.4	0	0	0	0	108.2	E261 S265	E261-V263 VanDerWaalsContact C-N 3.34Å; E261-V263 HydrophobicContact CG-CG2 4.45Å; E261-V263 PolarHBondContact O-N 3.39Å; V263-S265 PolarHBondContact O-N 3.49Å; V263-S265 VanDerWaalsContact O-N 3.08Å
264	P	27.6	Very low	29.6	Very low	105 Å²	105	141 Å²	141	68%	0.682	80%	0.795	S	S	*	*			trans	-77.8	97	177.9	29.9	-30.1	0	0	0	109.4	I262 N266	I262-P264 WeakPolarHBondContact O-CD 3.35Å; P264-N266 PolarHBondContact O-N 3.03Å
265	S	31.9	Very low	29.4	Very low	117 Å²	117	141.1 Å²	141.1	82%	0.818	81%	0.806	S	S	*	*			trans	-80.8	91	165.1	47.3	0	0	0	0	109.7	V263	V263-S265 PolarHBondContact O-N 3.49Å; V263-S265 VanDerWaalsContact O-N 3.08Å
266	N	28.5	Very low	29.1	Very low	134 Å²	134	144.4 Å²	144.4	72%	0.717	81%	0.809	S	S	*	*			trans	-52.8	129.2	161	-69.9	-38.6	0	0	0	111	P264	P264-N266 PolarHBondContact O-N 3.03Å
267	F	30.8	Very low	29	Very low	206 Å²	206	144.9 Å²	144.9	90%	0.904	81%	0.81	S	S	*	*			trans	177.6	88.6	146.4	-85.2	-62	0	0	0	107.3
268	S	32.6	Very low	28.8	Very low	102 Å²	102	144.9 Å²	144.9	71%	0.713	81%	0.81	S	S	*	*				70.1	106.2	94.1	77.5	0	0	0	0	116.2
269	D	29.6	Very low	28.8	Very low	161 Å²	161	147.6 Å²	147.6	86%	0.861	82%	0.818	S	S	*	*			trans	31.6	120.6	146.5	-69.4	-23.7	0	0	0	121.6
270	A	31.5	Very low	28.8	Very low	99 Å²	99	144 Å²	144	82%	0.818	81%	0.814	S	S	*	*			trans	-149.3	112	132	0	0	0	0	0	110.5
271	D	28.6	Very low	28.6	Very low	156 Å²	156	143 Å²	143	83%	0.834	81%	0.81	S	S	*	*			trans	-26.1	120.2	167.2	-60.7	-60.1	0	0	0	117.7
272	V	28	Very low	28.6	Very low	148 Å²	148	143.5 Å²	143.5	90%	0.897	82%	0.815	S	S	*	*			trans	-152.4	97.6	138.1	-173.2	0	0	0	0	110.1
273	L	26.7	Very low	28.4	Very low	164 Å²	164	144 Å²	144	86%	0.859	81%	0.814	S	S	*	*			trans	-153.7	159	151.6	-95	172.6	0	0	0	105.8
274	P	30.3	Very low	28.3	Very low	110 Å²	110	146.9 Å²	146.9	71%	0.714	82%	0.82	S	S	*	*			cis	-134.6	163.1	-10.6	35.5	-17.4	0	0	0	113.1
275	S	27.7	Very low	28.3	Very low	125 Å²	125	150.9 Å²	150.9	87%	0.874	83%	0.827	S	S	*	*			trans	-136.2	74.8	159.8	63.5	0	0	0	0	110.8
276	L	24.3	Very low	28	Very low	166 Å²	166	153.5 Å²	153.5	87%	0.869	83%	0.829	S	S	*	*			trans	-95.1	111.2	152.3	-90.7	161.6	0	0	0	106.1
277	E	26	Very low	27.9	Very low	182 Å²	182	152.4 Å²	152.4	85%	0.85	83%	0.829	S	S	*	*			trans	154.6	100	155.6	-90.5	175.1	-174.3	0	0	109.1
278	N	25.8	Very low	27.7	Very low	165 Å²	165	146.9 Å²	146.9	88%	0.882	82%	0.816	S	S	*	*			trans	164	95.4	142.8	-86.8	-31.1	0	0	0	111.4
279	S	28.9	Very low	27.5	Very low	122 Å²	122	147.5 Å²	147.5	85%	0.853	82%	0.82	S	S	*	*			trans	-178.1	58.3	134.8	42	0	0	0	0	111.2	N281	S279-N281 PolarHBondContact O-N 2.9Å
280	L	25.1	Very low	27.3	Very low	173 Å²	173	144.4 Å²	144.4	91%	0.906	81%	0.809	S	S	*	*			trans	-73.4	96.5	147.6	-111.7	143.8	0	0	0	106.8
281	N	27.6	Very low	27	Very low	139 Å²	139	146.9 Å²	146.9	74%	0.743	81%	0.807	S	S	*	*			trans	165	102.7	151.3	-98.9	-36.2	0	0	0	111	S279	S279-N281 PolarHBondContact O-N 2.9Å
282	M	29.4	Very low	26.8	Very low	181 Å²	181	146.7 Å²	146.7	89%	0.892	81%	0.806	S	S	*	*				-159.4	83.6	129.2	-87	-48.9	-159.4	0	0	107.1
283	Q	26.1	Very low	26.7	Very low	167 Å²	167	147.3 Å²	147.3	78%	0.78	80%	0.799	S	S	*	*			trans	-58.6	158.7	144.9	-79.3	174.2	-16.8	0	0	109
284	Q	27	Very low	26.8	Very low	163 Å²	163	150.2 Å²	150.2	76%	0.762	81%	0.805	S	S	*	*			trans	93.1	107.9	179.3	-54.6	169.1	2.1	0	0	111.5
285	F	27	Very low	26.7	Very low	188 Å²	188	153.5 Å²	153.5	83%	0.825	81%	0.808	S	S	*	*			cis	-147.4	122.6	38.2	-82.2	-99.7	0	0	0	110.8
286	M	26.3	Very low	26.7	Very low	172 Å²	172	156.2 Å²	156.2	85%	0.847	80%	0.804	S	S	*	*			trans	-75	149.3	143.8	-75.5	-149.9	85.7	0	0	108.2
287	P	26.7	Very low	26.9	Very low	112 Å²	112	155.6 Å²	155.6	73%	0.727	80%	0.801	S	S	*	*			trans	-119.5	105.9	131.2	14.6	3.7	0	0	0	108.8
288	S	25.8	Very low	27	Very low	89 Å²	89	154.1 Å²	154.1	62%	0.622	79%	0.792	S	S	*	*				39.2	115.5	121.8	-35.8	0	0	0	0	117.2	P290	S288-P290 VanDerWaalsContact O-CD 3.32Å; S288-P290 WeakPolarHBondContact O-CD 3.46Å
289	S	28.9	Very low	27.2	Very low	116 Å²	116	154.9 Å²	154.9	81%	0.811	78%	0.783	S	S	*	*			trans	-47.1	138.8	149.3	113.9	0	0	0	0	109.3
290	P	24.9	Very low	27.2	Very low	95 Å²	95	154.2 Å²	154.2	62%	0.617	78%	0.779	S	S	*	*				-147.8	140	122.3	28	-7.1	0	0	0	114.4	S288	S288-P290 VanDerWaalsContact O-CD 3.32Å; S288-P290 WeakPolarHBondContact O-CD 3.46Å
291	I	25.4	Very low	27.3	Very low	151 Å²	151	149.6 Å²	149.6	77%	0.774	77%	0.773	S	S	*	*				64.9	112.2	122.2	-54.9	166.3	0	0	0	117
292	D	25.2	Very low	27.5	Very low	152 Å²	152	147.8 Å²	147.8	81%	0.813	77%	0.771	S	S	*	*				30.4	143.8	122	-111.4	-25	0	0	0	120
293	E	25.8	Very low	27.6	Very low	161 Å²	161	146.8 Å²	146.8	75%	0.752	76%	0.764	S	S	*	*			trans	95.3	85.6	170.6	-57.4	-166.4	139.3	0	0	118.3
294	F	29.6	Very low	27.7	Very low	226 Å²	226	145.4 Å²	145.4	99%	0.991	76%	0.761	S	S	*	*				-125.5	70.8	128.6	-87.6	-79.8	0	0	0	110
295	K	26.6	Very low	27.8	Very low	178 Å²	178	143.1 Å²	143.1	77%	0.774	76%	0.759	S	S	*	*			trans	-85.7	137.3	152.9	-104	177.5	-178	166.2	0	108.2
296	K	27.6	Very low	27.7	Very low	182 Å²	182	145.3 Å²	145.3	79%	0.791	76%	0.761	S	S	*	*			trans	71.4	121.5	156.4	-67.2	173.8	172.5	178.7	0	117.6
297	L	29.1	Very low	27.8	Very low	154 Å²	154	142.3 Å²	142.3	81%	0.806	76%	0.757	S	S	*	*				175.1	94.9	119.4	-89.5	154.3	0	0	0	106.9
298	K	28.8	Very low	27.9	Very low	150 Å²	150	141.8 Å²	141.8	65%	0.652	76%	0.757	S	S	*	*				84.7	139.7	81	-86.9	-157.6	-178.7	176.5	0	114.1
299	Y	29.2	Very low	28.2	Very low	181 Å²	181	143.9 Å²	143.9	71%	0.71	76%	0.761	S	S	*	*			trans	85.7	133.6	161.4	-57.5	-71	0	0	0	116.1
300	S	28.1	Very low	28.2	Very low	109 Å²	109	146.4 Å²	146.4	76%	0.762	76%	0.757	S	S	*	*			cis	-177.9	141.7	-12.8	-124.2	0	0	0	0	107.2
301	G	28.5	Very low	28.5	Very low	76 Å²	76	149.7 Å²	149.7	78%	0.784	76%	0.764	S	S	*	*			trans	79.7	138.1	157.5	0	0	0	0	0	114.8
302	S	32.1	Very low	28.5	Very low	100 Å²	100	147.7 Å²	147.7	70%	0.699	76%	0.759	S	S	*	*			cis	173.7	151.7	13.4	63.5	0	0	0	0	103.6
303	H	30.5	Very low	28.5	Very low	160 Å²	160	151.5 Å²	151.5	74%	0.741	76%	0.763	S	S	*	*			cis	-162.8	142.8	22	-103.4	-61	0	0	0	106.6
304	L	27.5	Very low	28.7	Very low	139 Å²	139	147.5 Å²	147.5	73%	0.728	77%	0.765	S	S	*	*			trans	37	124.1	131.1	-87.6	91.4	0	0	0	118
305	T	30.2	Very low	28.5	Very low	115 Å²	115	142.3 Å²	142.3	71%	0.706	76%	0.757	S	S	*	*				-177.3	130.6	57.7	18.8	0	0	0	0	108.8
306	R	25.4	Very low	28.6	Very low	233 Å²	233	144.2 Å²	144.2	88%	0.879	76%	0.759	S	S	*	*				84.3	124	107.1	-163.8	178.2	-173.2	-177.6	2.1	112.6
307	S	28.1	Very low	28.5	Very low	109 Å²	109	142.1 Å²	142.1	76%	0.762	76%	0.757	S	S	*	*			cis	-165.9	152.2	12.4	38.1	0	0	0	0	111.1
308	S	29.7	Very low	28.3	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	75%	0.749	S	S	*	*			trans	-89.5	162.5	171.5	52.6	0	0	0	0	113.7
309	N	30.5	Very low	28	Very low	132 Å²	132	137.6 Å²	137.6	71%	0.706	75%	0.752	S	S	*	*			trans	-169.5	120.8	143.7	-91.9	-22.6	0	0	0	108.8
310	K	28.7	Very low	27.8	Very low	170 Å²	170	136.2 Å²	136.2	74%	0.739	76%	0.755	S	S	*	*				69.2	129.8	90.3	-76.5	-175.4	-179.2	179.8	0	111
311	E	31.6	Very low	27.7	Very low	164 Å²	164	135.6 Å²	135.6	77%	0.766	75%	0.75	S	S	*	*			cis	-156.3	141.3	36.1	-94.4	132.3	-163.8	0	0	107.3
312	V	25.2	Very low	27.5	Very low	109 Å²	109	136 Å²	136	66%	0.661	75%	0.747	S	S	*	*				63.9	129.2	62.3	-158.5	0	0	0	0	114.6
313	Y	26.7	Very low	27.2	Very low	232 Å²	232	139.7 Å²	139.7	91%	0.91	75%	0.753	S	S	*	*			trans	87.9	128.7	159.5	-77.9	-73.2	0	0	0	120
314	G	29.7	Very low	27	Very low	76 Å²	76	136.6 Å²	136.6	78%	0.784	75%	0.749	S	S	*	*			trans	163.3	43.1	155.6	0	0	0	0	0	119.9
315	S	24.1	Very low	27	Very low	118 Å²	118	136 Å²	136	83%	0.825	75%	0.751	S	S	*	*			trans	-56.9	133.8	158.9	-57.6	0	0	0	0	111
316	R	28.9	Very low	26.9	Very low	218 Å²	218	136.5 Å²	136.5	82%	0.823	75%	0.754	S	S	*	*			trans	160.8	129.5	135.4	-95.3	172	170.5	164.8	-2.2	112.3
317	N	25.6	Very low	27.2	Very low	138 Å²	138	133 Å²	133	74%	0.738	75%	0.752	S	S	*	*			trans	65.6	140.7	135.2	-56.7	-3.2	0	0	0	116.3
318	S	24.3	Very low	27.1	Very low	93 Å²	93	133.4 Å²	133.4	65%	0.65	75%	0.746	S	S	*	*			cis	170	151.1	4.7	51.9	0	0	0	0	104.2
319	V	24.3	Very low	27.3	Very low	115 Å²	115	135.3 Å²	135.3	70%	0.697	75%	0.748	S	S	*	*			trans	80.9	124.7	131.8	161.8	0	0	0	0	118.4
320	I	25.3	Very low	27.2	Very low	153 Å²	153	136.5 Å²	136.5	79%	0.785	75%	0.749	S	S	*	*			trans	75.9	140.3	145.2	-69.4	172.7	0	0	0	115.8
321	S	25.4	Very low	27.4	Very low	95 Å²	95	133.9 Å²	133.9	66%	0.664	75%	0.752	S	S	*	*			cis	-170	159.1	-0.9	-105.4	0	0	0	0	106.8
322	A	24.3	Very low	27.3	Very low	85 Å²	85	130.8 Å²	130.8	70%	0.702	75%	0.748	S	S	*	*				40.9	131	113.4	0	0	0	0	0	114.9
323	E	26.3	Very low	27.5	Very low	178 Å²	178	133.2 Å²	133.2	83%	0.832	76%	0.756	S	S	*	*			cis	-175.5	143.6	43	-111	161.7	163.4	0	0	105.7
324	S	24.4	Very low	27.6	Very low	94 Å²	94	127.1 Å²	127.1	66%	0.657	75%	0.747	S	S	*	*				53.7	114.6	103.7	134.6	0	0	0	0	116.3
325	T	29.1	Very low	27.8	Very low	127 Å²	127	127.5 Å²	127.5	78%	0.779	74%	0.738	S	S	*	*				170.1	109.5	123.5	29.1	0	0	0	0	108.8
326	V	26.8	Very low	28	Very low	125 Å²	125	130.5 Å²	130.5	76%	0.758	74%	0.739	S	S	*	*				68.1	118.6	89.1	179.1	0	0	0	0	113.1
327	L	31.6	Very low	28.1	Very low	161 Å²	161	126.2 Å²	126.2	84%	0.843	74%	0.736	S	S	*	*				166.5	93.1	129.9	-85.7	170.3	0	0	0	108.1
328	N	27.9	Very low	28.2	Very low	117 Å²	117	130.3 Å²	130.3	63%	0.626	74%	0.742	S	S	*	*				66.3	118.3	85.9	-132.9	32.8	0	0	0	114.3
329	D	32.3	Very low	28.4	Very low	141 Å²	141	130.7 Å²	130.7	75%	0.754	74%	0.742	S	S	*	*			trans	168.6	93.5	130.1	-82.5	-11.7	0	0	0	108.9
330	Q	29.5	Very low	28.3	Very low	157 Å²	157	129.6 Å²	129.6	73%	0.734	74%	0.739	S	S	*	*				70.9	102.5	89.9	-74.9	-166	18.3	0	0	114.9
331	S	31.7	Very low	28.5	Very low	116 Å²	116	131.4 Å²	131.4	81%	0.811	74%	0.742	S	S	*	*				156.1	148.3	116.1	56.5	0	0	0	0	110.7
332	S	29.2	Very low	28.7	Very low	98 Å²	98	135 Å²	135	69%	0.685	75%	0.748	S	S	*	*			cis	178.3	155.7	-20.7	-77.6	0	0	0	0	105.1
333	I	30.2	Very low	28.8	Very low	161 Å²	161	138.3 Å²	138.3	83%	0.826	75%	0.749	S	S	*	*			trans	91.2	99	157.3	-57.7	144.1	0	0	0	115.4
334	S	29.7	Very low	28.9	Very low	103 Å²	103	139 Å²	139	72%	0.72	75%	0.751	S	S	*	*				94.8	134.4	78.7	-168.1	0	0	0	0	110.1
335	S	32.3	Very low	29	Very low	84 Å²	84	143.5 Å²	143.5	59%	0.587	76%	0.759	S	S	*	*			cis	-173.6	148.7	18.2	20	0	0	0	0	109.2
336	H	28.8	Very low	29	Very low	181 Å²	181	143.8 Å²	143.8	84%	0.838	76%	0.76	S	S	*	*			trans	57.8	127.6	141.1	-70.2	-64.7	0	0	0	118.5
337	V	31.4	Very low	28.9	Very low	128 Å²	128	146 Å²	146	78%	0.776	76%	0.762	S	S	*	*			cis	-164.6	137.8	44.1	172.8	0	0	0	0	108.9
338	R	27	Very low	28.8	Very low	225 Å²	225	145.6 Å²	145.6	85%	0.849	76%	0.76	S	S	*	*			trans	-125.6	149.2	152.1	-165.8	-179	-170.6	169.3	4	106.6
339	P	29	Very low	28.9	Very low	101 Å²	101	144.8 Å²	144.8	66%	0.656	76%	0.764	S	S	*	*				-142.9	150	123.2	29.1	-10.9	0	0	0	114.6
340	S	23.2	Very low	28.6	Very low	91 Å²	91	144.8 Å²	144.8	64%	0.636	77%	0.769	S	S	*	*			trans	-85.1	147.3	165	51.8	0	0	0	0	111.9
341	F	29.7	Very low	28.6	Very low	192 Å²	192	142.8 Å²	142.8	84%	0.842	77%	0.772	S	S	*	*			trans	-144.7	110.4	153.7	-75	-79.2	0	0	0	106.1
342	H	29.3	Very low	28.5	Very low	170 Å²	170	141.6 Å²	141.6	79%	0.787	76%	0.764	S	S	*	*				70.3	118.3	73.7	-124.4	50.8	0	0	0	115.3
343	E	24.8	Very low	28.6	Very low	155 Å²	155	143.9 Å²	143.9	72%	0.724	77%	0.768	S	S	*	*			trans	-15	148	169.9	-60.9	173.4	152	0	0	119.5
344	H	29.7	Very low	28.5	Very low	191 Å²	191	142.8 Å²	142.8	88%	0.884	76%	0.764	S	S	*	*				-159.3	125.9	128	-93.8	-61.9	0	0	0	112.8
345	K	25.7	Very low	28.8	Very low	190 Å²	190	145.2 Å²	145.2	83%	0.826	77%	0.767	S	S	*	*			trans	-78.8	134	171	-175.3	-177.6	-172.1	-178.5	0	109.6
346	V	30.1	Very low	28.7	Very low	133 Å²	133	147.9 Å²	147.9	81%	0.806	78%	0.775	S	S	*	*			trans	-139	112.6	165.2	-175.3	0	0	0	0	110.7
347	H	24.1	Very low	28.9	Very low	170 Å²	170	147 Å²	147	79%	0.787	78%	0.777	S	S	*	*			trans	-99.5	143.3	154.2	-104.6	-85.1	0	0	0	107.1
348	L	30.2	Very low	28.8	Very low	154 Å²	154	152 Å²	152	81%	0.806	78%	0.782	S	S	*	*			trans	173.3	104.5	150.7	-90.6	145.6	0	0	0	107.2
349	S	30.1	Very low	29	Very low	100 Å²	100	146.9 Å²	146.9	70%	0.699	78%	0.78	S	S	*	*				82.7	108.4	92.4	-60.5	0	0	0	0	115.6
350	T	24.9	Very low	28.9	Very low	141 Å²	141	148 Å²	148	87%	0.865	79%	0.785	S	S	*	*			trans	10.2	128.1	143.4	43.4	0	0	0	0	120.2
351	S	30.3	Very low	29.3	Very low	115 Å²	115	149.4 Å²	149.4	80%	0.804	80%	0.795	S	S	*	*			trans	-164.8	130.7	130.2	178.2	0	0	0	0	112.7
352	S	29.4	Very low	29.1	Very low	91 Å²	91	145.2 Å²	145.2	64%	0.636	79%	0.789	S	S	*	*			trans	-45.3	160.6	170.7	44.1	0	0	0	0	120.7
353	N	31.2	Very low	29.3	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	79%	0.794	S	S	*	*			trans	92.9	107.1	140.3	-73.4	-10.9	0	0	0	120.8
354	N	28.4	Very low	29.8	Very low	137 Å²	137	140.6 Å²	140.6	73%	0.733	80%	0.799	S	S	*	*				67.1	123.2	113.1	-133.5	-5.3	0	0	0	117.7
355	I	34.3	Very low	29.7	Very low	154 Å²	154	140.3 Å²	140.3	79%	0.79	80%	0.798	S	S	*	*				167.6	122.2	126	-81.9	152	0	0	0	109
356	N	30.1	Very low	30	Very low	140 Å²	140	138.8 Å²	138.8	75%	0.749	80%	0.798	S	S	*	*			trans	-34.9	139.1	163.8	-68.5	-38.1	0	0	0	113.8
357	N	34.1	Very low	30.2	Very low	163 Å²	163	138.9 Å²	138.9	87%	0.872	79%	0.793	S	S	*	*				-157.9	128.7	129.6	-95.3	-26.3	0	0	0	113.3
358	R	28.6	Very low	30.6	Very low	234 Å²	234	138.9 Å²	138.9	88%	0.883	79%	0.793	S	S	*	*			trans	-69.6	134.6	174.4	-176.6	-172.2	-152	-169.2	5.5	110.6
359	S	30.9	Very low	30.8	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	80%	0.799	S	S	*	*			trans	-156.4	105.4	152.9	39	0	0	0	0	111
360	V	27.7	Very low	30.8	Very low	126 Å²	126	141.7 Å²	141.7	76%	0.764	80%	0.798	S	S	*	*			trans	-72.9	139.2	160.9	176.2	0	0	0	0	107.8
361	S	31.7	Very low	31.2	Very low	120 Å²	120	141.9 Å²	141.9	84%	0.839	80%	0.799	S	S	*	*			trans	-144.2	109.3	160.1	-76.1	0	0	0	0	109.2
362	S	25.5	Very low	31.2	Very low	104 Å²	104	141.3 Å²	141.3	73%	0.727	80%	0.795	S	S	*	*			trans	-86.4	145.7	166.1	55	0	0	0	0	110.1
363	S	34.2	Very low	31.4	Very low	126 Å²	126	144.9 Å²	144.9	88%	0.881	81%	0.807	S	S	*	*			trans	-179.5	140.5	160.8	-75.1	0	0	0	0	106.5
364	A	33.8	Very low	31.5	Very low	101 Å²	101	146.6 Å²	146.6	84%	0.835	81%	0.807	S	S	*	*			cis	-168.1	152.6	-9.7	0	0	0	0	0	106.3
365	E	28	Very low	32	Very low	185 Å²	185	149.2 Å²	149.2	86%	0.864	82%	0.815	S	S	*	*			trans	-63.9	150.9	-179.6	-60.4	163.5	129.4	0	0	114.5
366	L	33.2	Very low	32	Very low	159 Å²	159	148.4 Å²	148.4	83%	0.832	81%	0.812	S	S	*	*			trans	-149.3	104.5	146.3	-83.1	179.1	0	0	0	113.7
367	I	33.9	Very low	32.1	Very low	135 Å²	135	146.8 Å²	146.8	69%	0.692	81%	0.812	S	S	*	*				70.2	104.7	126.3	-53	-179.7	0	0	0	122.2
368	H	31.9	Very low	31.9	Very low	169 Å²	169	144.3 Å²	144.3	78%	0.782	81%	0.807	S	S	*	*				31.2	126.6	129	-61.6	-86.2	0	0	0	123.1
369	K	34.1	Very low	32.1	Very low	216 Å²	216	138.6 Å²	138.6	94%	0.939	80%	0.803	S	S	*	*				-163	121.6	113.1	-115.2	171.4	-179.8	178.3	0	112.9
370	S	29.8	Very low	32.2	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	81%	0.805	S	S	*	*			trans	-96.9	142.6	176.7	45	0	0	0	0	111.6
371	V	33.3	Very low	32.5	Very low	145 Å²	145	136.1 Å²	136.1	88%	0.879	80%	0.802	S	S	*	*			trans	-142.2	118.4	143.1	-177.8	0	0	0	0	107.9
372	S	31.7	Very low	32.5	Very low	103 Å²	103	142.8 Å²	142.8	72%	0.72	81%	0.809	S	S	*	*			trans	-118.6	131.6	167.2	49.3	0	0	0	0	106.5
373	D	33.2	Very low	32.9	Very low	165 Å²	165	141 Å²	141	88%	0.882	81%	0.806	S	S	*	*			trans	-145.3	128.7	155.1	-103.3	-27.8	0	0	0	110.5
374	K	34.3	Very low	32.6	Very low	183 Å²	183	147 Å²	147	80%	0.796	81%	0.81	S	S	*	*			trans	-79.9	151.3	175	-64	-179.7	173	-176.9	0	109.1
375	H	38.3	Very low	32.4	Very low	191 Å²	191	147.5 Å²	147.5	88%	0.884	81%	0.808	S	S	*	*			trans	-158.7	133.2	137.6	-101.2	-65.4	0	0	0	111.9
376	D	34.8	Very low	32.3	Very low	137 Å²	137	145.9 Å²	145.9	73%	0.733	80%	0.804	S	S	*	*			trans	-68.8	164.7	179.5	-59.8	-71.3	0	0	0	114.7
377	S	30.8	Very low	32.1	Very low	106 Å²	106	144.9 Å²	144.9	74%	0.741	81%	0.805	S	S	*	*			trans	109.8	122.5	134.1	-57	0	0	0	0	119.4
378	S	30.9	Very low	31.8	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	81%	0.806	S	S	*	*			trans	82.2	107.5	135.4	-61.7	0	0	0	0	118.5
379	S	31.9	Very low	31.4	Very low	114 Å²	114	142 Å²	142	80%	0.797	81%	0.805	S	S	*	*				78.7	103.8	76.3	160.6	0	0	0	0	114.7
380	S	34	Very low	31.2	Very low	123 Å²	123	140.9 Å²	140.9	86%	0.86	80%	0.803	S	S	*	*				170	144.7	123.5	68.2	0	0	0	0	107.3
381	G	32.3	Very low	31	Very low	67 Å²	67	142.2 Å²	142.2	69%	0.691	81%	0.807	S	S	*	*			cis	158.4	150.4	7	0	0	0	0	0	108.1
382	R	33.7	Very low	30.7	Very low	260 Å²	260	141.6 Å²	141.6	98%	0.981	80%	0.803	S	S	*	*			trans	83.7	120.9	170.3	-60.1	178.3	164.7	-163.3	-4.1	115.8
383	G	32.1	Very low	30.6	Very low	66 Å²	66	141.7 Å²	141.7	68%	0.68	80%	0.802	S	S	*	*			cis	129.9	114.2	2.5	0	0	0	0	0	111.5
384	R	28	Very low	30.5	Very low	252 Å²	252	142.1 Å²	142.1	95%	0.951	80%	0.796	S	S	*	*			trans	55.8	145	144.8	-55.9	-179.5	164.7	-172.3	-5.9	116.9
385	S	30.1	Very low	30.2	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	79%	0.794	S	S	*	*			cis	-172.4	160.8	34.6	-166.1	0	0	0	0	110.2
386	L	25.6	Very low	29.6	Very low	150 Å²	150	136.1 Å²	136.1	79%	0.785	78%	0.781	S	S	*	*			trans	-64.9	147.7	174.4	-65.4	146.9	0	0	0	115.2
387	T	30.4	Very low	29.3	Very low	139 Å²	139	136.1 Å²	136.1	85%	0.853	78%	0.781	S	S	*	*			trans	-169.4	108.2	144.9	35.8	0	0	0	0	106
388	V	27.1	Very low	29.3	Very low	119 Å²	119	137.9 Å²	137.9	72%	0.721	79%	0.787	S	S	*	*				69.2	103.2	55.2	-177.3	0	0	0	0	114.6
389	T	23.6	Very low	29.1	Very low	123 Å²	123	138 Å²	138	76%	0.755	79%	0.788	S	S	*	*			trans	56.3	125.2	154.1	36.4	0	0	0	0	121.8
390	Q	28.7	Very low	29.2	Very low	193 Å²	193	138.3 Å²	138.3	90%	0.902	79%	0.788	S	S	*	*				-165.2	120.8	109	-109.4	176	-2	0	0	112.3
391	T	25.7	Very low	28.9	Very low	127 Å²	127	137.9 Å²	137.9	78%	0.779	78%	0.782	S	S	*	*			trans	-74.8	140.1	164.7	28.1	0	0	0	0	112
392	V	28.8	Very low	28.6	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	79%	0.785	S	S	*	*			trans	-146.8	123.5	147	-172.1	0	0	0	0	109.5
393	P	28.8	Very low	28.2	Very low	106 Å²	106	132.4 Å²	132.4	69%	0.688	77%	0.773	S	S	*	*			trans	-116.8	139.8	169.2	36	-23.7	0	0	0	112.4
394	F	30	Very low	27.9	Very low	173 Å²	173	136.8 Å²	136.8	76%	0.759	78%	0.78	S	S	*	*			trans	-157.2	115.2	159.4	-90	-79.5	0	0	0	107.7
395	Q	28.6	Very low	28	Very low	163 Å²	163	131.8 Å²	131.8	76%	0.762	77%	0.771	S	S	*	*				56.2	132.6	98.9	-66.7	-171.9	-3.8	0	0	113.2
396	S	26.5	Very low	27.8	Very low	86 Å²	86	133.8 Å²	133.8	60%	0.601	77%	0.768	S	S	*	*			cis	-179.9	166.7	5.9	40.8	0	0	0	0	108.1
397	N	27.8	Very low	27.9	Very low	137 Å²	137	133.3 Å²	133.3	73%	0.733	77%	0.765	S	S	*	*			trans	76.7	105.8	151	-60.3	-12.9	0	0	0	119.7
398	T	31.2	Very low	27.6	Very low	142 Å²	142	133.5 Å²	133.5	87%	0.871	76%	0.761	S	S	*	*				156.1	144.3	95.9	41.3	0	0	0	0	112.7
399	S	26.4	Very low	27.7	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	77%	0.767	S	S	*	*			trans	-70.6	167.4	-169.3	-21.5	0	0	0	0	115.2
400	P	33.4	Very low	27.6	Very low	120 Å²	120	137.8 Å²	137.8	78%	0.779	77%	0.772	S	S	*	*			trans	-85.3	168.3	-170.1	36.9	-34	0	0	0	113.1
401	P	29.2	Very low	27.8	Very low	113 Å²	113	133.5 Å²	133.5	73%	0.734	76%	0.761	S	S	*	*				-148.3	147.6	120.5	34	-15.8	0	0	0	115.9
402	S	24.4	Very low	27.8	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	76%	0.761	S	S	*	*				37.9	134	129	-38	0	0	0	0	122.1
403	S	26.5	Very low	27.7	Very low	103 Å²	103	132.8 Å²	132.8	72%	0.72	76%	0.755	S	S	*	*			trans	109.8	114.7	134.1	74	0	0	0	0	119.3
404	L	25.1	Very low	27.7	Very low	157 Å²	157	138 Å²	138	82%	0.822	76%	0.761	S	S	*	*				70.1	141.9	127.9	-69.1	168.7	0	0	0	120.7
405	L	29.2	Very low	27.6	Very low	147 Å²	147	135.9 Å²	135.9	77%	0.77	76%	0.758	S	S	*	*			trans	86.4	136.3	167	-58.9	155.8	0	0	0	115
406	E	27	Very low	27.6	Very low	156 Å²	156	133.5 Å²	133.5	73%	0.729	75%	0.754	S	S	*	*			cis	177.4	159.3	-18.1	-129.5	177.4	-175.4	0	0	103.8
407	L	27.4	Very low	27.7	Very low	139 Å²	139	134.6 Å²	134.6	73%	0.728	76%	0.758	S	S	*	*			trans	80.6	95.3	156.6	-65.5	152.3	0	0	0	119.3
408	N	24.8	Very low	27.8	Very low	143 Å²	143	136.5 Å²	136.5	77%	0.765	76%	0.762	S	S	*	*				29.4	127.5	111.2	-57.7	-20.3	0	0	0	117.4
409	T	28.2	Very low	27.7	Very low	137 Å²	137	134.4 Å²	134.4	84%	0.84	75%	0.745	S	S	*	*				168.5	125	99.5	-46.4	0	0	0	0	110.1
410	F	22.4	Very low	27.7	Very low	195 Å²	195	138.9 Å²	138.9	86%	0.855	75%	0.746	S	S	*	*			trans	-65.8	-168.5	165.2	-88.2	-87.4	0	0	0	111.5
411	P	32.5	Very low	27.6	Very low	104 Å²	104	138.3 Å²	138.3	68%	0.675	74%	0.742	S	S	*	*			cis	-144.3	175.9	5.9	43.4	-23.3	0	0	0	117.5
412	D	25.4	Very low	27.6	Very low	146 Å²	146	141.1 Å²	141.1	78%	0.781	75%	0.75	S	S	*	*			trans	60.5	118.6	133	-83.5	-25.9	0	0	0	125.1
413	S	27.9	Very low	27.6	Very low	97 Å²	97	143.3 Å²	143.3	68%	0.678	75%	0.748	S	S	*	*				124.9	129.8	101.9	67.4	0	0	0	0	119.8
414	R	28.5	Very low	27.7	Very low	215 Å²	215	145.5 Å²	145.5	81%	0.811	75%	0.746	S	S	*	*				90.1	128.3	128.5	-88.5	176.3	176.7	169.4	1.4	123
415	N	27.4	Very low	27.9	Very low	128 Å²	128	145 Å²	145	68%	0.684	74%	0.744	S	S	*	*			trans	80.3	139.5	135.2	-73.8	-2.3	0	0	0	117.4
416	T	29.4	Very low	27.6	Very low	113 Å²	113	143 Å²	143	69%	0.693	74%	0.743	S	S	*	*			cis	-175.4	131.1	25.5	9.5	0	0	0	0	107.2
417	T	27.2	Very low	27.7	Very low	110 Å²	110	141.6 Å²	141.6	68%	0.675	75%	0.75	S	S	*	*				68.3	119.1	94.5	-40	0	0	0	0	117.5
418	H	29.9	Very low	27.6	Very low	176 Å²	176	142.7 Å²	142.7	82%	0.815	75%	0.751	S	S	*	*			trans	-179.8	148.5	147.6	-87.6	-50.8	0	0	0	108.5
419	N	29.4	Very low	27.7	Very low	98 Å²	98	146 Å²	146	52%	0.524	76%	0.759	S	S	.	*			cis	-178.1	138.8	-25	-119.5	-4.2	0	0	0	108.2
420	Y	26.8	Very low	27.7	Very low	209 Å²	209	144 Å²	144	82%	0.82	75%	0.751	S	S	*	*			trans	85.5	149.8	147.2	-63.8	-60.6	0	0	0	125.9
421	P	30.8	Very low	28	Very low	108 Å²	108	146 Å²	146	70%	0.701	75%	0.752	S	S	*	*			trans	-127.1	179.2	-156.9	42	-22.2	0	0	0	114.4
422	I	29	Very low	27.6	Very low	173 Å²	173	150.6 Å²	150.6	89%	0.887	76%	0.762	S	S	*	*			trans	-146	135.6	159.5	-61.9	-175.1	0	0	0	110.8
423	E	25.2	Very low	27.8	Very low	156 Å²	156	148.9 Å²	148.9	73%	0.729	76%	0.761	S	S	*	*			trans	-76.3	156.8	179.8	-59.2	166.8	142	0	0	114.3
424	H	28.4	Very low	27.8	Very low	149 Å²	149	152.6 Å²	152.6	69%	0.69	77%	0.772	S	S	*	*				158	138.8	103.7	-108.8	-73.2	0	0	0	115.1
425	N	29.1	Very low	27.7	Very low	145 Å²	145	149.8 Å²	149.8	78%	0.775	77%	0.774	S	S	*	*			trans	91.8	123.9	140.6	-77.3	-11.6	0	0	0	123.2
426	S	24.1	Very low	27.7	Very low	107 Å²	107	152.8 Å²	152.8	75%	0.748	78%	0.781	S	S	*	*			trans	-92.4	155.2	-178.1	46.8	0	0	0	0	112.8
427	S	28.8	Very low	27.7	Very low	125 Å²	125	155.2 Å²	155.2	87%	0.874	79%	0.789	S	S	*	*			trans	-152.1	129.3	144.6	56.4	0	0	0	0	111.4
428	H	25.3	Very low	27.7	Very low	162 Å²	162	155.8 Å²	155.8	75%	0.75	79%	0.791	S	S	*	*			trans	-79.1	153.1	179.5	-100.5	-98.9	0	0	0	112.4
429	F	26.9	Very low	27.9	Very low	214 Å²	214	152.2 Å²	152.2	94%	0.939	79%	0.786	S	S	*	*			trans	-137.2	125.7	144.3	-114.4	-87.4	0	0	0	110.4
430	S	26.4	Very low	27.7	Very low	94 Å²	94	155.2 Å²	155.2	66%	0.657	80%	0.803	S	S	*	*			trans	-135.4	140.3	173.4	-61.7	0	0	0	0	109.6
431	R	29.3	Very low	27.8	Very low	237 Å²	237	155 Å²	155	89%	0.894	81%	0.809	S	S	*	*			trans	-170.3	105.5	158	-107.9	174.4	-178.9	-173.8	-0.1	107.8
432	K	25.3	Very low	27.8	Very low	201 Å²	201	158.4 Å²	158.4	87%	0.874	81%	0.813	S	S	*	*				50.7	110.4	86.5	-76.1	-172.9	178.2	179.6	0	114.6
433	S	28.5	Very low	27.6	Very low	110 Å²	110	156.2 Å²	156.2	77%	0.769	80%	0.801	S	S	*	*				158.8	119.7	116.8	58.1	0	0	0	0	113.6
434	L	28.1	Very low	27.7	Very low	174 Å²	174	156 Å²	156	91%	0.911	81%	0.806	S	S	*	*			trans	-179.5	94.1	130.8	-100.6	151.6	0	0	0	111.4
435	N	26.2	Very low	27.4	Very low	157 Å²	157	156.7 Å²	156.7	84%	0.84	81%	0.814	S	S	*	*			trans	-106.6	128.9	158.3	-89.7	-23.4	0	0	0	107.2
436	K	28.4	Very low	27.3	Very low	191 Å²	191	155.1 Å²	155.1	83%	0.83	81%	0.814	S	S	*	*			trans	149.5	117.2	141.3	-92.7	179.7	170	179.9	0	113.3
437	L	29.5	Very low	27.5	Very low	164 Å²	164	160.9 Å²	160.9	86%	0.859	82%	0.821	S	S	*	*			trans	179.9	99.5	132.9	-95.5	145.3	0	0	0	105.6
438	V	26.3	Very low	27.4	Very low	121 Å²	121	162.3 Å²	162.3	73%	0.733	82%	0.819	S	S	*	*				58.4	111.4	80.7	-179.5	0	0	0	0	108.9
439	S	33.2	Very low	27.6	Very low	101 Å²	101	158.7 Å²	158.7	71%	0.706	81%	0.812	S	S	*	*				-171.8	136.3	56.6	38.4	0	0	0	0	113.6
440	N	25.9	Very low	27.6	Very low	162 Å²	162	156.4 Å²	156.4	87%	0.866	81%	0.808	S	S	*	*			trans	28.6	109.2	137.1	-60.3	-19.4	0	0	0	120.7
441	E	30.2	Very low	27.7	Very low	203 Å²	203	159.1 Å²	159.1	95%	0.949	81%	0.81	S	S	*	*				-148.4	147.5	130	-149.1	163.6	-166.1	0	0	112
442	K	29.7	Very low	27.6	Very low	180 Å²	180	153.4 Å²	153.4	78%	0.783	80%	0.802	S	S	*	*			trans	-91	139.4	-161.4	-93.2	173.9	166.4	176.9	0	112.5
443	I	24.9	Very low	27.7	Very low	127 Å²	127	148.2 Å²	148.2	65%	0.651	79%	0.791	S	S	*	*				60.6	107.3	129	-52.6	165.6	0	0	0	117.3
444	N	27.3	Very low	27.7	Very low	153 Å²	153	147.6 Å²	147.6	82%	0.818	79%	0.787	S	S	*	*				-179.8	130.9	109	-101.1	-29.7	0	0	0	112.1
445	N	23.1	Very low	27.8	Very low	163 Å²	163	147.5 Å²	147.5	87%	0.872	79%	0.785	S	S	*	*			trans	-65	130.1	173.7	-64.8	-21.8	0	0	0	111
446	S	26.5	Very low	28	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	78%	0.784	S	S	*	*			trans	-156.6	116.1	158.1	170	0	0	0	0	107.8
447	Y	27.6	Very low	28.1	Very low	228 Å²	228	141.3 Å²	141.3	89%	0.894	77%	0.768	S	S	*	*			trans	-44.5	137	-175.4	-78.9	-101.1	0	0	0	114.7
448	D	26.3	Very low	28.3	Very low	155 Å²	155	145 Å²	145	83%	0.829	77%	0.771	S	S	*	*			trans	-63.3	125.3	-165.5	-75.2	-53.1	0	0	0	114.9
449	S	29.8	Very low	28.6	Very low	87 Å²	87	143 Å²	143	61%	0.608	76%	0.757	S	S	*	*			trans	-74	124.3	157	70.6	0	0	0	0	109	H451	S449-H451 PolarHBondContact O-N 3.32Å
450	I	27.5	Very low	28.8	Very low	165 Å²	165	142 Å²	142	85%	0.846	76%	0.755	S	S	*	*			trans	-56.1	99.8	172.9	-62.4	165.5	0	0	0	108.5	T452	I450-T452 PolarHBondContact O-N 3.48Å
451	H	28.4	Very low	29.5	Very low	151 Å²	151	141.2 Å²	141.2	70%	0.699	75%	0.745	S	S	*	*			trans	-82.6	98.9	-179.3	-114.8	-77.6	0	0	0	109.5	S449 S453	S449-H451 PolarHBondContact O-N 3.32Å; H451-S453 PolarHBondContact O-N 2.96Å; H451-S453 VanDerWaalsContact O-N 3.12Å; H451-S453 PolarHBondContact O-OG 3.03Å
452	T	26.8	Very low	29.7	Very low	117 Å²	117	136 Å²	136	72%	0.718	72%	0.724	S	S	*	*			trans	-56.1	105.4	162.5	43.3	0	0	0	0	109.7	I450	I450-T452 PolarHBondContact O-N 3.48Å
453	S	26.8	Very low	30.3	Very low	93 Å²	93	132.2 Å²	132.2	65%	0.65	71%	0.711	S	S	*	*			trans	-142.2	92.5	-177.4	-41.8	0	0	0	0	111.4	H451	H451-S453 PolarHBondContact O-N 2.96Å; H451-S453 VanDerWaalsContact O-N 3.12Å; H451-S453 PolarHBondContact O-OG 3.03Å
454	S	28.8	Very low	31.2	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	72%	0.715	S	S	*	*			trans	52	113.1	155.6	-157.5	0	0	0	0	120.2	L456	S454-L456 PolarHBondContact O-N 3.37Å
455	I	31.7	Very low	31.6	Very low	171 Å²	171	135.5 Å²	135.5	88%	0.877	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-2.3	-179.9	-73.7	165.8	0	0	0	114.2
456	L	29.4	Very low	32.3	Very low	158 Å²	158	133.7 Å²	133.7	83%	0.827	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.9	9.3	-173.5	-68	173.5	0	0	0	116.6	S454 W458	S454-L456 PolarHBondContact O-N 3.37Å; L456-W458 PolarHBondContact O-N 3.38Å
457	A	31.1	Very low	33	Very low	60 Å²	60	137.2 Å²	137.2	50%	0.496	70%	0.704	S	S	.	*			trans	-101.5	81.1	-177.6	0	0	0	0	0	113.6	N459	A457-N459 PolarHBondContact O-N 2.85Å
458	W	33.2	Very low	33.6	Very low	241 Å²	241	135.3 Å²	135.3	91%	0.913	70%	0.7	S	S	*	*			trans	-87.2	79.3	163.8	-79.4	32.5	0	0	0	110	L456	L456-W458 PolarHBondContact O-N 3.38Å
459	N	32.6	Very low	33.9	Very low	81 Å²	81	136.4 Å²	136.4	43%	0.433	70%	0.702	S	S	.	*			trans	-84.2	130.1	159.3	165	-0.1	0	0	0	108	A457 E461 N462	A457-N459 PolarHBondContact O-N 2.85Å; N459-E461 PolarHBondContact ND2-OE2 3.48Å; N459-E461 PolarHBondContact O-N 3.42Å; N459-E461 WeakPolarHBondContact OD1-CB 3.4Å; N459-E461 PolarHBondContact OD1-N 3.15Å; N459-N462 PolarHBondContact O-N 3.44Å
460	A	38.4	Very low	34	Very low	80 Å²	80	138.8 Å²	138.8	66%	0.661	71%	0.708	S	S	*	*	H	α-helix	trans	-51.3	-23.5	177	0	0	0	0	0	114.8
461	E	38.8	Very low	34.3	Very low	144 Å²	144	139.6 Å²	139.6	67%	0.673	71%	0.706	S	S	*	*	H	α-helix	trans	-71.5	-26.7	176.4	-68.9	176.2	142.1	0	0	113.5	N459 I463 E464	N459-E461 PolarHBondContact ND2-OE2 3.48Å; N459-E461 PolarHBondContact O-N 3.42Å; N459-E461 WeakPolarHBondContact OD1-CB 3.4Å; N459-E461 PolarHBondContact OD1-N 3.15Å; E461-I463 VanDerWaalsContact C-N 3.3Å; E461-I463 PolarHBondContact O-N 3.3Å; E461-E464 PolarHBondContact O-N 2.91Å
462	N	35.7	Very low	34.4	Very low	94 Å²	94	139.2 Å²	139.2	50%	0.503	71%	0.709	S	S	.	*	H	α-helix	trans	-75	-20.1	178.8	-104	-13.6	0	0	0	113.1	N459 N466	N459-N462 PolarHBondContact O-N 3.44Å; N462-N466 PolarHBondContact O-ND2 3.04Å
463	I	41.6	Very low	34.8	Very low	101 Å²	101	142.4 Å²	142.4	52%	0.518	72%	0.715	S	S	.	*	H	α-helix	trans	-78.4	-27.7	179	-60.7	173.8	0	0	0	110.8	E461	E461-I463 VanDerWaalsContact C-N 3.3Å; E461-I463 PolarHBondContact O-N 3.3Å
464	E	44.4	Very low	35.1	Very low	156 Å²	156	144.6 Å²	144.6	73%	0.729	72%	0.719	S	S	*	*	H	α-helix	trans	-79.5	-29.5	178.1	-157	175.4	-177.2	0	0	112.4	E461	E461-E464 PolarHBondContact O-N 2.91Å
465	Y	35	Very low	35.1	Very low	193 Å²	193	150.1 Å²	150.1	76%	0.757	73%	0.725	S	S	*	*	H	α-helix	trans	-74	-36.5	178.5	-148.9	-95.6	0	0	0	112.6	K467	Y465-K467 VanDerWaalsContact C-N 3.34Å; Y465-K467 PolarHBondContact O-N 3.27Å
466	N	37.8	Very low	35	Very low	124 Å²	124	149.5 Å²	149.5	66%	0.663	72%	0.724	S	S	*	*	H	α-helix	trans	-79.2	-11.6	180	-74.4	-35	0	0	0	114.5	N462 K468	N462-N466 PolarHBondContact O-ND2 3.04Å; N466-K468 VanDerWaalsContact C-N 3.28Å; N466-K468 PolarHBondContact O-N 2.9Å
467	K	41.7	Very low	35	Very low	186 Å²	186	144.5 Å²	144.5	81%	0.809	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-0.7	179.2	-143.5	170.4	-174.5	172.9	0	113.9	Y465	Y465-K467 VanDerWaalsContact C-N 3.34Å; Y465-K467 PolarHBondContact O-N 3.27Å
468	K	40	Very low	35.1	Very low	188 Å²	188	145.1 Å²	145.1	82%	0.817	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	-6.8	-176.9	-105.1	176.1	-179.7	168.8	0	115.2	N466 N470	N466-K468 VanDerWaalsContact C-N 3.28Å; N466-K468 PolarHBondContact O-N 2.9Å; K468-N470 PolarHBondContact O-N 3.22Å
469	M	32.7	Very low	35.1	Very low	177 Å²	177	140.3 Å²	140.3	87%	0.872	70%	0.703	S	S	*	*	S	Bend	trans	-80.6	114.2	173.3	-89	-75.1	177.7	0	0	109.6
470	N	33	Very low	35.4	Very low	137 Å²	137	141.8 Å²	141.8	73%	0.733	71%	0.711	S	S	*	*			trans	-87.3	140.1	-156.1	-160.3	7.7	0	0	0	110.9	K468 N472	K468-N470 PolarHBondContact O-N 3.22Å; N470-N472 PolarHBondContact O-N 3.12Å; N470-N472 VanDerWaalsContact O-N 3.12Å
471	K	33.5	Very low	35.5	Very low	183 Å²	183	143.9 Å²	143.9	80%	0.796	71%	0.707	S	S	*	*	S	Bend	trans	-42.9	111.8	163.3	-66.5	163.7	174.7	175.7	0	109.6
472	N	30.4	Very low	35.3	Very low	143 Å²	143	142.4 Å²	142.4	77%	0.765	70%	0.703	S	S	*	*			trans	163.5	134.8	152.8	-79.4	-20.5	0	0	0	106.8	N470	N470-N472 PolarHBondContact O-N 3.12Å; N470-N472 VanDerWaalsContact O-N 3.12Å
473	E	34.5	Very low	35.6	Very low	183 Å²	183	141.6 Å²	141.6	86%	0.855	70%	0.702	S	S	*	*			trans	83.9	127.5	-177.4	-56.5	176.4	171.2	0	0	113.3
474	L	33.2	Very low	35.4	Very low	139 Å²	139	139.9 Å²	139.9	73%	0.728	70%	0.698	S	S	*	*			cis	-165	120.4	6.7	-102	151.6	0	0	0	104.5
475	R	29.4	Very low	35.1	Very low	213 Å²	213	138 Å²	138	80%	0.804	69%	0.692	S	S	*	*				61.5	113.3	112.7	-90	-170.6	169.5	-119.9	-1.9	117.2
476	D	29	Very low	35.1	Very low	158 Å²	158	134.9 Å²	134.9	85%	0.845	69%	0.689	S	S	*	*			trans	26.1	92.3	137.8	-59.5	-16	0	0	0	117.3
477	G	30	Very low	35	Very low	54 Å²	54	132.5 Å²	132.5	56%	0.557	68%	0.682	S	S	*	*			trans	-127.6	105	164.9	0	0	0	0	0	109.2
478	S	33.2	Very low	34.7	Very low	73 Å²	73	128.1 Å²	128.1	51%	0.51	67%	0.671	S	S	.	*			trans	-70.8	157.2	-176.3	59.7	0	0	0	0	112.1	D480 E481	S478-D480 PolarHBondContact O-N 3.26Å; S478-E481 PolarHBondContact O-N 3.19Å
479	L	32.9	Very low	34.5	Very low	139 Å²	139	122.7 Å²	122.7	73%	0.728	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.7	-15.7	173	-163.7	73.2	0	0	0	114.2	E481 T483	L479-E481 VanDerWaalsContact C-N 3.3Å; L479-E481 PolarHBondContact O-N 3.2Å; L479-T483 PolarHBondContact O-N 3.02Å; L479-T483 PolarHBondContact O-OG1 3.48Å
480	D	39.2	Very low	34.6	Very low	113 Å²	113	121.5 Å²	121.5	60%	0.604	65%	0.653	S	S	*	*	H	α-helix	trans	-68.7	-23.9	172.2	-67.1	-32.8	0	0	0	112.9	S478 S484	S478-D480 PolarHBondContact O-N 3.26Å; D480-S484 WeakPolarHBondContact O-CA 3.46Å; D480-S484 WeakPolarHBondContact O-CB 3.43Å; D480-S484 PolarHBondContact O-N 3.47Å; D480-S484 PolarHBondContact O-OG 3.43Å
481	E	39.8	Very low	34.5	Very low	123 Å²	123	119.9 Å²	119.9	58%	0.575	65%	0.648	S	S	*	*	H	α-helix	trans	-75.7	-36.3	176.6	-78	-173.8	160.8	0	0	112.5	S478 L479 S484 L485	S478-E481 PolarHBondContact O-N 3.19Å; L479-E481 VanDerWaalsContact C-N 3.3Å; L479-E481 PolarHBondContact O-N 3.2Å; E481-S484 PolarHBondContact O-N 2.91Å; E481-L485 VanDerWaalsContact O-CB 3.25Å; E481-L485 WeakPolarHBondContact O-CB 3.48Å; E481-L485 PolarHBondContact O-N 3.49Å
482	L	35	Very low	34.3	Very low	113 Å²	113	116.6 Å²	116.6	59%	0.592	65%	0.647	S	S	*	*	H	α-helix	trans	-71.7	-37.5	173.9	-96.2	160.5	0	0	0	111.6	L485 L486	L482-L485 PolarHBondContact O-N 2.73Å; L482-L486 WeakPolarHBondContact O-CB 3.34Å; L482-L486 VanDerWaalsContact O-CG 3.31Å; L482-L486 WeakPolarHBondContact O-CG 3.09Å; L482-L486 PolarHBondContact O-N 3.03Å
483	T	41.4	Very low	34.5	Very low	78 Å²	78	117.1 Å²	117.1	48%	0.479	65%	0.65	S	S	.	*	H	α-helix	trans	-70.4	-36.8	173.9	-48.1	0	0	0	0	111	L479 S487	L479-T483 PolarHBondContact O-N 3.02Å; L479-T483 PolarHBondContact O-OG1 3.48Å; T483-S487 WeakPolarHBondContact O-CB 3.39Å; T483-S487 PolarHBondContact O-N 3.48Å; T483-S487 PolarHBondContact O-OG 2.89Å
484	S	37.7	Very low	34.4	Very low	64 Å²	64	114.2 Å²	114.2	45%	0.448	65%	0.645	S	S	.	*	H	α-helix	trans	-67.6	-42.7	171.9	-65.1	0	0	0	0	111.4	D480 E481 L486 S487 T488	D480-S484 WeakPolarHBondContact O-CA 3.46Å; D480-S484 WeakPolarHBondContact O-CB 3.43Å; D480-S484 PolarHBondContact O-N 3.47Å; D480-S484 PolarHBondContact O-OG 3.43Å; E481-S484 PolarHBondContact O-N 2.91Å; S484-L486 PolarHBondContact O-N 2.88Å; S484-S487 CarbonylContact O-C 3.59Å; S484-S487 PolarHBondContact O-N 3.24Å; S484-S487 VanDerWaalsContact O-N 3.13Å; S484-T488 VanDerWaalsContact O-CB 3.29Å; S484-T488 WeakPolarHBondContact O-CB 3.43Å; S484-T488 WeakPolarHBondContact O-CG2 3.43Å; S484-T488 PolarHBondContact O-N 3.48Å; S484-T488 PolarHBondContact O-OG1 3.24Å
485	L	37.2	Very low	34.5	Very low	116 Å²	116	113.7 Å²	113.7	61%	0.607	64%	0.643	S	S	*	*	H	α-helix	trans	-60.1	-43	176.4	-97	153	0	0	0	112.6	E481 L482 T488 S489	E481-L485 VanDerWaalsContact O-CB 3.25Å; E481-L485 WeakPolarHBondContact O-CB 3.48Å; E481-L485 PolarHBondContact O-N 3.49Å; L482-L485 PolarHBondContact O-N 2.73Å; L485-T488 WeakPolarHBondContact CA-OG1 3.37Å; L485-T488 PolarHBondContact O-OG1 3.43Å; L485-S489 PolarHBondContact O-N 3.23Å
486	L	34.8	Very low	34.6	Very low	129 Å²	129	112 Å²	112	68%	0.675	64%	0.642	S	S	*	*	H	α-helix	trans	-71.6	-30.2	175.6	-68.6	170.8	0	0	0	112.4	L482 S484	L482-L486 WeakPolarHBondContact O-CB 3.34Å; L482-L486 VanDerWaalsContact O-CG 3.31Å; L482-L486 WeakPolarHBondContact O-CG 3.09Å; L482-L486 PolarHBondContact O-N 3.03Å; S484-L486 PolarHBondContact O-N 2.88Å
487	S	36.3	Very low	34.9	Very low	74 Å²	74	110.9 Å²	110.9	52%	0.517	64%	0.64	S	S	.	*	H	α-helix	trans	-82.8	-28.8	177.6	-57.4	0	0	0	0	113.5	T483 S484	T483-S487 WeakPolarHBondContact O-CB 3.39Å; T483-S487 PolarHBondContact O-N 3.48Å; T483-S487 PolarHBondContact O-OG 2.89Å; S484-S487 CarbonylContact O-C 3.59Å; S484-S487 PolarHBondContact O-N 3.24Å; S484-S487 VanDerWaalsContact O-N 3.13Å
488	T	36.6	Very low	34.9	Very low	94 Å²	94	112.7 Å²	112.7	58%	0.577	64%	0.644	S	S	*	*	H	α-helix	trans	-81.9	-16.3	-179.9	53.3	0	0	0	0	112.8	S484 L485 L490	S484-T488 VanDerWaalsContact O-CB 3.29Å; S484-T488 WeakPolarHBondContact O-CB 3.43Å; S484-T488 WeakPolarHBondContact O-CG2 3.43Å; S484-T488 PolarHBondContact O-N 3.48Å; S484-T488 PolarHBondContact O-OG1 3.24Å; L485-T488 WeakPolarHBondContact CA-OG1 3.37Å; L485-T488 PolarHBondContact O-OG1 3.43Å; T488-L490 PolarHBondContact O-N 3.45Å
489	S	35.9	Very low	34.8	Very low	74 Å²	74	116 Å²	116	52%	0.517	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82	3.7	178.2	-158.4	0	0	0	0	114.1	L485	L485-S489 PolarHBondContact O-N 3.23Å
490	L	34.2	Very low	34.7	Very low	152 Å²	152	118.5 Å²	118.5	80%	0.796	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	3.8	179.9	-87.3	160.9	0	0	0	114.3	T488	T488-L490 PolarHBondContact O-N 3.45Å
491	V	31	Very low	34.3	Very low	103 Å²	103	119.7 Å²	119.7	62%	0.624	68%	0.675	S	S	*	*			trans	-114.9	105.2	176.1	-175.8	0	0	0	0	109.3	D493	V491-D493 PolarHBondContact O-N 3.36Å
492	S	29.2	Very low	33.9	Very low	113 Å²	113	119.5 Å²	119.5	79%	0.79	69%	0.688	S	S	*	*			trans	-62.6	96.5	171.5	48.9	0	0	0	0	110.9
493	D	33.1	Very low	33.9	Very low	154 Å²	154	117.2 Å²	117.2	82%	0.824	69%	0.691	S	S	*	*			trans	-96.5	89.3	170	-116.7	-13.9	0	0	0	110	V491 D495	V491-D493 PolarHBondContact O-N 3.36Å; D493-D495 PolarHBondContact O-N 3.37Å
494	T	32.8	Very low	34	Very low	123 Å²	123	121.2 Å²	121.2	76%	0.755	70%	0.704	S	S	*	*			trans	-73.5	95.3	159.2	47.1	0	0	0	0	108.3
495	D	34.9	Very low	33.9	Very low	127 Å²	127	121.9 Å²	121.9	68%	0.679	71%	0.708	S	S	*	*				171.5	117.2	121	-95.1	-31.6	0	0	0	112	D493	D493-D495 PolarHBondContact O-N 3.37Å
496	K	31.9	Very low	34.2	Very low	179 Å²	179	120 Å²	120	78%	0.778	70%	0.702	S	S	*	*			trans	67.4	105.3	146.3	-58.2	173.2	-176	174.3	0	116.7
497	V	35.3	Very low	34.9	Very low	134 Å²	134	117.1 Å²	117.1	81%	0.812	69%	0.69	S	S	*	*				-173	104.9	106.5	168.8	0	0	0	0	108.8
498	S	30.9	Very low	35.3	Very low	92 Å²	92	118.9 Å²	118.9	64%	0.643	70%	0.698	S	S	*	*			trans	9.7	114	147	57.3	0	0	0	0	120.3
499	N	31.6	Very low	36.1	Very low	143 Å²	143	118.5 Å²	118.5	77%	0.765	70%	0.699	S	S	*	*				159.2	109.2	106.4	-85.7	-14.8	0	0	0	112.2	V501	N499-V501 PolarHBondContact O-N 2.94Å
500	E	30.2	Very low	36.7	Very low	191 Å²	191	118.3 Å²	118.3	89%	0.893	69%	0.692	S	S	*	*			trans	41.2	68.9	137.9	-60.5	-174.7	162.3	0	0	120
501	V	30.9	Very low	37.3	Very low	137 Å²	137	114.7 Å²	114.7	83%	0.83	67%	0.673	S	S	*	*			trans	-141	102.7	138	-177.1	0	0	0	0	106.5	N499 G503	N499-V501 PolarHBondContact O-N 2.94Å; V501-G503 PolarHBondContact O-N 3.35Å
502	S	32	Very low	38.2	Very low	120 Å²	120	113.3 Å²	113.3	84%	0.839	67%	0.665	S	S	*	*			trans	-72.9	64.1	175.9	167.7	0	0	0	0	109.9	H504	S502-H504 PolarHBondContact O-N 3.47Å; S502-H504 VanDerWaalsContact O-N 3.16Å
503	G	34.1	Very low	39.3	Very low	64 Å²	64	110.3 Å²	110.3	66%	0.66	65%	0.647	S	S	*	*			trans	-71.2	100.3	165.8	0	0	0	0	0	107.5	V501 C505	V501-G503 PolarHBondContact O-N 3.35Å; G503-C505 PolarHBondContact O-N 2.92Å
504	H	43.7	Very low	40	Very low	162 Å²	162	109.6 Å²	109.6	75%	0.75	64%	0.638	S	S	*	*			trans	-65.2	102.5	173.9	-134.3	36.9	0	0	0	106.9	S502	S502-H504 PolarHBondContact O-N 3.47Å; S502-H504 VanDerWaalsContact O-N 3.16Å
505	C	35.9	Very low	40.9	Very low	78 Å²	78	108.6 Å²	108.6	53%	0.527	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-62	121.3	169.3	-159.3	0	0	0	0	106	G503 T507	G503-C505 PolarHBondContact O-N 2.92Å; C505-T507 PolarHBondContact O-N 3.5Å; C505-T507 VanDerWaalsContact O-N 3.09Å
506	P	43.2	Very low	41.7	Very low	77 Å²	77	106.8 Å²	106.8	50%	0.5	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-57.2	122	-177.2	22.8	-31.8	0	0	0	108.1	D510 I511	P506-D510 HydrophobicContact CB-CB 4.13Å; P506-I511 HydrophobicContact CB-CG1 4.18Å
507	T	48.9	Very low	42.7	Very low	68 Å²	68	105 Å²	105	42%	0.417	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-66.6	157.9	174.8	63.6	0	0	0	0	108.7	C505 S509 D510 I511	C505-T507 PolarHBondContact O-N 3.5Å; C505-T507 VanDerWaalsContact O-N 3.09Å; T507-S509 PolarHBondContact O-N 2.9Å; T507-D510 WeakPolarHBondContact CB-OD2 3.21Å; T507-D510 PolarHBondContact N-OD2 2.94Å; T507-D510 WeakPolarHBondContact O-CA 3.4Å; T507-D510 WeakPolarHBondContact O-CB 3.27Å; T507-D510 PolarHBondContact O-N 3.49Å; T507-D510 PolarHBondContact OG1-N 3.38Å; T507-D510 PolarHBondContact OG1-OD2 3.28Å; T507-I511 PolarHBondContact O-N 3.41Å; T507-I511 VanDerWaalsContact O-N 3.11Å
508	T	46	Very low	43.4	Very low	112 Å²	112	104.9 Å²	104.9	69%	0.687	60%	0.601	S	S	*	*	H	α-helix	trans	-52.9	-29.6	171.7	-46.1	0	0	0	0	111.5	V512	T508-V512 HydrophobicContact CG2-CG2 4.42Å; T508-V512 WeakPolarHBondContact O-CB 3.45Å; T508-V512 WeakPolarHBondContact O-CG2 3.32Å; T508-V512 PolarHBondContact O-N 3.33Å
509	S	52	Low	44.2	Very low	85 Å²	85	102.9 Å²	102.9	59%	0.594	59%	0.59	S	S	*	*	H	α-helix	trans	-66.3	-38.1	173.3	-170.6	0	0	0	0	113	T507 A513	T507-S509 PolarHBondContact O-N 2.9Å; S509-A513 VanDerWaalsContact O-CB 3.29Å; S509-A513 WeakPolarHBondContact O-CB 3.49Å; S509-A513 PolarHBondContact O-N 3.35Å
510	D	49	Very low	45.1	Very low	70 Å²	70	97.1 Å²	97.1	37%	0.374	56%	0.561	S	S	.	*	H	α-helix	trans	-68.6	-42.8	178.1	-58.4	-44.6	0	0	0	110.5	P506 T507 A513 E514	P506-D510 HydrophobicContact CB-CB 4.13Å; T507-D510 WeakPolarHBondContact CB-OD2 3.21Å; T507-D510 PolarHBondContact N-OD2 2.94Å; T507-D510 WeakPolarHBondContact O-CA 3.4Å; T507-D510 WeakPolarHBondContact O-CB 3.27Å; T507-D510 PolarHBondContact O-N 3.49Å; T507-D510 PolarHBondContact OG1-N 3.38Å; T507-D510 PolarHBondContact OG1-OD2 3.28Å; D510-A513 PolarHBondContact O-N 3.33Å; D510-E514 WeakPolarHBondContact O-CB 3.39Å; D510-E514 PolarHBondContact O-N 2.95Å
511	I	47.2	Very low	46.3	Very low	77 Å²	77	92 Å²	92	40%	0.395	54%	0.543	S	S	.	.	H	α-helix	trans	-63.8	-44.1	175.7	-59.7	172.8	0	0	0	110.8	P506 T507 A513 E514 I515	P506-I511 HydrophobicContact CB-CG1 4.18Å; T507-I511 PolarHBondContact O-N 3.41Å; T507-I511 VanDerWaalsContact O-N 3.11Å; I511-A513 VanDerWaalsContact C-N 3.32Å; I511-A513 PolarHBondContact O-N 3.03Å; I511-E514 PolarHBondContact O-N 2.92Å; I511-I515 HydrophobicContact CG2-CD1 3.91Å; I511-I515 VanDerWaalsContact O-CG1 3.29Å; I511-I515 WeakPolarHBondContact O-CG1 3.42Å; I511-I515 PolarHBondContact O-N 2.99Å
512	V	48.8	Very low	47.3	Very low	73 Å²	73	89.2 Å²	89.2	44%	0.442	52%	0.523	S	S	.	.	H	α-helix	trans	-65.5	-36.8	177.1	169	0	0	0	0	111.3	T508 N516	T508-V512 HydrophobicContact CG2-CG2 4.42Å; T508-V512 WeakPolarHBondContact O-CB 3.45Å; T508-V512 WeakPolarHBondContact O-CG2 3.32Å; T508-V512 PolarHBondContact O-N 3.33Å; V512-N516 WeakPolarHBondContact O-CB 3.45Å; V512-N516 VanDerWaalsContact O-CG 3.24Å; V512-N516 PolarHBondContact O-N 3.16Å; V512-N516 PolarHBondContact O-ND2 2.87Å; V512-N516 VanDerWaalsContact O-ND2 3.11Å
513	A	52.4	Low	48.5	Very low	51 Å²	51	88.6 Å²	88.6	42%	0.421	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-44.2	174.7	0	0	0	0	0	111.6	S509 D510 I511 N516 E517	S509-A513 VanDerWaalsContact O-CB 3.29Å; S509-A513 WeakPolarHBondContact O-CB 3.49Å; S509-A513 PolarHBondContact O-N 3.35Å; D510-A513 PolarHBondContact O-N 3.33Å; I511-A513 VanDerWaalsContact C-N 3.32Å; I511-A513 PolarHBondContact O-N 3.03Å; A513-N516 PolarHBondContact O-N 2.8Å; A513-E517 WeakPolarHBondContact O-CB 3.46Å; A513-E517 PolarHBondContact O-N 3.06Å
514	E	49.4	Very low	49.7	Very low	138 Å²	138	89 Å²	89	65%	0.645	49%	0.49	S	S	*	.	H	α-helix	trans	-63.5	-42.5	177.4	-170.2	174.6	-172.6	0	0	112.1	D510 I511 E517 F518	D510-E514 WeakPolarHBondContact O-CB 3.39Å; D510-E514 PolarHBondContact O-N 2.95Å; I511-E514 PolarHBondContact O-N 2.92Å; E514-E517 PolarHBondContact O-N 3.31Å; E514-F518 WeakPolarHBondContact O-CB 3.41Å; E514-F518 PolarHBondContact O-N 3.31Å
515	I	51.8	Low	50.2	Low	102 Å²	102	89.8 Å²	89.8	52%	0.523	49%	0.486	S	S	.	.	H	α-helix	trans	-63.5	-43	175	-68.3	168.3	0	0	0	111.2	I511 E517 F518 A519	I511-I515 HydrophobicContact CG2-CD1 3.91Å; I511-I515 VanDerWaalsContact O-CG1 3.29Å; I511-I515 WeakPolarHBondContact O-CG1 3.42Å; I511-I515 PolarHBondContact O-N 2.99Å; I515-E517 VanDerWaalsContact C-N 3.34Å; I515-F518 PolarHBondContact O-N 3.3Å; I515-A519 WeakPolarHBondContact O-CB 3.5Å; I515-A519 PolarHBondContact O-N 2.83Å
516	N	50.4	Low	51.2	Low	89 Å²	89	90.6 Å²	90.6	48%	0.476	49%	0.485	S	S	.	.	H	α-helix	trans	-65.8	-37.7	178.1	-76.7	-31.9	0	0	0	112	V512 A513 A519 C520	V512-N516 WeakPolarHBondContact O-CB 3.45Å; V512-N516 VanDerWaalsContact O-CG 3.24Å; V512-N516 PolarHBondContact O-N 3.16Å; V512-N516 PolarHBondContact O-ND2 2.87Å; V512-N516 VanDerWaalsContact O-ND2 3.11Å; A513-N516 PolarHBondContact O-N 2.8Å; N516-A519 PolarHBondContact O-N 3.09Å; N516-C520 WeakPolarHBondContact O-CB 3.46Å; N516-C520 PolarHBondContact O-N 2.76Å
517	E	53.5	Low	51.8	Low	142 Å²	142	89.7 Å²	89.7	66%	0.664	48%	0.476	S	S	*	.	H	α-helix	trans	-65.9	-44.3	175.6	-170.2	167.7	-169.8	0	0	111	A513 E514 I515 A519 C520 V521	A513-E517 WeakPolarHBondContact O-CB 3.46Å; A513-E517 PolarHBondContact O-N 3.06Å; E514-E517 PolarHBondContact O-N 3.31Å; I515-E517 VanDerWaalsContact C-N 3.34Å; E517-A519 PolarHBondContact O-N 3.02Å; E517-C520 PolarHBondContact O-N 3.06Å; E517-V521 WeakPolarHBondContact O-CG2 3.37Å; E517-V521 PolarHBondContact O-N 2.77Å
518	F	50.3	Low	52.2	Low	132 Å²	132	91.2 Å²	91.2	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-60.1	-45.3	174	179.8	-107.5	0	0	0	112.6	E514 I515 C520 V521 L522	E514-F518 WeakPolarHBondContact O-CB 3.41Å; E514-F518 PolarHBondContact O-N 3.31Å; I515-F518 PolarHBondContact O-N 3.3Å; F518-C520 VanDerWaalsContact C-N 3.32Å; F518-C520 PolarHBondContact O-N 3.41Å; F518-V521 PolarHBondContact O-N 2.97Å; F518-L522 HydrophobicContact CD1-CD1 3.83Å; F518-L522 HydrophobicContact CE1-CD1 3.25Å; F518-L522 HydrophobicContact CE1-CG 4.08Å; F518-L522 HydrophobicContact CE2-CD1 4.38Å; F518-L522 HydrophobicContact CE2-CG 4.38Å; F518-L522 HydrophobicContact CZ-CD1 3.57Å; F518-L522 HydrophobicContact CZ-CD2 4.44Å; F518-L522 HydrophobicContact CZ-CG 4Å; F518-L522 PolarHBondContact O-N 2.88Å
519	A	46.5	Very low	52.7	Low	50 Å²	50	90.7 Å²	90.7	41%	0.413	47%	0.467	S	S	.	.	H	α-helix	trans	-60.3	-41.4	176.5	0	0	0	0	0	112	I515 N516 E517 V521 L522 E523	I515-A519 WeakPolarHBondContact O-CB 3.5Å; I515-A519 PolarHBondContact O-N 2.83Å; N516-A519 PolarHBondContact O-N 3.09Å; E517-A519 PolarHBondContact O-N 3.02Å; A519-V521 VanDerWaalsContact C-N 3.35Å; A519-V521 PolarHBondContact O-N 3.16Å; A519-L522 PolarHBondContact O-N 2.77Å; A519-E523 WeakPolarHBondContact O-CB 3.29Å; A519-E523 PolarHBondContact O-N 3.48Å
520	C	51.6	Low	53.1	Low	22 Å²	22	93.8 Å²	93.8	15%	0.149	47%	0.466	C	S	.	.	H	α-helix	trans	-64	-39.2	176.2	-171.1	0	0	0	0	112	N516 E517 F518 E523 K524	N516-C520 WeakPolarHBondContact O-CB 3.46Å; N516-C520 PolarHBondContact O-N 2.76Å; E517-C520 PolarHBondContact O-N 3.06Å; F518-C520 VanDerWaalsContact C-N 3.32Å; F518-C520 PolarHBondContact O-N 3.41Å; C520-E523 PolarHBondContact O-N 2.84Å; C520-K524 WeakPolarHBondContact O-CG 3.18Å; C520-K524 PolarHBondContact O-N 2.95Å
521	V	54.8	Low	53.5	Low	84 Å²	84	92.7 Å²	92.7	51%	0.509	46%	0.463	S	S	.	.	H	α-helix	trans	-66.1	-43.4	176	172.1	0	0	0	0	111.3	E517 F518 A519 K524 R525	E517-V521 WeakPolarHBondContact O-CG2 3.37Å; E517-V521 PolarHBondContact O-N 2.77Å; F518-V521 PolarHBondContact O-N 2.97Å; A519-V521 VanDerWaalsContact C-N 3.35Å; A519-V521 PolarHBondContact O-N 3.16Å; V521-K524 PolarHBondContact O-N 2.91Å; V521-R525 PolarHBondContact O-N 3.36Å
522	L	51.3	Low	54.1	Low	78 Å²	78	92.3 Å²	92.3	41%	0.408	47%	0.465	S	S	.	.	H	α-helix	trans	-61.1	-44.8	174.8	-82.6	174.4	0	0	0	111.9	F518 A519 K524 R525 L526	F518-L522 HydrophobicContact CD1-CD1 3.83Å; F518-L522 HydrophobicContact CE1-CD1 3.25Å; F518-L522 HydrophobicContact CE1-CG 4.08Å; F518-L522 HydrophobicContact CE2-CD1 4.38Å; F518-L522 HydrophobicContact CE2-CG 4.38Å; F518-L522 HydrophobicContact CZ-CD1 3.57Å; F518-L522 HydrophobicContact CZ-CD2 4.44Å; F518-L522 HydrophobicContact CZ-CG 4Å; F518-L522 PolarHBondContact O-N 2.88Å; A519-L522 PolarHBondContact O-N 2.77Å; L522-K524 VanDerWaalsContact C-N 3.35Å; L522-K524 PolarHBondContact O-N 2.92Å; L522-R525 PolarHBondContact O-N 3.48Å; L522-R525 VanDerWaalsContact O-N 3.15Å; L522-L526 WeakPolarHBondContact O-CG 3.41Å; L522-L526 PolarHBondContact O-N 2.91Å
523	E	58.7	Low	54.5	Low	106 Å²	106	96.3 Å²	96.3	50%	0.495	47%	0.473	S	S	.	.	H	α-helix	trans	-60.7	-43.4	177.6	-173	179.5	-173.4	0	0	111.7	A519 C520 R525 L526 N527	A519-E523 WeakPolarHBondContact O-CB 3.29Å; A519-E523 PolarHBondContact O-N 3.48Å; C520-E523 PolarHBondContact O-N 2.84Å; E523-R525 VanDerWaalsContact C-N 3.32Å; E523-R525 PolarHBondContact O-N 3.45Å; E523-L526 PolarHBondContact O-N 2.89Å; E523-N527 WeakPolarHBondContact O-CB 3.32Å; E523-N527 PolarHBondContact O-N 3.16Å; E523-N527 PolarHBondContact O-ND2 3.45Å
524	K	58	Low	54.8	Low	73 Å²	73	99.8 Å²	99.8	32%	0.317	48%	0.479	S	S	.	.	H	α-helix	trans	-59.1	-43.3	174	-76.6	177.2	-178.8	175.9	0	111.7	C520 V521 L522 N527 Y528 C619	C520-K524 WeakPolarHBondContact O-CG 3.18Å; C520-K524 PolarHBondContact O-N 2.95Å; V521-K524 PolarHBondContact O-N 2.91Å; L522-K524 VanDerWaalsContact C-N 3.35Å; L522-K524 PolarHBondContact O-N 2.92Å; K524-N527 PolarHBondContact O-N 3.32Å; K524-Y528 WeakPolarHBondContact O-CB 2.61Å; K524-Y528 PolarHBondContact O-N 2.88Å; K524-C619 PolarHBondContact NZ-SG 2.8Å
525	R	55	Low	55.3	Low	179 Å²	179	95.6 Å²	95.6	68%	0.675	46%	0.457	S	S	*	.	H	α-helix	trans	-69.6	-38.5	-179.7	-163.2	167.5	-177.2	166.2	-0.4	112.3	V521 L522 E523 Y528 L529	V521-R525 PolarHBondContact O-N 3.36Å; L522-R525 PolarHBondContact O-N 3.48Å; L522-R525 VanDerWaalsContact O-N 3.15Å; E523-R525 VanDerWaalsContact C-N 3.32Å; E523-R525 PolarHBondContact O-N 3.45Å; R525-Y528 WeakPolarHBondContact O-CB 3.18Å; R525-Y528 PolarHBondContact O-N 3.23Å; R525-L529 PolarHBondContact O-N 3.41Å
526	L	56.1	Low	55.7	Low	95 Å²	95	93.4 Å²	93.4	50%	0.497	45%	0.454	S	S	.	.	H	α-helix	trans	-66	-42.2	174	-74.6	172.8	0	0	0	112	L522 E523 Y528 L529 R530	L522-L526 WeakPolarHBondContact O-CG 3.41Å; L522-L526 PolarHBondContact O-N 2.91Å; E523-L526 PolarHBondContact O-N 2.89Å; L526-Y528 VanDerWaalsContact C-N 3.32Å; L526-Y528 PolarHBondContact O-N 3.17Å; L526-L529 PolarHBondContact O-N 3.43Å; L526-R530 WeakPolarHBondContact O-CG 3.43Å; L526-R530 PolarHBondContact O-N 3.49Å
527	N	56.9	Low	56.4	Low	58 Å²	58	94 Å²	94	31%	0.31	45%	0.454	S	S	.	.	H	α-helix	trans	-65.5	-36.4	175.5	-75.3	-29.1	0	0	0	111.9	E523 K524 R530 S531	E523-N527 WeakPolarHBondContact O-CB 3.32Å; E523-N527 PolarHBondContact O-N 3.16Å; E523-N527 PolarHBondContact O-ND2 3.45Å; K524-N527 PolarHBondContact O-N 3.32Å; N527-R530 PolarHBondContact O-N 2.86Å; N527-R530 PolarHBondContact OD1-NH1 3.38Å; N527-S531 PolarHBondContact O-N 3.1Å
528	Y	56.3	Low	56.6	Low	100 Å²	100	88.3 Å²	88.3	39%	0.392	43%	0.429	S	S	.	.	H	α-helix	trans	-61.5	-50.4	171.1	178.3	-96.6	0	0	0	111.7	K524 R525 L526 R530 S531 V532 L669	K524-Y528 WeakPolarHBondContact O-CB 2.61Å; K524-Y528 PolarHBondContact O-N 2.88Å; R525-Y528 WeakPolarHBondContact O-CB 3.18Å; R525-Y528 PolarHBondContact O-N 3.23Å; L526-Y528 VanDerWaalsContact C-N 3.32Å; L526-Y528 PolarHBondContact O-N 3.17Å; Y528-R530 VanDerWaalsContact C-N 3.33Å; Y528-R530 PolarHBondContact O-N 3.42Å; Y528-S531 WeakPolarHBondContact O-CB 3.26Å; Y528-S531 PolarHBondContact O-N 2.94Å; Y528-S531 PolarHBondContact O-OG 3.08Å; Y528-V532 HydrophobicContact CD1-CG2 4.34Å; Y528-V532 HydrophobicContact CE1-CG2 3.92Å; Y528-V532 HydrophobicContact CE2-CG2 4.49Å; Y528-V532 PolarHBondContact O-N 3.12Å; Y528-L669 VanDerWaalsContact OH-CD2 3.31Å; Y528-L669 WeakPolarHBondContact OH-CD2 3.39Å
529	L	56.8	Low	56.9	Low	101 Å²	101	84.5 Å²	84.5	53%	0.529	41%	0.413	S	S	.	.	H	α-helix	trans	-58.3	-42.5	176.6	-81.4	159.8	0	0	0	112.5	R525 L526 S531 V532 Y533	R525-L529 PolarHBondContact O-N 3.41Å; L526-L529 PolarHBondContact O-N 3.43Å; L529-S531 VanDerWaalsContact C-N 3.33Å; L529-S531 PolarHBondContact O-N 3.36Å; L529-V532 PolarHBondContact O-N 2.96Å; L529-Y533 WeakPolarHBondContact O-CB 3.35Å; L529-Y533 PolarHBondContact O-N 3.11Å
530	R	61.1	Low	57.6	Low	149 Å²	149	84.7 Å²	84.7	56%	0.562	42%	0.415	S	S	*	.	H	α-helix	trans	-57.9	-44.4	172.9	-76.8	179	-177.6	147.2	-1.9	111.7	L526 N527 Y528 V532 Y533 F534	L526-R530 WeakPolarHBondContact O-CG 3.43Å; L526-R530 PolarHBondContact O-N 3.49Å; N527-R530 PolarHBondContact O-N 2.86Å; N527-R530 PolarHBondContact OD1-NH1 3.38Å; Y528-R530 VanDerWaalsContact C-N 3.33Å; Y528-R530 PolarHBondContact O-N 3.42Å; R530-V532 PolarHBondContact O-N 3.48Å; R530-Y533 PolarHBondContact O-N 2.83Å; R530-F534 HydrophobicContact CB-CD2 4.42Å; R530-F534 HydrophobicContact CB-CE2 4.37Å; R530-F534 WeakPolarHBondContact O-CD2 3.13Å; R530-F534 PolarHBondContact O-N 3.29Å
531	S	55.8	Low	58.1	Low	47 Å²	47	89.4 Å²	89.4	33%	0.329	44%	0.435	S	S	.	.	H	α-helix	trans	-63.4	-40	179.5	76.1	0	0	0	0	112.8	N527 Y528 L529 R535	N527-S531 PolarHBondContact O-N 3.1Å; Y528-S531 WeakPolarHBondContact O-CB 3.26Å; Y528-S531 PolarHBondContact O-N 2.94Å; Y528-S531 PolarHBondContact O-OG 3.08Å; L529-S531 VanDerWaalsContact C-N 3.33Å; L529-S531 PolarHBondContact O-N 3.36Å; S531-R535 WeakPolarHBondContact O-CB 3.48Å; S531-R535 PolarHBondContact O-N 2.94Å
532	V	59.9	Low	58.1	Low	69 Å²	69	86.8 Å²	86.8	42%	0.418	42%	0.422	S	S	.	.	H	α-helix	trans	-65.6	-44.5	175.5	175.8	0	0	0	0	110.4	Y528 L529 R530 R535 A536	Y528-V532 HydrophobicContact CD1-CG2 4.34Å; Y528-V532 HydrophobicContact CE1-CG2 3.92Å; Y528-V532 HydrophobicContact CE2-CG2 4.49Å; Y528-V532 PolarHBondContact O-N 3.12Å; L529-V532 PolarHBondContact O-N 2.96Å; R530-V532 PolarHBondContact O-N 3.48Å; V532-R535 PolarHBondContact O-N 3.03Å; V532-A536 WeakPolarHBondContact O-CB 3.15Å; V532-A536 PolarHBondContact O-N 2.95Å
533	Y	58.8	Low	58.5	Low	158 Å²	158	87.2 Å²	87.2	62%	0.62	42%	0.424	S	S	*	.	H	α-helix	trans	-60.7	-48.5	177.1	-178.6	-94.1	0	0	0	112.1	L529 R530 R535 A536 H537	L529-Y533 WeakPolarHBondContact O-CB 3.35Å; L529-Y533 PolarHBondContact O-N 3.11Å; R530-Y533 PolarHBondContact O-N 2.83Å; Y533-R535 VanDerWaalsContact C-N 3.31Å; Y533-R535 PolarHBondContact O-N 3.28Å; Y533-A536 PolarHBondContact O-N 3.09Å; Y533-H537 WeakPolarHBondContact O-CB 3.34Å; Y533-H537 PolarHBondContact O-N 2.79Å
534	F	58.3	Low	58.4	Low	123 Å²	123	84.3 Å²	84.3	54%	0.539	42%	0.419	S	S	.	.	H	α-helix	trans	-61.3	-38.5	177.4	-80.8	-63.6	0	0	0	112.7	R530 S538	R530-F534 HydrophobicContact CB-CD2 4.42Å; R530-F534 HydrophobicContact CB-CE2 4.37Å; R530-F534 WeakPolarHBondContact O-CD2 3.13Å; R530-F534 PolarHBondContact O-N 3.29Å; F534-S538 WeakPolarHBondContact O-CB 3.31Å; F534-S538 PolarHBondContact O-N 3.49Å; F534-S538 PolarHBondContact O-OG 2.91Å
535	R	60.1	Low	58.5	Low	51 Å²	51	82.7 Å²	82.7	19%	0.192	42%	0.422	C	S	.	.	H	α-helix	trans	-66.1	-48.5	176	-175.5	178.4	177.4	179.3	-0	111.2	S531 V532 Y533 H537 S538 E539 L604	S531-R535 WeakPolarHBondContact O-CB 3.48Å; S531-R535 PolarHBondContact O-N 2.94Å; V532-R535 PolarHBondContact O-N 3.03Å; Y533-R535 VanDerWaalsContact C-N 3.31Å; Y533-R535 PolarHBondContact O-N 3.28Å; R535-H537 VanDerWaalsContact C-N 3.3Å; R535-H537 PolarHBondContact O-N 3.41Å; R535-S538 PolarHBondContact O-N 3.11Å; R535-E539 HydrophobicContact CG-CG 4.49Å; R535-E539 WeakPolarHBondContact CG-OE1 3.26Å; R535-E539 IonicContact CZ-OE1 3.23Å; R535-E539 IonicContact NE-OE1 3.97Å; R535-E539 PolarHBondContact NE-OE1 3.21Å; R535-E539 IonicContact NH2-OE1 2.7Å; R535-E539 WeakPolarHBondContact O-CB 3.5Å; R535-E539 WeakPolarHBondContact O-CG 3.32Å; R535-E539 PolarHBondContact O-N 3.41Å; R535-L604 VanDerWaalsContact CZ-CD2 3.43Å
536	A	58.8	Low	58.6	Low	55 Å²	55	76.3 Å²	76.3	46%	0.455	40%	0.402	S	S	.	.	H	α-helix	trans	-60.4	-40.7	177.5	0	0	0	0	0	111.9	V532 Y533 E539 A540	V532-A536 WeakPolarHBondContact O-CB 3.15Å; V532-A536 PolarHBondContact O-N 2.95Å; Y533-A536 PolarHBondContact O-N 3.09Å; A536-E539 PolarHBondContact O-N 2.7Å; A536-A540 VanDerWaalsContact O-CB 3.32Å; A536-A540 WeakPolarHBondContact O-CB 3.41Å; A536-A540 PolarHBondContact O-N 3.05Å
537	H	66.2	Low	58.9	Low	102 Å²	102	76 Å²	76	47%	0.472	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-44.4	176.1	-170	75.8	0	0	0	112	Y533 R535 E539 A540 E541	Y533-H537 WeakPolarHBondContact O-CB 3.34Å; Y533-H537 PolarHBondContact O-N 2.79Å; R535-H537 VanDerWaalsContact C-N 3.3Å; R535-H537 PolarHBondContact O-N 3.41Å; H537-E539 PolarHBondContact O-N 2.96Å; H537-A540 PolarHBondContact O-N 3.16Å; H537-E541 WeakPolarHBondContact O-CB 3.21Å; H537-E541 PolarHBondContact O-N 3.08Å
538	S	57.8	Low	59	Low	22 Å²	22	79.9 Å²	79.9	15%	0.154	42%	0.42	C	S	.	.	H	α-helix	trans	-64.9	-39.7	177.1	-56	0	0	0	0	112.3	F534 R535 A542	F534-S538 WeakPolarHBondContact O-CB 3.31Å; F534-S538 PolarHBondContact O-N 3.49Å; F534-S538 PolarHBondContact O-OG 2.91Å; R535-S538 PolarHBondContact O-N 3.11Å; S538-A542 WeakPolarHBondContact O-CB 3.37Å; S538-A542 PolarHBondContact O-N 3.3Å
539	E	57.1	Low	58.9	Low	52 Å²	52	78 Å²	78	24%	0.243	42%	0.416	C	S	.	.	H	α-helix	trans	-64.4	-42.7	174.5	-74.8	176.5	-167.1	0	0	111	R535 A536 H537 A542 L543 K676	R535-E539 HydrophobicContact CG-CG 4.49Å; R535-E539 WeakPolarHBondContact CG-OE1 3.26Å; R535-E539 IonicContact CZ-OE1 3.23Å; R535-E539 IonicContact NE-OE1 3.97Å; R535-E539 PolarHBondContact NE-OE1 3.21Å; R535-E539 IonicContact NH2-OE1 2.7Å; R535-E539 WeakPolarHBondContact O-CB 3.5Å; R535-E539 WeakPolarHBondContact O-CG 3.32Å; R535-E539 PolarHBondContact O-N 3.41Å; A536-E539 PolarHBondContact O-N 2.7Å; H537-E539 PolarHBondContact O-N 2.96Å; E539-A542 PolarHBondContact O-N 3.1Å; E539-L543 WeakPolarHBondContact O-CG 3.29Å; E539-L543 PolarHBondContact O-N 3.03Å; E539-K676 IonicContact OE2-NZ 3.88Å
540	A	60	Low	58.8	Low	54 Å²	54	75.6 Å²	75.6	45%	0.446	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-41.6	176.5	0	0	0	0	0	112.4	A536 H537 L543 A544	A536-A540 VanDerWaalsContact O-CB 3.32Å; A536-A540 WeakPolarHBondContact O-CB 3.41Å; A536-A540 PolarHBondContact O-N 3.05Å; H537-A540 PolarHBondContact O-N 3.16Å; A540-L543 PolarHBondContact O-N 3.38Å; A540-A544 WeakPolarHBondContact O-CB 3.48Å; A540-A544 PolarHBondContact O-N 3.29Å
541	E	61.8	Low	58.6	Low	121 Å²	121	72.1 Å²	72.1	57%	0.565	40%	0.401	S	S	*	.	H	α-helix	trans	-63.4	-41.3	175.3	-167	-170.3	169.6	0	0	111.3	H537 A544 G545	H537-E541 WeakPolarHBondContact O-CB 3.21Å; H537-E541 PolarHBondContact O-N 3.08Å; E541-A544 PolarHBondContact O-N 2.93Å; E541-G545 PolarHBondContact O-N 3.02Å
542	A	55.6	Low	58.6	Low	29 Å²	29	74 Å²	74	24%	0.24	41%	0.414	C	S	.	.	H	α-helix	trans	-63.6	-42.3	175.4	0	0	0	0	0	112.1	S538 E539 G545 L546	S538-A542 WeakPolarHBondContact O-CB 3.37Å; S538-A542 PolarHBondContact O-N 3.3Å; E539-A542 PolarHBondContact O-N 3.1Å; A542-G545 PolarHBondContact O-N 2.99Å; A542-L546 PolarHBondContact O-N 2.93Å
543	L	59.1	Low	58.2	Low	87 Å²	87	74.8 Å²	74.8	46%	0.455	41%	0.412	S	S	.	.	H	α-helix	trans	-66.1	-42.2	174.5	-75.4	170.2	0	0	0	112	E539 A540 G545 L546 V547	E539-L543 WeakPolarHBondContact O-CG 3.29Å; E539-L543 PolarHBondContact O-N 3.03Å; A540-L543 PolarHBondContact O-N 3.38Å; L543-G545 VanDerWaalsContact C-N 3.34Å; L543-G545 PolarHBondContact O-N 3.05Å; L543-L546 WeakPolarHBondContact O-CB 3.32Å; L543-L546 PolarHBondContact O-N 2.97Å; L543-V547 WeakPolarHBondContact O-CG2 3.29Å; L543-V547 PolarHBondContact O-N 2.88Å
544	A	57.6	Low	57.7	Low	46 Å²	46	68.2 Å²	68.2	38%	0.38	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-43.1	176.2	0	0	0	0	0	111.2	A540 E541 L546 V547 Q548	A540-A544 WeakPolarHBondContact O-CB 3.48Å; A540-A544 PolarHBondContact O-N 3.29Å; E541-A544 PolarHBondContact O-N 2.93Å; A544-L546 VanDerWaalsContact C-N 3.32Å; A544-L546 PolarHBondContact O-N 2.94Å; A544-V547 PolarHBondContact O-N 3.34Å; A544-Q548 WeakPolarHBondContact O-CB 3.42Å; A544-Q548 PolarHBondContact O-N 3.36Å
545	G	58.8	Low	57.1	Low	38 Å²	38	69 Å²	69	39%	0.392	40%	0.398	S	S	.	.	H	α-helix	trans	-60.3	-39.6	173.3	0	0	0	0	0	112.8	E541 A542 L543 L549	E541-G545 PolarHBondContact O-N 3.02Å; A542-G545 PolarHBondContact O-N 2.99Å; L543-G545 VanDerWaalsContact C-N 3.34Å; L543-G545 PolarHBondContact O-N 3.05Å; G545-L549 VanDerWaalsContact O-CB 3.23Å; G545-L549 WeakPolarHBondContact O-CB 3.41Å; G545-L549 PolarHBondContact O-N 3.17Å; G545-L549 VanDerWaalsContact O-N 3.09Å
546	L	58.3	Low	56.5	Low	46 Å²	46	73.1 Å²	73.1	24%	0.241	42%	0.424	C	S	.	.	H	α-helix	trans	-63.9	-49.1	173.9	-170.5	83.8	0	0	0	111.2	A542 L543 A544 Q548 L549 V550 A596 F684	A542-L546 PolarHBondContact O-N 2.93Å; L543-L546 WeakPolarHBondContact O-CB 3.32Å; L543-L546 PolarHBondContact O-N 2.97Å; A544-L546 VanDerWaalsContact C-N 3.32Å; A544-L546 PolarHBondContact O-N 2.94Å; L546-Q548 PolarHBondContact O-N 3.46Å; L546-L549 PolarHBondContact O-N 2.72Å; L546-V550 WeakPolarHBondContact O-CB 3.47Å; L546-V550 VanDerWaalsContact O-CG2 3.3Å; L546-V550 WeakPolarHBondContact O-CG2 3.16Å; L546-V550 PolarHBondContact O-N 2.93Å; L546-A596 HydrophobicContact CD1-CB 4.2Å; L546-F684 HydrophobicContact CD2-CE1 4.1Å; L546-F684 HydrophobicContact CD2-CZ 4.48Å
547	V	61	Low	55.9	Low	89 Å²	89	71.3 Å²	71.3	54%	0.539	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-44.3	-179.3	171.9	0	0	0	0	111.1	L543 A544 L549 V550 T551	L543-V547 WeakPolarHBondContact O-CG2 3.29Å; L543-V547 PolarHBondContact O-N 2.88Å; A544-V547 PolarHBondContact O-N 3.34Å; V547-L549 VanDerWaalsContact C-N 3.29Å; V547-L549 PolarHBondContact O-N 3.4Å; V547-V550 PolarHBondContact O-N 2.82Å; V547-T551 HydrophobicContact CG1-CG2 4.4Å; V547-T551 WeakPolarHBondContact O-CB 3.35Å; V547-T551 WeakPolarHBondContact O-CG2 3.43Å; V547-T551 PolarHBondContact O-N 3.32Å; V547-T551 PolarHBondContact O-OG1 3.39Å
548	Q	59.8	Low	55.1	Low	139 Å²	139	69.3 Å²	69.3	65%	0.65	40%	0.398	S	S	*	.	H	α-helix	trans	-64.5	-35.7	178.2	-166.8	174.5	17.7	0	0	111.7	A544 L546 T551 S552	A544-Q548 WeakPolarHBondContact O-CB 3.42Å; A544-Q548 PolarHBondContact O-N 3.36Å; L546-Q548 PolarHBondContact O-N 3.46Å; Q548-T551 VanDerWaalsContact CA-OG1 3.26Å; Q548-T551 WeakPolarHBondContact CA-OG1 3.2Å; Q548-T551 PolarHBondContact O-OG1 2.85Å; Q548-T551 VanDerWaalsContact O-OG1 3.13Å; Q548-S552 WeakPolarHBondContact O-CB 3.47Å; Q548-S552 PolarHBondContact O-N 2.89Å; Q548-S552 PolarHBondContact O-OG 3.45Å
549	L	54.8	Low	54.5	Low	60 Å²	60	74.8 Å²	74.8	31%	0.314	42%	0.421	S	S	.	.	H	α-helix	trans	-77.7	-36.5	179.7	-161.8	139.4	0	0	0	112.5	G545 L546 V547 S552 K553 L592	G545-L549 VanDerWaalsContact O-CB 3.23Å; G545-L549 WeakPolarHBondContact O-CB 3.41Å; G545-L549 PolarHBondContact O-N 3.17Å; G545-L549 VanDerWaalsContact O-N 3.09Å; L546-L549 PolarHBondContact O-N 2.72Å; V547-L549 VanDerWaalsContact C-N 3.29Å; V547-L549 PolarHBondContact O-N 3.4Å; L549-S552 WeakPolarHBondContact CA-OG 3.4Å; L549-S552 PolarHBondContact O-OG 3.45Å; L549-K553 HydrophobicContact CD2-CD 4.36Å; L549-K553 PolarHBondContact O-N 3.25Å; L549-L592 HydrophobicContact CD1-CD2 3.92Å; L549-L592 HydrophobicContact CD2-CD1 3.45Å; L549-L592 VanDerWaalsContact CD2-CD1 3.45Å; L549-L592 HydrophobicContact CD2-CD2 3.75Å; L549-L592 HydrophobicContact CD2-CG 4.16Å; L549-L592 HydrophobicContact CG-CD2 4.49Å
550	V	55.1	Low	53.8	Low	51 Å²	51	75 Å²	75	31%	0.309	43%	0.428	S	S	.	.	H	α-helix	trans	-60.6	-55.5	168.1	172.2	0	0	0	0	108.4	L546 V547 S552 K553 S554 I558	L546-V550 WeakPolarHBondContact O-CB 3.47Å; L546-V550 VanDerWaalsContact O-CG2 3.3Å; L546-V550 WeakPolarHBondContact O-CG2 3.16Å; L546-V550 PolarHBondContact O-N 2.93Å; V547-V550 PolarHBondContact O-N 2.82Å; V550-S552 PolarHBondContact O-N 3.3Å; V550-K553 CarbonylContact O-C 2.94Å; V550-K553 PolarHBondContact O-N 2.87Å; V550-S554 VanDerWaalsContact O-CA 3.27Å; V550-S554 WeakPolarHBondContact O-CA 3.16Å; V550-S554 WeakPolarHBondContact O-CB 3.23Å; V550-S554 PolarHBondContact O-N 3.36Å; V550-S554 PolarHBondContact O-OG 3.29Å; V550-I558 HydrophobicContact CG1-CD1 3.81Å
551	T	56	Low	52.9	Low	75 Å²	75	75 Å²	75	46%	0.46	42%	0.419	S	S	.	.	H	α-helix	trans	-61.5	-39.7	-177.4	47.8	0	0	0	0	114.5	V547 Q548 K553 S554	V547-T551 HydrophobicContact CG1-CG2 4.4Å; V547-T551 WeakPolarHBondContact O-CB 3.35Å; V547-T551 WeakPolarHBondContact O-CG2 3.43Å; V547-T551 PolarHBondContact O-N 3.32Å; V547-T551 PolarHBondContact O-OG1 3.39Å; Q548-T551 VanDerWaalsContact CA-OG1 3.26Å; Q548-T551 WeakPolarHBondContact CA-OG1 3.2Å; Q548-T551 PolarHBondContact O-OG1 2.85Å; Q548-T551 VanDerWaalsContact O-OG1 3.13Å; T551-K553 PolarHBondContact O-N 3.2Å; T551-S554 WeakPolarHBondContact CA-OG 3.25Å; T551-S554 PolarHBondContact O-OG 3.44Å; T551-S554 VanDerWaalsContact O-OG 3.12Å
552	S	56.1	Low	52.2	Low	87 Å²	87	74.1 Å²	74.1	61%	0.608	42%	0.418	S	S	*	.	H	α-helix	trans	-71.9	-24.8	178.6	56.9	0	0	0	0	114.1	Q548 L549 V550	Q548-S552 WeakPolarHBondContact O-CB 3.47Å; Q548-S552 PolarHBondContact O-N 2.89Å; Q548-S552 PolarHBondContact O-OG 3.45Å; L549-S552 WeakPolarHBondContact CA-OG 3.4Å; L549-S552 PolarHBondContact O-OG 3.45Å; V550-S552 PolarHBondContact O-N 3.3Å
553	K	51	Low	51.6	Low	86 Å²	86	77 Å²	77	37%	0.374	43%	0.43	S	S	.	.	H	α-helix	trans	-103.8	-15.9	175	-72.6	-179.1	174.8	170.5	0	113.5	L549 V550 T551 L555 N556 I557 H588	L549-K553 HydrophobicContact CD2-CD 4.36Å; L549-K553 PolarHBondContact O-N 3.25Å; V550-K553 CarbonylContact O-C 2.94Å; V550-K553 PolarHBondContact O-N 2.87Å; T551-K553 PolarHBondContact O-N 3.2Å; K553-L555 PolarHBondContact O-N 2.95Å; K553-N556 PolarHBondContact O-N 3.14Å; K553-I557 HydrophobicContact CB-CD1 4.07Å; K553-I557 WeakPolarHBondContact O-CG1 2.94Å; K553-H588 PolarHBondContact NZ-CD2 3.49Å; K553-H588 PolarHBondContact NZ-NE2 3.36Å
554	S	47.8	Very low	50.9	Low	19 Å²	19	75.5 Å²	75.5	13%	0.133	43%	0.426	C	S	.	.	H	α-helix	trans	-78.8	-17.7	-171.7	58.2	0	0	0	0	115.2	V550 T551 N556 I557 I558	V550-S554 VanDerWaalsContact O-CA 3.27Å; V550-S554 WeakPolarHBondContact O-CA 3.16Å; V550-S554 WeakPolarHBondContact O-CB 3.23Å; V550-S554 PolarHBondContact O-N 3.36Å; V550-S554 PolarHBondContact O-OG 3.29Å; T551-S554 WeakPolarHBondContact CA-OG 3.25Å; T551-S554 PolarHBondContact O-OG 3.44Å; T551-S554 VanDerWaalsContact O-OG 3.12Å; S554-N556 PolarHBondContact O-N 3.42Å; S554-N556 VanDerWaalsContact O-N 3.1Å; S554-I557 PolarHBondContact O-N 3.32Å; S554-I557 VanDerWaalsContact O-N 3.1Å; S554-I558 WeakPolarHBondContact O-CB 3.38Å; S554-I558 PolarHBondContact O-N 3.32Å
555	L	46.7	Very low	50.2	Low	141 Å²	141	80.8 Å²	80.8	74%	0.738	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.8	169.6	-98.6	139.8	0	0	0	111.2	K553	K553-L555 PolarHBondContact O-N 2.95Å
556	N	47.1	Very low	49.5	Very low	136 Å²	136	85.6 Å²	85.6	73%	0.727	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-2.6	174.2	-71.5	-30	0	0	0	115.1	K553 S554	K553-N556 PolarHBondContact O-N 3.14Å; S554-N556 PolarHBondContact O-N 3.42Å; S554-N556 VanDerWaalsContact O-N 3.1Å
557	I	47.1	Very low	48.8	Very low	17 Å²	17	87.9 Å²	87.9	9%	0.087	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-29	-172.8	-56.4	173.1	0	0	0	113	K553 S554 P560 N585	K553-I557 HydrophobicContact CB-CD1 4.07Å; K553-I557 WeakPolarHBondContact O-CG1 2.94Å; S554-I557 PolarHBondContact O-N 3.32Å; S554-I557 VanDerWaalsContact O-N 3.1Å; I557-P560 WeakPolarHBondContact O-CD 3.07Å; I557-P560 WeakPolarHBondContact O-CG 3.41Å; I557-N585 HydrophobicContact CD1-CB 4Å; I557-N585 HydrophobicContact CG1-CB 4.17Å
558	I	48.3	Very low	48	Very low	60 Å²	60	92 Å²	92	31%	0.308	49%	0.485	S	S	.	.	H	α-helix	trans	-83.9	-32.9	179.1	-70.1	-179.9	0	0	0	112.2	V550 S554 M561 N562	V550-I558 HydrophobicContact CG1-CD1 3.81Å; S554-I558 WeakPolarHBondContact O-CB 3.38Å; S554-I558 PolarHBondContact O-N 3.32Å; I558-M561 HydrophobicContact CG1-CE 3.9Å; I558-M561 PolarHBondContact O-N 3.32Å; I558-N562 PolarHBondContact O-N 3.41Å
559	E	45.3	Very low	47.4	Very low	137 Å²	137	92.7 Å²	92.7	64%	0.64	49%	0.493	S	S	*	.	H	α-helix	trans	-56.5	-45.9	172.3	-97.8	-167.4	161.5	0	0	113.5	M561 N563	E559-M561 PolarHBondContact O-N 2.95Å; E559-N563 WeakPolarHBondContact O-CB 3.26Å; E559-N563 VanDerWaalsContact O-CG 3.29Å; E559-N563 PolarHBondContact O-N 2.9Å; E559-N563 VanDerWaalsContact O-N 3.12Å; E559-N563 PolarHBondContact O-ND2 3.44Å; E559-N563 VanDerWaalsContact O-ND2 3.13Å
560	P	42.3	Very low	46.8	Very low	57 Å²	57	96 Å²	96	37%	0.37	51%	0.511	S	S	.	.	H	α-helix	trans	-70	-26	176.5	20.5	-28.4	0	0	0	114.2	I557 S564	I557-P560 WeakPolarHBondContact O-CD 3.07Å; I557-P560 WeakPolarHBondContact O-CG 3.41Å; P560-S564 WeakPolarHBondContact O-CB 3.36Å; P560-S564 PolarHBondContact O-N 2.9Å; P560-S564 PolarHBondContact O-OG 3.24Å
561	M	42.6	Very low	46.2	Very low	53 Å²	53	100.1 Å²	100.1	26%	0.261	53%	0.532	S	S	.	.	H	α-helix	trans	-75.2	-35.4	175.5	-76.8	-170	-49.6	0	0	113.4	I558 E559 S564 L691	I558-M561 HydrophobicContact CG1-CE 3.9Å; I558-M561 PolarHBondContact O-N 3.32Å; E559-M561 PolarHBondContact O-N 2.95Å; M561-S564 PolarHBondContact O-OG 3.48Å; M561-S564 VanDerWaalsContact O-OG 3.1Å; M561-L691 HydrophobicContact SD-CD2 4.48Å
562	N	45.9	Very low	45.3	Very low	104 Å²	104	103.7 Å²	103.7	56%	0.556	55%	0.548	S	S	*	.	H	α-helix	trans	-74.8	-29.2	173.5	-85.2	-13.4	0	0	0	112.2	I558	I558-N562 PolarHBondContact O-N 3.41Å
563	N	42.3	Very low	44.6	Very low	89 Å²	89	104.8 Å²	104.8	48%	0.476	56%	0.556	S	S	.	*	H	α-helix	trans	-83.7	-19.5	178.3	-72.1	-29	0	0	0	114.2	E559 N567	E559-N563 WeakPolarHBondContact O-CB 3.26Å; E559-N563 VanDerWaalsContact O-CG 3.29Å; E559-N563 PolarHBondContact O-N 2.9Å; E559-N563 VanDerWaalsContact O-N 3.12Å; E559-N563 PolarHBondContact O-ND2 3.44Å; E559-N563 VanDerWaalsContact O-ND2 3.13Å; N563-N567 PolarHBondContact O-ND2 3.4Å
564	S	45.1	Very low	44	Very low	56 Å²	56	108 Å²	108	39%	0.392	58%	0.575	S	S	.	*	H	α-helix	trans	-77.8	-34	175.4	60.3	0	0	0	0	112.5	P560 M561	P560-S564 WeakPolarHBondContact O-CB 3.36Å; P560-S564 PolarHBondContact O-N 2.9Å; P560-S564 PolarHBondContact O-OG 3.24Å; M561-S564 PolarHBondContact O-OG 3.48Å; M561-S564 VanDerWaalsContact O-OG 3.1Å
565	Q	42.9	Very low	43.6	Very low	156 Å²	156	115.2 Å²	115.2	73%	0.729	61%	0.611	S	S	*	*	H	α-helix	trans	-79.1	-23	176.1	-70.8	-168.8	-5.5	0	0	114.2
566	L	44.8	Very low	43.4	Very low	140 Å²	140	117.4 Å²	117.4	73%	0.733	62%	0.615	S	S	*	*	H	α-helix	trans	-84.2	-13.9	177.6	-88.5	162	0	0	0	114.2
567	N	43.3	Very low	43.1	Very low	94 Å²	94	118.2 Å²	118.2	50%	0.503	62%	0.619	S	S	.	*			trans	-104.3	4.3	-173.4	-88.6	-33	0	0	0	115.9	N563 N569 N570	N563-N567 PolarHBondContact O-ND2 3.4Å; N567-N569 PolarHBondContact O-N 3.27Å; N567-N570 PolarHBondContact O-N 3.04Å
568	E	44.3	Very low	42.8	Very low	175 Å²	175	123 Å²	123	82%	0.818	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-12.3	176.7	-72.2	-165.1	151.2	0	0	114
569	N	46.1	Very low	42.4	Very low	153 Å²	153	124.5 Å²	124.5	82%	0.818	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	4.6	-179.5	-79.9	-27.5	0	0	0	115.8	N567	N567-N569 PolarHBondContact O-N 3.27Å
570	N	43.6	Very low	42.3	Very low	130 Å²	130	124.7 Å²	124.7	70%	0.695	66%	0.663	S	S	*	*	S	Bend	trans	-131.1	91.2	176.7	-95.2	-23.5	0	0	0	113	N567	N567-N570 PolarHBondContact O-N 3.04Å
571	N	41.5	Very low	42.5	Very low	138 Å²	138	126.2 Å²	126.2	74%	0.738	67%	0.669	S	S	*	*			trans	-1.3	115.4	150.1	-61.8	-45.8	0	0	0	117
572	N	37.5	Very low	42.7	Very low	150 Å²	150	126.8 Å²	126.8	80%	0.802	68%	0.675	S	S	*	*	S	Bend	trans	56.7	83.2	139	-57.4	-23.9	0	0	0	118.4
573	S	41.4	Very low	42.7	Very low	110 Å²	110	126 Å²	126	77%	0.769	67%	0.667	S	S	*	*			trans	-177	-6.9	137.3	49.5	0	0	0	0	120
574	I	38.4	Very low	43.2	Very low	154 Å²	154	127.9 Å²	127.9	79%	0.79	67%	0.674	S	S	*	*			trans	-104.2	-3.1	-162.2	-57.8	178.7	0	0	0	116.2	K576	I574-K576 PolarHBondContact O-N 3.22Å; I574-K576 VanDerWaalsContact O-N 3.11Å
575	L	39.8	Very low	43.6	Very low	170 Å²	170	128 Å²	128	89%	0.89	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	48.5	-177.8	-94.9	159.9	0	0	0	115.4
576	K	41.2	Very low	44.2	Very low	187 Å²	187	121.2 Å²	121.2	81%	0.813	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-5.5	179.5	-86.4	-172.1	177.3	-179.6	0	117.7	I574	I574-K576 PolarHBondContact O-N 3.22Å; I574-K576 VanDerWaalsContact O-N 3.11Å
577	N	40.8	Very low	45	Very low	153 Å²	153	118.4 Å²	118.4	82%	0.818	62%	0.623	S	S	*	*	S	Bend	trans	-123.7	101	-177.3	-61.6	-21.4	0	0	0	110.7
578	N	40.5	Very low	45.6	Very low	116 Å²	116	118.2 Å²	118.2	62%	0.62	62%	0.619	S	S	*	*			trans	73.9	65	171.5	-67.5	-13.7	0	0	0	119.5	L580	N578-L580 PolarHBondContact O-N 3.15Å
579	P	41.5	Very low	46.1	Very low	93 Å²	93	111.5 Å²	111.5	60%	0.604	59%	0.589	S	S	*	*	H	α-helix	trans	-64.4	-21.8	163.9	26.4	-32.2	0	0	0	113.7
580	L	42.4	Very low	46.8	Very low	140 Å²	140	105.7 Å²	105.7	73%	0.733	56%	0.557	S	S	*	*	H	α-helix	trans	-72.6	-29	-176	-87.2	146.1	0	0	0	114.6	N578	N578-L580 PolarHBondContact O-N 3.15Å
581	N	46.2	Very low	47.8	Very low	90 Å²	90	102 Å²	102	48%	0.481	54%	0.541	S	S	.	.	H	α-helix	trans	-82.4	-23.6	-175.6	-136.2	13.8	0	0	0	112.5	N585	N581-N585 WeakPolarHBondContact O-CB 3.3Å; N581-N585 PolarHBondContact O-N 3.47Å; N581-N585 PolarHBondContact O-ND2 3.46Å
582	V	46.7	Very low	48.6	Very low	64 Å²	64	97.4 Å²	97.4	39%	0.388	52%	0.516	S	S	.	.	H	α-helix	trans	-73.9	-42.7	178.6	179.5	0	0	0	0	109.6	N585 H586	V582-N585 PolarHBondContact O-N 2.95Å; V582-H586 WeakPolarHBondContact CG1-CD2 3.4Å; V582-H586 WeakPolarHBondContact CG1-NE2 3.16Å; V582-H586 PolarHBondContact O-CD2 3.41Å; V582-H586 PolarHBondContact O-N 2.89Å
583	H	47.1	Very low	49.6	Very low	87 Å²	87	91.1 Å²	91.1	40%	0.403	48%	0.483	S	S	.	.	H	α-helix	trans	-64.5	-42.4	179.3	-164.1	58	0	0	0	113.5	N585 H586 L587 N695	H583-N585 VanDerWaalsContact C-N 3.34Å; H583-N585 PolarHBondContact O-N 3.15Å; H583-H586 PolarHBondContact O-N 3.15Å; H583-L587 WeakPolarHBondContact O-CG 3.24Å; H583-L587 PolarHBondContact O-N 2.99Å; H583-N695 PolarHBondContact ND1-OD1 2.75Å
584	E	52.1	Low	50.8	Low	130 Å²	130	88.5 Å²	88.5	61%	0.607	46%	0.462	S	S	*	.	H	α-helix	trans	-63.8	-38.6	174.9	-76.3	-172.5	166.3	0	0	112.3	H588	E584-H588 WeakPolarHBondContact O-CB 3.33Å; E584-H588 PolarHBondContact O-N 3.42Å
585	N	53.5	Low	52	Low	58 Å²	58	87.5 Å²	87.5	31%	0.31	45%	0.452	S	S	.	.	H	α-helix	trans	-66.9	-38.8	176.6	-73.9	-23.2	0	0	0	112.2	I557 N581 V582 H583 H588 L589	I557-N585 HydrophobicContact CD1-CB 4Å; I557-N585 HydrophobicContact CG1-CB 4.17Å; N581-N585 WeakPolarHBondContact O-CB 3.3Å; N581-N585 PolarHBondContact O-N 3.47Å; N581-N585 PolarHBondContact O-ND2 3.46Å; V582-N585 PolarHBondContact O-N 2.95Å; H583-N585 VanDerWaalsContact C-N 3.34Å; H583-N585 PolarHBondContact O-N 3.15Å; N585-H588 PolarHBondContact O-N 2.87Å; N585-L589 PolarHBondContact O-N 2.86Å
586	H	55.9	Low	52.8	Low	14 Å²	14	80.7 Å²	80.7	7%	0.065	42%	0.42	C	S	.	.	H	α-helix	trans	-69.5	-42	175.9	-71	-59.5	0	0	0	112.7	V582 H583 H588 L589 E590 N695	V582-H586 WeakPolarHBondContact CG1-CD2 3.4Å; V582-H586 WeakPolarHBondContact CG1-NE2 3.16Å; V582-H586 PolarHBondContact O-CD2 3.41Å; V582-H586 PolarHBondContact O-N 2.89Å; H583-H586 PolarHBondContact O-N 3.15Å; H586-H588 VanDerWaalsContact C-N 3.27Å; H586-H588 PolarHBondContact O-N 3.32Å; H586-L589 PolarHBondContact O-N 3.47Å; H586-E590 WeakPolarHBondContact O-CB 3.32Å; H586-E590 PolarHBondContact O-N 2.86Å; H586-N695 VanDerWaalsContact CB-OD1 3.23Å; H586-N695 WeakPolarHBondContact CB-OD1 3.45Å
587	L	61.3	Low	53.7	Low	81 Å²	81	72.3 Å²	72.3	42%	0.424	38%	0.384	S	S	.	.	H	α-helix	trans	-60.4	-37.8	173.8	-77.9	163.5	0	0	0	111.9	H583 S591	H583-L587 WeakPolarHBondContact O-CG 3.24Å; H583-L587 PolarHBondContact O-N 2.99Å; L587-S591 WeakPolarHBondContact O-CB 3.19Å; L587-S591 PolarHBondContact O-N 3.33Å
588	H	56	Low	54.9	Low	89 Å²	89	68.8 Å²	68.8	41%	0.412	37%	0.365	S	S	.	.	H	α-helix	trans	-67.5	-41.4	176	-168.3	63.2	0	0	0	112.1	K553 E584 N585 H586 S591 L592	K553-H588 PolarHBondContact NZ-CD2 3.49Å; K553-H588 PolarHBondContact NZ-NE2 3.36Å; E584-H588 WeakPolarHBondContact O-CB 3.33Å; E584-H588 PolarHBondContact O-N 3.42Å; N585-H588 PolarHBondContact O-N 2.87Å; H586-H588 VanDerWaalsContact C-N 3.27Å; H586-H588 PolarHBondContact O-N 3.32Å; H588-S591 PolarHBondContact O-N 2.84Å; H588-L592 WeakPolarHBondContact NE2-CD1 3.22Å; H588-L592 WeakPolarHBondContact O-CB 3.43Å; H588-L592 WeakPolarHBondContact O-CD1 3.48Å; H588-L592 PolarHBondContact O-N 3.5Å
589	L	54.7	Low	55.8	Low	35 Å²	35	70.6 Å²	70.6	18%	0.183	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-42.4	175.3	-162.3	82.8	0	0	0	111.4	N585 H586 L592 L593 L691	N585-L589 PolarHBondContact O-N 2.86Å; H586-L589 PolarHBondContact O-N 3.47Å; L589-L592 PolarHBondContact O-N 3.41Å; L589-L593 HydrophobicContact CG-CD1 4.49Å; L589-L593 PolarHBondContact O-N 3.28Å; L589-L691 HydrophobicContact CD2-CD1 3.58Å; L589-L691 HydrophobicContact CD2-CD2 3.58Å; L589-L691 HydrophobicContact CD2-CG 4.22Å; L589-L691 HydrophobicContact CG-CD1 4.3Å
590	E	61.2	Low	56.5	Low	31 Å²	31	67 Å²	67	15%	0.145	34%	0.338	C	S	.	.	H	α-helix	trans	-59.4	-48.8	174.5	-167.2	-175.4	170.6	0	0	111	H586 L592 L593 V594 L688 R692	H586-E590 WeakPolarHBondContact O-CB 3.32Å; H586-E590 PolarHBondContact O-N 2.86Å; E590-L592 VanDerWaalsContact C-N 3.26Å; E590-L592 PolarHBondContact O-N 2.98Å; E590-L593 PolarHBondContact O-N 2.97Å; E590-V594 WeakPolarHBondContact O-CG2 3.34Å; E590-V594 PolarHBondContact O-N 2.67Å; E590-L688 HydrophobicContact CB-CD2 4.41Å; E590-L688 HydrophobicContact CG-CD2 3.59Å; E590-R692 IonicContact OE1-CZ 3.27Å; E590-R692 VanDerWaalsContact OE1-CZ 3.27Å; E590-R692 IonicContact OE1-NE 2.78Å; E590-R692 PolarHBondContact OE1-NE 3.13Å; E590-R692 IonicContact OE1-NH2 2.87Å; E590-R692 PolarHBondContact OE1-NH2 3.12Å
591	S	64.8	Low	57.4	Low	53 Å²	53	63.1 Å²	63.1	37%	0.371	32%	0.318	S	S	.	.	H	α-helix	trans	-59.8	-35.8	176.9	-179.3	0	0	0	0	112.9	L587 H588 K595	L587-S591 WeakPolarHBondContact O-CB 3.19Å; L587-S591 PolarHBondContact O-N 3.33Å; H588-S591 PolarHBondContact O-N 2.84Å; S591-K595 WeakPolarHBondContact O-CG 3.37Å; S591-K595 PolarHBondContact O-N 3.48Å; S591-K595 VanDerWaalsContact O-N 3.09Å
592	L	57.5	Low	58.2	Low	40 Å²	40	65.1 Å²	65.1	21%	0.209	33%	0.325	C	S	.	.	H	α-helix	trans	-72.4	-42.5	178	-96.2	149.2	0	0	0	112.7	L549 H588 L589 E590 V594 K595 A596	L549-L592 HydrophobicContact CD1-CD2 3.92Å; L549-L592 HydrophobicContact CD2-CD1 3.45Å; L549-L592 VanDerWaalsContact CD2-CD1 3.45Å; L549-L592 HydrophobicContact CD2-CD2 3.75Å; L549-L592 HydrophobicContact CD2-CG 4.16Å; L549-L592 HydrophobicContact CG-CD2 4.49Å; H588-L592 WeakPolarHBondContact NE2-CD1 3.22Å; H588-L592 WeakPolarHBondContact O-CB 3.43Å; H588-L592 WeakPolarHBondContact O-CD1 3.48Å; H588-L592 PolarHBondContact O-N 3.5Å; L589-L592 PolarHBondContact O-N 3.41Å; E590-L592 VanDerWaalsContact C-N 3.26Å; E590-L592 PolarHBondContact O-N 2.98Å; L592-V594 VanDerWaalsContact C-N 3.33Å; L592-K595 PolarHBondContact O-N 2.89Å; L592-A596 WeakPolarHBondContact O-CB 3.14Å; L592-A596 PolarHBondContact O-N 3.3Å
593	L	58	Low	58.5	Low	19 Å²	19	64.1 Å²	64.1	10%	0.099	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-45.1	174.3	-80.8	164.2	0	0	0	111	L589 E590 K595 A596 I597 F684 L688 L691	L589-L593 HydrophobicContact CG-CD1 4.49Å; L589-L593 PolarHBondContact O-N 3.28Å; E590-L593 PolarHBondContact O-N 2.97Å; L593-K595 PolarHBondContact O-N 3.24Å; L593-A596 PolarHBondContact O-N 3.11Å; L593-I597 VanDerWaalsContact O-CG1 3.3Å; L593-I597 WeakPolarHBondContact O-CG1 3.44Å; L593-I597 PolarHBondContact O-N 3.23Å; L593-F684 HydrophobicContact CD2-CD1 3.9Å; L593-F684 HydrophobicContact CD2-CE1 4.19Å; L593-L688 HydrophobicContact CB-CD2 3.76Å; L593-L688 HydrophobicContact CB-CG 4.23Å; L593-L688 HydrophobicContact CD1-CD2 4.01Å; L593-L688 HydrophobicContact CD1-CG 4.35Å; L593-L691 HydrophobicContact CD1-CD1 3.29Å
594	V	66.3	Low	58.7	Low	55 Å²	55	60.6 Å²	60.6	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-45.9	175	173.3	0	0	0	0	111.2	E590 L592 A596 I597 D598 L688	E590-V594 WeakPolarHBondContact O-CG2 3.34Å; E590-V594 PolarHBondContact O-N 2.67Å; L592-V594 VanDerWaalsContact C-N 3.33Å; V594-A596 VanDerWaalsContact C-N 3.31Å; V594-A596 PolarHBondContact O-N 3.02Å; V594-I597 WeakPolarHBondContact O-CB 3.39Å; V594-I597 PolarHBondContact O-N 2.9Å; V594-D598 PolarHBondContact O-N 3.32Å; V594-L688 HydrophobicContact CG2-CD1 4.46Å; V594-L688 HydrophobicContact CG2-CD2 4.31Å
595	K	64.5	Low	59.1	Low	133 Å²	133	61.2 Å²	61.2	58%	0.578	30%	0.304	S	S	*	.	H	α-helix	trans	-62.9	-35.4	176.4	-77.1	175.6	-178.5	177.6	0	113.5	S591 L592 L593 R599	S591-K595 WeakPolarHBondContact O-CG 3.37Å; S591-K595 PolarHBondContact O-N 3.48Å; S591-K595 VanDerWaalsContact O-N 3.09Å; L592-K595 PolarHBondContact O-N 2.89Å; L593-K595 PolarHBondContact O-N 3.24Å; K595-R599 WeakPolarHBondContact O-CB 3.44Å; K595-R599 PolarHBondContact O-N 2.85Å
596	A	56.4	Low	59.1	Low	26 Å²	26	65 Å²	65	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-44.6	177.5	0	0	0	0	0	110.7	L546 L592 L593 V594 R599 I600	L546-A596 HydrophobicContact CD1-CB 4.2Å; L592-A596 WeakPolarHBondContact O-CB 3.14Å; L592-A596 PolarHBondContact O-N 3.3Å; L593-A596 PolarHBondContact O-N 3.11Å; V594-A596 VanDerWaalsContact C-N 3.31Å; V594-A596 PolarHBondContact O-N 3.02Å; A596-R599 PolarHBondContact O-N 3.45Å; A596-I600 VanDerWaalsContact O-CG1 3.31Å; A596-I600 WeakPolarHBondContact O-CG1 3.46Å; A596-I600 PolarHBondContact O-N 2.94Å
597	I	61.3	Low	58.6	Low	11 Å²	11	68.5 Å²	68.5	6%	0.056	33%	0.331	C	S	.	.	H	α-helix	trans	-56.9	-52.5	173	-68.9	166.6	0	0	0	110.4	L593 V594 R599 I600 D601 M681 F684 L688	L593-I597 VanDerWaalsContact O-CG1 3.3Å; L593-I597 WeakPolarHBondContact O-CG1 3.44Å; L593-I597 PolarHBondContact O-N 3.23Å; V594-I597 WeakPolarHBondContact O-CB 3.39Å; V594-I597 PolarHBondContact O-N 2.9Å; I597-R599 VanDerWaalsContact C-N 3.26Å; I597-R599 PolarHBondContact O-N 3.45Å; I597-I600 WeakPolarHBondContact O-CB 3.2Å; I597-I600 PolarHBondContact O-N 2.85Å; I597-I600 VanDerWaalsContact O-N 3.1Å; I597-D601 PolarHBondContact O-N 3.4Å; I597-M681 HydrophobicContact CB-CE 4.47Å; I597-M681 HydrophobicContact CG1-SD 4.48Å; I597-M681 HydrophobicContact CG2-CE 3.25Å; I597-M681 HydrophobicContact CG2-SD 3.88Å; I597-F684 HydrophobicContact CD1-CB 3.9Å; I597-F684 HydrophobicContact CG1-CB 4.12Å; I597-F684 HydrophobicContact CG1-CD2 4.5Å; I597-F684 HydrophobicContact CG1-CG 4.25Å; I597-L688 HydrophobicContact CD1-CD1 3.68Å
598	D	65.8	Low	57.9	Low	80 Å²	80	67.1 Å²	67.1	43%	0.428	32%	0.324	S	S	.	.	H	α-helix	trans	-58	-38.8	179.3	-72.2	-22.3	0	0	0	112.3	V594 D601 Q602	V594-D598 PolarHBondContact O-N 3.32Å; D598-D601 PolarHBondContact O-N 3.26Å; D598-Q602 WeakPolarHBondContact O-CB 3.25Å; D598-Q602 VanDerWaalsContact O-CG 3.29Å; D598-Q602 WeakPolarHBondContact O-CG 3.44Å; D598-Q602 PolarHBondContact O-N 3.26Å
599	R	59.4	Low	57.2	Low	154 Å²	154	66.9 Å²	66.9	58%	0.581	33%	0.329	S	S	*	.	H	α-helix	trans	-69.8	-39.3	178.6	-173.4	170.3	179.6	-178.1	-4	111.7	K595 A596 I597 L603	K595-R599 WeakPolarHBondContact O-CB 3.44Å; K595-R599 PolarHBondContact O-N 2.85Å; A596-R599 PolarHBondContact O-N 3.45Å; I597-R599 VanDerWaalsContact C-N 3.26Å; I597-R599 PolarHBondContact O-N 3.45Å; R599-L603 HydrophobicContact CG-CD1 4.16Å; R599-L603 WeakPolarHBondContact O-CB 3.43Å; R599-L603 WeakPolarHBondContact O-CD1 3.18Å; R599-L603 WeakPolarHBondContact O-CG 3.34Å; R599-L603 PolarHBondContact O-N 3.32Å
600	I	55.4	Low	56.5	Low	16 Å²	16	67.7 Å²	67.7	8%	0.082	34%	0.336	C	S	.	.	H	α-helix	trans	-60.7	-50.8	173.3	-69.9	166.2	0	0	0	108.7	A596 I597 Q602 L603 L604 M680 F684	A596-I600 VanDerWaalsContact O-CG1 3.31Å; A596-I600 WeakPolarHBondContact O-CG1 3.46Å; A596-I600 PolarHBondContact O-N 2.94Å; I597-I600 WeakPolarHBondContact O-CB 3.2Å; I597-I600 PolarHBondContact O-N 2.85Å; I597-I600 VanDerWaalsContact O-N 3.1Å; I600-Q602 PolarHBondContact O-N 3.15Å; I600-L603 PolarHBondContact O-N 3.03Å; I600-L603 VanDerWaalsContact O-N 3.11Å; I600-L604 HydrophobicContact CG2-CD1 4.02Å; I600-L604 HydrophobicContact CG2-CG 4.2Å; I600-L604 VanDerWaalsContact O-CG 3.26Å; I600-L604 WeakPolarHBondContact O-CG 3.49Å; I600-L604 PolarHBondContact O-N 3.44Å; I600-M680 HydrophobicContact CD1-CE 4.27Å; I600-M680 HydrophobicContact CG2-CE 3.85Å; I600-F684 HydrophobicContact CD1-CE2 4.12Å
601	D	61.4	Low	55.2	Low	59 Å²	59	68.7 Å²	68.7	32%	0.316	35%	0.346	S	S	.	.	H	α-helix	trans	-58.8	-43.8	-179.7	-72.3	-16.5	0	0	0	112.5	I597 D598 L603 L604 E605 H677	I597-D601 PolarHBondContact O-N 3.4Å; D598-D601 PolarHBondContact O-N 3.26Å; D601-L603 PolarHBondContact O-N 3.47Å; D601-L604 PolarHBondContact O-N 3.41Å; D601-E605 WeakPolarHBondContact O-CB 3.5Å; D601-E605 PolarHBondContact O-N 3.25Å; D601-H677 IonicContact OD1-CE1 3.39Å; D601-H677 PolarHBondContact OD1-CE1 3.24Å; D601-H677 IonicContact OD1-NE2 3.79Å
602	Q	62.8	Low	53.8	Low	132 Å²	132	69.9 Å²	69.9	62%	0.617	35%	0.354	S	S	*	.	H	α-helix	trans	-62.4	-40.3	175.2	-75.2	174.2	26.2	0	0	113	D598 I600 K606	D598-Q602 WeakPolarHBondContact O-CB 3.25Å; D598-Q602 VanDerWaalsContact O-CG 3.29Å; D598-Q602 WeakPolarHBondContact O-CG 3.44Å; D598-Q602 PolarHBondContact O-N 3.26Å; I600-Q602 PolarHBondContact O-N 3.15Å; Q602-K606 WeakPolarHBondContact O-CB 3.3Å; Q602-K606 PolarHBondContact O-N 3.46Å
603	L	53.8	Low	52.8	Low	43 Å²	43	74.5 Å²	74.5	23%	0.225	38%	0.375	C	S	.	.	H	α-helix	trans	-66.1	-42.6	176.2	-70.6	167.1	0	0	0	109.9	R599 I600 D601 E605 K606 Y607	R599-L603 HydrophobicContact CG-CD1 4.16Å; R599-L603 WeakPolarHBondContact O-CB 3.43Å; R599-L603 WeakPolarHBondContact O-CD1 3.18Å; R599-L603 WeakPolarHBondContact O-CG 3.34Å; R599-L603 PolarHBondContact O-N 3.32Å; I600-L603 PolarHBondContact O-N 3.03Å; I600-L603 VanDerWaalsContact O-N 3.11Å; D601-L603 PolarHBondContact O-N 3.47Å; L603-E605 PolarHBondContact O-N 3Å; L603-K606 PolarHBondContact O-N 2.82Å; L603-Y607 HydrophobicContact CB-CD2 4.33Å; L603-Y607 HydrophobicContact CB-CE2 4.38Å; L603-Y607 HydrophobicContact CD2-CE2 3.85Å; L603-Y607 WeakPolarHBondContact O-CD2 3.35Å; L603-Y607 PolarHBondContact O-N 3.27Å
604	L	50.9	Low	51.8	Low	14 Å²	14	77.7 Å²	77.7	7%	0.073	40%	0.395	C	S	.	.	H	α-helix	trans	-61	-45.9	176.2	-67.1	-171.6	0	0	0	111.9	R535 I600 D601 K606 Y607 I608 H677	R535-L604 VanDerWaalsContact CZ-CD2 3.43Å; I600-L604 HydrophobicContact CG2-CD1 4.02Å; I600-L604 HydrophobicContact CG2-CG 4.2Å; I600-L604 VanDerWaalsContact O-CG 3.26Å; I600-L604 WeakPolarHBondContact O-CG 3.49Å; I600-L604 PolarHBondContact O-N 3.44Å; D601-L604 PolarHBondContact O-N 3.41Å; L604-K606 VanDerWaalsContact C-N 3.3Å; L604-K606 PolarHBondContact O-N 3.34Å; L604-Y607 PolarHBondContact O-N 3.04Å; L604-I608 HydrophobicContact CB-CD1 3.95Å; L604-I608 WeakPolarHBondContact O-CB 3.38Å; L604-I608 WeakPolarHBondContact O-CD1 3.42Å; L604-I608 WeakPolarHBondContact O-CG1 3.43Å; L604-I608 PolarHBondContact O-N 3.23Å; L604-H677 WeakPolarHBondContact CD1-CE1 3.45Å; L604-H677 VanDerWaalsContact CD1-ND1 3.27Å; L604-H677 WeakPolarHBondContact CD1-ND1 3.29Å
605	E	59.9	Low	50.3	Low	142 Å²	142	79.9 Å²	79.9	66%	0.664	40%	0.403	S	S	*	.	H	α-helix	trans	-62	-40	176.7	-164.9	172	-164.1	0	0	111.4	D601 L603 Y607 T609	D601-E605 WeakPolarHBondContact O-CB 3.5Å; D601-E605 PolarHBondContact O-N 3.25Å; L603-E605 PolarHBondContact O-N 3Å; E605-Y607 PolarHBondContact O-N 3.1Å; E605-T609 WeakPolarHBondContact O-CB 3.33Å; E605-T609 PolarHBondContact O-N 3.02Å; E605-T609 PolarHBondContact O-OG1 3.36Å
606	K	52.9	Low	48.9	Very low	139 Å²	139	81.5 Å²	81.5	60%	0.604	41%	0.411	S	S	*	.	H	α-helix	trans	-67.5	-31.9	177.5	-168.7	178.9	179.5	-173.3	0	113.6	Q602 L603 L604 P610	Q602-K606 WeakPolarHBondContact O-CB 3.3Å; Q602-K606 PolarHBondContact O-N 3.46Å; L603-K606 PolarHBondContact O-N 2.82Å; L604-K606 VanDerWaalsContact C-N 3.3Å; L604-K606 PolarHBondContact O-N 3.34Å; K606-P610 WeakPolarHBondContact O-CD 3.07Å; K606-P610 WeakPolarHBondContact O-CG 3.37Å
607	Y	46.8	Very low	47.9	Very low	86 Å²	86	86 Å²	86	34%	0.337	43%	0.431	S	S	.	.	H	α-helix	trans	-103.9	-17.6	-174.6	-67.1	-64.1	0	0	0	114.8	L603 L604 E605 P610	L603-Y607 HydrophobicContact CB-CD2 4.33Å; L603-Y607 HydrophobicContact CB-CE2 4.38Å; L603-Y607 HydrophobicContact CD2-CE2 3.85Å; L603-Y607 WeakPolarHBondContact O-CD2 3.35Å; L603-Y607 PolarHBondContact O-N 3.27Å; L604-Y607 PolarHBondContact O-N 3.04Å; E605-Y607 PolarHBondContact O-N 3.1Å; Y607-P610 VanDerWaalsContact C-CD 3.46Å; Y607-P610 WeakPolarHBondContact O-CD 3.49Å
608	I	45.2	Very low	46.6	Very low	52 Å²	52	87 Å²	87	27%	0.267	44%	0.439	S	S	.	.	H	α-helix	trans	-82	-30.1	173.8	-66.1	168.4	0	0	0	111.2	L604	L604-I608 HydrophobicContact CB-CD1 3.95Å; L604-I608 WeakPolarHBondContact O-CB 3.38Å; L604-I608 WeakPolarHBondContact O-CD1 3.42Å; L604-I608 WeakPolarHBondContact O-CG1 3.43Å; L604-I608 PolarHBondContact O-N 3.23Å
609	T	42	Very low	45	Very low	84 Å²	84	86.9 Å²	86.9	52%	0.515	44%	0.443	S	S	.	.	S	Bend	trans	-72.7	-33.1	-178.3	-47.4	0	0	0	0	114.9	E605 C611 S612	E605-T609 WeakPolarHBondContact O-CB 3.33Å; E605-T609 PolarHBondContact O-N 3.02Å; E605-T609 PolarHBondContact O-OG1 3.36Å; T609-C611 PolarHBondContact O-N 3.46Å; T609-S612 PolarHBondContact O-OG 3.37Å
610	P	41.1	Very low	43.8	Very low	52 Å²	52	83.2 Å²	83.2	34%	0.338	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-75.2	-20.5	178.7	-15.7	30.3	0	0	0	114.7	K606 Y607 S612 E613 V614	K606-P610 WeakPolarHBondContact O-CD 3.07Å; K606-P610 WeakPolarHBondContact O-CG 3.37Å; Y607-P610 VanDerWaalsContact C-CD 3.46Å; Y607-P610 WeakPolarHBondContact O-CD 3.49Å; P610-S612 PolarHBondContact O-N 3.16Å; P610-S612 VanDerWaalsContact O-N 3.14Å; P610-E613 PolarHBondContact O-N 3.36Å; P610-E613 VanDerWaalsContact O-N 3.12Å; P610-V614 HydrophobicContact CB-CG2 4.33Å; P610-V614 WeakPolarHBondContact O-CG2 3.28Å; P610-V614 PolarHBondContact O-N 2.96Å
611	C	32.6	Very low	42.8	Very low	52 Å²	52	85.6 Å²	85.6	35%	0.351	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-62.5	-23.3	-177	-71.5	0	0	0	0	113.3	T609 I615	T609-C611 PolarHBondContact O-N 3.46Å; C611-I615 VanDerWaalsContact O-CD1 3.28Å; C611-I615 WeakPolarHBondContact O-CD1 3.42Å; C611-I615 WeakPolarHBondContact O-CG1 3.37Å
612	S	35.3	Very low	41.4	Very low	78 Å²	78	85.7 Å²	85.7	55%	0.545	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-88.4	-18.6	176.1	47.7	0	0	0	0	115.2	T609 P610	T609-S612 PolarHBondContact O-OG 3.37Å; P610-S612 PolarHBondContact O-N 3.16Å; P610-S612 VanDerWaalsContact O-N 3.14Å
613	E	36.8	Very low	40.1	Very low	138 Å²	138	86 Å²	86	65%	0.645	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-33	-178.7	-75.7	-173.1	159.5	0	0	112.9	P610 I615 K616	P610-E613 PolarHBondContact O-N 3.36Å; P610-E613 VanDerWaalsContact O-N 3.12Å; E613-I615 PolarHBondContact O-N 2.86Å; E613-K616 PolarHBondContact O-N 3.23Å
614	V	36.4	Very low	39	Very low	86 Å²	86	89.7 Å²	89.7	52%	0.521	49%	0.489	S	S	.	.	H	α-helix	trans	-66.1	-27.8	179	176.6	0	0	0	0	112.1	P610 S618	P610-V614 HydrophobicContact CB-CG2 4.33Å; P610-V614 WeakPolarHBondContact O-CG2 3.28Å; P610-V614 PolarHBondContact O-N 2.96Å; V614-S618 PolarHBondContact O-OG 3.06Å
615	I	34.8	Very low	38.1	Very low	100 Å²	100	93.1 Å²	93.1	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-82.8	-23.2	-179.4	-56.7	176.8	0	0	0	112.2	C611 E613	C611-I615 VanDerWaalsContact O-CD1 3.28Å; C611-I615 WeakPolarHBondContact O-CD1 3.42Å; C611-I615 WeakPolarHBondContact O-CG1 3.37Å; E613-I615 PolarHBondContact O-N 2.86Å
616	K	36.2	Very low	36.7	Very low	168 Å²	168	89.5 Å²	89.5	73%	0.73	51%	0.509	S	S	*	.	H	α-helix	trans	-85.2	-27.8	-178.9	-83.9	-178.5	176.7	175.9	0	114.3	E613	E613-K616 PolarHBondContact O-N 3.23Å
617	N	34.6	Very low	35.8	Very low	119 Å²	119	88.1 Å²	88.1	64%	0.636	51%	0.512	S	S	*	.	H	α-helix	trans	-95.8	-10.5	-172.7	-71.5	-9.6	0	0	0	114.9	S620	N617-S620 PolarHBondContact O-OG 3.27Å
618	S	34.5	Very low	34.9	Very low	34 Å²	34	89 Å²	89	24%	0.238	53%	0.53	C	S	.	.	S	Bend	trans	-87.7	-13.3	-179.5	34.2	0	0	0	0	113.7	V614 C622	V614-S618 PolarHBondContact O-OG 3.06Å; S618-C622 PolarHBondContact O-SG 3.06Å
619	C	33.1	Very low	34	Very low	76 Å²	76	95.3 Å²	95.3	51%	0.514	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-12.5	176.1	-93.7	0	0	0	0	114.6	K524	K524-C619 PolarHBondContact NZ-SG 2.8Å
620	S	34.5	Very low	33.4	Very low	77 Å²	77	100.1 Å²	100.1	54%	0.538	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.3	-22	179.9	50.5	0	0	0	0	114.3	N617	N617-S620 PolarHBondContact O-OG 3.27Å
621	S	34	Very low	32.8	Very low	66 Å²	66	103.2 Å²	103.2	46%	0.462	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.8	-17.5	-176.5	53.5	0	0	0	0	114.7	S625	S621-S625 PolarHBondContact O-OG 2.83Å
622	C	32.4	Very low	32.5	Very low	61 Å²	61	110.6 Å²	110.6	41%	0.412	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.3	-16.4	-179.1	-65.8	0	0	0	0	113.7	S618	S618-C622 PolarHBondContact O-SG 3.06Å
623	L	34.1	Very low	32.5	Very low	138 Å²	138	112.9 Å²	112.9	72%	0.723	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-29.4	175.6	-77.6	164.2	0	0	0	113.1
624	D	32	Very low	32.3	Very low	122 Å²	122	116 Å²	116	65%	0.652	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-19.4	-177	-75.3	-21.4	0	0	0	113.6	T627	D624-T627 PolarHBondContact O-OG1 3.29Å
625	S	31.4	Very low	31.9	Very low	86 Å²	86	120.8 Å²	120.8	60%	0.601	66%	0.659	S	S	*	*	S	Bend	trans	-87.6	-14.8	-179.3	-56.6	0	0	0	0	113.5	S621 T627	S621-S625 PolarHBondContact O-OG 2.83Å; S625-T627 VanDerWaalsContact C-N 3.34Å
626	A	31	Very low	31.8	Very low	65 Å²	65	122.9 Å²	122.9	54%	0.537	68%	0.677	S	S	.	*	G	3₁₀ helix	trans	-81	-12.5	176.4	0	0	0	0	0	113.2	C628	A626-C628 VanDerWaalsContact C-N 3.32Å; A626-C628 PolarHBondContact O-N 2.92Å
627	T	32.4	Very low	31.4	Very low	111 Å²	111	120.8 Å²	120.8	68%	0.681	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-81.4	1.8	179.1	19.3	0	0	0	0	115.4	D624 S625	D624-T627 PolarHBondContact O-OG1 3.29Å; S625-T627 VanDerWaalsContact C-N 3.34Å
628	C	28.3	Very low	31.1	Very low	105 Å²	105	121.8 Å²	121.8	71%	0.709	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-103.1	3.8	-172	-69.3	0	0	0	0	116.2	A626	A626-C628 VanDerWaalsContact C-N 3.32Å; A626-C628 PolarHBondContact O-N 2.92Å
629	F	27.6	Very low	30.8	Very low	184 Å²	184	129 Å²	129	81%	0.807	71%	0.706	S	S	*	*			trans	-111	67.8	177.1	-71.8	-80.9	0	0	0	112.6
630	H	28.6	Very low	30.6	Very low	184 Å²	184	129.9 Å²	129.9	85%	0.852	71%	0.714	S	S	*	*			trans	-129.5	102.3	161	-95.4	-63.5	0	0	0	111.2	K632	H630-K632 PolarHBondContact O-N 2.86Å
631	P	27.6	Very low	30.1	Very low	118 Å²	118	133.3 Å²	133.3	77%	0.766	73%	0.731	S	S	*	*			trans	-81.9	109.4	168.3	30.5	-26.3	0	0	0	110
632	K	27.9	Very low	29.8	Very low	206 Å²	206	134.9 Å²	134.9	90%	0.896	74%	0.742	S	S	*	*			trans	42.1	96.7	146.8	-60.2	178.7	180	171.6	0	117.6	H630	H630-K632 PolarHBondContact O-N 2.86Å
633	S	34.7	Very low	29.5	Very low	127 Å²	127	141.9 Å²	141.9	89%	0.888	77%	0.766	S	S	*	*			trans	-140.5	129.8	141.9	64	0	0	0	0	111.1
634	K	32.3	Very low	29.1	Very low	204 Å²	204	140.2 Å²	140.2	89%	0.887	76%	0.762	S	S	*	*			trans	-77.6	140.2	-171.6	-82.3	168.5	169.7	170.7	0	111.2
635	K	28.9	Very low	28.6	Very low	185 Å²	185	139.6 Å²	139.6	80%	0.804	77%	0.766	S	S	*	*			trans	39.8	120.3	143.3	-70.4	-174.9	172.9	-172.3	0	117.4
636	V	30.9	Very low	28.3	Very low	144 Å²	144	144 Å²	144	87%	0.873	77%	0.774	S	S	*	*				-155.8	123.8	103.4	160.7	0	0	0	0	108.1
637	D	28	Very low	28	Very low	124 Å²	124	148.8 Å²	148.8	66%	0.663	79%	0.785	S	S	*	*			trans	-59.1	136.5	170.7	-57	-69.8	0	0	0	111.5
638	N	29.8	Very low	27.7	Very low	141 Å²	141	149 Å²	149	75%	0.754	79%	0.791	S	S	*	*				165.6	144.2	120.6	-82	-34.7	0	0	0	112.4
639	F	27.9	Very low	27.7	Very low	184 Å²	184	152.1 Å²	152.1	81%	0.807	79%	0.793	S	S	*	*			trans	101.9	82.4	161	-66.7	-73.8	0	0	0	119.7
640	S	27.4	Very low	27.6	Very low	96 Å²	96	150 Å²	150	67%	0.671	79%	0.789	S	S	*	*				65.5	94.8	112.8	-67.7	0	0	0	0	119.6	S642	S640-S642 PolarHBondContact O-N 3.07Å
641	T	25.1	Very low	27.6	Very low	148 Å²	148	144.5 Å²	144.5	91%	0.908	77%	0.772	S	S	*	*			trans	-20.9	108	136.5	43.5	0	0	0	0	114.4
642	S	26.9	Very low	27.6	Very low	100 Å²	100	145.1 Å²	145.1	70%	0.699	77%	0.768	S	S	*	*			trans	-131.3	117.8	147.7	69.1	0	0	0	0	109.4	S640 T644	S640-S642 PolarHBondContact O-N 3.07Å; S642-T644 PolarHBondContact O-N 3.4Å; S642-T644 VanDerWaalsContact O-N 3.15Å
643	K	26.2	Very low	27.7	Very low	208 Å²	208	140.2 Å²	140.2	90%	0.904	76%	0.759	S	S	*	*			trans	-60.2	108.7	172.2	-67.8	170.7	175	176.3	0	108.4
644	T	25.7	Very low	27.5	Very low	103 Å²	103	138 Å²	138	63%	0.632	74%	0.743	S	S	*	*			trans	-125.1	94.6	156.2	35.8	0	0	0	0	108.1	S642 F646	S642-T644 PolarHBondContact O-N 3.4Å; S642-T644 VanDerWaalsContact O-N 3.15Å; T644-F646 VanDerWaalsContact C-N 3.34Å; T644-F646 PolarHBondContact O-N 3.09Å
645	C	22.1	Very low	27.5	Very low	109 Å²	109	135 Å²	135	74%	0.736	73%	0.731	S	S	*	*			trans	-67	93.9	167	-152.7	0	0	0	0	107.1	H647	C645-H647 PolarHBondContact O-N 2.89Å
646	F	25.4	Very low	27.5	Very low	179 Å²	179	131.7 Å²	131.7	79%	0.785	72%	0.716	S	S	*	*			trans	-86	95.1	164	-85.8	-80.5	0	0	0	108.3	T644 S648	T644-F646 VanDerWaalsContact C-N 3.34Å; T644-F646 PolarHBondContact O-N 3.09Å; F646-S648 VanDerWaalsContact C-N 3.32Å; F646-S648 PolarHBondContact O-N 3.4Å
647	H	24.3	Very low	27.4	Very low	164 Å²	164	131.4 Å²	131.4	76%	0.759	71%	0.71	S	S	*	*			trans	-63.1	92.6	157.5	-77.6	-67.6	0	0	0	109.1	C645	C645-H647 PolarHBondContact O-N 2.89Å
648	S	27.4	Very low	27.6	Very low	116 Å²	116	129.6 Å²	129.6	81%	0.811	71%	0.707	S	S	*	*			trans	-96.8	93.1	152.2	57.5	0	0	0	0	108.3	F646	F646-S648 VanDerWaalsContact C-N 3.32Å; F646-S648 PolarHBondContact O-N 3.4Å
649	K	27.3	Very low	27.6	Very low	170 Å²	170	128.8 Å²	128.8	74%	0.739	70%	0.702	S	S	*	*			trans	-54.3	141.2	165.3	-82.2	174.9	172.6	173.8	0	110.4
650	N	25.3	Very low	28	Very low	139 Å²	139	130 Å²	130	74%	0.743	70%	0.703	S	S	*	*			trans	77.9	110.5	145.8	-55.9	-11.1	0	0	0	117.8
651	S	28.2	Very low	28.2	Very low	70 Å²	70	132.1 Å²	132.1	49%	0.49	71%	0.707	S	S	.	*	S	Bend		158.1	0.6	104.6	-68.5	0	0	0	0	115.7	K655	S651-K655 WeakPolarHBondContact O-CG 3.24Å
652	I	28.7	Very low	28.5	Very low	131 Å²	131	132.7 Å²	132.7	67%	0.672	70%	0.704	S	S	*	*	S	Bend	trans	-99.7	-38.1	-174.2	-56.6	174	0	0	0	112.3	S654 K655 F656	I652-S654 VanDerWaalsContact C-N 3.31Å; I652-S654 PolarHBondContact O-N 3.38Å; I652-K655 PolarHBondContact O-N 3.09Å; I652-F656 HydrophobicContact CG2-CD2 4.3Å; I652-F656 HydrophobicContact CG2-CE2 4.45Å; I652-F656 PolarHBondContact O-N 3.38Å
653	S	30.1	Very low	28.9	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-13.1	179.3	62.9	0	0	0	0	115	N657	S653-N657 PolarHBondContact O-ND2 3.42Å
654	S	30.9	Very low	29.4	Very low	80 Å²	80	130.2 Å²	130.2	56%	0.559	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-15.9	171.3	60.6	0	0	0	0	113.9	I652	I652-S654 VanDerWaalsContact C-N 3.31Å; I652-S654 PolarHBondContact O-N 3.38Å
655	K	30.8	Very low	30.2	Very low	143 Å²	143	127.7 Å²	127.7	62%	0.622	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-24.8	177.2	-87.7	-176.1	174.5	-176.7	0	113.4	S651 I652 S658	S651-K655 WeakPolarHBondContact O-CG 3.24Å; I652-K655 PolarHBondContact O-N 3.09Å; K655-S658 PolarHBondContact O-OG 3.27Å
656	F	29.4	Very low	31.4	Very low	114 Å²	114	128.4 Å²	128.4	50%	0.5	68%	0.677	S	S	.	*	S	Bend	trans	-89.5	-22	175.7	-84.9	-83.7	0	0	0	113.8	I652 S658 L659	I652-F656 HydrophobicContact CG2-CD2 4.3Å; I652-F656 HydrophobicContact CG2-CE2 4.45Å; I652-F656 PolarHBondContact O-N 3.38Å; F656-S658 VanDerWaalsContact C-N 3.29Å; F656-S658 PolarHBondContact O-N 2.86Å; F656-L659 HydrophobicContact CD1-CD1 4.37Å
657	N	29.9	Very low	32.7	Very low	138 Å²	138	123.9 Å²	123.9	74%	0.738	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-9.8	174.6	-81.2	-16.5	0	0	0	114.1	S653	S653-N657 PolarHBondContact O-ND2 3.42Å
658	S	30.6	Very low	33.7	Very low	87 Å²	87	120.6 Å²	120.6	61%	0.608	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	7.2	174.9	72	0	0	0	0	113.8	K655 F656	K655-S658 PolarHBondContact O-OG 3.27Å; F656-S658 VanDerWaalsContact C-N 3.29Å; F656-S658 PolarHBondContact O-N 2.86Å
659	L	30.8	Very low	34.7	Very low	123 Å²	123	117.7 Å²	117.7	64%	0.644	62%	0.624	S	S	*	*	S	Bend	trans	-103.8	8.5	179.3	-82.8	163.4	0	0	0	112.8	F656	F656-L659 HydrophobicContact CD1-CD1 4.37Å
660	Y	36.7	Very low	36	Very low	210 Å²	210	115.7 Å²	115.7	82%	0.824	61%	0.611	S	S	*	*			trans	-113.5	25.2	-180	-83.2	-81.8	0	0	0	113.1
661	D	30.4	Very low	37.7	Very low	141 Å²	141	115.3 Å²	115.3	75%	0.754	60%	0.603	S	S	*	*			trans	-107.3	132.8	163.8	-106.7	-29.3	0	0	0	107.1
662	D	32.1	Very low	38.8	Very low	159 Å²	159	116.7 Å²	116.7	85%	0.85	61%	0.605	S	S	*	*	S	Bend	trans	87.1	120.5	-174.1	-55.7	-28.1	0	0	0	114.8
663	S	34.4	Very low	40	Very low	103 Å²	103	113.5 Å²	113.5	72%	0.72	59%	0.589	S	S	*	*	S	Bend	cis	-168.1	50.1	28.4	41.1	0	0	0	0	113.4
664	F	36.5	Very low	41.6	Very low	154 Å²	154	112.5 Å²	112.5	68%	0.675	58%	0.575	S	S	*	*	S	Bend	trans	-152.6	84	143.1	-125.6	-86.3	0	0	0	105	D666 L669	F664-D666 PolarHBondContact O-N 3.5Å; F664-L669 HydrophobicContact CD1-CB 4.46Å
665	S	44.2	Very low	43	Very low	49 Å²	49	112 Å²	112	34%	0.343	57%	0.566	S	S	.	*			trans	-61.3	141.7	-177	58.6	0	0	0	0	108.6	V667 E668 L669	S665-V667 CarbonylContact O-C 3.58Å; S665-V667 PolarHBondContact O-N 2.9Å; S665-V667 WeakPolarHBondContact OG-CB 3.39Å; S665-E668 PolarHBondContact N-OE2 3.3Å; S665-E668 PolarHBondContact O-N 3.01Å; S665-E668 WeakPolarHBondContact OG-CG 3.4Å; S665-E668 PolarHBondContact OG-N 2.94Å; S665-L669 PolarHBondContact O-N 3.25Å
666	D	47.2	Very low	44.2	Very low	125 Å²	125	111.1 Å²	111.1	67%	0.668	56%	0.562	S	S	*	*	H	α-helix	trans	-47.6	-24.8	166.6	-88.5	-27.4	0	0	0	111.2	F664 R670	F664-D666 PolarHBondContact O-N 3.5Å; D666-R670 WeakPolarHBondContact O-CB 3.48Å; D666-R670 PolarHBondContact O-N 3.44Å
667	V	51.8	Low	45.8	Very low	83 Å²	83	108 Å²	108	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-67.9	-42.5	172.1	-176.2	0	0	0	0	113.3	S665 K671	S665-V667 CarbonylContact O-C 3.58Å; S665-V667 PolarHBondContact O-N 2.9Å; S665-V667 WeakPolarHBondContact OG-CB 3.39Å; V667-K671 HydrophobicContact CG1-CD 4.27Å; V667-K671 VanDerWaalsContact O-CB 3.32Å; V667-K671 WeakPolarHBondContact O-CB 3.25Å; V667-K671 WeakPolarHBondContact O-CG 3.47Å; V667-K671 PolarHBondContact O-N 3.38Å
668	E	46.4	Very low	47.4	Very low	96 Å²	96	105.7 Å²	105.7	45%	0.449	53%	0.534	S	S	.	.	H	α-helix	trans	-71.3	-42	178.3	-81.7	173.2	155.7	0	0	112.6	S665 K671 L672	S665-E668 PolarHBondContact N-OE2 3.3Å; S665-E668 PolarHBondContact O-N 3.01Å; S665-E668 WeakPolarHBondContact OG-CG 3.4Å; S665-E668 PolarHBondContact OG-N 2.94Å; E668-K671 WeakPolarHBondContact O-CB 3.31Å; E668-K671 PolarHBondContact O-N 3.5Å; E668-L672 WeakPolarHBondContact O-CB 3.47Å; E668-L672 PolarHBondContact O-N 3.18Å
669	L	48.3	Very low	48.6	Very low	54 Å²	54	108.3 Å²	108.3	28%	0.283	53%	0.531	S	S	.	.	H	α-helix	trans	-68	-39	174	-174.6	64.1	0	0	0	110.9	Y528 F664 S665 L672 L673	Y528-L669 VanDerWaalsContact OH-CD2 3.31Å; Y528-L669 WeakPolarHBondContact OH-CD2 3.39Å; F664-L669 HydrophobicContact CD1-CB 4.46Å; S665-L669 PolarHBondContact O-N 3.25Å; L669-L672 HydrophobicContact CD1-CD2 4.42Å; L669-L672 PolarHBondContact O-N 2.84Å; L669-L673 HydrophobicContact CG-CD1 4.31Å; L669-L673 WeakPolarHBondContact O-CB 3.39Å; L669-L673 VanDerWaalsContact O-CG 3.32Å; L669-L673 WeakPolarHBondContact O-CG 3.5Å; L669-L673 PolarHBondContact O-N 3.03Å
670	R	54.4	Low	50	Low	128 Å²	128	105 Å²	105	48%	0.483	51%	0.513	S	S	.	.	H	α-helix	trans	-60.8	-45.8	171.2	-179.2	174.6	-85.8	-116.2	1.4	111.2	D666 L672 L673 D674	D666-R670 WeakPolarHBondContact O-CB 3.48Å; D666-R670 PolarHBondContact O-N 3.44Å; R670-L672 VanDerWaalsContact C-N 3.3Å; R670-L672 PolarHBondContact O-N 3.16Å; R670-L673 PolarHBondContact O-N 3.3Å; R670-D674 VanDerWaalsContact O-CB 3.31Å; R670-D674 WeakPolarHBondContact O-CB 3.44Å; R670-D674 PolarHBondContact O-N 2.9Å
671	K	60	Low	51.2	Low	132 Å²	132	96.1 Å²	96.1	57%	0.574	48%	0.48	S	S	*	.	H	α-helix	trans	-57.5	-41.2	172.8	-79.2	169.5	-180	174.8	0	112	V667 E668 L675	V667-K671 HydrophobicContact CG1-CD 4.27Å; V667-K671 VanDerWaalsContact O-CB 3.32Å; V667-K671 WeakPolarHBondContact O-CB 3.25Å; V667-K671 WeakPolarHBondContact O-CG 3.47Å; V667-K671 PolarHBondContact O-N 3.38Å; E668-K671 WeakPolarHBondContact O-CB 3.31Å; E668-K671 PolarHBondContact O-N 3.5Å; K671-L675 WeakPolarHBondContact O-CB 3.43Å; K671-L675 PolarHBondContact O-N 3.4Å
672	L	51.7	Low	52.9	Low	98 Å²	98	94.7 Å²	94.7	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-68.4	-40.6	178.6	-173.4	67.7	0	0	0	111.8	E668 L669 R670 L675 K676	E668-L672 WeakPolarHBondContact O-CB 3.47Å; E668-L672 PolarHBondContact O-N 3.18Å; L669-L672 HydrophobicContact CD1-CD2 4.42Å; L669-L672 PolarHBondContact O-N 2.84Å; R670-L672 VanDerWaalsContact C-N 3.3Å; R670-L672 PolarHBondContact O-N 3.16Å; L672-L675 PolarHBondContact O-N 2.88Å; L672-K676 WeakPolarHBondContact O-CB 3.21Å; L672-K676 PolarHBondContact O-N 2.78Å
673	L	54.3	Low	53.9	Low	64 Å²	64	89.7 Å²	89.7	34%	0.335	45%	0.447	S	S	.	.	H	α-helix	trans	-67.6	-40.7	175	-72	171.7	0	0	0	111.7	L669 R670 L675 K676 H677	L669-L673 HydrophobicContact CG-CD1 4.31Å; L669-L673 WeakPolarHBondContact O-CB 3.39Å; L669-L673 VanDerWaalsContact O-CG 3.32Å; L669-L673 WeakPolarHBondContact O-CG 3.5Å; L669-L673 PolarHBondContact O-N 3.03Å; R670-L673 PolarHBondContact O-N 3.3Å; L673-L675 VanDerWaalsContact C-N 3.32Å; L673-K676 PolarHBondContact O-N 3.5Å; L673-H677 WeakPolarHBondContact O-CB 3.34Å; L673-H677 PolarHBondContact O-N 2.69Å
674	D	62.7	Low	55.1	Low	81 Å²	81	85.9 Å²	85.9	43%	0.433	42%	0.418	S	S	.	.	H	α-helix	trans	-62.7	-41.9	173.7	-67.5	-18	0	0	0	110	R670 H677 E678	R670-D674 VanDerWaalsContact O-CB 3.31Å; R670-D674 WeakPolarHBondContact O-CB 3.44Å; R670-D674 PolarHBondContact O-N 2.9Å; D674-H677 PolarHBondContact O-N 3.01Å; D674-E678 WeakPolarHBondContact O-CB 3.41Å; D674-E678 PolarHBondContact O-N 2.71Å
675	L	60.8	Low	56.4	Low	71 Å²	71	82.9 Å²	82.9	37%	0.372	41%	0.406	S	S	.	.	H	α-helix	trans	-66	-42.9	175.8	-169.3	74.1	0	0	0	111.9	K671 L672 L673 H677 E678 Y679	K671-L675 WeakPolarHBondContact O-CB 3.43Å; K671-L675 PolarHBondContact O-N 3.4Å; L672-L675 PolarHBondContact O-N 2.88Å; L673-L675 VanDerWaalsContact C-N 3.32Å; L675-H677 VanDerWaalsContact C-N 3.33Å; L675-H677 PolarHBondContact O-N 2.9Å; L675-E678 WeakPolarHBondContact O-CB 3.33Å; L675-E678 PolarHBondContact O-N 3.48Å; L675-Y679 HydrophobicContact CD1-CD2 4.41Å; L675-Y679 HydrophobicContact CD1-CE2 3.87Å; L675-Y679 HydrophobicContact CD2-CE2 3.95Å; L675-Y679 HydrophobicContact CG-CD2 3.9Å; L675-Y679 HydrophobicContact CG-CE2 3.58Å; L675-Y679 WeakPolarHBondContact O-CD2 3.5Å; L675-Y679 PolarHBondContact O-N 2.95Å
676	K	56.9	Low	57.2	Low	124 Å²	124	85.4 Å²	85.4	54%	0.539	42%	0.415	S	S	.	.	H	α-helix	trans	-59.7	-45.3	173.9	-177.9	-167.6	173.3	-163.7	0	110.6	E539 L672 L673 Y679 M680	E539-K676 IonicContact OE2-NZ 3.88Å; L672-K676 WeakPolarHBondContact O-CB 3.21Å; L672-K676 PolarHBondContact O-N 2.78Å; L673-K676 PolarHBondContact O-N 3.5Å; K676-Y679 PolarHBondContact O-N 3.16Å; K676-M680 WeakPolarHBondContact O-CB 3.27Å; K676-M680 PolarHBondContact O-N 3.11Å
677	H	61.1	Low	57.5	Low	49 Å²	49	82.1 Å²	82.1	23%	0.227	40%	0.401	C	S	.	.	H	α-helix	trans	-62.6	-44.1	176.1	175.2	67.9	0	0	0	111.3	D601 L604 L673 D674 L675 Y679 M680 M681	D601-H677 IonicContact OD1-CE1 3.39Å; D601-H677 PolarHBondContact OD1-CE1 3.24Å; D601-H677 IonicContact OD1-NE2 3.79Å; L604-H677 WeakPolarHBondContact CD1-CE1 3.45Å; L604-H677 VanDerWaalsContact CD1-ND1 3.27Å; L604-H677 WeakPolarHBondContact CD1-ND1 3.29Å; L673-H677 WeakPolarHBondContact O-CB 3.34Å; L673-H677 PolarHBondContact O-N 2.69Å; D674-H677 PolarHBondContact O-N 3.01Å; L675-H677 VanDerWaalsContact C-N 3.33Å; L675-H677 PolarHBondContact O-N 2.9Å; H677-Y679 PolarHBondContact O-N 2.93Å; H677-M680 PolarHBondContact O-N 2.79Å; H677-M681 WeakPolarHBondContact O-CB 3.45Å; H677-M681 VanDerWaalsContact O-CG 3.3Å; H677-M681 WeakPolarHBondContact O-CG 3.24Å; H677-M681 PolarHBondContact O-N 2.92Å
678	E	64.6	Low	57.9	Low	88 Å²	88	78.4 Å²	78.4	41%	0.411	38%	0.378	S	S	.	.	H	α-helix	trans	-58.2	-45.4	175.4	-168.9	-167	150.9	0	0	111.7	D674 L675 M681 K682	D674-E678 WeakPolarHBondContact O-CB 3.41Å; D674-E678 PolarHBondContact O-N 2.71Å; L675-E678 WeakPolarHBondContact O-CB 3.33Å; L675-E678 PolarHBondContact O-N 3.48Å; E678-M681 PolarHBondContact O-N 3.13Å; E678-K682 HydrophobicContact CG-CD 4.35Å; E678-K682 WeakPolarHBondContact O-CB 3.24Å; E678-K682 VanDerWaalsContact O-CG 3.31Å; E678-K682 WeakPolarHBondContact O-CG 3.25Å; E678-K682 PolarHBondContact O-N 2.65Å; E678-K682 VanDerWaalsContact OE1-CE 3.28Å; E678-K682 WeakPolarHBondContact OE1-CE 3.38Å; E678-K682 IonicContact OE1-NZ 2.63Å; E678-K682 PolarHBondContact OE1-NZ 2.8Å
679	Y	55.9	Low	58.8	Low	143 Å²	143	77.7 Å²	77.7	56%	0.561	38%	0.377	S	S	*	.	H	α-helix	trans	-64.7	-41	176.5	-81.6	-64.1	0	0	0	112.7	L675 K676 H677 K682 A683	L675-Y679 HydrophobicContact CD1-CD2 4.41Å; L675-Y679 HydrophobicContact CD1-CE2 3.87Å; L675-Y679 HydrophobicContact CD2-CE2 3.95Å; L675-Y679 HydrophobicContact CG-CD2 3.9Å; L675-Y679 HydrophobicContact CG-CE2 3.58Å; L675-Y679 WeakPolarHBondContact O-CD2 3.5Å; L675-Y679 PolarHBondContact O-N 2.95Å; K676-Y679 PolarHBondContact O-N 3.16Å; H677-Y679 PolarHBondContact O-N 2.93Å; Y679-K682 PolarHBondContact O-N 2.82Å; Y679-A683 WeakPolarHBondContact O-CB 3.34Å; Y679-A683 PolarHBondContact O-N 3.46Å
680	M	59.8	Low	59.2	Low	53 Å²	53	80.2 Å²	80.2	26%	0.261	39%	0.388	S	S	.	.	H	α-helix	trans	-64.1	-44.9	177	-174.2	179.5	68.7	0	0	111.2	I600 K676 H677 A683 F684	I600-M680 HydrophobicContact CD1-CE 4.27Å; I600-M680 HydrophobicContact CG2-CE 3.85Å; K676-M680 WeakPolarHBondContact O-CB 3.27Å; K676-M680 PolarHBondContact O-N 3.11Å; H677-M680 PolarHBondContact O-N 2.79Å; M680-A683 WeakPolarHBondContact O-CB 3.08Å; M680-A683 PolarHBondContact O-N 2.69Å; M680-F684 HydrophobicContact CG-CD2 3.87Å; M680-F684 HydrophobicContact CG-CE2 3.57Å; M680-F684 WeakPolarHBondContact O-CD2 3.34Å; M680-F684 PolarHBondContact O-N 3.05Å; M680-F684 HydrophobicContact SD-CE2 4.12Å
681	M	62.8	Low	59.1	Low	24 Å²	24	74.7 Å²	74.7	12%	0.118	37%	0.368	C	S	.	.	H	α-helix	trans	-63.8	-41.5	175.6	-70.5	-60.9	-71.3	0	0	111.8	I597 H677 E678 A683 F684 H685	I597-M681 HydrophobicContact CB-CE 4.47Å; I597-M681 HydrophobicContact CG1-SD 4.48Å; I597-M681 HydrophobicContact CG2-CE 3.25Å; I597-M681 HydrophobicContact CG2-SD 3.88Å; H677-M681 WeakPolarHBondContact O-CB 3.45Å; H677-M681 VanDerWaalsContact O-CG 3.3Å; H677-M681 WeakPolarHBondContact O-CG 3.24Å; H677-M681 PolarHBondContact O-N 2.92Å; E678-M681 PolarHBondContact O-N 3.13Å; M681-A683 VanDerWaalsContact C-N 3.33Å; M681-A683 PolarHBondContact O-N 3.42Å; M681-F684 PolarHBondContact O-N 3.24Å; M681-H685 WeakPolarHBondContact O-CB 3.48Å; M681-H685 PolarHBondContact O-CD2 3.45Å; M681-H685 PolarHBondContact O-N 3.29Å
682	K	65.5	Low	59.3	Low	111 Å²	111	74 Å²	74	48%	0.483	36%	0.361	S	S	.	.	H	α-helix	trans	-59.2	-42.2	172.2	-81	172.5	170.1	169.8	0	112.1	E678 Y679 H685 L686	E678-K682 HydrophobicContact CG-CD 4.35Å; E678-K682 WeakPolarHBondContact O-CB 3.24Å; E678-K682 VanDerWaalsContact O-CG 3.31Å; E678-K682 WeakPolarHBondContact O-CG 3.25Å; E678-K682 PolarHBondContact O-N 2.65Å; E678-K682 VanDerWaalsContact OE1-CE 3.28Å; E678-K682 WeakPolarHBondContact OE1-CE 3.38Å; E678-K682 IonicContact OE1-NZ 2.63Å; E678-K682 PolarHBondContact OE1-NZ 2.8Å; Y679-K682 PolarHBondContact O-N 2.82Å; K682-H685 PolarHBondContact O-N 3.41Å; K682-L686 WeakPolarHBondContact O-CB 3.17Å; K682-L686 PolarHBondContact O-N 2.96Å
683	A	52.3	Low	59.7	Low	53 Å²	53	75.1 Å²	75.1	44%	0.438	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-43.8	176.7	0	0	0	0	0	111.6	Y679 M680 M681 L686 C687	Y679-A683 WeakPolarHBondContact O-CB 3.34Å; Y679-A683 PolarHBondContact O-N 3.46Å; M680-A683 WeakPolarHBondContact O-CB 3.08Å; M680-A683 PolarHBondContact O-N 2.69Å; M681-A683 VanDerWaalsContact C-N 3.33Å; M681-A683 PolarHBondContact O-N 3.42Å; A683-L686 WeakPolarHBondContact O-CB 3.29Å; A683-L686 PolarHBondContact O-N 2.94Å; A683-C687 PolarHBondContact O-N 2.88Å; A683-C687 PolarHBondContact O-SG 2.8Å; A683-C687 VanDerWaalsContact O-SG 3.35Å
684	F	59.7	Low	59.5	Low	24 Å²	24	76 Å²	76	11%	0.105	37%	0.372	C	S	.	.	H	α-helix	trans	-63.5	-41.7	175.1	-79.8	-60.6	0	0	0	112.8	L546 L593 I597 I600 M680 M681 C687 L688	L546-F684 HydrophobicContact CD2-CE1 4.1Å; L546-F684 HydrophobicContact CD2-CZ 4.48Å; L593-F684 HydrophobicContact CD2-CD1 3.9Å; L593-F684 HydrophobicContact CD2-CE1 4.19Å; I597-F684 HydrophobicContact CD1-CB 3.9Å; I597-F684 HydrophobicContact CG1-CB 4.12Å; I597-F684 HydrophobicContact CG1-CD2 4.5Å; I597-F684 HydrophobicContact CG1-CG 4.25Å; I600-F684 HydrophobicContact CD1-CE2 4.12Å; M680-F684 HydrophobicContact CG-CD2 3.87Å; M680-F684 HydrophobicContact CG-CE2 3.57Å; M680-F684 WeakPolarHBondContact O-CD2 3.34Å; M680-F684 PolarHBondContact O-N 3.05Å; M680-F684 HydrophobicContact SD-CE2 4.12Å; M681-F684 PolarHBondContact O-N 3.24Å; F684-C687 WeakPolarHBondContact O-CB 3.18Å; F684-C687 PolarHBondContact O-N 2.87Å; F684-L688 WeakPolarHBondContact O-CG 3.2Å; F684-L688 PolarHBondContact O-N 2.93Å
685	H	64.5	Low	59	Low	91 Å²	91	73.8 Å²	73.8	42%	0.421	36%	0.36	S	S	.	.	H	α-helix	trans	-64	-40.3	173.7	-77.1	-56	0	0	0	112	M681 K682 C687 L688 D689	M681-H685 WeakPolarHBondContact O-CB 3.48Å; M681-H685 PolarHBondContact O-CD2 3.45Å; M681-H685 PolarHBondContact O-N 3.29Å; K682-H685 PolarHBondContact O-N 3.41Å; H685-C687 VanDerWaalsContact C-N 3.32Å; H685-C687 PolarHBondContact O-N 3.2Å; H685-L688 CarbonylContact O-C 3.55Å; H685-L688 WeakPolarHBondContact O-CB 3.09Å; H685-L688 PolarHBondContact O-N 3.03Å; H685-D689 WeakPolarHBondContact O-CB 3.23Å; H685-D689 PolarHBondContact O-N 2.91Å
686	L	60.5	Low	58.4	Low	102 Å²	102	80.8 Å²	80.8	53%	0.534	39%	0.391	S	S	.	.	H	α-helix	trans	-61.1	-42.3	174.5	-166.8	79.3	0	0	0	111.3	K682 A683 D689 Q690	K682-L686 WeakPolarHBondContact O-CB 3.17Å; K682-L686 PolarHBondContact O-N 2.96Å; A683-L686 WeakPolarHBondContact O-CB 3.29Å; A683-L686 PolarHBondContact O-N 2.94Å; L686-D689 PolarHBondContact O-N 2.81Å; L686-Q690 WeakPolarHBondContact O-CB 3.07Å; L686-Q690 VanDerWaalsContact O-CG 3.31Å; L686-Q690 WeakPolarHBondContact O-CG 3.3Å; L686-Q690 PolarHBondContact O-N 3.36Å
687	C	53.9	Low	58.5	Low	56 Å²	56	78.6 Å²	78.6	38%	0.378	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-42.3	173.6	-69.8	0	0	0	0	111.9	A683 F684 H685 Q690 L691	A683-C687 PolarHBondContact O-N 2.88Å; A683-C687 PolarHBondContact O-SG 2.8Å; A683-C687 VanDerWaalsContact O-SG 3.35Å; F684-C687 WeakPolarHBondContact O-CB 3.18Å; F684-C687 PolarHBondContact O-N 2.87Å; H685-C687 VanDerWaalsContact C-N 3.32Å; H685-C687 PolarHBondContact O-N 3.2Å; C687-Q690 PolarHBondContact O-N 2.95Å; C687-L691 WeakPolarHBondContact O-CB 3.46Å; C687-L691 WeakPolarHBondContact O-CD1 2.95Å; C687-L691 VanDerWaalsContact O-CG 3.28Å; C687-L691 WeakPolarHBondContact O-CG 3.22Å; C687-L691 PolarHBondContact O-N 3.06Å
688	L	60.5	Low	58.4	Low	5 Å²	5	80.2 Å²	80.2	3%	0.026	39%	0.392	C	S	.	.	H	α-helix	trans	-62.8	-43.7	175	-79	167.6	0	0	0	112	E590 L593 V594 I597 F684 H685 L691 R692	E590-L688 HydrophobicContact CB-CD2 4.41Å; E590-L688 HydrophobicContact CG-CD2 3.59Å; L593-L688 HydrophobicContact CB-CD2 3.76Å; L593-L688 HydrophobicContact CB-CG 4.23Å; L593-L688 HydrophobicContact CD1-CD2 4.01Å; L593-L688 HydrophobicContact CD1-CG 4.35Å; V594-L688 HydrophobicContact CG2-CD1 4.46Å; V594-L688 HydrophobicContact CG2-CD2 4.31Å; I597-L688 HydrophobicContact CD1-CD1 3.68Å; F684-L688 WeakPolarHBondContact O-CG 3.2Å; F684-L688 PolarHBondContact O-N 2.93Å; H685-L688 CarbonylContact O-C 3.55Å; H685-L688 WeakPolarHBondContact O-CB 3.09Å; H685-L688 PolarHBondContact O-N 3.03Å; L688-L691 PolarHBondContact O-N 3.17Å; L688-R692 WeakPolarHBondContact O-CG 3.49Å; L688-R692 PolarHBondContact O-N 2.93Å
689	D	64.5	Low	58	Low	80 Å²	80	79.7 Å²	79.7	43%	0.428	39%	0.391	S	S	.	.	H	α-helix	trans	-66.4	-40.5	178.6	-72.7	-16.8	0	0	0	111.1	H685 L686 L691 R692 L693	H685-D689 WeakPolarHBondContact O-CB 3.23Å; H685-D689 PolarHBondContact O-N 2.91Å; L686-D689 PolarHBondContact O-N 2.81Å; D689-L691 VanDerWaalsContact C-N 3.33Å; D689-L691 PolarHBondContact O-N 3.38Å; D689-R692 PolarHBondContact O-N 3.19Å; D689-L693 WeakPolarHBondContact O-CB 3.26Å; D689-L693 WeakPolarHBondContact O-CD1 2.95Å; D689-L693 WeakPolarHBondContact O-CG 3.48Å; D689-L693 PolarHBondContact O-N 3.33Å
690	Q	56.9	Low	58.1	Low	108 Å²	108	76 Å²	76	51%	0.505	38%	0.381	S	S	.	.	H	α-helix	trans	-62.2	-40.1	172.4	-75.5	-178.7	0.9	0	0	112	L686 C687 L694	L686-Q690 WeakPolarHBondContact O-CB 3.07Å; L686-Q690 VanDerWaalsContact O-CG 3.31Å; L686-Q690 WeakPolarHBondContact O-CG 3.3Å; L686-Q690 PolarHBondContact O-N 3.36Å; C687-Q690 PolarHBondContact O-N 2.95Å; Q690-L694 WeakPolarHBondContact O-CD1 3.26Å; Q690-L694 VanDerWaalsContact O-CG 3.3Å; Q690-L694 WeakPolarHBondContact O-CG 3.41Å; Q690-L694 PolarHBondContact O-N 3.01Å; Q690-L694 VanDerWaalsContact O-N 3.11Å
691	L	52.7	Low	58	Low	11 Å²	11	77.4 Å²	77.4	6%	0.058	39%	0.388	C	S	.	.	H	α-helix	trans	-67.8	-35.3	174.9	-75.4	164.2	0	0	0	112.8	M561 L589 L593 C687 L688 D689 L694 N695	M561-L691 HydrophobicContact SD-CD2 4.48Å; L589-L691 HydrophobicContact CD2-CD1 3.58Å; L589-L691 HydrophobicContact CD2-CD2 3.58Å; L589-L691 HydrophobicContact CD2-CG 4.22Å; L589-L691 HydrophobicContact CG-CD1 4.3Å; L593-L691 HydrophobicContact CD1-CD1 3.29Å; C687-L691 WeakPolarHBondContact O-CB 3.46Å; C687-L691 WeakPolarHBondContact O-CD1 2.95Å; C687-L691 VanDerWaalsContact O-CG 3.28Å; C687-L691 WeakPolarHBondContact O-CG 3.22Å; C687-L691 PolarHBondContact O-N 3.06Å; L688-L691 PolarHBondContact O-N 3.17Å; D689-L691 VanDerWaalsContact C-N 3.33Å; D689-L691 PolarHBondContact O-N 3.38Å; L691-L694 PolarHBondContact O-N 3.32Å; L691-N695 PolarHBondContact O-N 2.98Å
692	R	63.2	Low	57.7	Low	118 Å²	118	81 Å²	81	45%	0.445	41%	0.406	S	S	.	.	H	α-helix	trans	-69	-42.4	174.7	-76.7	176.3	177.5	166.8	1.9	112.1	E590 L688 D689 L694 N695 E696	E590-R692 IonicContact OE1-CZ 3.27Å; E590-R692 VanDerWaalsContact OE1-CZ 3.27Å; E590-R692 IonicContact OE1-NE 2.78Å; E590-R692 PolarHBondContact OE1-NE 3.13Å; E590-R692 IonicContact OE1-NH2 2.87Å; E590-R692 PolarHBondContact OE1-NH2 3.12Å; L688-R692 WeakPolarHBondContact O-CG 3.49Å; L688-R692 PolarHBondContact O-N 2.93Å; D689-R692 PolarHBondContact O-N 3.19Å; R692-L694 PolarHBondContact O-N 3.32Å; R692-N695 CarbonylContact O-C 3.6Å; R692-N695 WeakPolarHBondContact O-CA 3.07Å; R692-N695 WeakPolarHBondContact O-CB 3.18Å; R692-N695 PolarHBondContact O-N 3.1Å; R692-E696 PolarHBondContact O-N 3.29Å; R692-E696 VanDerWaalsContact O-N 3.1Å
693	L	60.3	Low	57.2	Low	121 Å²	121	78.9 Å²	78.9	63%	0.634	40%	0.401	S	S	*	.	H	α-helix	trans	-60.6	-28.8	172.6	-80.9	158.1	0	0	0	112.5	D689 N695	D689-L693 WeakPolarHBondContact O-CB 3.26Å; D689-L693 WeakPolarHBondContact O-CD1 2.95Å; D689-L693 WeakPolarHBondContact O-CG 3.48Å; D689-L693 PolarHBondContact O-N 3.33Å; L693-N695 VanDerWaalsContact C-N 3.34Å
694	L	51.1	Low	57.5	Low	82 Å²	82	80.8 Å²	80.8	43%	0.429	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.5	172.9	-73.4	164.4	0	0	0	113.3	Q690 L691 R692	Q690-L694 WeakPolarHBondContact O-CD1 3.26Å; Q690-L694 VanDerWaalsContact O-CG 3.3Å; Q690-L694 WeakPolarHBondContact O-CG 3.41Å; Q690-L694 PolarHBondContact O-N 3.01Å; Q690-L694 VanDerWaalsContact O-N 3.11Å; L691-L694 PolarHBondContact O-N 3.32Å; R692-L694 PolarHBondContact O-N 3.32Å
695	N	50.7	Low	57.4	Low	35 Å²	35	85.6 Å²	85.6	19%	0.187	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-13.2	179.5	-91.3	-19.3	0	0	0	113.7	H583 H586 L691 R692 L693	H583-N695 PolarHBondContact ND1-OD1 2.75Å; H586-N695 VanDerWaalsContact CB-OD1 3.23Å; H586-N695 WeakPolarHBondContact CB-OD1 3.45Å; L691-N695 PolarHBondContact O-N 2.98Å; R692-N695 CarbonylContact O-C 3.6Å; R692-N695 WeakPolarHBondContact O-CA 3.07Å; R692-N695 WeakPolarHBondContact O-CB 3.18Å; R692-N695 PolarHBondContact O-N 3.1Å; L693-N695 VanDerWaalsContact C-N 3.34Å
696	E	49.6	Very low	56.7	Low	218 Å²	218	85.1 Å²	85.1	100%	1.019	42%	0.422	S	S	*	.			trans	-87	0	168.1	-69.3	-173.8	169.2	0	0	111.2	R692	R692-E696 PolarHBondContact O-N 3.29Å; R692-E696 VanDerWaalsContact O-N 3.1Å

Retrieved 696 of 696 residues in 121.9 ms (Link to these results)

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