G4VT14_SCHMA Loading...

SERPIN domain-containing protein

AlphaFold DB , UniProt , Accession G4VT14, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 536 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	44.5	Very low	44	Very low	188 Å²	188	130.2 Å²	130.2	93%	0.926	59%	0.594	S	S	*	*				0	-43.1	0	-70.7	-157.5	164.2	0	0	114.2	R3 I4	M1-R3 PolarHBondContact O-N 3.04Å; M1-I4 WeakPolarHBondContact O-CB 3.01Å; M1-I4 PolarHBondContact O-N 3.02Å; M1-I4 VanDerWaalsContact O-N 3.09Å
2	F	32.1	Very low	43.9	Very low	145 Å²	145	131.3 Å²	131.3	64%	0.636	59%	0.592	S	S	*	*	H	α-helix	trans	-59.4	-35.3	-175.9	-140	-92.8	0	0	0	115.6	I4 W5 I6 L526	F2-I4 VanDerWaalsContact C-N 3.3Å; F2-I4 PolarHBondContact O-N 3.43Å; F2-W5 PolarHBondContact O-N 3.38Å; F2-I6 HydrophobicContact CD1-CD1 4.08Å; F2-I6 HydrophobicContact CE1-CD1 4.33Å; F2-I6 PolarHBondContact O-N 3.06Å; F2-L526 HydrophobicContact CZ-CD1 3.94Å
3	R	35.4	Very low	43.8	Very low	223 Å²	223	126.6 Å²	126.6	84%	0.842	57%	0.574	S	S	*	*	H	α-helix	trans	-66.1	-29.2	176.3	-74.5	-170.5	172.7	-176.1	-1.1	113.7	M1 Y7	M1-R3 PolarHBondContact O-N 3.04Å; R3-Y7 PolarHBondContact O-N 3.14Å
4	I	45.5	Very low	44	Very low	103 Å²	103	124.6 Å²	124.6	53%	0.528	57%	0.569	S	S	.	*	H	α-helix	trans	-72.5	-40.4	-180	-79.8	141.1	0	0	0	110.8	M1 F2 Y7 F8	M1-I4 WeakPolarHBondContact O-CB 3.01Å; M1-I4 PolarHBondContact O-N 3.02Å; M1-I4 VanDerWaalsContact O-N 3.09Å; F2-I4 VanDerWaalsContact C-N 3.3Å; F2-I4 PolarHBondContact O-N 3.43Å; I4-Y7 WeakPolarHBondContact O-CA 3.45Å; I4-Y7 VanDerWaalsContact O-CB 3.29Å; I4-Y7 WeakPolarHBondContact O-CB 3.5Å; I4-Y7 PolarHBondContact O-N 3.17Å; I4-Y7 VanDerWaalsContact O-N 3.13Å; I4-F8 HydrophobicContact CG2-CD2 3.92Å; I4-F8 HydrophobicContact CG2-CE2 4.04Å; I4-F8 PolarHBondContact O-N 2.82Å
5	W	42.8	Very low	43.7	Very low	180 Å²	180	128.9 Å²	128.9	68%	0.682	58%	0.579	S	S	*	*	H	α-helix	trans	-66.7	-38.8	178.2	-83.2	93.9	0	0	0	113.1	F2 Y7 F8 A9	F2-W5 PolarHBondContact O-N 3.38Å; W5-Y7 VanDerWaalsContact C-N 3.26Å; W5-Y7 PolarHBondContact O-N 3.41Å; W5-F8 PolarHBondContact O-N 2.95Å; W5-A9 WeakPolarHBondContact O-CB 3.42Å; W5-A9 PolarHBondContact O-N 3.16Å
6	I	50.5	Low	43.4	Very low	87 Å²	87	126.3 Å²	126.3	45%	0.446	57%	0.571	S	S	.	*	H	α-helix	trans	-62.2	-38	172.1	-72.5	166.5	0	0	0	110.6	F2 L10	F2-I6 HydrophobicContact CD1-CD1 4.08Å; F2-I6 HydrophobicContact CE1-CD1 4.33Å; F2-I6 PolarHBondContact O-N 3.06Å; I6-L10 HydrophobicContact CG2-CD1 3.83Å; I6-L10 WeakPolarHBondContact O-CB 3.33Å; I6-L10 PolarHBondContact O-N 2.81Å
7	Y	44.5	Very low	43.1	Very low	168 Å²	168	123.3 Å²	123.3	66%	0.659	56%	0.564	S	S	*	*	H	α-helix	trans	-63.2	-45.9	174.4	-113.5	-87.9	0	0	0	112.3	R3 I4 W5 L10 I11	R3-Y7 PolarHBondContact O-N 3.14Å; I4-Y7 WeakPolarHBondContact O-CA 3.45Å; I4-Y7 VanDerWaalsContact O-CB 3.29Å; I4-Y7 WeakPolarHBondContact O-CB 3.5Å; I4-Y7 PolarHBondContact O-N 3.17Å; I4-Y7 VanDerWaalsContact O-N 3.13Å; W5-Y7 VanDerWaalsContact C-N 3.26Å; W5-Y7 PolarHBondContact O-N 3.41Å; Y7-L10 PolarHBondContact O-N 2.98Å; Y7-I11 HydrophobicContact CD1-CD1 4.32Å; Y7-I11 VanDerWaalsContact O-CG1 3.27Å; Y7-I11 WeakPolarHBondContact O-CG1 3.44Å; Y7-I11 PolarHBondContact O-N 3.28Å
8	F	46.1	Very low	42.7	Very low	136 Å²	136	121.3 Å²	121.3	60%	0.596	56%	0.563	S	S	*	*	H	α-helix	trans	-63	-45.5	176.3	-92.2	-80.1	0	0	0	112.4	I4 W5 L10 I11 Y12	I4-F8 HydrophobicContact CG2-CD2 3.92Å; I4-F8 HydrophobicContact CG2-CE2 4.04Å; I4-F8 PolarHBondContact O-N 2.82Å; W5-F8 PolarHBondContact O-N 2.95Å; F8-L10 VanDerWaalsContact C-N 3.27Å; F8-L10 PolarHBondContact O-N 3.32Å; F8-I11 PolarHBondContact O-N 3.4Å; F8-Y12 WeakPolarHBondContact O-CB 3.5Å; F8-Y12 PolarHBondContact O-N 2.81Å
9	A	44.6	Very low	42.2	Very low	56 Å²	56	118.3 Å²	118.3	46%	0.463	56%	0.556	S	S	.	*	H	α-helix	trans	-60.6	-37.8	176.6	0	0	0	0	0	112	W5 Y12 L13	W5-A9 WeakPolarHBondContact O-CB 3.42Å; W5-A9 PolarHBondContact O-N 3.16Å; A9-Y12 PolarHBondContact O-N 2.75Å; A9-L13 WeakPolarHBondContact O-CB 3.44Å; A9-L13 PolarHBondContact O-N 2.82Å
10	L	48.5	Very low	41.8	Very low	63 Å²	63	118 Å²	118	33%	0.33	56%	0.563	S	S	.	*	H	α-helix	trans	-70.2	-42.4	175.5	-89.6	158.8	0	0	0	112.9	I6 Y7 F8 Y12 L13 I14	I6-L10 HydrophobicContact CG2-CD1 3.83Å; I6-L10 WeakPolarHBondContact O-CB 3.33Å; I6-L10 PolarHBondContact O-N 2.81Å; Y7-L10 PolarHBondContact O-N 2.98Å; F8-L10 VanDerWaalsContact C-N 3.27Å; F8-L10 PolarHBondContact O-N 3.32Å; L10-Y12 VanDerWaalsContact C-N 3.25Å; L10-Y12 PolarHBondContact O-N 3.03Å; L10-L13 PolarHBondContact O-N 3.35Å; L10-I14 WeakPolarHBondContact O-CB 3.29Å; L10-I14 VanDerWaalsContact O-CG1 3.29Å; L10-I14 WeakPolarHBondContact O-CG1 3.4Å; L10-I14 PolarHBondContact O-N 3.38Å
11	I	49.8	Very low	41.2	Very low	83 Å²	83	115.9 Å²	115.9	43%	0.426	57%	0.565	S	S	.	*	H	α-helix	trans	-60.3	-40.9	174.4	-70.2	165	0	0	0	109.8	Y7 F8 I14 R15	Y7-I11 HydrophobicContact CD1-CD1 4.32Å; Y7-I11 VanDerWaalsContact O-CG1 3.27Å; Y7-I11 WeakPolarHBondContact O-CG1 3.44Å; Y7-I11 PolarHBondContact O-N 3.28Å; F8-I11 PolarHBondContact O-N 3.4Å; I11-I14 PolarHBondContact O-N 3.45Å; I11-R15 WeakPolarHBondContact O-CB 3.37Å; I11-R15 PolarHBondContact O-N 2.9Å
12	Y	43	Very low	40.6	Very low	144 Å²	144	113.8 Å²	113.8	57%	0.565	56%	0.558	S	S	*	*	H	α-helix	trans	-66.1	-41.8	176.6	-149.1	-98.7	0	0	0	111.9	F8 A9 L10 I14 R15 I16	F8-Y12 WeakPolarHBondContact O-CB 3.5Å; F8-Y12 PolarHBondContact O-N 2.81Å; A9-Y12 PolarHBondContact O-N 2.75Å; L10-Y12 VanDerWaalsContact C-N 3.25Å; L10-Y12 PolarHBondContact O-N 3.03Å; Y12-I14 VanDerWaalsContact C-N 3.35Å; Y12-I14 PolarHBondContact O-N 2.88Å; Y12-R15 PolarHBondContact O-N 2.91Å; Y12-I16 HydrophobicContact CD1-CD1 3.61Å; Y12-I16 HydrophobicContact CD1-CG1 4.24Å; Y12-I16 HydrophobicContact CE1-CD1 3.71Å; Y12-I16 HydrophobicContact CE1-CG1 4.28Å; Y12-I16 WeakPolarHBondContact O-CG1 3.35Å; Y12-I16 PolarHBondContact O-N 2.78Å
13	L	42	Very low	40.2	Very low	70 Å²	70	113.5 Å²	113.5	37%	0.366	56%	0.558	S	S	.	*	H	α-helix	trans	-63.4	-40.4	176.1	-157	92.1	0	0	0	112	A9 L10 T17 V107	A9-L13 WeakPolarHBondContact O-CB 3.44Å; A9-L13 PolarHBondContact O-N 2.82Å; L10-L13 PolarHBondContact O-N 3.35Å; L13-T17 PolarHBondContact O-N 3.23Å; L13-T17 PolarHBondContact O-OG1 3.29Å; L13-V107 HydrophobicContact CD1-CG1 3.88Å
14	I	47	Very low	39.9	Very low	99 Å²	99	110 Å²	110	51%	0.508	55%	0.552	S	S	.	*	H	α-helix	trans	-67.6	-42.5	175.6	-68.2	165.6	0	0	0	110.3	L10 I11 Y12 I16 T17 V18	L10-I14 WeakPolarHBondContact O-CB 3.29Å; L10-I14 VanDerWaalsContact O-CG1 3.29Å; L10-I14 WeakPolarHBondContact O-CG1 3.4Å; L10-I14 PolarHBondContact O-N 3.38Å; I11-I14 PolarHBondContact O-N 3.45Å; Y12-I14 VanDerWaalsContact C-N 3.35Å; Y12-I14 PolarHBondContact O-N 2.88Å; I14-I16 PolarHBondContact O-N 3.49Å; I14-T17 WeakPolarHBondContact CA-OG1 3.24Å; I14-T17 PolarHBondContact O-N 3.11Å; I14-T17 PolarHBondContact O-OG1 3.28Å; I14-V18 HydrophobicContact CG2-CG2 4.05Å; I14-V18 WeakPolarHBondContact O-CB 3.33Å; I14-V18 VanDerWaalsContact O-CG2 3.28Å; I14-V18 WeakPolarHBondContact O-CG2 3.45Å; I14-V18 PolarHBondContact O-N 2.77Å
15	R	38.7	Very low	39.4	Very low	188 Å²	188	111.3 Å²	111.3	71%	0.709	57%	0.566	S	S	*	*	H	α-helix	trans	-62	-43.7	176	-85.8	-157	178.9	-169.9	1.8	112	I11 Y12 T17 S19	I11-R15 WeakPolarHBondContact O-CB 3.37Å; I11-R15 PolarHBondContact O-N 2.9Å; Y12-R15 PolarHBondContact O-N 2.91Å; R15-T17 PolarHBondContact O-N 3.19Å; R15-S19 WeakPolarHBondContact O-CA 3.44Å; R15-S19 WeakPolarHBondContact O-CB 3.41Å; R15-S19 PolarHBondContact O-N 3.3Å
16	I	39.8	Very low	39	Very low	88 Å²	88	106.9 Å²	106.9	45%	0.451	56%	0.563	S	S	.	*	H	α-helix	trans	-61.4	-47.8	176.6	-68.2	167.3	0	0	0	110.3	Y12 I14 V18 S19 T20	Y12-I16 HydrophobicContact CD1-CD1 3.61Å; Y12-I16 HydrophobicContact CD1-CG1 4.24Å; Y12-I16 HydrophobicContact CE1-CD1 3.71Å; Y12-I16 HydrophobicContact CE1-CG1 4.28Å; Y12-I16 WeakPolarHBondContact O-CG1 3.35Å; Y12-I16 PolarHBondContact O-N 2.78Å; I14-I16 PolarHBondContact O-N 3.49Å; I16-V18 PolarHBondContact O-N 3.03Å; I16-S19 PolarHBondContact O-N 3.29Å; I16-T20 WeakPolarHBondContact O-CG2 3.35Å; I16-T20 PolarHBondContact O-N 3.17Å; I16-T20 PolarHBondContact O-OG1 2.67Å
17	T	37.3	Very low	38.1	Very low	75 Å²	75	109.2 Å²	109.2	46%	0.46	58%	0.576	S	S	.	*	H	α-helix	trans	-68.5	-35.4	-177.7	35.9	0	0	0	0	113.7	L13 I14 R15 T20 A21	L13-T17 PolarHBondContact O-N 3.23Å; L13-T17 PolarHBondContact O-OG1 3.29Å; I14-T17 WeakPolarHBondContact CA-OG1 3.24Å; I14-T17 PolarHBondContact O-N 3.11Å; I14-T17 PolarHBondContact O-OG1 3.28Å; R15-T17 PolarHBondContact O-N 3.19Å; T17-T20 PolarHBondContact O-OG1 3.28Å; T17-A21 WeakPolarHBondContact O-CB 3.45Å; T17-A21 PolarHBondContact O-N 3.29Å
18	V	36.5	Very low	37.3	Very low	88 Å²	88	111.3 Å²	111.3	53%	0.533	59%	0.585	S	S	.	*	H	α-helix	trans	-77.7	-38.8	176.8	177.1	0	0	0	0	111.3	I14 I16 T20 A21 N22	I14-V18 HydrophobicContact CG2-CG2 4.05Å; I14-V18 WeakPolarHBondContact O-CB 3.33Å; I14-V18 VanDerWaalsContact O-CG2 3.28Å; I14-V18 WeakPolarHBondContact O-CG2 3.45Å; I14-V18 PolarHBondContact O-N 2.77Å; I16-V18 PolarHBondContact O-N 3.03Å; V18-T20 VanDerWaalsContact C-N 3.31Å; V18-T20 PolarHBondContact O-N 3.25Å; V18-A21 PolarHBondContact O-N 3.39Å; V18-A21 VanDerWaalsContact O-N 3.1Å; V18-N22 PolarHBondContact O-N 3.35Å
19	S	32.8	Very low	36.7	Very low	63 Å²	63	109.5 Å²	109.5	44%	0.441	59%	0.586	S	S	.	*	H	α-helix	trans	-64.8	-35.4	177.9	-165.3	0	0	0	0	111.6	R15 I16 A21 H23	R15-S19 WeakPolarHBondContact O-CA 3.44Å; R15-S19 WeakPolarHBondContact O-CB 3.41Å; R15-S19 PolarHBondContact O-N 3.3Å; I16-S19 PolarHBondContact O-N 3.29Å; S19-A21 VanDerWaalsContact C-N 3.33Å; S19-H23 PolarHBondContact O-CD2 2.92Å
20	T	33.9	Very low	36.1	Very low	112 Å²	112	114.4 Å²	114.4	69%	0.687	61%	0.605	S	S	*	*	H	α-helix	trans	-77.5	-17.9	174.5	53.3	0	0	0	0	113.8	I16 T17 V18	I16-T20 WeakPolarHBondContact O-CG2 3.35Å; I16-T20 PolarHBondContact O-N 3.17Å; I16-T20 PolarHBondContact O-OG1 2.67Å; T17-T20 PolarHBondContact O-OG1 3.28Å; V18-T20 VanDerWaalsContact C-N 3.31Å; V18-T20 PolarHBondContact O-N 3.25Å
21	A	29.8	Very low	35.5	Very low	75 Å²	75	116 Å²	116	62%	0.62	62%	0.621	S	S	*	*	H	α-helix	trans	-86	-19.1	-175.5	0	0	0	0	0	113.9	T17 V18 S19	T17-A21 WeakPolarHBondContact O-CB 3.45Å; T17-A21 PolarHBondContact O-N 3.29Å; V18-A21 PolarHBondContact O-N 3.39Å; V18-A21 VanDerWaalsContact O-N 3.1Å; S19-A21 VanDerWaalsContact C-N 3.33Å
22	N	30.9	Very low	34.5	Very low	143 Å²	143	120.5 Å²	120.5	77%	0.765	64%	0.641	S	S	*	*	H	α-helix	trans	-126.4	-2.2	-174.6	-101.9	3.2	0	0	0	115.9	V18 Q24	V18-N22 PolarHBondContact O-N 3.35Å; N22-Q24 PolarHBondContact O-N 3.04Å; N22-Q24 VanDerWaalsContact O-N 3.14Å
23	H	24.4	Very low	34.1	Very low	139 Å²	139	121.9 Å²	121.9	64%	0.644	66%	0.657	S	S	*	*			trans	-86.8	88	173.2	-77.2	-61.6	0	0	0	110.3	S19	S19-H23 PolarHBondContact O-CD2 2.92Å
24	Q	29.7	Very low	33.4	Very low	151 Å²	151	125 Å²	125	71%	0.706	67%	0.672	S	S	*	*			trans	-61.6	130	151.7	-123.6	-178.6	-9.6	0	0	107	N22 S26	N22-Q24 PolarHBondContact O-N 3.04Å; N22-Q24 VanDerWaalsContact O-N 3.14Å; Q24-S26 PolarHBondContact O-N 3.26Å
25	P	34.1	Very low	32.6	Very low	129 Å²	129	127.5 Å²	127.5	84%	0.838	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	12.8	-169	-20.7	32.4	0	0	0	117
26	S	34.2	Very low	32.3	Very low	88 Å²	88	126 Å²	126	62%	0.615	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-4.2	-171.4	54.1	0	0	0	0	115.9	Q24	Q24-S26 PolarHBondContact O-N 3.26Å
27	D	31.9	Very low	31.8	Very low	135 Å²	135	129.2 Å²	129.2	72%	0.722	71%	0.708	S	S	*	*			trans	-102.6	43.5	-175.3	-70.4	-17.2	0	0	0	113.5	P29	D27-P29 WeakPolarHBondContact O-CD 3.48Å
28	Y	27.4	Very low	31.7	Very low	213 Å²	213	133.3 Å²	133.3	84%	0.835	73%	0.726	S	S	*	*			trans	-89.1	104	160.2	-101.1	-89.3	0	0	0	108	D30	Y28-D30 PolarHBondContact O-N 2.76Å
29	P	33.5	Very low	31.5	Very low	97 Å²	97	134.6 Å²	134.6	63%	0.63	74%	0.736	S	S	*	*			trans	-70.2	119.9	161.8	28.4	-30.2	0	0	0	107.5	D27 S31	D27-P29 WeakPolarHBondContact O-CD 3.48Å; P29-S31 PolarHBondContact O-N 3.43Å; P29-S31 PolarHBondContact O-OG 3.11Å
30	D	33.3	Very low	31.2	Very low	160 Å²	160	137.4 Å²	137.4	86%	0.856	76%	0.756	S	S	*	*			trans	-52.7	89.3	167.1	-70.2	-39.1	0	0	0	108.6	Y28 E32	Y28-D30 PolarHBondContact O-N 2.76Å; D30-E32 PolarHBondContact O-N 3.4Å; D30-E32 VanDerWaalsContact O-N 3.14Å
31	S	34.8	Very low	31	Very low	96 Å²	96	137.2 Å²	137.2	67%	0.671	76%	0.759	S	S	*	*			trans	-84.2	94.1	-178.8	-59.3	0	0	0	0	106.2	P29 L33	P29-S31 PolarHBondContact O-N 3.43Å; P29-S31 PolarHBondContact O-OG 3.11Å; S31-L33 PolarHBondContact O-N 3.3Å
32	E	30.2	Very low	31.1	Very low	178 Å²	178	140.6 Å²	140.6	83%	0.832	77%	0.772	S	S	*	*			trans	-44.3	121	166.4	-73.7	177.7	151.5	0	0	108.7	D30 I34	D30-E32 PolarHBondContact O-N 3.4Å; D30-E32 VanDerWaalsContact O-N 3.14Å; E32-I34 PolarHBondContact O-N 2.87Å
33	L	33.1	Very low	31.1	Very low	173 Å²	173	139 Å²	139	91%	0.906	77%	0.772	S	S	*	*			trans	-56.6	103	171.3	-105.2	80.5	0	0	0	107.7	S31 D35	S31-L33 PolarHBondContact O-N 3.3Å; L33-D35 PolarHBondContact O-N 2.84Å
34	I	28.9	Very low	31.4	Very low	134 Å²	134	141.2 Å²	141.2	69%	0.687	78%	0.78	S	S	*	*			trans	-77.2	102.9	169.4	-56.7	175.5	0	0	0	106.3	E32 M36	E32-I34 PolarHBondContact O-N 2.87Å; I34-M36 HydrophobicContact CG2-CE 4.12Å; I34-M36 HydrophobicContact CG2-CG 4.01Å; I34-M36 PolarHBondContact O-N 3.28Å
35	D	29.2	Very low	31.7	Very low	153 Å²	153	139.7 Å²	139.7	82%	0.818	78%	0.783	S	S	*	*			trans	-63.7	94.9	170.2	-130.6	-8.2	0	0	0	108.1	L33	L33-D35 PolarHBondContact O-N 2.84Å
36	M	31.8	Very low	31.6	Very low	156 Å²	156	144.8 Å²	144.8	77%	0.768	79%	0.787	S	S	*	*			trans	-93.8	97	177.5	-87.1	-89	170.6	0	0	109	I34 L38	I34-M36 HydrophobicContact CG2-CE 4.12Å; I34-M36 HydrophobicContact CG2-CG 4.01Å; I34-M36 PolarHBondContact O-N 3.28Å; M36-L38 PolarHBondContact O-N 2.74Å
37	D	30.7	Very low	31.4	Very low	156 Å²	156	151.5 Å²	151.5	83%	0.834	80%	0.8	S	S	*	*			trans	-57.1	98.4	168.4	-75.4	-44.5	0	0	0	110.6	P39	D37-P39 WeakPolarHBondContact O-CD 3.27Å
38	L	33.9	Very low	31.3	Very low	161 Å²	161	151.5 Å²	151.5	84%	0.843	81%	0.805	S	S	*	*			trans	-89.5	118.6	-179.8	-155.5	77.8	0	0	0	110.8	M36 S40	M36-L38 PolarHBondContact O-N 2.74Å; L38-S40 PolarHBondContact O-N 2.97Å
39	P	32	Very low	31.6	Very low	115 Å²	115	146.9 Å²	146.9	75%	0.747	80%	0.804	S	S	*	*			trans	-74.9	121.8	-175.5	26.1	-32.1	0	0	0	113	D37 S41	D37-P39 WeakPolarHBondContact O-CD 3.27Å; P39-S41 PolarHBondContact O-N 3.47Å
40	S	28	Very low	31.7	Very low	121 Å²	121	151.9 Å²	151.9	85%	0.846	82%	0.819	S	S	*	*			trans	-83.2	88.6	178.9	63.7	0	0	0	0	112.7	L38	L38-S40 PolarHBondContact O-N 2.97Å
41	S	29.1	Very low	31.6	Very low	108 Å²	108	148.7 Å²	148.7	76%	0.755	81%	0.809	S	S	*	*			trans	-165.4	94.6	156.5	55.4	0	0	0	0	113.1	P39	P39-S41 PolarHBondContact O-N 3.47Å
42	V	31.5	Very low	31.6	Very low	146 Å²	146	152 Å²	152	89%	0.885	82%	0.819	S	S	*	*			trans	-131.6	112.1	159.7	-173.8	0	0	0	0	108.5
43	S	32.4	Very low	31.8	Very low	110 Å²	110	148.3 Å²	148.3	77%	0.769	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-67.1	135.5	-178.4	48.3	0	0	0	0	112.5
44	K	30.4	Very low	31.8	Very low	186 Å²	186	150.4 Å²	150.4	81%	0.809	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.1	129.6	179.3	-72.5	167.7	178.5	167.1	0	111.7
45	P	35.2	Very low	32	Very low	118 Å²	118	152.8 Å²	152.8	77%	0.766	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.8	133.9	174.7	29.5	-30.9	0	0	0	111.5
46	Y	31.6	Very low	32.2	Very low	236 Å²	236	151.8 Å²	151.8	93%	0.925	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-73.8	130.5	175.4	-80.4	-100.7	0	0	0	110.7
47	Y	29.6	Very low	32.4	Very low	229 Å²	229	149.6 Å²	149.6	90%	0.898	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-68.8	138.5	176.7	-90.9	-103.5	0	0	0	112
48	T	31.5	Very low	32.6	Very low	135 Å²	135	150.5 Å²	150.5	83%	0.828	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-85.1	146.2	170.1	40.4	0	0	0	0	111.6
49	S	33.7	Very low	32.7	Very low	116 Å²	116	147.6 Å²	147.6	81%	0.811	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-73.9	120.3	-172	-54.8	0	0	0	0	113.4	S51	S49-S51 PolarHBondContact O-N 2.83Å
50	E	34.3	Very low	32.9	Very low	203 Å²	203	147.6 Å²	147.6	95%	0.949	78%	0.783	S	S	*	*			trans	-75.9	111.1	170.3	-72.3	177.9	158.7	0	0	110
51	S	32	Very low	33.2	Very low	93 Å²	93	145 Å²	145	65%	0.65	77%	0.765	S	S	*	*			trans	-106.6	136.5	173.7	10.5	0	0	0	0	110.1	S49	S49-S51 PolarHBondContact O-N 2.83Å
52	D	34.4	Very low	33.4	Very low	164 Å²	164	149.8 Å²	149.8	88%	0.877	77%	0.767	S	S	*	*	S	Bend	trans	75.1	19	149.5	-53.1	-22.8	0	0	0	122.4	Y54	D52-Y54 PolarHBondContact O-N 2.91Å
53	S	35.2	Very low	33.4	Very low	101 Å²	101	148.3 Å²	148.3	71%	0.706	75%	0.753	S	S	*	*			trans	-98.2	41.6	172.3	-157.6	0	0	0	0	114.5
54	Y	32.2	Very low	33.3	Very low	218 Å²	218	146.1 Å²	146.1	86%	0.855	74%	0.737	S	S	*	*	S	Bend	trans	-103.7	-19.3	-179.6	-135.3	-92.9	0	0	0	114.9	D52	D52-Y54 PolarHBondContact O-N 2.91Å
55	E	33.4	Very low	33.5	Very low	184 Å²	184	147.4 Å²	147.4	86%	0.86	74%	0.737	S	S	*	*	S	Bend	trans	-85.5	-26.7	-176.2	-73.7	-151.3	137.3	0	0	114.7	N57	E55-N57 VanDerWaalsContact C-N 3.29Å; E55-N57 PolarHBondContact O-N 2.92Å
56	N	33.2	Very low	33.3	Very low	131 Å²	131	148.7 Å²	148.7	70%	0.701	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-10.6	-173.1	-119	-20.6	0	0	0	114.7
57	N	35.8	Very low	33.4	Very low	110 Å²	110	140.8 Å²	140.8	59%	0.588	72%	0.72	S	S	*	*	H	α-helix	trans	-84.5	-13.8	-177	-84.1	-29.9	0	0	0	114.8	E55	E55-N57 VanDerWaalsContact C-N 3.29Å; E55-N57 PolarHBondContact O-N 2.92Å
58	K	35.8	Very low	33.4	Very low	176 Å²	176	136.6 Å²	136.6	77%	0.765	71%	0.708	S	S	*	*	H	α-helix	trans	-70.9	-36.3	178.9	-95.4	-179.8	179.7	171.8	0	112.7	S61	K58-S61 PolarHBondContact O-N 2.76Å; K58-S61 PolarHBondContact O-OG 2.94Å
59	V	34.9	Very low	33.6	Very low	100 Å²	100	140 Å²	140	61%	0.606	71%	0.711	S	S	*	*	H	α-helix	trans	-71.1	-39.2	-177.1	-176.9	0	0	0	0	111.5	S61 R62	V59-S61 VanDerWaalsContact C-N 3.26Å; V59-S61 PolarHBondContact O-N 2.71Å; V59-R62 PolarHBondContact O-N 3.16Å
60	L	37.2	Very low	33.3	Very low	114 Å²	114	145.5 Å²	145.5	60%	0.597	71%	0.714	S	S	*	*	H	α-helix	trans	-62.9	-30.3	177.2	-87.4	154.8	0	0	0	113.3	R62 I63 S64	L60-R62 VanDerWaalsContact C-N 3.29Å; L60-R62 PolarHBondContact O-N 2.92Å; L60-I63 PolarHBondContact O-N 3.4Å; L60-S64 WeakPolarHBondContact O-CB 3.29Å; L60-S64 PolarHBondContact O-N 3.46Å; L60-S64 VanDerWaalsContact O-N 3.11Å
61	S	34.1	Very low	32.9	Very low	67 Å²	67	139.2 Å²	139.2	47%	0.469	70%	0.697	S	S	.	*	H	α-helix	trans	-65.5	-28	-179.9	76.6	0	0	0	0	113.9	K58 V59	K58-S61 PolarHBondContact O-N 2.76Å; K58-S61 PolarHBondContact O-OG 2.94Å; V59-S61 VanDerWaalsContact C-N 3.26Å; V59-S61 PolarHBondContact O-N 2.71Å
62	R	33.5	Very low	32.7	Very low	208 Å²	208	143.8 Å²	143.8	79%	0.785	71%	0.708	S	S	*	*	H	α-helix	trans	-79.3	-39.6	178.1	-75.2	-170.9	-175.8	-178.2	2.8	112.2	V59 L60 S64 R65	V59-R62 PolarHBondContact O-N 3.16Å; L60-R62 VanDerWaalsContact C-N 3.29Å; L60-R62 PolarHBondContact O-N 2.92Å; R62-S64 VanDerWaalsContact C-N 3.33Å; R62-R65 PolarHBondContact O-N 3.28Å
63	I	30.7	Very low	32.3	Very low	116 Å²	116	143.7 Å²	143.7	60%	0.595	70%	0.702	S	S	*	*	H	α-helix	trans	-68.4	-36.4	179.1	-59.9	176.1	0	0	0	110.5	L60 R65 I66	L60-I63 PolarHBondContact O-N 3.4Å; I63-R65 PolarHBondContact O-N 2.94Å; I63-I66 PolarHBondContact O-N 2.77Å
64	S	31	Very low	31.9	Very low	63 Å²	63	145.9 Å²	145.9	44%	0.441	71%	0.705	S	S	.	*	H	α-helix	trans	-55.1	-33.8	174.8	156	0	0	0	0	113.3	L60 R62 I66 H68	L60-S64 WeakPolarHBondContact O-CB 3.29Å; L60-S64 PolarHBondContact O-N 3.46Å; L60-S64 VanDerWaalsContact O-N 3.11Å; R62-S64 VanDerWaalsContact C-N 3.33Å; S64-I66 VanDerWaalsContact C-N 3.33Å; S64-I66 PolarHBondContact O-N 3.38Å; S64-H68 PolarHBondContact O-CD2 2.88Å; S64-H68 VanDerWaalsContact O-CD2 3.28Å
65	R	34.7	Very low	31.7	Very low	213 Å²	213	142.4 Å²	142.4	80%	0.804	70%	0.7	S	S	*	*	H	α-helix	trans	-73.7	-23.5	-174.6	-132.6	-176.4	-87	-169.3	-6	113.5	R62 I63	R62-R65 PolarHBondContact O-N 3.28Å; I63-R65 PolarHBondContact O-N 2.94Å
66	I	31.6	Very low	31.4	Very low	146 Å²	146	139.7 Å²	139.7	75%	0.749	69%	0.69	S	S	*	*	H	α-helix	trans	-89.2	-27.5	-177.9	-62	171.9	0	0	0	111.6	I63 S64 H68	I63-I66 PolarHBondContact O-N 2.77Å; S64-I66 VanDerWaalsContact C-N 3.33Å; S64-I66 PolarHBondContact O-N 3.38Å; I66-H68 VanDerWaalsContact C-N 3.27Å; I66-H68 PolarHBondContact O-N 2.81Å
67	A	33.4	Very low	30.9	Very low	70 Å²	70	137.8 Å²	137.8	58%	0.579	68%	0.683	S	S	*	*	H	α-helix	trans	-73.8	-11.5	-179.2	0	0	0	0	0	114.6	K69 R70	A67-K69 PolarHBondContact O-N 2.87Å; A67-R70 PolarHBondContact O-N 2.87Å
68	H	29.3	Very low	30.5	Very low	140 Å²	140	140.8 Å²	140.8	65%	0.648	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	0.8	-175.1	-84.9	-53.6	0	0	0	116.4	S64 I66	S64-H68 PolarHBondContact O-CD2 2.88Å; S64-H68 VanDerWaalsContact O-CD2 3.28Å; I66-H68 VanDerWaalsContact C-N 3.27Å; I66-H68 PolarHBondContact O-N 2.81Å
69	K	34.5	Very low	30.1	Very low	208 Å²	208	138.7 Å²	138.7	90%	0.904	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-4.9	173.2	-78.1	-167.3	177.7	-176.4	0	114.9	A67	A67-K69 PolarHBondContact O-N 2.87Å
70	R	27.5	Very low	29.7	Very low	231 Å²	231	141.1 Å²	141.1	87%	0.872	70%	0.7	S	S	*	*	S	Bend	trans	-118.8	106.2	-178.5	-123.6	175.6	179.8	169.7	-1.4	110.5	A67	A67-R70 PolarHBondContact O-N 2.87Å
71	A	27.3	Very low	29.2	Very low	70 Å²	70	143.1 Å²	143.1	58%	0.579	70%	0.704	S	S	*	*			trans	55.3	95.9	167.8	0	0	0	0	0	115.5	H73	A71-H73 VanDerWaalsContact CB-CD2 3.5Å; A71-H73 WeakPolarHBondContact CB-CD2 3.47Å; A71-H73 PolarHBondContact O-N 3.09Å
72	Q	27.5	Very low	28.9	Very low	189 Å²	189	144.3 Å²	144.3	88%	0.883	71%	0.71	S	S	*	*			trans	-64.5	70.7	159.9	-66.1	177.5	-17.7	0	0	109.6	L74	Q72-L74 PolarHBondContact O-N 3.47Å; Q72-L74 VanDerWaalsContact O-N 3.16Å
73	H	25.2	Very low	28.5	Very low	163 Å²	163	145.9 Å²	145.9	76%	0.755	72%	0.716	S	S	*	*			trans	-69.7	107.5	155.3	-72.1	-80.5	0	0	0	105	A71 L75	A71-H73 VanDerWaalsContact CB-CD2 3.5Å; A71-H73 WeakPolarHBondContact CB-CD2 3.47Å; A71-H73 PolarHBondContact O-N 3.09Å; H73-L75 PolarHBondContact O-N 3.18Å
74	L	27.3	Very low	28.3	Very low	146 Å²	146	147.3 Å²	147.3	76%	0.764	72%	0.724	S	S	*	*			trans	-59.5	80.2	178	-162.5	94.4	0	0	0	108.5	Q72 I76	Q72-L74 PolarHBondContact O-N 3.47Å; Q72-L74 VanDerWaalsContact O-N 3.16Å; L74-I76 HydrophobicContact CD2-CD1 3.9Å; L74-I76 HydrophobicContact CD2-CG1 3.65Å; L74-I76 HydrophobicContact CG-CG1 4.09Å; L74-I76 PolarHBondContact O-N 3.21Å
75	L	27.4	Very low	28.3	Very low	146 Å²	146	149.4 Å²	149.4	76%	0.764	73%	0.73	S	S	*	*			trans	-69.5	94.9	164.8	-162.1	78.3	0	0	0	104	H73 T77	H73-L75 PolarHBondContact O-N 3.18Å; L75-T77 HydrophobicContact CD2-CG2 4.16Å; L75-T77 PolarHBondContact O-N 3.31Å
76	I	26.7	Very low	28	Very low	127 Å²	127	151 Å²	151	65%	0.651	74%	0.736	S	S	*	*			trans	-67.1	79	166.1	-55.8	171.7	0	0	0	104.5	L74 H78	L74-I76 HydrophobicContact CD2-CD1 3.9Å; L74-I76 HydrophobicContact CD2-CG1 3.65Å; L74-I76 HydrophobicContact CG-CG1 4.09Å; L74-I76 PolarHBondContact O-N 3.21Å; I76-H78 PolarHBondContact O-N 3.48Å
77	T	24	Very low	27.7	Very low	90 Å²	90	147.2 Å²	147.2	55%	0.552	73%	0.733	S	S	*	*			trans	-50.7	131.7	155.3	39.3	0	0	0	0	105.5	L75 L79	L75-T77 HydrophobicContact CD2-CG2 4.16Å; L75-T77 PolarHBondContact O-N 3.31Å; T77-L79 PolarHBondContact O-N 3.37Å
78	H	27	Very low	27.5	Very low	174 Å²	174	151 Å²	151	81%	0.806	73%	0.733	S	S	*	*			trans	-55.1	86.5	171.8	-77.7	-98.9	0	0	0	107.7	I76 D80	I76-H78 PolarHBondContact O-N 3.48Å; H78-D80 PolarHBondContact O-N 3.15Å
79	L	27.7	Very low	27.5	Very low	132 Å²	132	150.7 Å²	150.7	69%	0.691	74%	0.737	S	S	*	*			trans	-58.2	108.2	176.3	-98.4	121.7	0	0	0	105.3	T77 F81	T77-L79 PolarHBondContact O-N 3.37Å; L79-F81 VanDerWaalsContact C-N 3.28Å; L79-F81 PolarHBondContact O-N 3.39Å
80	D	26.1	Very low	27.4	Very low	151 Å²	151	148 Å²	148	81%	0.807	73%	0.732	S	S	*	*			trans	23.4	66.9	150	-62.4	-33.8	0	0	0	113.2	H78 P82	H78-D80 PolarHBondContact O-N 3.15Å; D80-P82 WeakPolarHBondContact O-CD 3.34Å; D80-P82 VanDerWaalsContact O-N 3.17Å
81	F	26.5	Very low	27.5	Very low	156 Å²	156	141.9 Å²	141.9	68%	0.684	72%	0.717	S	S	*	*			trans	-60.1	121.2	157.6	-87.2	-87.1	0	0	0	104.9	L79 R83	L79-F81 VanDerWaalsContact C-N 3.28Å; L79-F81 PolarHBondContact O-N 3.39Å; F81-R83 PolarHBondContact O-N 2.99Å
82	P	28.5	Very low	27.8	Very low	91 Å²	91	147.2 Å²	147.2	59%	0.591	73%	0.73	S	S	*	*			trans	-53.7	117.4	-178.6	19.3	-30.1	0	0	0	108	D80 N84	D80-P82 WeakPolarHBondContact O-CD 3.34Å; D80-P82 VanDerWaalsContact O-N 3.17Å; P82-N84 PolarHBondContact O-N 3.34Å
83	R	25.7	Very low	28.1	Very low	241 Å²	241	145 Å²	145	91%	0.909	72%	0.724	S	S	*	*	S	Bend	trans	-58.9	11.9	177.4	-87.5	-177	-179.4	177.5	0	114.2	F81	F81-R83 PolarHBondContact O-N 2.99Å
84	N	25.3	Very low	28.5	Very low	146 Å²	146	143.5 Å²	143.5	78%	0.781	72%	0.721	S	S	*	*			trans	-97	20.9	-175.5	-67.5	-16.7	0	0	0	113.5	P82 R86	P82-N84 PolarHBondContact O-N 3.34Å; N84-R86 PolarHBondContact O-N 3.33Å
85	L	32	Very low	28.8	Very low	107 Å²	107	145.4 Å²	145.4	56%	0.56	72%	0.72	S	S	*	*			trans	-87.1	34.2	170.8	-63.8	-172	0	0	0	112.7	G87 Y88	L85-G87 PolarHBondContact O-N 3.2Å; L85-Y88 HydrophobicContact CB-CD2 3.91Å; L85-Y88 HydrophobicContact CB-CE2 4.11Å; L85-Y88 HydrophobicContact CD1-CD2 4.14Å; L85-Y88 HydrophobicContact CD1-CE2 3.75Å; L85-Y88 HydrophobicContact CD2-CD2 4.04Å; L85-Y88 HydrophobicContact CD2-CE2 3.37Å; L85-Y88 HydrophobicContact CG-CD2 4.21Å; L85-Y88 HydrophobicContact CG-CE2 3.89Å
86	R	27.4	Very low	29.2	Very low	247 Å²	247	141.1 Å²	141.1	93%	0.932	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	30.5	176.3	-158.2	-178.7	179.2	-177.6	1	112.7	N84	N84-R86 PolarHBondContact O-N 3.33Å
87	G	25.6	Very low	29.8	Very low	66 Å²	66	139.3 Å²	139.3	68%	0.68	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.4	5.4	-174.7	0	0	0	0	0	115.2	L85 D89	L85-G87 PolarHBondContact O-N 3.2Å; G87-D89 PolarHBondContact O-N 3.07Å
88	Y	28.5	Very low	30.5	Very low	150 Å²	150	140.9 Å²	140.9	59%	0.588	71%	0.714	S	S	*	*			trans	-77.9	87	168.8	-75.3	-68.7	0	0	0	108.6	L85 N90	L85-Y88 HydrophobicContact CB-CD2 3.91Å; L85-Y88 HydrophobicContact CB-CE2 4.11Å; L85-Y88 HydrophobicContact CD1-CD2 4.14Å; L85-Y88 HydrophobicContact CD1-CE2 3.75Å; L85-Y88 HydrophobicContact CD2-CD2 4.04Å; L85-Y88 HydrophobicContact CD2-CE2 3.37Å; L85-Y88 HydrophobicContact CG-CD2 4.21Å; L85-Y88 HydrophobicContact CG-CE2 3.89Å; Y88-N90 PolarHBondContact O-N 2.97Å
89	D	30.6	Very low	31.1	Very low	134 Å²	134	135.6 Å²	135.6	72%	0.717	70%	0.695	S	S	*	*			trans	-54.7	130	154.5	-145.8	-11.5	0	0	0	107	G87 N91	G87-D89 PolarHBondContact O-N 3.07Å; D89-N91 PolarHBondContact O-N 3.35Å
90	N	31.6	Very low	31.9	Very low	151 Å²	151	132.8 Å²	132.8	81%	0.807	68%	0.684	S	S	*	*			trans	-73.8	40.1	-170	-73	-50.2	0	0	0	112.7	Y88 E92	Y88-N90 PolarHBondContact O-N 2.97Å; N90-E92 VanDerWaalsContact C-N 3.34Å; N90-E92 PolarHBondContact O-N 2.62Å
91	N	29.4	Very low	32.9	Very low	103 Å²	103	130.1 Å²	130.1	55%	0.551	67%	0.673	S	S	*	*			trans	-75	93.6	168.7	-77.6	-17.9	0	0	0	107.9	D89 N93 D94	D89-N91 PolarHBondContact O-N 3.35Å; N91-N93 PolarHBondContact O-N 2.89Å; N91-D94 PolarHBondContact O-N 3.1Å
92	E	34.8	Very low	33.6	Very low	182 Å²	182	127.9 Å²	127.9	85%	0.85	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.6	-9.6	170.8	-90.2	-173.7	142.7	0	0	114	N90	N90-E92 VanDerWaalsContact C-N 3.34Å; N90-E92 PolarHBondContact O-N 2.62Å
93	N	32.7	Very low	34.4	Very low	143 Å²	143	128.8 Å²	128.8	77%	0.765	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-13.3	-177.5	-67.7	-28.9	0	0	0	115.3	N91 Y95 G96	N91-N93 PolarHBondContact O-N 2.89Å; N93-Y95 PolarHBondContact O-N 3.09Å; N93-G96 PolarHBondContact O-N 2.69Å
94	D	33.3	Very low	35.5	Very low	130 Å²	130	123 Å²	123	70%	0.695	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-82.1	-9	-175.7	-92.6	-8	0	0	0	114.8	N91 G96	N91-D94 PolarHBondContact O-N 3.1Å; D94-G96 PolarHBondContact O-N 2.93Å
95	Y	34.5	Very low	36.8	Very low	186 Å²	186	122.6 Å²	122.6	73%	0.729	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-79.4	0.4	172.3	-69	-76.5	0	0	0	113.7	N93	N93-Y95 PolarHBondContact O-N 3.09Å
96	G	34.7	Very low	37.6	Very low	56 Å²	56	118.3 Å²	118.3	58%	0.577	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-75.6	-19.8	-172.1	0	0	0	0	0	116.4	N93 D94	N93-G96 PolarHBondContact O-N 2.69Å; D94-G96 PolarHBondContact O-N 2.93Å
97	S	39.2	Very low	38.9	Very low	90 Å²	90	109.3 Å²	109.3	63%	0.629	58%	0.58	S	S	*	*	S	Bend	trans	-122.6	-16.2	-166	53.8	0	0	0	0	115.7	T99	S97-T99 PolarHBondContact O-N 3.07Å
98	D	40.4	Very low	40.2	Very low	122 Å²	122	109.5 Å²	109.5	65%	0.652	57%	0.571	S	S	*	*			trans	-84.4	12.8	-173.4	-88	-9.8	0	0	0	115.1	P100	D98-P100 VanDerWaalsContact O-CD 3.26Å; D98-P100 WeakPolarHBondContact O-CD 3.23Å; D98-P100 VanDerWaalsContact O-N 3.16Å
99	T	39	Very low	41.3	Very low	64 Å²	64	106.2 Å²	106.2	39%	0.393	56%	0.56	S	S	.	*	S	Bend	trans	-63.5	120.1	160.6	-19.7	0	0	0	0	106.5	S97 V101	S97-T99 PolarHBondContact O-N 3.07Å; T99-V101 PolarHBondContact O-N 3.18Å
100	P	44.8	Very low	42.4	Very low	73 Å²	73	100.1 Å²	100.1	47%	0.474	53%	0.528	S	S	.	.			trans	-52.3	124.7	-178.5	-23.6	31.2	0	0	0	108	D98 Y102 F103 Q104	D98-P100 VanDerWaalsContact O-CD 3.26Å; D98-P100 WeakPolarHBondContact O-CD 3.23Å; D98-P100 VanDerWaalsContact O-N 3.16Å; P100-Y102 CarbonylContact O-C 3.48Å; P100-Y102 PolarHBondContact O-N 2.86Å; P100-F103 WeakPolarHBondContact O-CA 3.49Å; P100-F103 PolarHBondContact O-N 3.48Å; P100-Q104 PolarHBondContact O-N 3.08Å
101	V	45.5	Very low	43.4	Very low	94 Å²	94	98.4 Å²	98.4	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-47.7	-27.5	-179.2	174.9	0	0	0	0	111.6	T99 K105	T99-V101 PolarHBondContact O-N 3.18Å; V101-K105 HydrophobicContact CG1-CD 4.38Å; V101-K105 WeakPolarHBondContact O-CB 3.14Å; V101-K105 WeakPolarHBondContact O-CG 3.44Å; V101-K105 PolarHBondContact O-N 3.09Å
102	Y	41.2	Very low	44.4	Very low	109 Å²	109	99.2 Å²	99.2	43%	0.427	52%	0.515	S	S	.	.	H	α-helix	trans	-59.8	-48.3	170.6	-176.5	-106.6	0	0	0	114.5	P100 K105 L106	P100-Y102 CarbonylContact O-C 3.48Å; P100-Y102 PolarHBondContact O-N 2.86Å; Y102-K105 PolarHBondContact O-N 3.25Å; Y102-L106 WeakPolarHBondContact O-CB 3.26Å; Y102-L106 PolarHBondContact O-N 3.4Å
103	F	45.7	Very low	45.1	Very low	110 Å²	110	90.8 Å²	90.8	48%	0.482	48%	0.477	S	S	.	.	H	α-helix	trans	-65.3	-42.6	178.4	-107.9	-80.7	0	0	0	111.5	P100 L106 V107	P100-F103 WeakPolarHBondContact O-CA 3.49Å; P100-F103 PolarHBondContact O-N 3.48Å; F103-L106 PolarHBondContact O-N 3.46Å; F103-V107 WeakPolarHBondContact O-CG2 3.36Å; F103-V107 PolarHBondContact O-N 3.22Å
104	Q	50.1	Low	45.9	Very low	120 Å²	120	88 Å²	88	56%	0.561	47%	0.468	S	S	*	.	H	α-helix	trans	-61.7	-46.1	175.9	-162.2	177.3	16.6	0	0	110.7	P100 L106 V107 S108	P100-Q104 PolarHBondContact O-N 3.08Å; Q104-L106 VanDerWaalsContact C-N 3.32Å; Q104-L106 PolarHBondContact O-N 2.95Å; Q104-V107 PolarHBondContact O-N 2.84Å; Q104-S108 WeakPolarHBondContact O-CB 3.34Å; Q104-S108 PolarHBondContact O-N 3.08Å; Q104-S108 PolarHBondContact O-OG 3.46Å
105	K	51.8	Low	46.7	Very low	138 Å²	138	88 Å²	88	60%	0.6	47%	0.467	S	S	*	.	H	α-helix	trans	-59.1	-40.1	173.2	-83	-178.2	177.3	178.5	0	112.9	V101 Y102 K109	V101-K105 HydrophobicContact CG1-CD 4.38Å; V101-K105 WeakPolarHBondContact O-CB 3.14Å; V101-K105 WeakPolarHBondContact O-CG 3.44Å; V101-K105 PolarHBondContact O-N 3.09Å; Y102-K105 PolarHBondContact O-N 3.25Å; K105-K109 VanDerWaalsContact O-CB 3.31Å; K105-K109 WeakPolarHBondContact O-CB 3.48Å; K105-K109 WeakPolarHBondContact O-CG 3.37Å; K105-K109 PolarHBondContact O-N 3.09Å
106	L	49	Very low	47	Very low	17 Å²	17	83.2 Å²	83.2	9%	0.089	45%	0.453	C	S	.	.	H	α-helix	trans	-67	-45	179.7	-166.6	80.3	0	0	0	111.1	Y102 F103 Q104 K109 V110 L130	Y102-L106 WeakPolarHBondContact O-CB 3.26Å; Y102-L106 PolarHBondContact O-N 3.4Å; F103-L106 PolarHBondContact O-N 3.46Å; Q104-L106 VanDerWaalsContact C-N 3.32Å; Q104-L106 PolarHBondContact O-N 2.95Å; L106-K109 PolarHBondContact O-N 3.27Å; L106-V110 WeakPolarHBondContact O-CG2 3.49Å; L106-V110 PolarHBondContact O-N 3.23Å; L106-L130 HydrophobicContact CD1-CD2 4.02Å; L106-L130 HydrophobicContact CD2-CD2 3.67Å; L106-L130 HydrophobicContact CG-CD2 4.36Å
107	V	53.7	Low	47.3	Very low	58 Å²	58	84.3 Å²	84.3	35%	0.352	45%	0.451	S	S	.	.	H	α-helix	trans	-64.4	-44.3	176.7	173.8	0	0	0	0	110.8	L13 F103 Q104 K109 V110 H111	L13-V107 HydrophobicContact CD1-CG1 3.88Å; F103-V107 WeakPolarHBondContact O-CG2 3.36Å; F103-V107 PolarHBondContact O-N 3.22Å; Q104-V107 PolarHBondContact O-N 2.84Å; V107-K109 PolarHBondContact O-N 2.83Å; V107-V110 PolarHBondContact O-N 2.8Å; V107-H111 WeakPolarHBondContact O-CB 3.28Å; V107-H111 PolarHBondContact O-N 2.69Å
108	S	52.5	Low	47.7	Very low	69 Å²	69	84.8 Å²	84.8	48%	0.483	45%	0.453	S	S	.	.	H	α-helix	trans	-61.1	-42.7	175.1	-61.3	0	0	0	0	112	Q104 H111 Q112	Q104-S108 WeakPolarHBondContact O-CB 3.34Å; Q104-S108 PolarHBondContact O-N 3.08Å; Q104-S108 PolarHBondContact O-OG 3.46Å; S108-H111 PolarHBondContact O-N 2.82Å; S108-Q112 PolarHBondContact O-N 2.87Å
109	K	52.3	Low	47.8	Very low	81 Å²	81	87.6 Å²	87.6	35%	0.352	46%	0.462	S	S	.	.	H	α-helix	trans	-62.2	-43.4	174.6	-83.8	-179.8	167.2	-171.2	0	112.1	K105 L106 V107 H111 Q112 A113 Y123 D127	K105-K109 VanDerWaalsContact O-CB 3.31Å; K105-K109 WeakPolarHBondContact O-CB 3.48Å; K105-K109 WeakPolarHBondContact O-CG 3.37Å; K105-K109 PolarHBondContact O-N 3.09Å; L106-K109 PolarHBondContact O-N 3.27Å; V107-K109 PolarHBondContact O-N 2.83Å; K109-H111 VanDerWaalsContact C-N 3.34Å; K109-Q112 PolarHBondContact O-N 3.34Å; K109-A113 WeakPolarHBondContact O-CB 3.43Å; K109-A113 PolarHBondContact O-N 3.25Å; K109-Y123 PolarHBondContact O-OH 2.86Å; K109-D127 IonicContact NZ-OD2 2.77Å; K109-D127 PolarHBondContact NZ-OD2 2.76Å
110	V	54.4	Low	48	Very low	7 Å²	7	92 Å²	92	4%	0.042	48%	0.475	C	S	.	.	H	α-helix	trans	-68	-37.3	178.2	178.1	0	0	0	0	110.9	L106 V107 A113 S114 I131 L134	L106-V110 WeakPolarHBondContact O-CG2 3.49Å; L106-V110 PolarHBondContact O-N 3.23Å; V107-V110 PolarHBondContact O-N 2.8Å; V110-A113 PolarHBondContact O-N 2.94Å; V110-S114 WeakPolarHBondContact O-CB 3.29Å; V110-S114 PolarHBondContact O-N 3.41Å; V110-I131 HydrophobicContact CG2-CG1 3.79Å; V110-L134 HydrophobicContact CB-CD2 3.92Å; V110-L134 HydrophobicContact CG1-CB 4.29Å; V110-L134 HydrophobicContact CG1-CD2 3.77Å; V110-L134 HydrophobicContact CG1-CG 4.45Å; V110-L134 HydrophobicContact CG2-CB 4.39Å; V110-L134 HydrophobicContact CG2-CD2 3.57Å
111	H	51.7	Low	47.8	Very low	114 Å²	114	91.9 Å²	91.9	53%	0.528	47%	0.468	S	S	.	.	H	α-helix	trans	-63.3	-43.8	174.5	-167.6	73.2	0	0	0	111.2	V107 S108 K109 S114 L115	V107-H111 WeakPolarHBondContact O-CB 3.28Å; V107-H111 PolarHBondContact O-N 2.69Å; S108-H111 PolarHBondContact O-N 2.82Å; K109-H111 VanDerWaalsContact C-N 3.34Å; H111-S114 PolarHBondContact O-N 3.47Å; H111-L115 WeakPolarHBondContact O-CG 3.46Å; H111-L115 PolarHBondContact O-N 3.3Å
112	Q	51.6	Low	47.6	Very low	121 Å²	121	95.6 Å²	95.6	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-60.3	-45.6	171.4	-106.5	178.8	-7.7	0	0	112.2	S108 K109 S114 L115 M116	S108-Q112 PolarHBondContact O-N 2.87Å; K109-Q112 PolarHBondContact O-N 3.34Å; Q112-S114 VanDerWaalsContact C-N 3.28Å; Q112-S114 PolarHBondContact O-N 2.98Å; Q112-L115 PolarHBondContact O-N 2.99Å; Q112-L115 VanDerWaalsContact O-N 3.12Å; Q112-M116 WeakPolarHBondContact O-CB 3.45Å; Q112-M116 WeakPolarHBondContact O-CG 3.46Å; Q112-M116 PolarHBondContact O-N 2.93Å
113	A	48.1	Very low	47.7	Very low	5 Å²	5	92.4 Å²	92.4	4%	0.041	47%	0.472	C	S	.	.	H	α-helix	trans	-66.1	-30.2	178.5	0	0	0	0	0	112.9	K109 V110 L115 Y123 I131	K109-A113 WeakPolarHBondContact O-CB 3.43Å; K109-A113 PolarHBondContact O-N 3.25Å; V110-A113 PolarHBondContact O-N 2.94Å; A113-L115 VanDerWaalsContact C-N 3.3Å; A113-Y123 HydrophobicContact CB-CE2 4.22Å; A113-I131 HydrophobicContact CB-CD1 4.14Å; A113-I131 HydrophobicContact CB-CG2 3.7Å
114	S	50.9	Low	47.6	Very low	84 Å²	84	91.2 Å²	91.2	59%	0.587	48%	0.477	S	S	*	.	H	α-helix	trans	-71.4	-25.3	173.7	176.3	0	0	0	0	112.7	V110 H111 Q112	V110-S114 WeakPolarHBondContact O-CB 3.29Å; V110-S114 PolarHBondContact O-N 3.41Å; H111-S114 PolarHBondContact O-N 3.47Å; Q112-S114 VanDerWaalsContact C-N 3.28Å; Q112-S114 PolarHBondContact O-N 2.98Å
115	L	49.9	Very low	47.5	Very low	129 Å²	129	89.9 Å²	89.9	68%	0.675	48%	0.481	S	S	*	.	H	α-helix	trans	-93.7	-24.9	178.5	-68.7	170.9	0	0	0	112.1	H111 Q112 A113	H111-L115 WeakPolarHBondContact O-CG 3.46Å; H111-L115 PolarHBondContact O-N 3.3Å; Q112-L115 PolarHBondContact O-N 2.99Å; Q112-L115 VanDerWaalsContact O-N 3.12Å; A113-L115 VanDerWaalsContact C-N 3.3Å
116	M	40.1	Very low	47.4	Very low	86 Å²	86	87 Å²	87	42%	0.424	47%	0.472	S	S	.	.	S	Bend	trans	-76.2	128.3	175.8	-77.4	-174	130.8	0	0	110.7	Q112 K120	Q112-M116 WeakPolarHBondContact O-CB 3.45Å; Q112-M116 WeakPolarHBondContact O-CG 3.46Å; Q112-M116 PolarHBondContact O-N 2.93Å; M116-K120 HydrophobicContact CE-CB 4.39Å
117	S	41.1	Very low	47.3	Very low	79 Å²	79	87.5 Å²	87.5	55%	0.552	48%	0.475	S	S	*	.			trans	-54.1	142.1	165.9	-171.4	0	0	0	0	109.8	E119 K120	S117-E119 PolarHBondContact O-N 3.13Å; S117-K120 PolarHBondContact O-N 3.11Å
118	P	46.9	Very low	47.2	Very low	101 Å²	101	87.1 Å²	87.1	66%	0.656	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-57	-10.8	-172.9	18.7	-32.4	0	0	0	115.7	K120 H121	P118-K120 PolarHBondContact O-N 3.17Å; P118-H121 PolarHBondContact O-CD2 3.32Å
119	E	42.8	Very low	47.3	Very low	181 Å²	181	88 Å²	88	85%	0.846	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-80.3	-6.5	-178.8	-72.5	-175.8	153.6	0	0	115.5	S117	S117-E119 PolarHBondContact O-N 3.13Å
120	K	44.4	Very low	47.3	Very low	155 Å²	155	86.2 Å²	86.2	67%	0.674	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-115.8	31.6	-179.7	-66.9	-168.4	-180	-178.8	0	114.7	M116 S117 P118 L122	M116-K120 HydrophobicContact CE-CB 4.39Å; S117-K120 PolarHBondContact O-N 3.11Å; P118-K120 PolarHBondContact O-N 3.17Å; K120-L122 VanDerWaalsContact C-N 3.31Å; K120-L122 PolarHBondContact O-N 3.45Å
121	H	39.3	Very low	47.3	Very low	71 Å²	71	86.1 Å²	86.1	33%	0.329	46%	0.459	S	S	.	.			trans	-74.1	81.4	176.4	-73.2	-62.6	0	0	0	112	P118 Y123	P118-H121 PolarHBondContact O-CD2 3.32Å; H121-Y123 VanDerWaalsContact C-N 3.26Å; H121-Y123 HydrophobicContact CB-CD2 4.25Å; H121-Y123 AromaticContact ND1-CD2 3.59Å; H121-Y123 AromaticContact ND1-CE2 3.71Å; H121-Y123 PolarHBondContact O-N 3.42Å
122	L	41.1	Very low	47.7	Very low	173 Å²	173	86.2 Å²	86.2	91%	0.906	46%	0.458	S	S	*	.			trans	-86.1	68	160.5	-82.5	157.2	0	0	0	108.7	K120	K120-L122 VanDerWaalsContact C-N 3.31Å; K120-L122 PolarHBondContact O-N 3.45Å
123	Y	43.2	Very low	48	Very low	42 Å²	42	81.8 Å²	81.8	17%	0.165	44%	0.438	C	S	.	.			trans	-112	142	174.1	-74.2	-82.7	0	0	0	110.7	K109 A113 H121 S125 D127 I131	K109-Y123 PolarHBondContact O-OH 2.86Å; A113-Y123 HydrophobicContact CB-CE2 4.22Å; H121-Y123 VanDerWaalsContact C-N 3.26Å; H121-Y123 HydrophobicContact CB-CD2 4.25Å; H121-Y123 AromaticContact ND1-CD2 3.59Å; H121-Y123 AromaticContact ND1-CE2 3.71Å; H121-Y123 PolarHBondContact O-N 3.42Å; Y123-S125 PolarHBondContact O-N 3.06Å; Y123-D127 HydrophobicContact CD1-CB 4.25Å; Y123-I131 HydrophobicContact CD1-CD1 3.71Å; Y123-I131 HydrophobicContact CD2-CD1 4.39Å; Y123-I131 HydrophobicContact CE1-CD1 3.6Å; Y123-I131 HydrophobicContact CE2-CD1 4.3Å; Y123-I131 HydrophobicContact CG-CD1 4.12Å
124	S	44.4	Very low	48.6	Very low	85 Å²	85	84.3 Å²	84.3	59%	0.594	45%	0.451	S	S	*	.			trans	-59.4	134	163.7	-177.3	0	0	0	0	108.3	D126 D127 E128	S124-D126 PolarHBondContact O-N 3.13Å; S124-D127 PolarHBondContact O-N 3.26Å; S124-E128 PolarHBondContact O-N 3.08Å
125	S	47.9	Very low	48.9	Very low	92 Å²	92	82.5 Å²	82.5	64%	0.643	43%	0.434	S	S	*	.	H	α-helix	trans	-44.6	-37.4	-171.7	-167.8	0	0	0	0	114.5	Y123 E128	Y123-S125 PolarHBondContact O-N 3.06Å; S125-E128 PolarHBondContact O-N 2.94Å
126	D	49.3	Very low	49.4	Very low	76 Å²	76	80.8 Å²	80.8	41%	0.406	43%	0.425	S	S	.	.	H	α-helix	trans	-73.1	-35.3	-178.7	-68.1	-11.1	0	0	0	113.2	S124 E128 Y520	S124-D126 PolarHBondContact O-N 3.13Å; D126-E128 VanDerWaalsContact C-N 3.3Å; D126-Y520 PolarHBondContact OD2-OH 3.15Å
127	D	46.8	Very low	50.2	Low	29 Å²	29	79.8 Å²	79.8	16%	0.155	42%	0.421	C	S	.	.	H	α-helix	trans	-70.9	-31.1	177.2	-84.4	-4	0	0	0	110.4	K109 Y123 S124 L130 I131	K109-D127 IonicContact NZ-OD2 2.77Å; K109-D127 PolarHBondContact NZ-OD2 2.76Å; Y123-D127 HydrophobicContact CD1-CB 4.25Å; S124-D127 PolarHBondContact O-N 3.26Å; D127-L130 PolarHBondContact O-N 3.47Å; D127-I131 WeakPolarHBondContact O-CB 3.5Å; D127-I131 WeakPolarHBondContact O-CD1 3.36Å; D127-I131 WeakPolarHBondContact O-CG1 3.39Å; D127-I131 PolarHBondContact O-N 3.28Å
128	E	52.4	Low	50.9	Low	50 Å²	50	79.6 Å²	79.6	23%	0.234	41%	0.413	C	S	.	.	H	α-helix	trans	-69.6	-40.1	-176.3	-141.7	-166.4	-116.8	0	0	112.6	S124 S125 D126 I131 K132	S124-E128 PolarHBondContact O-N 3.08Å; S125-E128 PolarHBondContact O-N 2.94Å; D126-E128 VanDerWaalsContact C-N 3.3Å; E128-I131 PolarHBondContact O-N 3.31Å; E128-K132 WeakPolarHBondContact O-CB 3.19Å; E128-K132 WeakPolarHBondContact O-CG 3.47Å; E128-K132 PolarHBondContact O-N 3.4Å; E128-K132 IonicContact OE2-NZ 2.78Å; E128-K132 PolarHBondContact OE2-NZ 2.95Å
129	E	55.5	Low	51.2	Low	87 Å²	87	81.1 Å²	81.1	41%	0.407	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-42.2	172.6	-73.4	-163.7	164.1	0	0	111.7	I131 K132 I133	E129-I131 VanDerWaalsContact C-N 3.33Å; E129-I131 PolarHBondContact O-N 2.87Å; E129-K132 PolarHBondContact O-N 3.3Å; E129-I133 WeakPolarHBondContact O-CB 3.28Å; E129-I133 VanDerWaalsContact O-CG1 3.28Å; E129-I133 WeakPolarHBondContact O-CG1 3.47Å; E129-I133 PolarHBondContact O-N 3.16Å
130	L	52.1	Low	51.6	Low	43 Å²	43	77.3 Å²	77.3	23%	0.225	39%	0.394	C	S	.	.	H	α-helix	trans	-65.4	-39.8	179.8	-131	116	0	0	0	111.3	L106 D127 I133 L134 L527	L106-L130 HydrophobicContact CD1-CD2 4.02Å; L106-L130 HydrophobicContact CD2-CD2 3.67Å; L106-L130 HydrophobicContact CG-CD2 4.36Å; D127-L130 PolarHBondContact O-N 3.47Å; L130-I133 PolarHBondContact O-N 2.93Å; L130-L134 WeakPolarHBondContact O-CB 3.45Å; L130-L134 PolarHBondContact O-N 2.85Å; L130-L527 HydrophobicContact CD1-CD1 3.93Å
131	I	54.6	Low	51.8	Low	6 Å²	6	75.2 Å²	75.2	3%	0.031	39%	0.385	C	S	.	.	H	α-helix	trans	-63.9	-46	173.5	-70.9	165.2	0	0	0	110.5	V110 A113 Y123 D127 E128 E129 I133 L134 I135	V110-I131 HydrophobicContact CG2-CG1 3.79Å; A113-I131 HydrophobicContact CB-CD1 4.14Å; A113-I131 HydrophobicContact CB-CG2 3.7Å; Y123-I131 HydrophobicContact CD1-CD1 3.71Å; Y123-I131 HydrophobicContact CD2-CD1 4.39Å; Y123-I131 HydrophobicContact CE1-CD1 3.6Å; Y123-I131 HydrophobicContact CE2-CD1 4.3Å; Y123-I131 HydrophobicContact CG-CD1 4.12Å; D127-I131 WeakPolarHBondContact O-CB 3.5Å; D127-I131 WeakPolarHBondContact O-CD1 3.36Å; D127-I131 WeakPolarHBondContact O-CG1 3.39Å; D127-I131 PolarHBondContact O-N 3.28Å; E128-I131 PolarHBondContact O-N 3.31Å; E129-I131 VanDerWaalsContact C-N 3.33Å; E129-I131 PolarHBondContact O-N 2.87Å; I131-I133 VanDerWaalsContact C-N 3.33Å; I131-I133 PolarHBondContact O-N 3.13Å; I131-L134 PolarHBondContact O-N 3.34Å; I131-I135 HydrophobicContact CG2-CD1 3.65Å; I131-I135 HydrophobicContact CG2-CG1 4.3Å; I131-I135 WeakPolarHBondContact O-CB 3.45Å; I131-I135 VanDerWaalsContact O-CG1 3.28Å; I131-I135 WeakPolarHBondContact O-CG1 3.29Å; I131-I135 PolarHBondContact O-N 3.42Å
132	K	59.7	Low	52.3	Low	116 Å²	116	79.9 Å²	79.9	50%	0.504	41%	0.405	S	S	.	.	H	α-helix	trans	-58.4	-44.4	176.2	-79.4	170.3	-177.4	155.1	0	111.7	E128 E129 I135 N136	E128-K132 WeakPolarHBondContact O-CB 3.19Å; E128-K132 WeakPolarHBondContact O-CG 3.47Å; E128-K132 PolarHBondContact O-N 3.4Å; E128-K132 IonicContact OE2-NZ 2.78Å; E128-K132 PolarHBondContact OE2-NZ 2.95Å; E129-K132 PolarHBondContact O-N 3.3Å; K132-I135 PolarHBondContact O-N 3.47Å; K132-N136 WeakPolarHBondContact O-CB 3.47Å; K132-N136 PolarHBondContact O-N 3.35Å
133	I	57.7	Low	52.5	Low	28 Å²	28	80.7 Å²	80.7	14%	0.144	40%	0.401	C	S	.	.	H	α-helix	trans	-61.6	-46	176.1	-71.1	165.2	0	0	0	110.8	E129 L130 I131 N136 L137 I530 L534	E129-I133 WeakPolarHBondContact O-CB 3.28Å; E129-I133 VanDerWaalsContact O-CG1 3.28Å; E129-I133 WeakPolarHBondContact O-CG1 3.47Å; E129-I133 PolarHBondContact O-N 3.16Å; L130-I133 PolarHBondContact O-N 2.93Å; I131-I133 VanDerWaalsContact C-N 3.33Å; I131-I133 PolarHBondContact O-N 3.13Å; I133-N136 PolarHBondContact O-N 3.37Å; I133-L137 HydrophobicContact CG2-CD1 3.96Å; I133-L137 PolarHBondContact O-N 2.93Å; I133-I530 HydrophobicContact CD1-CG2 4.2Å; I133-I530 HydrophobicContact CG2-CG2 3.89Å; I133-L534 HydrophobicContact CG1-CD1 4.31Å; I133-L534 HydrophobicContact CG2-CD1 4.11Å
134	L	60.1	Low	52.5	Low	58 Å²	58	85.8 Å²	85.8	30%	0.304	42%	0.424	S	S	.	.	H	α-helix	trans	-66.5	-40.6	-178.8	-150.9	74.8	0	0	0	111.7	V110 L130 I131 N136 L137 I138	V110-L134 HydrophobicContact CB-CD2 3.92Å; V110-L134 HydrophobicContact CG1-CB 4.29Å; V110-L134 HydrophobicContact CG1-CD2 3.77Å; V110-L134 HydrophobicContact CG1-CG 4.45Å; V110-L134 HydrophobicContact CG2-CB 4.39Å; V110-L134 HydrophobicContact CG2-CD2 3.57Å; L130-L134 WeakPolarHBondContact O-CB 3.45Å; L130-L134 PolarHBondContact O-N 2.85Å; I131-L134 PolarHBondContact O-N 3.34Å; L134-N136 VanDerWaalsContact C-N 3.33Å; L134-N136 PolarHBondContact O-N 3.43Å; L134-L137 HydrophobicContact CD1-CD1 4.5Å; L134-L137 WeakPolarHBondContact O-CB 3.36Å; L134-L137 PolarHBondContact O-N 3.48Å; L134-I138 VanDerWaalsContact O-CG1 3.29Å; L134-I138 WeakPolarHBondContact O-CG1 3.41Å; L134-I138 PolarHBondContact O-N 3.35Å
135	I	58.2	Low	52.3	Low	45 Å²	45	92.3 Å²	92.3	23%	0.231	44%	0.436	C	S	.	.	H	α-helix	trans	-60.8	-43.6	173.6	-69.4	169.9	0	0	0	110.5	I131 K132 I138 K139	I131-I135 HydrophobicContact CG2-CD1 3.65Å; I131-I135 HydrophobicContact CG2-CG1 4.3Å; I131-I135 WeakPolarHBondContact O-CB 3.45Å; I131-I135 VanDerWaalsContact O-CG1 3.28Å; I131-I135 WeakPolarHBondContact O-CG1 3.29Å; I131-I135 PolarHBondContact O-N 3.42Å; K132-I135 PolarHBondContact O-N 3.47Å; I135-I138 PolarHBondContact O-N 2.89Å; I135-K139 HydrophobicContact CG2-CD 4.31Å; I135-K139 WeakPolarHBondContact O-CG 3.37Å; I135-K139 PolarHBondContact O-N 3.33Å
136	N	59.8	Low	52	Low	93 Å²	93	94 Å²	94	50%	0.497	44%	0.442	S	S	.	.	H	α-helix	trans	-64.2	-40.5	177.4	-81.9	-15.6	0	0	0	112.4	K132 I133 L134 K139 L140	K132-N136 WeakPolarHBondContact O-CB 3.47Å; K132-N136 PolarHBondContact O-N 3.35Å; I133-N136 PolarHBondContact O-N 3.37Å; L134-N136 VanDerWaalsContact C-N 3.33Å; L134-N136 PolarHBondContact O-N 3.43Å; N136-K139 PolarHBondContact O-N 2.86Å; N136-L140 WeakPolarHBondContact O-CB 3.26Å; N136-L140 PolarHBondContact O-N 3Å
137	L	56.8	Low	51.5	Low	66 Å²	66	98.6 Å²	98.6	35%	0.346	46%	0.461	S	S	.	.	H	α-helix	trans	-59.1	-48.6	172.5	-85.1	156.4	0	0	0	111.1	I133 L134 K139 L140 F141	I133-L137 HydrophobicContact CG2-CD1 3.96Å; I133-L137 PolarHBondContact O-N 2.93Å; L134-L137 HydrophobicContact CD1-CD1 4.5Å; L134-L137 WeakPolarHBondContact O-CB 3.36Å; L134-L137 PolarHBondContact O-N 3.48Å; L137-K139 VanDerWaalsContact C-N 3.31Å; L137-K139 PolarHBondContact O-N 2.81Å; L137-L140 WeakPolarHBondContact O-CB 3.49Å; L137-L140 PolarHBondContact O-N 3.29Å; L137-L140 VanDerWaalsContact O-N 3.16Å; L137-F141 HydrophobicContact CD2-CE2 4.02Å; L137-F141 WeakPolarHBondContact O-CD2 3.39Å; L137-F141 PolarHBondContact O-N 3Å
138	I	55.6	Low	51	Low	74 Å²	74	108.3 Å²	108.3	38%	0.379	50%	0.495	S	S	.	.	H	α-helix	trans	-59.5	-42.6	177.6	-66.6	164.2	0	0	0	110.8	L134 I135 F141 K142	L134-I138 VanDerWaalsContact O-CG1 3.29Å; L134-I138 WeakPolarHBondContact O-CG1 3.41Å; L134-I138 PolarHBondContact O-N 3.35Å; I135-I138 PolarHBondContact O-N 2.89Å; I138-F141 PolarHBondContact O-N 2.84Å; I138-K142 PolarHBondContact O-N 3.31Å
139	K	54	Low	50.3	Low	134 Å²	134	111.8 Å²	111.8	58%	0.583	52%	0.52	S	S	*	.	H	α-helix	trans	-63.8	-42.6	175.4	-76.4	-179.7	179.1	177.6	0	112.1	I135 N136 L137 F141 K142 K143	I135-K139 HydrophobicContact CG2-CD 4.31Å; I135-K139 WeakPolarHBondContact O-CG 3.37Å; I135-K139 PolarHBondContact O-N 3.33Å; N136-K139 PolarHBondContact O-N 2.86Å; L137-K139 VanDerWaalsContact C-N 3.31Å; L137-K139 PolarHBondContact O-N 2.81Å; K139-F141 VanDerWaalsContact C-N 3.3Å; K139-F141 PolarHBondContact O-N 3.25Å; K139-K142 PolarHBondContact O-N 2.84Å; K139-K143 WeakPolarHBondContact O-CB 3.49Å; K139-K143 PolarHBondContact O-N 3.3Å
140	L	50.8	Low	49.3	Very low	100 Å²	100	116.2 Å²	116.2	52%	0.524	54%	0.538	S	S	.	.	H	α-helix	trans	-59.9	-40.9	175.8	-112.4	136.1	0	0	0	111.5	N136 L137 K144	N136-L140 WeakPolarHBondContact O-CB 3.26Å; N136-L140 PolarHBondContact O-N 3Å; L137-L140 WeakPolarHBondContact O-CB 3.49Å; L137-L140 PolarHBondContact O-N 3.29Å; L137-L140 VanDerWaalsContact O-N 3.16Å; L140-K144 WeakPolarHBondContact O-CB 3.28Å; L140-K144 PolarHBondContact O-N 2.9Å
141	F	49	Very low	48.6	Very low	111 Å²	111	119.9 Å²	119.9	49%	0.487	56%	0.564	S	S	.	*	H	α-helix	trans	-75.2	-36.3	176.9	-76.7	-70	0	0	0	113.1	L137 I138 K139 K143 K144	L137-F141 HydrophobicContact CD2-CE2 4.02Å; L137-F141 WeakPolarHBondContact O-CD2 3.39Å; L137-F141 PolarHBondContact O-N 3Å; I138-F141 PolarHBondContact O-N 2.84Å; K139-F141 VanDerWaalsContact C-N 3.3Å; K139-F141 PolarHBondContact O-N 3.25Å; F141-K143 VanDerWaalsContact C-N 3.31Å; F141-K143 PolarHBondContact O-N 2.91Å; F141-K144 CarbonylContact O-C 3.13Å; F141-K144 PolarHBondContact O-N 3.17Å
142	K	49.2	Very low	47.7	Very low	170 Å²	170	124.6 Å²	124.6	74%	0.739	59%	0.593	S	S	*	*	H	α-helix	trans	-64.5	-36.2	171	-85.8	-167.7	171.9	-176.9	0	112.2	I138 K139 R145	I138-K142 PolarHBondContact O-N 3.31Å; K139-K142 PolarHBondContact O-N 2.84Å; K142-R145 PolarHBondContact O-N 3.04Å
143	K	44.5	Very low	46.5	Very low	190 Å²	190	123 Å²	123	83%	0.826	60%	0.601	S	S	*	*	H	α-helix	trans	-74.8	-36.8	177.6	-160.9	179.6	-176.2	-177.8	0	111.9	K139 F141 R145	K139-K143 WeakPolarHBondContact O-CB 3.49Å; K139-K143 PolarHBondContact O-N 3.3Å; F141-K143 VanDerWaalsContact C-N 3.31Å; F141-K143 PolarHBondContact O-N 2.91Å; K143-R145 PolarHBondContact O-N 3.5Å
144	K	43.4	Very low	45.5	Very low	148 Å²	148	128.4 Å²	128.4	64%	0.643	63%	0.629	S	S	*	*	S	Bend	trans	-71.5	62.3	157.9	-77.4	-169.9	175.3	-178.5	0	108.9	L140 F141 V146	L140-K144 WeakPolarHBondContact O-CB 3.28Å; L140-K144 PolarHBondContact O-N 2.9Å; F141-K144 CarbonylContact O-C 3.13Å; F141-K144 PolarHBondContact O-N 3.17Å; K144-V146 VanDerWaalsContact C-N 3.35Å; K144-V146 PolarHBondContact O-N 3.18Å
145	R	40.5	Very low	44.3	Very low	223 Å²	223	128.7 Å²	128.7	84%	0.842	64%	0.64	S	S	*	*			trans	-41.9	113.2	157.4	-87.4	-169.5	-179.7	-174.5	1.1	104.9	K142 K143 Q147	K142-R145 PolarHBondContact O-N 3.04Å; K143-R145 PolarHBondContact O-N 3.5Å; R145-Q147 PolarHBondContact O-N 3Å
146	V	42.9	Very low	43.2	Very low	128 Å²	128	133.5 Å²	133.5	78%	0.776	67%	0.666	S	S	*	*			trans	-53.7	97.3	173.3	179.1	0	0	0	0	103.5	K144 R148	K144-V146 VanDerWaalsContact C-N 3.35Å; K144-V146 PolarHBondContact O-N 3.18Å; V146-R148 PolarHBondContact O-N 3.25Å
147	Q	37.5	Very low	41.8	Very low	172 Å²	172	135.3 Å²	135.3	80%	0.804	67%	0.672	S	S	*	*			trans	-57.6	104.9	168.6	-164.5	169.6	29.1	0	0	101.2	R145 V149	R145-Q147 PolarHBondContact O-N 3Å; Q147-V149 PolarHBondContact O-N 2.97Å
148	R	37.6	Very low	40.7	Very low	232 Å²	232	138.9 Å²	138.9	88%	0.875	69%	0.69	S	S	*	*			trans	-56.3	99	179	-82.1	-174.9	178.2	179.5	-0.7	104.1	V146 K150	V146-R148 PolarHBondContact O-N 3.25Å; R148-K150 VanDerWaalsContact C-N 3.33Å; R148-K150 PolarHBondContact O-N 3.3Å
149	V	36.1	Very low	39.5	Very low	124 Å²	124	141.7 Å²	141.7	75%	0.752	70%	0.704	S	S	*	*			trans	-60.3	110.5	170.8	-175.9	0	0	0	0	102.1	Q147 P151	Q147-V149 PolarHBondContact O-N 2.97Å; V149-P151 VanDerWaalsContact O-N 3.15Å
150	K	35.1	Very low	38.3	Very low	180 Å²	180	143.3 Å²	143.3	78%	0.783	72%	0.716	S	S	*	*			trans	-50.5	128.6	174	-75.6	-178.4	177.4	179.8	0	105.3	R148 V152	R148-K150 VanDerWaalsContact C-N 3.33Å; R148-K150 PolarHBondContact O-N 3.3Å; K150-V152 PolarHBondContact O-N 2.94Å
151	P	36.7	Very low	37.2	Very low	119 Å²	119	144.2 Å²	144.2	77%	0.773	73%	0.725	S	S	*	*			trans	-52.1	116.6	176	21	-30.5	0	0	0	106.1	V149 A153	V149-P151 VanDerWaalsContact O-N 3.15Å; P151-A153 PolarHBondContact O-N 3.35Å
152	V	35.8	Very low	36.2	Very low	105 Å²	105	150 Å²	150	64%	0.636	74%	0.744	S	S	*	*			trans	-69.6	87.2	176.1	179.2	0	0	0	0	104.6	K150 L154 A155	K150-V152 PolarHBondContact O-N 2.94Å; V152-L154 HydrophobicContact CG1-CB 4.32Å; V152-L154 PolarHBondContact O-N 2.81Å; V152-A155 PolarHBondContact O-N 2.98Å
153	A	36.1	Very low	35.5	Very low	82 Å²	82	146.8 Å²	146.8	68%	0.678	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	1.6	179.3	0	0	0	0	0	112.8	P151	P151-A153 PolarHBondContact O-N 3.35Å
154	L	36.7	Very low	35	Very low	142 Å²	142	142.1 Å²	142.1	74%	0.743	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	5.3	179.9	-76.8	160	0	0	0	113.9	V152 N156	V152-L154 HydrophobicContact CG1-CB 4.32Å; V152-L154 PolarHBondContact O-N 2.81Å; L154-N156 VanDerWaalsContact C-N 3.31Å; L154-N156 PolarHBondContact O-N 2.96Å
155	A	34	Very low	34.5	Very low	64 Å²	64	140.5 Å²	140.5	53%	0.529	74%	0.74	S	S	.	*			trans	-91.9	24.3	175.2	0	0	0	0	0	113.8	V152 H157	V152-A155 PolarHBondContact O-N 2.98Å; A155-H157 PolarHBondContact O-N 3.5Å
156	N	34.5	Very low	33.9	Very low	146 Å²	146	137.7 Å²	137.7	78%	0.781	74%	0.736	S	S	*	*			trans	-67.7	11.7	175.5	-82.8	-10.9	0	0	0	114.1	L154	L154-N156 VanDerWaalsContact C-N 3.31Å; L154-N156 PolarHBondContact O-N 2.96Å
157	H	30.5	Very low	33.3	Very low	131 Å²	131	138 Å²	138	61%	0.606	73%	0.732	S	S	*	*			trans	-144.9	76.7	176.5	11.6	-76.3	0	0	0	107.1	A155 I159	A155-H157 PolarHBondContact O-N 3.5Å; H157-I159 HydrophobicContact CB-CG1 4.23Å; H157-I159 PolarHBondContact O-N 2.91Å
158	I	34.2	Very low	33.2	Very low	142 Å²	142	137.8 Å²	137.8	73%	0.728	73%	0.731	S	S	*	*			trans	-66.8	90	149.7	-59.6	176.1	0	0	0	104.4	M160	I158-M160 HydrophobicContact CG2-CG 4.15Å; I158-M160 PolarHBondContact O-N 2.89Å
159	I	30.8	Very low	33.1	Very low	132 Å²	132	132.4 Å²	132.4	68%	0.677	72%	0.724	S	S	*	*			trans	-64	93.3	166.7	-57.1	174.9	0	0	0	104.4	H157 T161	H157-I159 HydrophobicContact CB-CG1 4.23Å; H157-I159 PolarHBondContact O-N 2.91Å; I159-T161 HydrophobicContact CG2-CG2 4.04Å; I159-T161 PolarHBondContact O-N 3.26Å
160	M	29.1	Very low	33	Very low	168 Å²	168	131.8 Å²	131.8	83%	0.828	73%	0.725	S	S	*	*			trans	-65.6	91.6	164.3	-67.5	-158.4	-155.6	0	0	105.6	I158 R162	I158-M160 HydrophobicContact CG2-CG 4.15Å; I158-M160 PolarHBondContact O-N 2.89Å; M160-R162 VanDerWaalsContact C-N 3.29Å; M160-R162 PolarHBondContact O-N 3.43Å
161	T	26.4	Very low	33	Very low	119 Å²	119	126.7 Å²	126.7	73%	0.73	72%	0.716	S	S	*	*			trans	-62.2	100.5	168.4	35.6	0	0	0	0	106	I159 P163	I159-T161 HydrophobicContact CG2-CG2 4.04Å; I159-T161 PolarHBondContact O-N 3.26Å; T161-P163 WeakPolarHBondContact O-CD 3.37Å; T161-P163 VanDerWaalsContact O-N 3.12Å
162	R	29.5	Very low	32.7	Very low	232 Å²	232	129.9 Å²	129.9	88%	0.875	72%	0.721	S	S	*	*			trans	-54.5	121.5	168.3	-167.1	177.1	-162.7	177.9	4.3	105.1	M160 A164	M160-R162 VanDerWaalsContact C-N 3.29Å; M160-R162 PolarHBondContact O-N 3.43Å; R162-A164 PolarHBondContact O-N 3.4Å
163	P	34.4	Very low	32.6	Very low	104 Å²	104	132.5 Å²	132.5	68%	0.675	73%	0.731	S	S	*	*			trans	-53.5	123.4	179.7	18.4	-28.9	0	0	0	107	T161 V165	T161-P163 WeakPolarHBondContact O-CD 3.37Å; T161-P163 VanDerWaalsContact O-N 3.12Å; P163-V165 PolarHBondContact O-N 2.85Å
164	A	33.4	Very low	32.7	Very low	91 Å²	91	133.9 Å²	133.9	75%	0.752	73%	0.732	S	S	*	*			trans	-60.2	96.2	171.5	0	0	0	0	0	105.6	R162 H166	R162-A164 PolarHBondContact O-N 3.4Å; A164-H166 PolarHBondContact O-N 2.89Å
165	V	32.2	Very low	32.5	Very low	115 Å²	115	132.2 Å²	132.2	70%	0.697	73%	0.73	S	S	*	*			trans	-65.3	99.7	167	-172	0	0	0	0	102.6	P163 I167	P163-V165 PolarHBondContact O-N 2.85Å; V165-I167 HydrophobicContact CB-CG1 4.47Å; V165-I167 HydrophobicContact CG1-CG1 4.14Å; V165-I167 PolarHBondContact O-N 3.25Å
166	H	27.8	Very low	32.5	Very low	164 Å²	164	135.1 Å²	135.1	76%	0.759	74%	0.744	S	S	*	*			trans	-58.9	92	159.5	-105.4	-87.9	0	0	0	104.5	A164 E168	A164-H166 PolarHBondContact O-N 2.89Å; H166-E168 PolarHBondContact O-N 3.21Å
167	I	31.4	Very low	32.3	Very low	133 Å²	133	135.1 Å²	135.1	68%	0.682	74%	0.744	S	S	*	*			trans	-70.1	88.6	161.5	-49.8	170.5	0	0	0	101.8	V165 T169	V165-I167 HydrophobicContact CB-CG1 4.47Å; V165-I167 HydrophobicContact CG1-CG1 4.14Å; V165-I167 PolarHBondContact O-N 3.25Å; I167-T169 PolarHBondContact O-N 2.88Å
168	E	34.8	Very low	32.3	Very low	169 Å²	169	135.3 Å²	135.3	79%	0.79	75%	0.749	S	S	*	*			trans	-61.3	88.6	154.9	-71.9	-173.4	173.8	0	0	104.1	H166 S170	H166-E168 PolarHBondContact O-N 3.21Å; E168-S170 PolarHBondContact O-N 3.46Å
169	T	35	Very low	32.3	Very low	118 Å²	118	136 Å²	136	72%	0.724	75%	0.754	S	S	*	*			trans	-53.5	103.4	161.6	-55.3	0	0	0	0	103.5	I167 A171	I167-T169 PolarHBondContact O-N 2.88Å; T169-A171 PolarHBondContact O-N 2.87Å
170	S	34.7	Very low	32.3	Very low	112 Å²	112	137 Å²	137	78%	0.783	76%	0.759	S	S	*	*			trans	-60.3	96.5	173.2	-155.2	0	0	0	0	103.8	E168 E172	E168-S170 PolarHBondContact O-N 3.46Å; S170-E172 PolarHBondContact O-N 3.4Å
171	A	34.7	Very low	32.7	Very low	72 Å²	72	135 Å²	135	60%	0.595	75%	0.751	S	S	*	*			trans	-54.1	114	171.1	0	0	0	0	0	104.1	T169 L173	T169-A171 PolarHBondContact O-N 2.87Å; A171-L173 VanDerWaalsContact C-N 3.29Å; A171-L173 PolarHBondContact O-N 3.33Å
172	E	31.4	Very low	32.9	Very low	186 Å²	186	138.6 Å²	138.6	87%	0.869	75%	0.753	S	S	*	*			trans	-39.2	107	158.1	-87.6	173.3	130.9	0	0	105.5	S170 P174	S170-E172 PolarHBondContact O-N 3.4Å; E172-P174 WeakPolarHBondContact O-CD 3.33Å; E172-P174 VanDerWaalsContact O-N 3.09Å
173	L	32.5	Very low	32.9	Very low	161 Å²	161	133.8 Å²	133.8	84%	0.843	75%	0.754	S	S	*	*			trans	-63.2	111	165.2	-95.1	87.8	0	0	0	104.1	A171	A171-L173 VanDerWaalsContact C-N 3.29Å; A171-L173 PolarHBondContact O-N 3.33Å
174	P	38.2	Very low	32.9	Very low	110 Å²	110	136.4 Å²	136.4	71%	0.714	75%	0.754	S	S	*	*			trans	-61.6	138.9	171.2	27	-32	0	0	0	107.7	E172	E172-P174 WeakPolarHBondContact O-CD 3.33Å; E172-P174 VanDerWaalsContact O-N 3.09Å
175	P	33.5	Very low	32.8	Very low	108 Å²	108	138.4 Å²	138.4	70%	0.701	75%	0.752	S	S	*	*			trans	-57	144.3	-179	21.4	-30.9	0	0	0	110.7	N177	P175-N177 PolarHBondContact O-N 3.48Å
176	P	33.1	Very low	32.7	Very low	125 Å²	125	141.7 Å²	141.7	81%	0.812	76%	0.76	S	S	*	*			trans	-78	98.3	-167	32.5	-31.7	0	0	0	108.9
177	N	31.3	Very low	32.9	Very low	145 Å²	145	142.8 Å²	142.8	78%	0.775	76%	0.763	S	S	*	*			trans	-119.8	107.8	166	-86.8	-17.5	0	0	0	107.9	P175	P175-N177 PolarHBondContact O-N 3.48Å
178	D	30.1	Very low	32.8	Very low	135 Å²	135	143.1 Å²	143.1	72%	0.722	77%	0.771	S	S	*	*			trans	40.8	98.1	145	-62.2	-27.1	0	0	0	116.8
179	L	33.8	Very low	32.7	Very low	157 Å²	157	142.7 Å²	142.7	82%	0.822	77%	0.773	S	S	*	*			trans	-162.3	94.2	138.2	-99.7	145.1	0	0	0	109.6	D181	L179-D181 HydrophobicContact CD2-CB 4.32Å; L179-D181 PolarHBondContact O-N 2.87Å
180	I	31.9	Very low	32.5	Very low	154 Å²	154	142.1 Å²	142.1	79%	0.79	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	14.2	174	-78.2	167.2	0	0	0	113
181	D	36	Very low	32	Very low	125 Å²	125	142.3 Å²	142.3	67%	0.668	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	8.3	-164.4	-84.2	-34.1	0	0	0	117.7	L179	L179-D181 HydrophobicContact CD2-CB 4.32Å; L179-D181 PolarHBondContact O-N 2.87Å
182	Y	32.3	Very low	32.1	Very low	194 Å²	194	144.7 Å²	144.7	76%	0.761	79%	0.785	S	S	*	*			trans	-106.9	29.4	173	-132.4	-91	0	0	0	114.4
183	C	28.4	Very low	32.1	Very low	132 Å²	132	145.2 Å²	145.2	89%	0.892	78%	0.784	S	S	*	*	S	Bend	trans	-85.5	11.5	160.2	-81.5	0	0	0	0	113.1
184	K	34.4	Very low	31.9	Very low	159 Å²	159	143.3 Å²	143.3	69%	0.691	78%	0.784	S	S	*	*	S	Bend	trans	-114.6	120.5	171	-85.1	176.9	176.8	172.2	0	109.4
185	D	32	Very low	31.5	Very low	132 Å²	132	142.7 Å²	142.7	71%	0.706	78%	0.779	S	S	*	*			trans	84.6	75.4	159.4	-46.6	-34.5	0	0	0	116.7
186	Q	29.2	Very low	31.3	Very low	185 Å²	185	143 Å²	143	86%	0.864	78%	0.784	S	S	*	*				-149.4	116.9	121.5	-113.4	176.2	76.2	0	0	113.4
187	K	31.9	Very low	31.4	Very low	187 Å²	187	143.8 Å²	143.8	81%	0.813	78%	0.779	S	S	*	*			trans	-56.9	139.4	177.2	-81	169	168.8	171.8	0	112.2	L189	K187-L189 PolarHBondContact O-N 2.84Å; K187-L189 VanDerWaalsContact O-N 3.14Å
188	T	28.7	Very low	31	Very low	139 Å²	139	139.2 Å²	139.2	85%	0.853	77%	0.767	S	S	*	*			trans	-19.2	103.6	148.9	-34.5	0	0	0	0	113.8
189	L	32.9	Very low	30.7	Very low	160 Å²	160	141.8 Å²	141.8	84%	0.838	77%	0.772	S	S	*	*			trans	-114.7	95.3	159.4	-100.7	114.5	0	0	0	109.2	K187	K187-L189 PolarHBondContact O-N 2.84Å; K187-L189 VanDerWaalsContact O-N 3.14Å
190	S	30.7	Very low	30.6	Very low	107 Å²	107	142.8 Å²	142.8	75%	0.748	77%	0.772	S	S	*	*			trans	22.8	112.1	142.7	-32.3	0	0	0	0	118.9
191	S	25.5	Very low	30.6	Very low	115 Å²	115	140.1 Å²	140.1	80%	0.804	77%	0.773	S	S	*	*			trans	-73.1	177.8	147.5	-54.7	0	0	0	0	110.8
192	P	37.4	Very low	30.5	Very low	123 Å²	123	139.7 Å²	139.7	80%	0.799	78%	0.78	S	S	*	*				-116.3	150.3	-68.5	35.1	-22	0	0	0	110.5
193	K	30.5	Very low	30.4	Very low	196 Å²	196	139.2 Å²	139.2	85%	0.852	78%	0.782	S	S	*	*			trans	-114.8	98.2	167.6	-129.3	175.7	-173.7	178.2	0	110.3	T195	K193-T195 PolarHBondContact O-N 3.24Å
194	S	27.8	Very low	30.5	Very low	121 Å²	121	139.2 Å²	139.2	85%	0.846	78%	0.778	S	S	*	*			trans	-64.6	120.2	162.2	-161.2	0	0	0	0	107.6
195	T	31.1	Very low	30.5	Very low	97 Å²	97	139.1 Å²	139.1	60%	0.595	79%	0.785	S	S	*	*			trans	-138.2	91.7	171.4	-56.7	0	0	0	0	107.9	K193 I197	K193-T195 PolarHBondContact O-N 3.24Å; T195-I197 HydrophobicContact CG2-CD1 3.86Å; T195-I197 HydrophobicContact CG2-CG1 3.87Å; T195-I197 PolarHBondContact O-N 3.2Å
196	S	29.1	Very low	30.5	Very low	115 Å²	115	138.3 Å²	138.3	80%	0.804	79%	0.79	S	S	*	*			trans	-61	112.8	159.2	166	0	0	0	0	108.8
197	I	33.5	Very low	30.6	Very low	141 Å²	141	137.5 Å²	137.5	72%	0.723	79%	0.79	S	S	*	*			trans	-135.5	101.4	157.6	-57.7	172.3	0	0	0	105.7	T195	T195-I197 HydrophobicContact CG2-CD1 3.86Å; T195-I197 HydrophobicContact CG2-CG1 3.87Å; T195-I197 PolarHBondContact O-N 3.2Å
198	G	24.6	Very low	30.7	Very low	49 Å²	49	133.4 Å²	133.4	51%	0.505	78%	0.783	S	S	.	*			trans	-72.1	165.1	161	0	0	0	0	0	111
199	F	24.1	Very low	30.7	Very low	189 Å²	189	134.4 Å²	134.4	83%	0.829	78%	0.783	S	S	*	*			trans	78.2	128.9	176.6	-50.4	-81.8	0	0	0	114
200	H	30	Very low	30.6	Very low	178 Å²	178	133.6 Å²	133.6	82%	0.824	79%	0.785	S	S	*	*			cis	-146.5	152.8	39	-79.4	-97.7	0	0	0	113	S202	H200-S202 PolarHBondContact O-N 2.94Å
201	A	31.9	Very low	30.4	Very low	99 Å²	99	135.2 Å²	135.2	82%	0.818	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-58.6	122.6	166.2	0	0	0	0	0	110	K203	A201-K203 PolarHBondContact O-N 2.87Å
202	S	34	Very low	31	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-61.2	126.6	176.8	-166.9	0	0	0	0	109.7	H200 T204	H200-S202 PolarHBondContact O-N 2.94Å; S202-T204 PolarHBondContact O-N 3.42Å
203	K	30.3	Very low	30.6	Very low	183 Å²	183	134.9 Å²	134.9	80%	0.796	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-56.8	136	171.2	-74.5	175.4	175.3	177.5	0	108.9	A201 D205	A201-K203 PolarHBondContact O-N 2.87Å; K203-D205 PolarHBondContact O-N 3.46Å
204	T	31.1	Very low	30.5	Very low	132 Å²	132	134.5 Å²	134.5	81%	0.81	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-51.3	117.6	161.8	32.9	0	0	0	0	109.9	S202 S206	S202-T204 PolarHBondContact O-N 3.42Å; T204-S206 PolarHBondContact O-N 3.48Å
205	D	34.1	Very low	30.7	Very low	158 Å²	158	133.3 Å²	133.3	85%	0.845	77%	0.771	S	S	*	*			trans	-71.9	109.8	165.5	-74.1	-40.3	0	0	0	108.8	K203 L207	K203-D205 PolarHBondContact O-N 3.46Å; D205-L207 PolarHBondContact O-N 2.95Å
206	S	31.9	Very low	30.6	Very low	115 Å²	115	135.8 Å²	135.8	80%	0.804	78%	0.78	S	S	*	*			trans	-71.2	99.9	170.3	-38.4	0	0	0	0	108.4	T204	T204-S206 PolarHBondContact O-N 3.48Å
207	L	31.7	Very low	30.6	Very low	167 Å²	167	139.7 Å²	139.7	87%	0.874	79%	0.786	S	S	*	*			trans	-75.4	136.9	170.8	-156.8	71.5	0	0	0	109.6	D205	D205-L207 PolarHBondContact O-N 2.95Å
208	P	33.1	Very low	30.2	Very low	102 Å²	102	140.9 Å²	140.9	66%	0.662	79%	0.788	S	S	*	*			trans	-75.5	146.1	-165.6	-12.5	28.6	0	0	0	113.8	T210	P208-T210 PolarHBondContact O-N 3.47Å; P208-T210 VanDerWaalsContact O-N 3.11Å
209	N	29.7	Very low	30.5	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	80%	0.802	S	S	*	*			trans	-44.5	111.6	162.3	-92.9	-22.7	0	0	0	111.5
210	T	31.1	Very low	30.8	Very low	143 Å²	143	141.3 Å²	141.3	88%	0.877	80%	0.799	S	S	*	*			trans	-88	113.7	155.4	44.6	0	0	0	0	108.6	P208	P208-T210 PolarHBondContact O-N 3.47Å; P208-T210 VanDerWaalsContact O-N 3.11Å
211	N	25.5	Very low	30.9	Very low	140 Å²	140	141.5 Å²	141.5	75%	0.749	80%	0.8	S	S	*	*			trans	-146.1	154.4	169.7	-127.9	-12.7	0	0	0	105.1
212	P	38.6	Very low	30.6	Very low	105 Å²	105	141.8 Å²	141.8	68%	0.682	80%	0.796	S	S	*	*			cis	-126.7	-167.2	-31.6	26.4	-4.2	0	0	0	110.1
213	T	28.3	Very low	30.4	Very low	127 Å²	127	146 Å²	146	78%	0.779	80%	0.8	S	S	*	*			trans	116.7	82.2	152.8	-38.4	0	0	0	0	116.3
214	E	30.1	Very low	30.3	Very low	187 Å²	187	142.4 Å²	142.4	87%	0.874	80%	0.798	S	S	*	*			trans	-142.7	94.4	143.2	-89.9	-175.4	163.1	0	0	105.7
215	S	30.2	Very low	30.2	Very low	96 Å²	96	142.7 Å²	142.7	67%	0.671	80%	0.799	S	S	*	*				67.4	94.2	94.7	74	0	0	0	0	115.4
216	L	29.3	Very low	29.9	Very low	150 Å²	150	142.7 Å²	142.7	79%	0.785	80%	0.799	S	S	*	*			trans	43.7	109.3	131.5	-72.9	158	0	0	0	119.6	Q218	L216-Q218 HydrophobicContact CD2-CG 4.49Å
217	Q	28.8	Very low	29.7	Very low	197 Å²	197	142.1 Å²	142.1	92%	0.921	80%	0.795	S	S	*	*				-145.7	118.3	125.2	-125.4	174.3	16.2	0	0	110.7
218	Q	26.8	Very low	29.5	Very low	166 Å²	166	139.7 Å²	139.7	78%	0.776	79%	0.792	S	S	*	*			trans	-87.4	135.9	174	-69.5	176.5	-54.2	0	0	109.3	L216	L216-Q218 HydrophobicContact CD2-CG 4.49Å
219	T	29.4	Very low	29.2	Very low	129 Å²	129	142 Å²	142	79%	0.791	80%	0.798	S	S	*	*			trans	-140.6	110.7	150.3	-46.1	0	0	0	0	107.5
220	P	31.7	Very low	29	Very low	118 Å²	118	142.4 Å²	142.4	77%	0.766	79%	0.794	S	S	*	*			trans	-92.3	122.7	171.9	31.2	-24.6	0	0	0	109.7
221	Q	31.1	Very low	28.8	Very low	182 Å²	182	142.1 Å²	142.1	85%	0.85	79%	0.793	S	S	*	*			trans	-132.1	113.8	159.3	-97.2	-173.7	-25.2	0	0	109.6
222	S	25.7	Very low	28.8	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	79%	0.787	S	S	*	*			trans	-65.2	136	172.7	-59.3	0	0	0	0	111.7
223	F	30.8	Very low	28.3	Very low	204 Å²	204	139 Å²	139	90%	0.895	79%	0.789	S	S	*	*			trans	-135.9	116.6	136.6	-82.2	-77	0	0	0	108.6
224	S	27	Very low	28.4	Very low	108 Å²	108	139 Å²	139	76%	0.755	79%	0.788	S	S	*	*			trans	-64.5	144.9	163.7	-53.3	0	0	0	0	110.1
225	T	30	Very low	28.3	Very low	138 Å²	138	137.1 Å²	137.1	85%	0.847	78%	0.784	S	S	*	*				177.9	117.7	119.9	-65.9	0	0	0	0	108.3
226	D	27.3	Very low	28.1	Very low	158 Å²	158	139.8 Å²	139.8	85%	0.845	79%	0.791	S	S	*	*			trans	-59.9	129	165.6	-75	-52.6	0	0	0	111
227	S	27.8	Very low	28	Very low	103 Å²	103	137.9 Å²	137.9	72%	0.72	79%	0.786	S	S	*	*			trans	-139.5	91.2	146.4	82.8	0	0	0	0	109.8	I229	S227-I229 PolarHBondContact O-N 3.36Å
228	S	27.6	Very low	27.9	Very low	116 Å²	116	135.3 Å²	135.3	81%	0.811	78%	0.778	S	S	*	*			trans	-67.2	105.8	159.9	54.4	0	0	0	0	109.1
229	I	27.5	Very low	28	Very low	152 Å²	152	130.6 Å²	130.6	78%	0.779	77%	0.767	S	S	*	*			trans	-128.8	98.7	163.4	-60	-177.1	0	0	0	108.9	S227	S227-I229 PolarHBondContact O-N 3.36Å
230	H	24.6	Very low	27.9	Very low	168 Å²	168	128.5 Å²	128.5	78%	0.778	76%	0.758	S	S	*	*			trans	71.6	89.5	134.3	-124.7	57.8	0	0	0	118.4	G232	H230-G232 PolarHBondContact O-N 2.88Å
231	T	25.9	Very low	27.6	Very low	137 Å²	137	131.3 Å²	131.3	84%	0.84	76%	0.761	S	S	*	*			trans	-54.1	90.2	137.3	37	0	0	0	0	109.7	T233	T231-T233 PolarHBondContact O-N 3.26Å
232	G	26.5	Very low	27.5	Very low	62 Å²	62	130 Å²	130	64%	0.639	76%	0.759	S	S	*	*			trans	-77	96.5	164	0	0	0	0	0	109.3	H230 V234	H230-G232 PolarHBondContact O-N 2.88Å; G232-V234 PolarHBondContact O-N 2.92Å
233	T	27.5	Very low	27.6	Very low	118 Å²	118	133.5 Å²	133.5	72%	0.724	76%	0.761	S	S	*	*			trans	-55	131.4	169.5	-56.5	0	0	0	0	111	T231 N235	T231-T233 PolarHBondContact O-N 3.26Å; T233-N235 PolarHBondContact O-N 2.78Å
234	V	30.8	Very low	27.5	Very low	125 Å²	125	131.1 Å²	131.1	76%	0.758	76%	0.756	S	S	*	*			trans	-17.8	103.1	160.2	-162.4	0	0	0	0	114.4	G232 N236	G232-V234 PolarHBondContact O-N 2.92Å; V234-N236 PolarHBondContact O-N 2.95Å
235	N	27.8	Very low	27.6	Very low	148 Å²	148	131.2 Å²	131.2	79%	0.791	75%	0.752	S	S	*	*			trans	-91.3	97.1	157.9	-86.3	-16.7	0	0	0	108.5	T233 V237	T233-N235 PolarHBondContact O-N 2.78Å; N235-V237 VanDerWaalsContact C-N 3.27Å; N235-V237 HydrophobicContact CB-CG2 4.02Å; N235-V237 PolarHBondContact O-N 3.3Å
236	N	27	Very low	27.5	Very low	152 Å²	152	128.9 Å²	128.9	81%	0.813	75%	0.747	S	S	*	*			trans	-67.5	86.6	162	-157.5	10.7	0	0	0	107.2	V234 D238	V234-N236 PolarHBondContact O-N 2.95Å; N236-D238 PolarHBondContact O-N 2.77Å
237	V	27.4	Very low	27.5	Very low	111 Å²	111	126.8 Å²	126.8	67%	0.673	74%	0.74	S	S	*	*			trans	-87.8	88	176.7	-174.8	0	0	0	0	108.2	N235 A239	N235-V237 VanDerWaalsContact C-N 3.27Å; N235-V237 HydrophobicContact CB-CG2 4.02Å; N235-V237 PolarHBondContact O-N 3.3Å; V237-A239 HydrophobicContact CG1-CB 3.79Å; V237-A239 PolarHBondContact O-N 3.46Å
238	D	26.9	Very low	27.6	Very low	142 Å²	142	127.4 Å²	127.4	76%	0.759	74%	0.741	S	S	*	*			trans	-71.6	78.4	161	-162.9	2.7	0	0	0	108.2	N236 S240	N236-D238 PolarHBondContact O-N 2.77Å; D238-S240 VanDerWaalsContact C-N 3.35Å; D238-S240 PolarHBondContact O-N 3.28Å
239	A	27.5	Very low	27.5	Very low	67 Å²	67	128.2 Å²	128.2	55%	0.554	74%	0.741	S	S	*	*			trans	-94.1	69.7	173.9	0	0	0	0	0	110	V237	V237-A239 HydrophobicContact CG1-CB 3.79Å; V237-A239 PolarHBondContact O-N 3.46Å
240	S	27.6	Very low	27.3	Very low	86 Å²	86	127.6 Å²	127.6	60%	0.601	74%	0.739	S	S	*	*			trans	-63.5	143.7	149.2	57.1	0	0	0	0	108.9	D238	D238-S240 VanDerWaalsContact C-N 3.35Å; D238-S240 PolarHBondContact O-N 3.28Å
241	H	26.4	Very low	27.5	Very low	177 Å²	177	125 Å²	125	82%	0.819	74%	0.74	S	S	*	*			trans	73.9	59.5	173.4	-70.3	-82.2	0	0	0	119.3	K243	H241-K243 VanDerWaalsContact C-N 3.32Å; H241-K243 PolarHBondContact O-N 3.49Å
242	L	27.6	Very low	27.4	Very low	153 Å²	153	126.8 Å²	126.8	80%	0.801	74%	0.738	S	S	*	*			trans	-85	84.8	148.9	-101.7	143.7	0	0	0	109.8	I244	L242-I244 VanDerWaalsContact C-N 3.33Å; L242-I244 PolarHBondContact O-N 2.95Å
243	K	28.8	Very low	27.5	Very low	179 Å²	179	130.7 Å²	130.7	78%	0.778	75%	0.75	S	S	*	*			trans	-63.8	90.7	165.2	-165	178.3	-172.4	-177.6	0	107.5	H241 T245	H241-K243 VanDerWaalsContact C-N 3.32Å; H241-K243 PolarHBondContact O-N 3.49Å; K243-T245 VanDerWaalsContact C-N 3.32Å; K243-T245 PolarHBondContact O-N 3.27Å; K243-T245 PolarHBondContact O-OG1 3.12Å
244	I	27.9	Very low	27.5	Very low	153 Å²	153	128.5 Å²	128.5	79%	0.785	75%	0.751	S	S	*	*			trans	-67.7	99.5	173.6	-61.3	176.3	0	0	0	107	L242 A246	L242-I244 VanDerWaalsContact C-N 3.33Å; L242-I244 PolarHBondContact O-N 2.95Å; I244-A246 PolarHBondContact O-N 3.21Å
245	T	28.6	Very low	27.1	Very low	111 Å²	111	132.5 Å²	132.5	68%	0.681	76%	0.758	S	S	*	*			trans	-79.6	93.2	172.1	-45.6	0	0	0	0	105.6	K243 T247	K243-T245 VanDerWaalsContact C-N 3.32Å; K243-T245 PolarHBondContact O-N 3.27Å; K243-T245 PolarHBondContact O-OG1 3.12Å; T245-T247 PolarHBondContact O-N 3.37Å
246	A	29	Very low	27.2	Very low	89 Å²	89	130.4 Å²	130.4	74%	0.736	76%	0.755	S	S	*	*			trans	-78.6	99.9	170.4	0	0	0	0	0	108	I244	I244-A246 PolarHBondContact O-N 3.21Å
247	T	27.7	Very low	27.2	Very low	113 Å²	113	132.1 Å²	132.1	69%	0.693	76%	0.759	S	S	*	*			trans	-60.9	130.9	175.1	-41.7	0	0	0	0	110.5	T245 V249	T245-T247 PolarHBondContact O-N 3.37Å; T247-V249 PolarHBondContact O-N 3.19Å
248	P	28.4	Very low	27.1	Very low	116 Å²	116	135.4 Å²	135.4	75%	0.753	77%	0.766	S	S	*	*			trans	-77.4	119.1	177.1	28.9	-31.4	0	0	0	110.8
249	V	26.1	Very low	27.4	Very low	133 Å²	133	133.5 Å²	133.5	81%	0.806	76%	0.762	S	S	*	*			trans	-91.5	109.5	168.5	173.4	0	0	0	0	108.6	T247	T247-V249 PolarHBondContact O-N 3.19Å
250	L	23.6	Very low	27.4	Very low	139 Å²	139	135.4 Å²	135.4	73%	0.728	77%	0.771	S	S	*	*			trans	-62.1	130.8	164.4	-118.7	83.6	0	0	0	109.8
251	S	28.1	Very low	27.4	Very low	114 Å²	114	137 Å²	137	80%	0.797	78%	0.783	S	S	*	*			trans	-149.3	102.5	151.9	-70.4	0	0	0	0	108.4
252	Q	23.7	Very low	27.4	Very low	174 Å²	174	137.2 Å²	137.2	81%	0.813	79%	0.786	S	S	*	*			trans	-70.5	130.6	170.9	-70.1	173.9	-10.4	0	0	109.8
253	T	28.6	Very low	27.5	Very low	145 Å²	145	138 Å²	138	89%	0.89	79%	0.79	S	S	*	*			trans	-151.7	127.4	153.5	40.6	0	0	0	0	109.8
254	G	27.1	Very low	27.6	Very low	71 Å²	71	137.6 Å²	137.6	73%	0.732	80%	0.796	S	S	*	*			trans	104.3	77.4	142.1	0	0	0	0	0	118
255	F	23.7	Very low	27.4	Very low	209 Å²	209	133.2 Å²	133.2	92%	0.917	79%	0.789	S	S	*	*			trans	-2.9	126.3	139.9	-66	-92.1	0	0	0	118.3
256	S	29	Very low	27.2	Very low	105 Å²	105	136 Å²	136	73%	0.734	80%	0.8	S	S	*	*				162.8	144.3	102.7	66.6	0	0	0	0	112.7
257	Q	26.7	Very low	27.1	Very low	188 Å²	188	137.4 Å²	137.4	88%	0.879	81%	0.805	S	S	*	*			trans	84.7	92	164.5	-54.1	-170.9	16	0	0	119.7
258	Q	26.4	Very low	27.1	Very low	179 Å²	179	139.8 Å²	139.8	84%	0.836	81%	0.811	S	S	*	*			trans	-64.7	168	136.1	-115.8	-175.1	-74.9	0	0	109.8
259	P	33.8	Very low	27.2	Very low	102 Å²	102	137.3 Å²	137.3	66%	0.662	81%	0.807	S	S	*	*			cis	-143.6	154.9	20.4	35.9	-13.1	0	0	0	118.7
260	S	26.4	Very low	27.2	Very low	107 Å²	107	140 Å²	140	75%	0.748	81%	0.808	S	S	*	*			trans	17.6	118.8	144	64.8	0	0	0	0	121.6
261	S	27.3	Very low	27.6	Very low	121 Å²	121	138.8 Å²	138.8	85%	0.846	81%	0.808	S	S	*	*			trans	-119.8	113.9	138.2	67.2	0	0	0	0	110.2
262	M	27.9	Very low	27.7	Very low	180 Å²	180	142.2 Å²	142.2	89%	0.887	81%	0.812	S	S	*	*			trans	3.8	115.7	157.2	-67	165.7	73.3	0	0	120
263	L	27.8	Very low	28	Very low	170 Å²	170	139.7 Å²	139.7	89%	0.89	81%	0.808	S	S	*	*				6.8	114.1	125.6	-67.9	159	0	0	0	118.5
264	N	31.1	Very low	28.1	Very low	170 Å²	170	139.8 Å²	139.8	91%	0.909	80%	0.798	S	S	*	*				-159.8	123.3	129.7	-110.8	-7.5	0	0	0	104.7
265	G	23.6	Very low	28.1	Very low	62 Å²	62	146.6 Å²	146.6	64%	0.639	80%	0.803	S	S	*	*			cis	117.8	85.7	39.3	0	0	0	0	0	107.7
266	N	25.1	Very low	28.3	Very low	169 Å²	169	144.7 Å²	144.7	90%	0.904	80%	0.795	S	S	*	*			trans	64.7	113	156.5	-57.4	-8.3	0	0	0	120.2
267	S	27.4	Very low	28.4	Very low	119 Å²	119	147 Å²	147	83%	0.832	80%	0.797	S	S	*	*				-175	126.5	93.2	-172	0	0	0	0	109.8	G269	S267-G269 PolarHBondContact O-N 3.46Å; S267-G269 VanDerWaalsContact O-N 3.09Å
268	I	28.4	Very low	28.5	Very low	162 Å²	162	143.8 Å²	143.8	83%	0.831	79%	0.791	S	S	*	*			trans	-71.9	96.6	178.3	-66.7	158.1	0	0	0	107.8
269	G	29.5	Very low	28.7	Very low	64 Å²	64	139.6 Å²	139.6	66%	0.66	79%	0.787	S	S	*	*			trans	-117.7	99.7	156.7	0	0	0	0	0	106.4	S267 P271	S267-G269 PolarHBondContact O-N 3.46Å; S267-G269 VanDerWaalsContact O-N 3.09Å; G269-P271 WeakPolarHBondContact O-CD 3.5Å; G269-P271 VanDerWaalsContact O-N 3.17Å
270	K	26	Very low	28.3	Very low	190 Å²	190	143.3 Å²	143.3	83%	0.826	80%	0.796	S	S	*	*			trans	-62.3	110	173.3	-71.7	176.1	176.3	178.4	0	107.7
271	P	32	Very low	28.5	Very low	113 Å²	113	147.1 Å²	147.1	73%	0.734	80%	0.802	S	S	*	*			trans	-74.8	128.8	163.5	30	-23.1	0	0	0	107.1	G269 T273	G269-P271 WeakPolarHBondContact O-CD 3.5Å; G269-P271 VanDerWaalsContact O-N 3.17Å; P271-T273 PolarHBondContact O-N 2.92Å; P271-T273 VanDerWaalsContact O-N 3.15Å
272	E	29.7	Very low	28.6	Very low	187 Å²	187	147.6 Å²	147.6	87%	0.874	80%	0.799	S	S	*	*			trans	-46.7	121.1	170.8	-67.7	178.7	148.9	0	0	108.8	E274	E272-E274 VanDerWaalsContact C-N 3.3Å; E272-E274 PolarHBondContact O-N 3.29Å
273	T	29.7	Very low	28.4	Very low	120 Å²	120	149.7 Å²	149.7	74%	0.736	80%	0.797	S	S	*	*			trans	-69.2	95.2	175.1	-44.3	0	0	0	0	106.4	P271 Y275	P271-T273 PolarHBondContact O-N 2.92Å; P271-T273 VanDerWaalsContact O-N 3.15Å; T273-Y275 PolarHBondContact O-N 2.85Å
274	E	30.4	Very low	28.5	Very low	147 Å²	147	145.1 Å²	145.1	69%	0.687	78%	0.779	S	S	*	*			trans	-53.1	111	165.2	-74.4	-173.3	158.9	0	0	107.1	E272 F276	E272-E274 VanDerWaalsContact C-N 3.3Å; E272-E274 PolarHBondContact O-N 3.29Å; E274-F276 HydrophobicContact CB-CD2 4.43Å; E274-F276 HydrophobicContact CB-CE2 4.34Å; E274-F276 PolarHBondContact O-N 3.49Å
275	Y	28.1	Very low	28.5	Very low	214 Å²	214	144.3 Å²	144.3	84%	0.839	78%	0.775	S	S	*	*			trans	-64.1	92.1	168.7	-75	-93.7	0	0	0	106.9	T273 I277	T273-Y275 PolarHBondContact O-N 2.85Å; Y275-I277 PolarHBondContact O-N 3.49Å
276	F	28.2	Very low	28.6	Very low	169 Å²	169	149.3 Å²	149.3	74%	0.741	78%	0.779	S	S	*	*			trans	-62.2	92	160.7	-84	-90.1	0	0	0	106.9	E274 T278	E274-F276 HydrophobicContact CB-CD2 4.43Å; E274-F276 HydrophobicContact CB-CE2 4.34Å; E274-F276 PolarHBondContact O-N 3.49Å; F276-T278 PolarHBondContact O-N 3.34Å
277	I	30.1	Very low	28.8	Very low	153 Å²	153	146.7 Å²	146.7	79%	0.785	77%	0.772	S	S	*	*			trans	-63.1	94.4	162.4	-59.7	174.8	0	0	0	104.5	Y275 A279	Y275-I277 PolarHBondContact O-N 3.49Å; I277-A279 PolarHBondContact O-N 3.07Å
278	T	29.1	Very low	28.8	Very low	122 Å²	122	151.9 Å²	151.9	75%	0.748	77%	0.773	S	S	*	*			trans	-60.2	89.5	167.4	33.6	0	0	0	0	106.7	F276 Q280	F276-T278 PolarHBondContact O-N 3.34Å; T278-Q280 PolarHBondContact O-N 3.5Å
279	A	30.4	Very low	28.7	Very low	91 Å²	91	152.4 Å²	152.4	75%	0.752	77%	0.774	S	S	*	*			trans	-56.5	99.4	162.4	0	0	0	0	0	105.6	I277 Q281	I277-A279 PolarHBondContact O-N 3.07Å; A279-Q281 VanDerWaalsContact C-N 3.29Å; A279-Q281 PolarHBondContact O-N 2.8Å
280	Q	26.5	Very low	28.6	Very low	180 Å²	180	153.4 Å²	153.4	84%	0.841	77%	0.771	S	S	*	*			trans	-52.1	102.6	171.1	-88.5	175.7	-26.3	0	0	106.1	T278 V282	T278-Q280 PolarHBondContact O-N 3.5Å; Q280-V282 PolarHBondContact O-N 3.24Å
281	Q	29.8	Very low	28.8	Very low	187 Å²	187	152.5 Å²	152.5	87%	0.874	77%	0.77	S	S	*	*			trans	-59.5	98.4	167.8	-116.2	175.7	4.4	0	0	104.9	A279 R283	A279-Q281 VanDerWaalsContact C-N 3.29Å; A279-Q281 PolarHBondContact O-N 2.8Å; Q281-R283 VanDerWaalsContact C-N 3.26Å; Q281-R283 PolarHBondContact O-N 3.03Å
282	V	28.9	Very low	28.7	Very low	131 Å²	131	154.2 Å²	154.2	79%	0.794	77%	0.772	S	S	*	*			trans	-58.4	101.6	169.1	178.4	0	0	0	0	104.9	Q280 S284	Q280-V282 PolarHBondContact O-N 3.24Å; V282-S284 PolarHBondContact O-N 3.49Å
283	R	25.5	Very low	28.6	Very low	224 Å²	224	151.5 Å²	151.5	85%	0.845	76%	0.763	S	S	*	*			trans	-70.7	82	-179	-141.4	-177.6	-169.8	-176.1	2.8	106.1	Q281 N285	Q281-R283 VanDerWaalsContact C-N 3.26Å; Q281-R283 PolarHBondContact O-N 3.03Å; R283-N285 PolarHBondContact O-N 3.03Å
284	S	28.3	Very low	28.8	Very low	73 Å²	73	151 Å²	151	51%	0.51	76%	0.762	S	S	.	*			trans	-65.2	108.3	171	53.1	0	0	0	0	106.9	V282 F286	V282-S284 PolarHBondContact O-N 3.49Å; S284-F286 PolarHBondContact O-N 3.02Å; S284-F286 VanDerWaalsContact OG-CD2 3.25Å; S284-F286 WeakPolarHBondContact OG-CD2 3.34Å; S284-F286 WeakPolarHBondContact OG-CE2 3.19Å
285	N	31.1	Very low	28.9	Very low	154 Å²	154	152.7 Å²	152.7	82%	0.824	77%	0.768	S	S	*	*			trans	-66.4	73.2	170.5	-69.4	-41.6	0	0	0	108.8	R283	R283-N285 PolarHBondContact O-N 3.03Å
286	F	27.4	Very low	28.8	Very low	166 Å²	166	145.4 Å²	145.4	73%	0.728	76%	0.758	S	S	*	*			trans	-69.7	130.4	162.7	-76	-77.2	0	0	0	107.1	S284 R288	S284-F286 PolarHBondContact O-N 3.02Å; S284-F286 VanDerWaalsContact OG-CD2 3.25Å; S284-F286 WeakPolarHBondContact OG-CD2 3.34Å; S284-F286 WeakPolarHBondContact OG-CE2 3.19Å; F286-R288 PolarHBondContact O-N 3.19Å
287	P	28.8	Very low	28.8	Very low	115 Å²	115	143.2 Å²	143.2	75%	0.747	76%	0.758	S	S	*	*			trans	-54.7	118.3	171.2	21.6	-29.9	0	0	0	107.4	M289	P287-M289 PolarHBondContact O-N 2.88Å
288	R	25.9	Very low	28.7	Very low	228 Å²	228	141.9 Å²	141.9	86%	0.86	76%	0.759	S	S	*	*			trans	-54.6	111.2	174.8	-168.8	174.4	-174.4	164.1	-1.2	105.5	F286 S290	F286-R288 PolarHBondContact O-N 3.19Å; R288-S290 PolarHBondContact O-N 2.71Å; R288-S290 PolarHBondContact O-OG 2.71Å
289	M	27.5	Very low	28.9	Very low	172 Å²	172	143.6 Å²	143.6	85%	0.847	76%	0.763	S	S	*	*			trans	-66.1	80.8	168.4	-74.1	-101.8	-119.7	0	0	106.4	P287 E291	P287-M289 PolarHBondContact O-N 2.88Å; M289-E291 PolarHBondContact O-N 2.97Å; M289-E291 VanDerWaalsContact O-N 3.15Å
290	S	27.6	Very low	28.6	Very low	85 Å²	85	146.7 Å²	146.7	59%	0.594	76%	0.762	S	S	*	*			trans	-57.5	115.5	169.7	-51.5	0	0	0	0	106.9	R288 L292	R288-S290 PolarHBondContact O-N 2.71Å; R288-S290 PolarHBondContact O-OG 2.71Å; S290-L292 PolarHBondContact O-N 3.24Å
291	E	29.3	Very low	28.8	Very low	172 Å²	172	145.5 Å²	145.5	80%	0.804	76%	0.76	S	S	*	*			trans	64.9	48.6	145.3	-57.5	169.6	-173.3	0	0	116.7	M289 N293	M289-E291 PolarHBondContact O-N 2.97Å; M289-E291 VanDerWaalsContact O-N 3.15Å; E291-N293 PolarHBondContact O-N 3.35Å
292	L	31	Very low	28.6	Very low	149 Å²	149	141.6 Å²	141.6	78%	0.78	75%	0.749	S	S	*	*			trans	-77.2	79.2	147.2	-73.6	175.3	0	0	0	107.7	S290 P294	S290-L292 PolarHBondContact O-N 3.24Å; L292-P294 WeakPolarHBondContact O-CD 3.46Å; L292-P294 VanDerWaalsContact O-N 3.14Å
293	N	27.1	Very low	28.7	Very low	129 Å²	129	145.1 Å²	145.1	69%	0.69	75%	0.754	S	S	*	*			trans	-57.9	111	173	-120	-14.2	0	0	0	108.4	E291 F295	E291-N293 PolarHBondContact O-N 3.35Å; N293-F295 PolarHBondContact O-N 2.9Å
294	P	34.6	Very low	28.7	Very low	109 Å²	109	137.5 Å²	137.5	71%	0.708	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	8.3	-179.5	30.9	-31.8	0	0	0	113	L292	L292-P294 WeakPolarHBondContact O-CD 3.46Å; L292-P294 VanDerWaalsContact O-N 3.14Å
295	F	31.2	Very low	28.8	Very low	184 Å²	184	142.4 Å²	142.4	81%	0.807	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	22.7	-179.2	-67	-73.7	0	0	0	113.4	N293 T297	N293-F295 PolarHBondContact O-N 2.9Å; F295-T297 PolarHBondContact O-N 3.36Å
296	G	25.7	Very low	28.9	Very low	61 Å²	61	141.7 Å²	141.7	63%	0.629	76%	0.757	S	S	*	*	S	Bend	trans	-60.6	110.9	158.9	0	0	0	0	0	107.9
297	T	28	Very low	29	Very low	123 Å²	123	137.1 Å²	137.1	76%	0.755	76%	0.757	S	S	*	*			trans	-32.5	136.5	176.8	8.3	0	0	0	0	111.7	F295 L299	F295-T297 PolarHBondContact O-N 3.36Å; T297-L299 PolarHBondContact O-N 3.27Å
298	P	30	Very low	29	Very low	124 Å²	124	139 Å²	139	81%	0.805	76%	0.761	S	S	*	*			trans	-51.2	108.8	-179.3	20.4	-31.6	0	0	0	108.1	H300	P298-H300 VanDerWaalsContact C-N 3.26Å; P298-H300 PolarHBondContact O-N 3.31Å
299	L	31.4	Very low	29.4	Very low	159 Å²	159	131.1 Å²	131.1	83%	0.832	74%	0.74	S	S	*	*			trans	-57	103.7	171.4	-81.3	161.5	0	0	0	104.6	T297 L301	T297-L299 PolarHBondContact O-N 3.27Å; L299-L301 PolarHBondContact O-N 3.46Å
300	H	25.3	Very low	30.3	Very low	155 Å²	155	130.9 Å²	130.9	72%	0.718	74%	0.741	S	S	*	*			trans	-52	100.7	166.3	-177.2	-97.8	0	0	0	104.8	P298 T302	P298-H300 VanDerWaalsContact C-N 3.26Å; P298-H300 PolarHBondContact O-N 3.31Å; H300-T302 PolarHBondContact ND1-OG1 2.8Å; H300-T302 PolarHBondContact O-N 3.47Å; H300-T302 PolarHBondContact O-OG1 2.93Å
301	L	30.1	Very low	30.5	Very low	155 Å²	155	132.8 Å²	132.8	81%	0.812	74%	0.74	S	S	*	*			trans	-69.8	76	171.9	-72.5	167.2	0	0	0	105.4	L299 F303	L299-L301 PolarHBondContact O-N 3.46Å; L301-F303 PolarHBondContact O-N 3.29Å; L301-F303 VanDerWaalsContact O-N 3.11Å
302	T	26.8	Very low	30.9	Very low	105 Å²	105	129.9 Å²	129.9	64%	0.644	74%	0.736	S	S	*	*			trans	-55.1	117.5	160.9	-19.7	0	0	0	0	104	H300 G304	H300-T302 PolarHBondContact ND1-OG1 2.8Å; H300-T302 PolarHBondContact O-N 3.47Å; H300-T302 PolarHBondContact O-OG1 2.93Å; T302-G304 PolarHBondContact O-N 2.83Å
303	F	30.2	Very low	31.4	Very low	205 Å²	205	129.7 Å²	129.7	90%	0.899	74%	0.736	S	S	*	*			trans	-57.6	89.1	171.4	-80	-97.7	0	0	0	106.8	L301 E305	L301-F303 PolarHBondContact O-N 3.29Å; L301-F303 VanDerWaalsContact O-N 3.11Å; F303-E305 PolarHBondContact O-N 2.95Å
304	G	25.5	Very low	31.5	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	73%	0.734	S	S	*	*			trans	-71.1	82.5	172.6	0	0	0	0	0	107.2	T302 N306	T302-G304 PolarHBondContact O-N 2.83Å; G304-N306 PolarHBondContact O-N 3.33Å
305	E	30.5	Very low	31.2	Very low	175 Å²	175	135.7 Å²	135.7	82%	0.818	74%	0.741	S	S	*	*	S	Bend	trans	-31.5	124.8	141.6	-154	169.2	-173.6	0	0	108.2	F303	F303-E305 PolarHBondContact O-N 2.95Å
306	N	33.2	Very low	31.4	Very low	140 Å²	140	136.6 Å²	136.6	75%	0.749	74%	0.741	S	S	*	*			trans	89	51.6	178.5	-44	-21.9	0	0	0	116.5	G304 N308	G304-N306 PolarHBondContact O-N 3.33Å; N306-N308 PolarHBondContact O-N 2.9Å
307	G	29.2	Very low	31.7	Very low	70 Å²	70	139.5 Å²	139.5	72%	0.722	75%	0.746	S	S	*	*			trans	-70.2	103.7	149.8	0	0	0	0	0	109.1	S309	G307-S309 PolarHBondContact O-N 3.49Å
308	N	29.2	Very low	32	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	74%	0.742	S	S	*	*			trans	-54.3	104.6	172.2	-71.9	-19.9	0	0	0	109.2	N306 I310	N306-N308 PolarHBondContact O-N 2.9Å; N308-I310 PolarHBondContact O-N 3.47Å
309	S	33.7	Very low	32.3	Very low	62 Å²	62	138.1 Å²	138.1	43%	0.434	74%	0.737	S	S	.	*			trans	-64.2	128.6	171.4	178.1	0	0	0	0	108.4	G307 H311	G307-S309 PolarHBondContact O-N 3.49Å; S309-H311 WeakPolarHBondContact CB-O 3.21Å; S309-H311 PolarHBondContact O-N 3.3Å; S309-H311 PolarHBondContact OG-N 3.4Å; S309-H311 PolarHBondContact OG-O 3Å
310	I	46.4	Very low	32.5	Very low	167 Å²	167	139.6 Å²	139.6	86%	0.856	73%	0.733	S	S	*	*	S	Bend	trans	-61.2	-13.3	173.4	-60.6	171.5	0	0	0	110.8	N308	N308-I310 PolarHBondContact O-N 3.47Å
311	H	32.2	Very low	32.9	Very low	124 Å²	124	139.4 Å²	139.4	57%	0.574	74%	0.737	S	S	*	*	S	Bend	trans	-121.5	108.5	166.4	-84.8	-65.2	0	0	0	111.3	S309 D313 Y314	S309-H311 WeakPolarHBondContact CB-O 3.21Å; S309-H311 PolarHBondContact O-N 3.3Å; S309-H311 PolarHBondContact OG-N 3.4Å; S309-H311 PolarHBondContact OG-O 3Å; H311-D313 PolarHBondContact O-N 2.84Å; H311-D313 VanDerWaalsContact O-N 3.15Å; H311-Y314 PolarHBondContact O-N 3.28Å
312	P	37.8	Very low	33	Very low	112 Å²	112	139.9 Å²	139.9	73%	0.727	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-16.7	179.1	23	-31.6	0	0	0	114.1
313	D	40.8	Very low	33.4	Very low	144 Å²	144	139.2 Å²	139.2	77%	0.77	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-6.1	-174.7	-57.5	-40.8	0	0	0	114.6	H311 K315	H311-D313 PolarHBondContact O-N 2.84Å; H311-D313 VanDerWaalsContact O-N 3.15Å; D313-K315 PolarHBondContact O-N 3.45Å
314	Y	28.8	Very low	33.4	Very low	170 Å²	170	138.2 Å²	138.2	67%	0.667	74%	0.738	S	S	*	*			trans	-89.6	87.1	178.8	-102.5	-94.8	0	0	0	111.3	H311 Y316	H311-Y314 PolarHBondContact O-N 3.28Å; Y314-Y316 PolarHBondContact O-N 3.33Å
315	K	30.2	Very low	33.9	Very low	194 Å²	194	139.9 Å²	139.9	84%	0.843	75%	0.745	S	S	*	*			trans	-75.3	109.5	164.1	-77.9	-176.6	177.4	179.1	0	109.4	D313 T317	D313-K315 PolarHBondContact O-N 3.45Å; K315-T317 PolarHBondContact O-N 3.48Å; K315-T317 VanDerWaalsContact O-N 3.08Å
316	Y	33.9	Very low	34	Very low	204 Å²	204	136.9 Å²	136.9	80%	0.8	74%	0.744	S	S	*	*			trans	-67.4	102.8	165.5	-73.5	-86.5	0	0	0	109.1	Y314 P318	Y314-Y316 PolarHBondContact O-N 3.33Å; Y316-P318 WeakPolarHBondContact O-CD 3.33Å
317	T	32.7	Very low	34.3	Very low	121 Å²	121	135.5 Å²	135.5	74%	0.742	75%	0.745	S	S	*	*			trans	-68.1	123.7	165.7	1.7	0	0	0	0	108.7	K315 V319	K315-T317 PolarHBondContact O-N 3.48Å; K315-T317 VanDerWaalsContact O-N 3.08Å; T317-V319 PolarHBondContact O-N 3.21Å
318	P	34.8	Very low	34.8	Very low	102 Å²	102	137.9 Å²	137.9	66%	0.662	75%	0.75	S	S	*	*			trans	-66.6	102.8	175	25.4	-31.2	0	0	0	109.1	Y316 Y320	Y316-P318 WeakPolarHBondContact O-CD 3.33Å; P318-Y320 PolarHBondContact O-N 3.45Å
319	V	36.4	Very low	34.8	Very low	117 Å²	117	139.1 Å²	139.1	71%	0.709	75%	0.753	S	S	*	*			trans	-73.4	96.4	173.5	-173.6	0	0	0	0	107.5	T317 N321	T317-V319 PolarHBondContact O-N 3.21Å; V319-N321 PolarHBondContact O-N 3.48Å
320	Y	35.3	Very low	34.9	Very low	190 Å²	190	141.6 Å²	141.6	75%	0.745	77%	0.771	S	S	*	*			trans	-63	102.8	167.9	-87.5	-95.4	0	0	0	108.3	P318 H322	P318-Y320 PolarHBondContact O-N 3.45Å; Y320-H322 PolarHBondContact O-CD2 3Å; Y320-H322 PolarHBondContact O-N 3.14Å
321	N	33.1	Very low	34.5	Very low	151 Å²	151	141 Å²	141	81%	0.807	77%	0.768	S	S	*	*			trans	-67.3	92.7	174.4	-90.9	-33.3	0	0	0	109.7	V319 A323	V319-N321 PolarHBondContact O-N 3.48Å; N321-A323 PolarHBondContact O-N 2.93Å
322	H	31.2	Very low	34.5	Very low	165 Å²	165	146.4 Å²	146.4	76%	0.764	78%	0.783	S	S	*	*			trans	-75.9	73.7	159.6	-64	-76.1	0	0	0	108.5	Y320 E324	Y320-H322 PolarHBondContact O-CD2 3Å; Y320-H322 PolarHBondContact O-N 3.14Å; H322-E324 PolarHBondContact O-N 2.97Å
323	A	37	Very low	34.5	Very low	90 Å²	90	152 Å²	152	74%	0.744	79%	0.79	S	S	*	*			trans	-75	89	163.4	0	0	0	0	0	106.9	N321 A325	N321-A323 PolarHBondContact O-N 2.93Å; A323-A325 PolarHBondContact O-N 3.32Å
324	E	30.2	Very low	34.3	Very low	184 Å²	184	150.7 Å²	150.7	86%	0.86	79%	0.789	S	S	*	*			trans	-52.7	110.1	167.8	-70.5	-177.5	165.1	0	0	108	H322 S326	H322-E324 PolarHBondContact O-N 2.97Å; E324-S326 VanDerWaalsContact C-N 3.33Å; E324-S326 PolarHBondContact O-N 3.01Å
325	A	34.6	Very low	34.6	Very low	100 Å²	100	150.1 Å²	150.1	83%	0.826	80%	0.798	S	S	*	*			trans	-67.9	94.2	177.3	0	0	0	0	0	108	A323 S327	A323-A325 PolarHBondContact O-N 3.32Å; A325-S327 PolarHBondContact O-N 3.29Å
326	S	33.7	Very low	34.9	Very low	113 Å²	113	148.3 Å²	148.3	79%	0.79	80%	0.796	S	S	*	*			trans	-54	124.8	171.2	58.3	0	0	0	0	109.1	E324 S328	E324-S326 VanDerWaalsContact C-N 3.33Å; E324-S326 PolarHBondContact O-N 3.01Å; S326-S328 PolarHBondContact O-N 3.06Å
327	S	39.9	Very low	35.1	Very low	111 Å²	111	146.3 Å²	146.3	78%	0.776	80%	0.798	S	S	*	*			trans	-52.4	133	178.9	58.8	0	0	0	0	110.8	A325 M329	A325-S327 PolarHBondContact O-N 3.29Å; S327-M329 PolarHBondContact O-N 3.41Å
328	S	38.2	Very low	35.2	Very low	119 Å²	119	147.7 Å²	147.7	83%	0.832	81%	0.806	S	S	*	*			trans	-59.1	110.1	-179.6	58.3	0	0	0	0	110.6	S326 S330	S326-S328 PolarHBondContact O-N 3.06Å; S328-S330 PolarHBondContact O-N 3.5Å; S328-S330 VanDerWaalsContact O-N 3.17Å
329	M	29.8	Very low	35	Very low	181 Å²	181	145.4 Å²	145.4	89%	0.892	80%	0.802	S	S	*	*			trans	-67.6	116.4	173	-149.7	173.1	-175.8	0	0	107.7	S327 I331	S327-M329 PolarHBondContact O-N 3.41Å; M329-I331 PolarHBondContact O-N 3.45Å
330	S	36.3	Very low	34.7	Very low	115 Å²	115	146.4 Å²	146.4	80%	0.804	81%	0.808	S	S	*	*			trans	-63.5	107.9	-178.8	-175.8	0	0	0	0	110.1	S328 R332	S328-S330 PolarHBondContact O-N 3.5Å; S328-S330 VanDerWaalsContact O-N 3.17Å; S330-R332 PolarHBondContact O-N 3Å
331	I	37.6	Very low	34.7	Very low	155 Å²	155	142.7 Å²	142.7	80%	0.795	81%	0.81	S	S	*	*			trans	-72.5	101.6	176.5	-61.1	168.4	0	0	0	107.5	M329 R333	M329-I331 PolarHBondContact O-N 3.45Å; I331-R333 PolarHBondContact O-N 3.1Å; I331-R333 VanDerWaalsContact O-N 3.13Å
332	R	32	Very low	35	Very low	236 Å²	236	143.1 Å²	143.1	89%	0.891	81%	0.811	S	S	*	*			trans	-62.3	111.8	172.4	-139.1	-174.9	-168.3	-167.9	4	108.3	S330 P334	S330-R332 PolarHBondContact O-N 3Å; R332-P334 WeakPolarHBondContact O-CD 3.44Å
333	R	37.7	Very low	35.2	Very low	230 Å²	230	141.3 Å²	141.3	87%	0.868	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-65.2	124.6	175.1	-72.4	-179.4	178.4	159.2	0.1	108.9	I331 N335	I331-R333 PolarHBondContact O-N 3.1Å; I331-R333 VanDerWaalsContact O-N 3.13Å; R333-N335 PolarHBondContact O-N 3.39Å
334	P	36.1	Very low	35.1	Very low	117 Å²	117	146.6 Å²	146.6	76%	0.76	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-62.5	134.8	170.6	18.7	-23	0	0	0	109.8	R332 I336	R332-P334 WeakPolarHBondContact O-CD 3.44Å; P334-I336 PolarHBondContact O-N 3.26Å
335	N	35.1	Very low	35.3	Very low	157 Å²	157	145.2 Å²	145.2	84%	0.84	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-56.1	121.2	175.5	-90.2	-17.7	0	0	0	109.5	R333 L337	R333-N335 PolarHBondContact O-N 3.39Å; N335-L337 PolarHBondContact O-N 2.96Å; N335-L337 VanDerWaalsContact O-N 3.09Å
336	I	38.1	Very low	35.5	Very low	157 Å²	157	146.4 Å²	146.4	81%	0.805	81%	0.814	S	S	*	*			trans	-71.3	103.1	175.7	-46.4	169.9	0	0	0	105.6	P334 T338	P334-I336 PolarHBondContact O-N 3.26Å; I336-T338 PolarHBondContact O-N 2.82Å; I336-T338 VanDerWaalsContact O-N 3.08Å
337	L	37.8	Very low	35.6	Very low	161 Å²	161	146.3 Å²	146.3	84%	0.843	81%	0.814	S	S	*	*			trans	-62.7	111.6	170.7	-114.4	94.6	0	0	0	107.8	N335 G339	N335-L337 PolarHBondContact O-N 2.96Å; N335-L337 VanDerWaalsContact O-N 3.09Å; L337-G339 PolarHBondContact O-N 3.39Å
338	T	33.3	Very low	35.6	Very low	150 Å²	150	146.9 Å²	146.9	92%	0.92	82%	0.815	S	S	*	*			trans	-69.7	73.2	171	5	0	0	0	0	109.2	I336	I336-T338 PolarHBondContact O-N 2.82Å; I336-T338 VanDerWaalsContact O-N 3.08Å
339	G	30.9	Very low	35.6	Very low	55 Å²	55	150.6 Å²	150.6	57%	0.567	82%	0.816	S	S	*	*			trans	-94.4	104	179.7	0	0	0	0	0	112.4	L337	L337-G339 PolarHBondContact O-N 3.39Å
340	T	31.8	Very low	36	Very low	137 Å²	137	150.3 Å²	150.3	84%	0.84	81%	0.812	S	S	*	*			trans	51.4	112	147.5	55.1	0	0	0	0	120.1
341	S	34.5	Very low	36	Very low	112 Å²	112	151.1 Å²	151.1	78%	0.783	81%	0.813	S	S	*	*			trans	-21.3	120.8	163.6	-169	0	0	0	0	116.4	T343	S341-T343 PolarHBondContact O-N 3.36Å
342	I	38.7	Very low	35.7	Very low	161 Å²	161	152.1 Å²	152.1	83%	0.826	81%	0.814	S	S	*	*			trans	-66.7	109.6	172.2	-60.4	164.4	0	0	0	108.1	K344	I342-K344 PolarHBondContact O-N 2.88Å
343	T	35.1	Very low	35.9	Very low	126 Å²	126	148.4 Å²	148.4	77%	0.773	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-60.1	118.8	172.3	-39.6	0	0	0	0	109	S341 L345	S341-T343 PolarHBondContact O-N 3.36Å; T343-L345 PolarHBondContact O-N 3.03Å
344	K	35.9	Very low	35.5	Very low	201 Å²	201	146.5 Å²	146.5	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-56.7	125.4	177.3	-85.5	178.1	173.9	177.6	0	110.1	I342	I342-K344 PolarHBondContact O-N 2.88Å
345	L	35.1	Very low	35.5	Very low	156 Å²	156	146.7 Å²	146.7	82%	0.817	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-60.9	143.1	171.5	-100.4	75.3	0	0	0	110.8	T343	T343-L345 PolarHBondContact O-N 3.03Å
346	P	38.2	Very low	35.2	Very low	124 Å²	124	144.1 Å²	144.1	81%	0.805	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.1	131.8	174	27.3	-31.2	0	0	0	111.6
347	S	36	Very low	34.9	Very low	112 Å²	112	145.4 Å²	145.4	78%	0.783	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.8	142.7	176.9	-71.1	0	0	0	0	112.4	K349	S347-K349 PolarHBondContact O-N 3.38Å
348	P	39.4	Very low	34.4	Very low	122 Å²	122	145.7 Å²	145.7	79%	0.792	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.9	130.1	-179	25.7	-32.2	0	0	0	111.6	E350	P348-E350 PolarHBondContact O-N 3.33Å
349	K	38.9	Very low	34.2	Very low	197 Å²	197	143.1 Å²	143.1	86%	0.857	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-69	118.4	173.8	-69.7	179.9	176.8	-179	0	109.7	S347 T351	S347-K349 PolarHBondContact O-N 3.38Å; K349-T351 PolarHBondContact O-N 3.03Å; K349-T351 VanDerWaalsContact O-N 3.15Å
350	E	37.3	Very low	34.3	Very low	175 Å²	175	147 Å²	147	82%	0.818	81%	0.812	S	S	*	*			trans	-58.1	113.6	170.6	-73.3	177	149.7	0	0	109.7	P348 H352	P348-E350 PolarHBondContact O-N 3.33Å; E350-H352 PolarHBondContact O-N 2.86Å
351	T	36.4	Very low	34.2	Very low	133 Å²	133	149.4 Å²	149.4	82%	0.816	81%	0.813	S	S	*	*			trans	-87.7	101.8	177.7	-13.7	0	0	0	0	107.5	K349 L353	K349-T351 PolarHBondContact O-N 3.03Å; K349-T351 VanDerWaalsContact O-N 3.15Å; T351-L353 PolarHBondContact O-N 3.49Å
352	H	32.4	Very low	34	Very low	175 Å²	175	153.4 Å²	153.4	81%	0.81	82%	0.816	S	S	*	*			trans	-62.9	98.2	171.2	-79.6	-88.3	0	0	0	109.8	E350 Q354	E350-H352 PolarHBondContact O-N 2.86Å; H352-Q354 PolarHBondContact O-N 3.47Å
353	L	35.3	Very low	33.6	Very low	158 Å²	158	152.8 Å²	152.8	83%	0.827	82%	0.82	S	S	*	*			trans	-80.1	105	167.3	-79.4	166	0	0	0	108.7	T351 V355	T351-L353 PolarHBondContact O-N 3.49Å; L353-V355 PolarHBondContact O-N 2.9Å
354	Q	30.4	Very low	33.2	Very low	190 Å²	190	154.3 Å²	154.3	89%	0.888	82%	0.822	S	S	*	*			trans	-61.8	111.4	168.6	-76.9	179.2	-20	0	0	109.5	H352 S356	H352-Q354 PolarHBondContact O-N 3.47Å; Q354-S356 PolarHBondContact O-N 2.9Å
355	V	35.1	Very low	32.6	Very low	121 Å²	121	150.5 Å²	150.5	73%	0.733	82%	0.816	S	S	*	*			trans	-81	104.8	168.4	178.7	0	0	0	0	107.5	L353 Q357	L353-V355 PolarHBondContact O-N 2.9Å; V355-Q357 HydrophobicContact CG1-CG 4.26Å; V355-Q357 PolarHBondContact O-N 3.26Å; V355-Q357 VanDerWaalsContact O-N 3.07Å
356	S	28.7	Very low	32.4	Very low	104 Å²	104	150.9 Å²	150.9	73%	0.727	82%	0.819	S	S	*	*			trans	-66.9	99.4	170.5	-169.5	0	0	0	0	109.2	Q354 Q358	Q354-S356 PolarHBondContact O-N 2.9Å; S356-Q358 PolarHBondContact O-N 3.35Å
357	Q	31.4	Very low	31.8	Very low	184 Å²	184	153.6 Å²	153.6	86%	0.86	82%	0.818	S	S	*	*			trans	-88.6	95.9	168.3	-75.8	-171.9	-6.4	0	0	108.5	V355	V355-Q357 HydrophobicContact CG1-CG 4.26Å; V355-Q357 PolarHBondContact O-N 3.26Å; V355-Q357 VanDerWaalsContact O-N 3.07Å
358	Q	27.3	Very low	31.6	Very low	166 Å²	166	160 Å²	160	78%	0.776	83%	0.826	S	S	*	*			trans	-96	124.4	176.5	-164.3	172.2	-21.2	0	0	110.4	S356	S356-Q358 PolarHBondContact O-N 3.35Å
359	S	29.1	Very low	30.8	Very low	96 Å²	96	159.5 Å²	159.5	67%	0.671	83%	0.826	S	S	*	*			trans	60.6	101.2	155.1	67	0	0	0	0	119.9
360	S	33.8	Very low	30.5	Very low	138 Å²	138	155 Å²	155	97%	0.965	82%	0.819	S	S	*	*				-140.4	91.1	128.7	-80.5	0	0	0	0	107.9
361	Q	29.6	Very low	30	Very low	187 Å²	187	152.8 Å²	152.8	87%	0.874	82%	0.818	S	S	*	*			trans	-99.3	146.7	171.7	-113.8	179.6	-5.3	0	0	108.7
362	K	29.9	Very low	29.5	Very low	196 Å²	196	151.6 Å²	151.6	85%	0.852	82%	0.815	S	S	*	*			trans	90.1	85.5	171	-65	-177.6	172.6	-178.9	0	117.2
363	V	29.6	Very low	29.3	Very low	148 Å²	148	149.2 Å²	149.2	90%	0.897	81%	0.813	S	S	*	*				-136.4	138.6	125.9	-179.4	0	0	0	0	108.3
364	L	27.5	Very low	28.9	Very low	158 Å²	158	145.3 Å²	145.3	83%	0.827	80%	0.804	S	S	*	*			trans	-54.8	138.9	-170.1	-106.7	70.2	0	0	0	116
365	T	24.1	Very low	28.9	Very low	121 Å²	121	142.2 Å²	142.2	74%	0.742	80%	0.8	S	S	*	*			trans	-14.1	124.7	144	-23.5	0	0	0	0	116.9
366	N	31.2	Very low	28.8	Very low	163 Å²	163	143.3 Å²	143.3	87%	0.872	81%	0.807	S	S	*	*			trans	-149.3	110.2	139.3	-99.5	-14	0	0	0	111.2
367	K	24.4	Very low	28.9	Very low	182 Å²	182	145.4 Å²	145.4	79%	0.791	81%	0.81	S	S	*	*			trans	-12.1	119.9	153.1	-85.3	168.8	164.3	175.4	0	115.3
368	Y	31.7	Very low	28.6	Very low	245 Å²	245	145 Å²	145	96%	0.961	81%	0.808	S	S	*	*				-147.1	135.8	120.7	-83.7	-74.2	0	0	0	109.2
369	S	23.7	Very low	28.8	Very low	113 Å²	113	142.4 Å²	142.4	79%	0.79	81%	0.805	S	S	*	*			trans	-94.8	139.9	-175.6	176.4	0	0	0	0	109.5
370	S	31.3	Very low	28.8	Very low	101 Å²	101	144.7 Å²	144.7	71%	0.706	81%	0.81	S	S	*	*			trans	-178.9	114.8	144.4	27.8	0	0	0	0	112.2
371	T	26.6	Very low	28.5	Very low	130 Å²	130	145 Å²	145	80%	0.798	80%	0.801	S	S	*	*			trans	48.6	114.9	133.3	55.8	0	0	0	0	119.5
372	S	25.5	Very low	28.7	Very low	108 Å²	108	144 Å²	144	76%	0.755	80%	0.801	S	S	*	*				102.3	132.8	60.9	-174.1	0	0	0	0	111.3
373	T	28.1	Very low	28.6	Very low	124 Å²	124	142.6 Å²	142.6	76%	0.761	80%	0.797	S	S	*	*			trans	112.6	95	146.7	-38.3	0	0	0	0	117.4
374	A	28.4	Very low	28.6	Very low	76 Å²	76	143.1 Å²	143.1	63%	0.628	79%	0.794	S	S	*	*				71.2	114.2	129.3	0	0	0	0	0	121.3
375	P	30.7	Very low	28.6	Very low	126 Å²	126	143.9 Å²	143.9	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-76.8	130.2	161.8	31.1	-29.9	0	0	0	110.7
376	V	32.7	Very low	28.8	Very low	143 Å²	143	143.4 Å²	143.4	87%	0.867	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-97.1	127.4	173	173.6	0	0	0	0	109.6
377	N	30.7	Very low	28.5	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-56.6	139.7	-173.2	-73.5	-70.1	0	0	0	115.2
378	Q	23.7	Very low	28.8	Very low	174 Å²	174	143.4 Å²	143.4	81%	0.813	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-81.1	141.7	151.7	-165.2	172.2	37.5	0	0	108.2
379	P	33.3	Very low	28.6	Very low	112 Å²	112	140 Å²	140	73%	0.727	79%	0.785	S	S	*	*				-145.9	130.8	120.5	32.5	-14.6	0	0	0	114.7
380	D	28.9	Very low	28.8	Very low	145 Å²	145	142.6 Å²	142.6	78%	0.775	79%	0.785	S	S	*	*				41.4	117.5	126.4	-61.8	-29.8	0	0	0	122.9
381	N	27.1	Very low	28.6	Very low	143 Å²	143	147 Å²	147	77%	0.765	79%	0.791	S	S	*	*				72.5	97	119.9	-153.2	12.4	0	0	0	118.7
382	L	34.1	Very low	28.7	Very low	168 Å²	168	148.9 Å²	148.9	88%	0.88	79%	0.791	S	S	*	*			trans	-113.8	103.9	160.4	-94.2	152.3	0	0	0	109.4	I384	L382-I384 PolarHBondContact O-N 2.86Å
383	E	28.2	Very low	28.6	Very low	166 Å²	166	152.1 Å²	152.1	78%	0.776	80%	0.797	S	S	*	*			trans	-65.6	115.3	173.1	-171	176.6	159.8	0	0	110.3
384	I	29.5	Very low	28.6	Very low	159 Å²	159	153.7 Å²	153.7	82%	0.815	80%	0.799	S	S	*	*			trans	-98.4	115.3	177.8	-60.3	173.5	0	0	0	108.8	L382	L382-I384 PolarHBondContact O-N 2.86Å
385	Q	27.3	Very low	28.6	Very low	174 Å²	174	158.5 Å²	158.5	81%	0.813	81%	0.809	S	S	*	*			trans	-72.7	144.4	178.5	-75.2	-168.8	36.8	0	0	113.4
386	P	27.3	Very low	28.2	Very low	111 Å²	111	161.7 Å²	161.7	72%	0.721	81%	0.813	S	S	*	*			trans	-97.3	140.5	-177.2	35.3	-32.6	0	0	0	116
387	I	26.2	Very low	27.9	Very low	144 Å²	144	164.2 Å²	164.2	74%	0.738	82%	0.815	S	S	*	*			trans	54.3	115.8	135	-49.9	164.7	0	0	0	119.6	Q389	I387-Q389 HydrophobicContact CG2-CG 4.35Å
388	Q	28.9	Very low	27.5	Very low	200 Å²	200	166.6 Å²	166.6	94%	0.935	82%	0.822	S	S	*	*			trans	-130.9	121.9	139.8	-92.5	-177.1	0.4	0	0	110.7
389	Q	27.3	Very low	27.6	Very low	174 Å²	174	161.7 Å²	161.7	81%	0.813	82%	0.818	S	S	*	*			trans	-79.4	123	173.6	-76.7	173.2	-35	0	0	109.9	I387	I387-Q389 HydrophobicContact CG2-CG 4.35Å
390	E	28.3	Very low	27.4	Very low	167 Å²	167	164.7 Å²	164.7	78%	0.78	82%	0.822	S	S	*	*			trans	-103	112.6	164.5	-163.4	174.4	155.9	0	0	109.2
391	K	27.5	Very low	27.1	Very low	193 Å²	193	162.7 Å²	162.7	84%	0.839	82%	0.819	S	S	*	*			trans	-85.6	114.2	169.5	-74.8	-179.1	177.3	179.8	0	108
392	Q	28.7	Very low	27.2	Very low	171 Å²	171	164.6 Å²	164.6	80%	0.799	82%	0.823	S	S	*	*			trans	-115.5	109.9	159.4	-108	-179.7	22.4	0	0	109.1
393	M	24	Very low	26.9	Very low	176 Å²	176	163 Å²	163	87%	0.867	82%	0.82	S	S	*	*			trans	-74.6	128.3	161.7	-77.7	174.2	70.7	0	0	107.9
394	L	28.3	Very low	27.1	Very low	156 Å²	156	158.9 Å²	158.9	82%	0.817	82%	0.823	S	S	*	*			trans	-152.8	114.7	150.8	-132.4	94.9	0	0	0	112.7
395	Q	27.5	Very low	26.9	Very low	177 Å²	177	160.4 Å²	160.4	83%	0.827	82%	0.823	S	S	*	*			trans	53.9	124.4	141	-74.7	176.3	-0	0	0	123.4
396	Q	22.7	Very low	26.8	Very low	194 Å²	194	160.1 Å²	160.1	91%	0.907	83%	0.827	S	S	*	*			trans	-62.4	139.4	160	-68	165.4	-34.4	0	0	111.9
397	Q	26.6	Very low	27.3	Very low	196 Å²	196	160 Å²	160	92%	0.916	83%	0.826	S	S	*	*			trans	-130.2	113.4	158	-114.7	-178.6	-5.8	0	0	108.6
398	E	22.7	Very low	27.2	Very low	199 Å²	199	162.7 Å²	162.7	93%	0.93	84%	0.835	S	S	*	*			trans	-73.5	131.4	161.9	-76.1	174.6	127.3	0	0	108.9
399	G	24.6	Very low	27.2	Very low	71 Å²	71	161.8 Å²	161.8	73%	0.732	83%	0.831	S	S	*	*			trans	-154.4	106.2	-180	0	0	0	0	0	112.8
400	Q	28.9	Very low	27.2	Very low	175 Å²	175	158.8 Å²	158.8	82%	0.818	83%	0.829	S	S	*	*			trans	73	102.7	143.4	-69.4	177.7	-12.4	0	0	121.1
401	S	23.6	Very low	27.3	Very low	102 Å²	102	158.1 Å²	158.1	71%	0.713	83%	0.83	S	S	*	*			trans	-30	126.8	141.2	47.5	0	0	0	0	117.7
402	H	29.8	Very low	27.3	Very low	184 Å²	184	155.7 Å²	155.7	85%	0.852	83%	0.832	S	S	*	*			trans	-129.2	99	150.5	-76	-30.9	0	0	0	110.7	G404	H402-G404 PolarHBondContact O-N 3.37Å
403	T	27.5	Very low	27.3	Very low	133 Å²	133	156.8 Å²	156.8	82%	0.816	84%	0.837	S	S	*	*			trans	-78.5	100.7	163.6	41.5	0	0	0	0	109.4
404	G	31.1	Very low	27.4	Very low	80 Å²	80	158.1 Å²	158.1	83%	0.825	84%	0.838	S	S	*	*			trans	-82.5	111.1	167.9	0	0	0	0	0	110.8	H402	H402-G404 PolarHBondContact O-N 3.37Å
405	K	25.9	Very low	27.4	Very low	192 Å²	192	155.3 Å²	155.3	84%	0.835	83%	0.832	S	S	*	*			trans	-76.5	138.5	169.6	-68.1	172.3	173.8	179.1	0	110.3
406	L	26.4	Very low	27.6	Very low	168 Å²	168	152.6 Å²	152.6	88%	0.88	83%	0.832	S	S	*	*			trans	-168.5	158	145.8	-126.4	76.5	0	0	0	109.4
407	P	35.9	Very low	27.9	Very low	109 Å²	109	152.3 Å²	152.3	71%	0.708	83%	0.831	S	S	*	*				-117.8	161.2	-113.8	20.8	3.2	0	0	0	114.2	Q409	P407-Q409 PolarHBondContact O-N 2.77Å
408	Q	24.7	Very low	28.1	Very low	199 Å²	199	150.8 Å²	150.8	93%	0.93	83%	0.827	S	S	*	*			trans	-49	123.7	170.3	-72	168.3	-43	0	0	112.8
409	Q	29.6	Very low	28.5	Very low	181 Å²	181	146.1 Å²	146.1	85%	0.846	82%	0.816	S	S	*	*			trans	-100.3	113.7	154.3	-86.5	-174.2	-27.8	0	0	108.8	P407	P407-Q409 PolarHBondContact O-N 2.77Å
410	S	26.7	Very low	28.9	Very low	112 Å²	112	148.6 Å²	148.6	78%	0.783	82%	0.82	S	S	*	*			trans	-72	113.9	167.1	51.1	0	0	0	0	109.9
411	L	30.8	Very low	28.9	Very low	153 Å²	153	147.2 Å²	147.2	80%	0.801	82%	0.823	S	S	*	*			trans	-114.4	107.4	157.7	-95.7	111.9	0	0	0	109.3	Q413	L411-Q413 PolarHBondContact O-N 3.47Å
412	T	26.9	Very low	29.4	Very low	142 Å²	142	148 Å²	148	87%	0.871	82%	0.824	S	S	*	*			trans	-60.5	104.8	166.6	23.8	0	0	0	0	110.2
413	Q	29.6	Very low	29.2	Very low	193 Å²	193	144 Å²	144	90%	0.902	82%	0.816	S	S	*	*			trans	-99.7	114.9	163.5	-93.8	-176.2	-22.3	0	0	110.1	L411	L411-Q413 PolarHBondContact O-N 3.47Å
414	K	26	Very low	29.3	Very low	204 Å²	204	143.9 Å²	143.9	89%	0.887	82%	0.816	S	S	*	*			trans	-64.1	136.5	179	-107.7	173.7	172.3	176.7	0	111.7
415	S	27.8	Very low	29	Very low	98 Å²	98	148.4 Å²	148.4	69%	0.685	82%	0.815	S	S	*	*			trans	-26	131.4	160.8	56.3	0	0	0	0	117.1
416	S	32.3	Very low	29.3	Very low	120 Å²	120	147.6 Å²	147.6	84%	0.839	81%	0.814	S	S	*	*			trans	-126.4	96.7	142.8	-74.8	0	0	0	0	107.1
417	Q	28.2	Very low	29.3	Very low	187 Å²	187	147.6 Å²	147.6	87%	0.874	81%	0.809	S	S	*	*			trans	-87.6	109.8	179.9	-136	173.4	11.7	0	0	106.8
418	I	31.5	Very low	29.1	Very low	164 Å²	164	149.8 Å²	149.8	84%	0.841	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-97.9	120.7	171.4	-62.1	171.5	0	0	0	106.6
419	S	31.7	Very low	29.5	Very low	101 Å²	101	144.5 Å²	144.5	71%	0.706	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.5	142.7	-174.7	-59.8	0	0	0	0	112.7
420	P	31.4	Very low	29.5	Very low	123 Å²	123	142.2 Å²	142.2	80%	0.799	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-73.8	129.4	176.5	27.8	-31.7	0	0	0	111.8
421	V	30.3	Very low	29.6	Very low	146 Å²	146	142.4 Å²	142.4	89%	0.885	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-77.8	123.2	173.6	175.1	0	0	0	0	109.3
422	T	32.3	Very low	29.4	Very low	120 Å²	120	140.3 Å²	140.3	74%	0.736	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-83.7	124.4	-178.1	31.9	0	0	0	0	112.7
423	S	27.5	Very low	29.6	Very low	98 Å²	98	142.6 Å²	142.6	69%	0.685	80%	0.797	S	S	*	*			trans	25.8	113.6	133.9	163.1	0	0	0	0	118.5
424	T	28.1	Very low	29.5	Very low	132 Å²	132	140 Å²	140	81%	0.81	79%	0.789	S	S	*	*			trans	-118.7	104.4	151.9	-40.4	0	0	0	0	108.8
425	Q	25.7	Very low	29.8	Very low	175 Å²	175	139.7 Å²	139.7	82%	0.818	79%	0.788	S	S	*	*			trans	-73.6	126.4	166.7	-80.7	175.1	-5.6	0	0	108.9
426	Q	32.5	Very low	29.8	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.813	79%	0.788	S	S	*	*			trans	-110.9	116.1	159	-78.6	-172	-10.1	0	0	108.6
427	H	25.3	Very low	29.8	Very low	168 Å²	168	142.9 Å²	142.9	78%	0.778	79%	0.789	S	S	*	*			trans	-94.8	110.5	-179.2	-172.6	-88	0	0	0	107.6
428	I	31.7	Very low	29.8	Very low	155 Å²	155	138.5 Å²	138.5	80%	0.795	79%	0.785	S	S	*	*			trans	-122.2	121	171.1	-54.5	174.8	0	0	0	107.6
429	S	32.5	Very low	29.8	Very low	88 Å²	88	136.2 Å²	136.2	62%	0.615	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73.9	148.6	-172.2	-57.4	0	0	0	0	113.4
430	P	31.5	Very low	29.6	Very low	134 Å²	134	140.4 Å²	140.4	87%	0.87	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-79.3	123.3	177.8	29.8	-31.7	0	0	0	111.8
431	S	28	Very low	29.6	Very low	116 Å²	116	140.1 Å²	140.1	81%	0.811	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-96.5	119.6	168.2	75	0	0	0	0	110.7
432	S	26.4	Very low	29.6	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-58	136.2	164.4	39.3	0	0	0	0	112.7
433	K	30.4	Very low	29.5	Very low	190 Å²	190	139.1 Å²	139.1	83%	0.826	78%	0.782	S	S	*	*			trans	178.4	114.8	138.5	-100.4	166.4	-177.1	-179.3	0	111.4
434	D	27.6	Very low	29.8	Very low	138 Å²	138	140.9 Å²	140.9	74%	0.738	79%	0.789	S	S	*	*			trans	33.5	117.6	136.8	-51.5	-35.4	0	0	0	118.8
435	F	32.2	Very low	29.8	Very low	199 Å²	199	140.6 Å²	140.6	87%	0.873	78%	0.782	S	S	*	*				-170.3	128.9	112.1	-106.6	-79.1	0	0	0	110.4
436	S	27.8	Very low	30.1	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	78%	0.782	S	S	*	*			trans	-64	123.4	176.8	49.4	0	0	0	0	113.2
437	H	32.8	Very low	30	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.866	78%	0.783	S	S	*	*			trans	-130	103.6	146.8	-84.7	-70.3	0	0	0	109.2
438	A	28.7	Very low	30.2	Very low	95 Å²	95	138.1 Å²	138.1	79%	0.785	78%	0.784	S	S	*	*			trans	-63.1	126.9	165.1	0	0	0	0	0	109.3
439	S	31.8	Very low	30.1	Very low	116 Å²	116	136.5 Å²	136.5	81%	0.811	78%	0.781	S	S	*	*			trans	-140	106.3	156.7	-70.8	0	0	0	0	106.7	S441	S439-S441 PolarHBondContact O-N 2.81Å
440	Q	26.9	Very low	30	Very low	189 Å²	189	137.3 Å²	137.3	88%	0.883	78%	0.783	S	S	*	*			trans	-55.3	117.6	-177.8	-73	165.9	-19.7	0	0	110.4
441	S	31.5	Very low	30	Very low	118 Å²	118	136.4 Å²	136.4	83%	0.825	78%	0.777	S	S	*	*			trans	-85.7	106	160.2	170.9	0	0	0	0	107.1	S439 D443	S439-S441 PolarHBondContact O-N 2.81Å; S441-D443 PolarHBondContact O-N 3.34Å
442	T	30.4	Very low	30	Very low	114 Å²	114	139.4 Å²	139.4	70%	0.699	78%	0.778	S	S	*	*			trans	-63.9	113.4	175	-54	0	0	0	0	109.8	V444	T442-V444 PolarHBondContact O-N 3.3Å
443	D	30.3	Very low	30.1	Very low	130 Å²	130	139.8 Å²	139.8	70%	0.695	78%	0.776	S	S	*	*			trans	-55.4	114	166.1	-118.1	-44.2	0	0	0	110.1	S441 N445	S441-D443 PolarHBondContact O-N 3.34Å; D443-N445 PolarHBondContact OD1-ND2 3.39Å
444	V	33.8	Very low	29.9	Very low	135 Å²	135	139.4 Å²	139.4	82%	0.818	78%	0.777	S	S	*	*			trans	-122.4	54.5	160.8	-78.2	0	0	0	0	109	T442	T442-V444 PolarHBondContact O-N 3.3Å
445	N	29	Very low	30.1	Very low	126 Å²	126	142 Å²	142	67%	0.674	78%	0.782	S	S	*	*			trans	-77.8	106.3	148.5	-76	-60.1	0	0	0	107.4	D443	D443-N445 PolarHBondContact OD1-ND2 3.39Å
446	N	30.8	Very low	30	Very low	150 Å²	150	138.6 Å²	138.6	80%	0.802	78%	0.78	S	S	*	*			trans	163.4	81.2	147.1	-83.1	-15.9	0	0	0	111.5
447	L	30.7	Very low	30	Very low	162 Å²	162	137.4 Å²	137.4	85%	0.848	78%	0.783	S	S	*	*			trans	-140.1	66.5	146.3	-111.2	117.9	0	0	0	108.9	V449	L447-V449 VanDerWaalsContact C-N 3.34Å; L447-V449 HydrophobicContact CD2-CG2 4.11Å; L447-V449 PolarHBondContact O-N 2.86Å; L447-V449 VanDerWaalsContact O-N 3.09Å
448	L	29.8	Very low	29.8	Very low	153 Å²	153	137.2 Å²	137.2	80%	0.801	78%	0.782	S	S	*	*			trans	-69.4	92.5	162.4	-166.6	77.6	0	0	0	107.2	T450	L448-T450 PolarHBondContact O-N 3.12Å; L448-T450 VanDerWaalsContact O-N 3.08Å
449	V	29	Very low	29.7	Very low	121 Å²	121	140.9 Å²	140.9	73%	0.733	78%	0.783	S	S	*	*			trans	-77.6	92.1	172.2	-179.4	0	0	0	0	107.7	L447	L447-V449 VanDerWaalsContact C-N 3.34Å; L447-V449 HydrophobicContact CD2-CG2 4.11Å; L447-V449 PolarHBondContact O-N 2.86Å; L447-V449 VanDerWaalsContact O-N 3.09Å
450	T	30.2	Very low	29.7	Very low	105 Å²	105	145.4 Å²	145.4	64%	0.644	79%	0.788	S	S	*	*			trans	-73.1	129.5	172	-35.1	0	0	0	0	109.3	L448 H452	L448-T450 PolarHBondContact O-N 3.12Å; L448-T450 VanDerWaalsContact O-N 3.08Å; T450-H452 PolarHBondContact O-N 3.17Å; T450-H452 VanDerWaalsContact O-N 3.1Å
451	P	31.5	Very low	29.6	Very low	115 Å²	115	144.7 Å²	144.7	75%	0.747	79%	0.785	S	S	*	*			trans	-69.4	106.7	178.5	26.4	-32.6	0	0	0	110	T453	P451-T453 PolarHBondContact O-N 3.3Å
452	H	29.2	Very low	29.4	Very low	180 Å²	180	147.6 Å²	147.6	83%	0.833	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77.5	119.8	178.5	-147.4	40	0	0	0	110.5	T450	T450-H452 PolarHBondContact O-N 3.17Å; T450-H452 VanDerWaalsContact O-N 3.1Å
453	T	28.1	Very low	29.2	Very low	116 Å²	116	147.8 Å²	147.8	71%	0.712	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-61.4	141.5	-178.2	-46.8	0	0	0	0	112.2	P451	P451-T453 PolarHBondContact O-N 3.3Å
454	Q	26.6	Very low	29.1	Very low	182 Å²	182	146.9 Å²	146.9	85%	0.85	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-52	128.6	175.3	-72.8	166.5	-47	0	0	113
455	F	30.3	Very low	28.9	Very low	192 Å²	192	145.3 Å²	145.3	84%	0.842	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-102.6	119.9	154.4	-84	-84.2	0	0	0	109.4
456	P	29.9	Very low	28.8	Very low	127 Å²	127	148 Å²	148	83%	0.825	79%	0.789	S	S	*	*			trans	-86.1	106.3	171.4	30.7	-27.8	0	0	0	110.1
457	G	28.1	Very low	28.6	Very low	72 Å²	72	150 Å²	150	74%	0.742	79%	0.793	S	S	*	*			trans	-125.5	94	-178.9	0	0	0	0	0	113.1
458	Q	29.8	Very low	28.6	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	78%	0.781	S	S	*	*			trans	32.9	115.3	148.4	-58.8	-163.9	1.8	0	0	122.1
459	Q	26	Very low	28.6	Very low	171 Å²	171	144.2 Å²	144.2	80%	0.799	78%	0.779	S	S	*	*				27.2	113.5	127.2	-65.2	-175.6	-11.8	0	0	119.3
460	K	31	Very low	28.8	Very low	212 Å²	212	147 Å²	147	92%	0.922	78%	0.783	S	S	*	*			trans	-129.9	102.3	135.3	-80.2	-169.2	175.8	-178.4	0	109.4	Q462	K460-Q462 PolarHBondContact O-N 3.13Å
461	Q	24.9	Very low	28.8	Very low	173 Å²	173	150.5 Å²	150.5	81%	0.808	79%	0.79	S	S	*	*			trans	-62.2	122	157.7	-84.7	172.2	-14.9	0	0	107.8
462	Q	28.2	Very low	28.9	Very low	180 Å²	180	151 Å²	151	84%	0.841	79%	0.793	S	S	*	*			trans	-117	90	160.4	-156.9	169.4	7.9	0	0	107	K460 V464	K460-Q462 PolarHBondContact O-N 3.13Å; Q462-V464 HydrophobicContact CG-CG2 4.29Å; Q462-V464 PolarHBondContact O-N 2.85Å
463	V	26	Very low	29	Very low	118 Å²	118	150.4 Å²	150.4	72%	0.715	79%	0.794	S	S	*	*			trans	-73.2	108.5	167.4	174.7	0	0	0	0	106.2
464	V	29.2	Very low	29.1	Very low	111 Å²	111	153.6 Å²	153.6	67%	0.673	80%	0.801	S	S	*	*			trans	-114.9	104.8	162.2	177	0	0	0	0	106.8	Q462 Q466	Q462-V464 HydrophobicContact CG-CG2 4.29Å; Q462-V464 PolarHBondContact O-N 2.85Å; V464-Q466 PolarHBondContact O-N 3.46Å
465	S	28.5	Very low	29.2	Very low	102 Å²	102	154 Å²	154	71%	0.713	80%	0.803	S	S	*	*			trans	-64.4	117.7	166.3	-54.7	0	0	0	0	108.6
466	Q	27.7	Very low	29.2	Very low	183 Å²	183	148.8 Å²	148.8	86%	0.855	80%	0.795	S	S	*	*			trans	-115.8	94.4	159.2	-105.6	-175.4	-12.1	0	0	108.8	V464	V464-Q466 PolarHBondContact O-N 3.46Å
467	E	25.4	Very low	29.4	Very low	192 Å²	192	148.3 Å²	148.3	90%	0.897	80%	0.795	S	S	*	*			trans	-72.5	110.9	163.8	-172.2	172.6	179	0	0	107.7
468	S	31.3	Very low	29.9	Very low	83 Å²	83	153.2 Å²	153.2	58%	0.58	80%	0.796	S	S	*	*			trans	-139.9	85.5	166.1	69	0	0	0	0	110.3	H470	S468-H470 PolarHBondContact O-N 3.31Å
469	S	29.4	Very low	29.8	Very low	110 Å²	110	150.5 Å²	150.5	77%	0.769	79%	0.792	S	S	*	*			trans	2.2	88.6	142.8	178	0	0	0	0	116
470	H	32.7	Very low	30.1	Very low	178 Å²	178	152.5 Å²	152.5	82%	0.824	79%	0.794	S	S	*	*			trans	-96.3	101.5	161.6	-76.9	-52.3	0	0	0	109.7	S468	S468-H470 PolarHBondContact O-N 3.31Å
471	K	30.5	Very low	30	Very low	179 Å²	179	147.8 Å²	147.8	78%	0.778	78%	0.783	S	S	*	*			trans	-50.9	140.4	166.4	-89.2	177.4	172.5	177.8	0	110.4	I473	K471-I473 PolarHBondContact O-N 3.02Å
472	P	33.8	Very low	30.5	Very low	126 Å²	126	147.1 Å²	147.1	82%	0.818	79%	0.785	S	S	*	*			trans	-66.8	113.2	178.8	26.2	-32.3	0	0	0	110.3	Q474	P472-Q474 PolarHBondContact O-N 2.99Å
473	I	32.1	Very low	30.7	Very low	167 Å²	167	144 Å²	144	86%	0.856	78%	0.778	S	S	*	*			trans	-76.7	119.4	171.7	-64.8	171.8	0	0	0	107.5	K471	K471-I473 PolarHBondContact O-N 3.02Å
474	Q	30.6	Very low	30.9	Very low	183 Å²	183	143.8 Å²	143.8	86%	0.855	78%	0.779	S	S	*	*			trans	-52.3	133.1	-178.8	-69.2	171	-5.4	0	0	111.9	P472 A476	P472-Q474 PolarHBondContact O-N 2.99Å; Q474-A476 PolarHBondContact O-N 3.02Å
475	Q	27.9	Very low	31	Very low	192 Å²	192	143.3 Å²	143.3	90%	0.897	78%	0.781	S	S	*	*			trans	-61	97.5	173.3	-76.6	169.6	-53.8	0	0	110	S477	Q475-S477 PolarHBondContact O-N 2.97Å
476	A	31	Very low	31.3	Very low	81 Å²	81	143.9 Å²	143.9	67%	0.669	78%	0.782	S	S	*	*			trans	-75	109.3	162	0	0	0	0	0	108.1	Q474 K478	Q474-A476 PolarHBondContact O-N 3.02Å; A476-K478 VanDerWaalsContact C-N 3.29Å; A476-K478 PolarHBondContact O-N 3.03Å
477	S	34.3	Very low	31.5	Very low	118 Å²	118	142.4 Å²	142.4	83%	0.825	78%	0.779	S	S	*	*			trans	-56.1	86	172	-41	0	0	0	0	110.2	Q475 T479	Q475-S477 PolarHBondContact O-N 2.97Å; S477-T479 PolarHBondContact O-N 2.88Å; S477-T479 VanDerWaalsContact O-N 3.16Å
478	K	36.7	Very low	32	Very low	175 Å²	175	138.6 Å²	138.6	76%	0.761	77%	0.771	S	S	*	*			trans	-76.7	104.8	173.3	-73.9	-176.6	-179	179.2	0	108	A476 Y480	A476-K478 VanDerWaalsContact C-N 3.29Å; A476-K478 PolarHBondContact O-N 3.03Å; K478-Y480 WeakPolarHBondContact O-CD2 3.45Å; K478-Y480 PolarHBondContact O-N 3.4Å
479	T	28.5	Very low	32	Very low	127 Å²	127	140.2 Å²	140.2	78%	0.779	78%	0.779	S	S	*	*			trans	-47.5	109.8	164.3	-55.1	0	0	0	0	108.6	S477 T481	S477-T479 PolarHBondContact O-N 2.88Å; S477-T479 VanDerWaalsContact O-N 3.16Å; T479-T481 VanDerWaalsContact C-N 3.26Å; T479-T481 PolarHBondContact O-N 3.19Å
480	Y	31.8	Very low	31.8	Very low	212 Å²	212	140 Å²	140	83%	0.831	78%	0.778	S	S	*	*			trans	-70.2	88.1	171.9	-72.3	-89.1	0	0	0	107.8	K478 N482	K478-Y480 WeakPolarHBondContact O-CD2 3.45Å; K478-Y480 PolarHBondContact O-N 3.4Å; Y480-N482 PolarHBondContact O-N 2.88Å
481	T	30.6	Very low	31.5	Very low	114 Å²	114	137.1 Å²	137.1	70%	0.699	77%	0.773	S	S	*	*			trans	-63	119.4	156.3	-35	0	0	0	0	105.4	T479 V483	T479-T481 VanDerWaalsContact C-N 3.26Å; T479-T481 PolarHBondContact O-N 3.19Å; T481-V483 PolarHBondContact O-N 3.16Å
482	N	34.8	Very low	31.3	Very low	159 Å²	159	134.7 Å²	134.7	85%	0.85	77%	0.768	S	S	*	*			trans	-59.9	70.2	175.4	-77.3	-50	0	0	0	110.4	Y480 P484	Y480-N482 PolarHBondContact O-N 2.88Å; N482-P484 WeakPolarHBondContact O-CD 3.03Å
483	V	31.1	Very low	30.8	Very low	113 Å²	113	134.5 Å²	134.5	69%	0.685	76%	0.764	S	S	*	*			trans	-83.8	115.4	164.7	-173.5	0	0	0	0	104.5	T481 S485	T481-V483 PolarHBondContact O-N 3.16Å; V483-S485 PolarHBondContact O-N 3.17Å
484	P	30.1	Very low	30.6	Very low	115 Å²	115	135 Å²	135	75%	0.747	76%	0.761	S	S	*	*			trans	-53.5	113.6	179.4	19.8	-30	0	0	0	108	N482 P486	N482-P484 WeakPolarHBondContact O-CD 3.03Å; P484-P486 WeakPolarHBondContact O-CD 3.5Å; P484-P486 VanDerWaalsContact O-N 3.08Å
485	S	31.9	Very low	30.5	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	76%	0.755	S	S	*	*			trans	-55.4	118.1	176.6	-173.1	0	0	0	0	106.8	V483 L487	V483-S485 PolarHBondContact O-N 3.17Å; S485-L487 PolarHBondContact O-N 2.91Å
486	P	35	Very low	30.6	Very low	113 Å²	113	131.3 Å²	131.3	73%	0.734	75%	0.752	S	S	*	*			trans	-58.3	115.8	176.6	21.8	-29.3	0	0	0	106.6	P484	P484-P486 WeakPolarHBondContact O-CD 3.5Å; P484-P486 VanDerWaalsContact O-N 3.08Å
487	L	32.2	Very low	30.7	Very low	153 Å²	153	134 Å²	134	80%	0.801	75%	0.754	S	S	*	*			trans	-49.5	135.9	177.9	-86.9	88.1	0	0	0	108.2	S485	S485-L487 PolarHBondContact O-N 2.91Å
488	P	34.9	Very low	30.6	Very low	112 Å²	112	131 Å²	131	73%	0.727	74%	0.741	S	S	*	*			trans	-53.6	132.3	179.4	22	-31.9	0	0	0	108.1	S490	P488-S490 PolarHBondContact O-N 3.17Å
489	P	31.4	Very low	30.7	Very low	116 Å²	116	130.2 Å²	130.2	75%	0.753	75%	0.746	S	S	*	*			trans	-53.9	115.5	179.2	21.2	-31.3	0	0	0	107.5	V491	P489-V491 VanDerWaalsContact C-N 3.26Å; P489-V491 PolarHBondContact O-N 3.14Å
490	S	26.4	Very low	31.1	Very low	107 Å²	107	132 Å²	132	75%	0.748	74%	0.739	S	S	*	*			trans	-64.9	93.8	174.2	34.4	0	0	0	0	107.1	P488 L492	P488-S490 PolarHBondContact O-N 3.17Å; S490-L492 VanDerWaalsContact C-N 3.29Å; S490-L492 PolarHBondContact O-N 3.21Å
491	V	25.8	Very low	31.3	Very low	117 Å²	117	126.1 Å²	126.1	71%	0.709	72%	0.722	S	S	*	*			trans	-66.1	96.7	172.9	-175.8	0	0	0	0	106	P489 T493	P489-V491 VanDerWaalsContact C-N 3.26Å; P489-V491 PolarHBondContact O-N 3.14Å; V491-T493 VanDerWaalsContact C-N 3.26Å; V491-T493 PolarHBondContact O-N 2.73Å
492	L	26.3	Very low	31.8	Very low	128 Å²	128	128 Å²	128	67%	0.67	72%	0.717	S	S	*	*			trans	-62.5	91.4	169	-92.7	148.1	0	0	0	107.7	S490 F494	S490-L492 VanDerWaalsContact C-N 3.29Å; S490-L492 PolarHBondContact O-N 3.21Å; L492-F494 HydrophobicContact CB-CE2 4.21Å; L492-F494 HydrophobicContact CB-CZ 4.17Å; L492-F494 VanDerWaalsContact O-CD2 3.29Å; L492-F494 WeakPolarHBondContact O-CD2 3.38Å; L492-F494 WeakPolarHBondContact O-CE2 3.28Å; L492-F494 PolarHBondContact O-N 3.34Å; L492-F494 VanDerWaalsContact O-N 3.09Å
493	T	24.3	Very low	32.1	Very low	122 Å²	122	125.1 Å²	125.1	75%	0.748	70%	0.698	S	S	*	*			trans	-71.4	100.4	170.3	13.5	0	0	0	0	108.3	V491 S495	V491-T493 VanDerWaalsContact C-N 3.26Å; V491-T493 PolarHBondContact O-N 2.73Å; T493-S495 PolarHBondContact O-N 3.45Å; T493-S495 VanDerWaalsContact O-N 3.07Å
494	F	28.1	Very low	32.1	Very low	177 Å²	177	127.5 Å²	127.5	78%	0.776	70%	0.695	S	S	*	*			trans	-68.7	103.5	168	-58.5	-81.4	0	0	0	107.8	L492 K496	L492-F494 HydrophobicContact CB-CE2 4.21Å; L492-F494 HydrophobicContact CB-CZ 4.17Å; L492-F494 VanDerWaalsContact O-CD2 3.29Å; L492-F494 WeakPolarHBondContact O-CD2 3.38Å; L492-F494 WeakPolarHBondContact O-CE2 3.28Å; L492-F494 PolarHBondContact O-N 3.34Å; L492-F494 VanDerWaalsContact O-N 3.09Å; F494-K496 PolarHBondContact O-N 3.08Å
495	S	27.4	Very low	32.4	Very low	106 Å²	106	126.9 Å²	126.9	74%	0.741	69%	0.686	S	S	*	*			trans	-63.8	121.3	165.5	-60.6	0	0	0	0	107.2	T493 I497	T493-S495 PolarHBondContact O-N 3.45Å; T493-S495 VanDerWaalsContact O-N 3.07Å; S495-I497 PolarHBondContact O-N 3.35Å
496	K	29.2	Very low	32.6	Very low	192 Å²	192	127.3 Å²	127.3	84%	0.835	68%	0.679	S	S	*	*			trans	-44.2	108.5	177.9	-162	178.1	-176.7	-173.7	0	108.5	F494 G498	F494-K496 PolarHBondContact O-N 3.08Å; K496-G498 PolarHBondContact O-N 3.21Å; K496-G498 VanDerWaalsContact O-N 3.08Å
497	I	35.1	Very low	32.6	Very low	137 Å²	137	129.8 Å²	129.8	70%	0.703	68%	0.679	S	S	*	*			trans	-60.4	114.2	171.2	-74.9	156.9	0	0	0	104.4	S495 Y500	S495-I497 PolarHBondContact O-N 3.35Å; I497-Y500 HydrophobicContact CG2-CD2 4.02Å
498	G	30.2	Very low	32.5	Very low	54 Å²	54	128.8 Å²	128.8	56%	0.557	67%	0.67	S	S	*	*			trans	-52.8	142.3	177.8	0	0	0	0	0	109.6	K496 Y500	K496-G498 PolarHBondContact O-N 3.21Å; K496-G498 VanDerWaalsContact O-N 3.08Å; G498-Y500 PolarHBondContact O-N 3.15Å
499	D	39.8	Very low	32.8	Very low	160 Å²	160	132.8 Å²	132.8	86%	0.856	68%	0.679	S	S	*	*			trans	-45.5	100.7	-175.9	-61.5	-42.3	0	0	0	109.7	D501	D499-D501 PolarHBondContact O-N 3.01Å
500	Y	36	Very low	33.2	Very low	163 Å²	163	131.6 Å²	131.6	64%	0.639	67%	0.673	S	S	*	*			trans	-81.1	110.1	-176.3	-124.9	-93.1	0	0	0	106.1	I497 G498 W502	I497-Y500 HydrophobicContact CG2-CD2 4.02Å; G498-Y500 PolarHBondContact O-N 3.15Å; Y500-W502 VanDerWaalsContact C-N 3.31Å; Y500-W502 PolarHBondContact O-N 2.69Å
501	D	36.7	Very low	33.6	Very low	90 Å²	90	132.9 Å²	132.9	48%	0.481	66%	0.662	S	S	.	*			trans	-69.6	93.8	168.6	-173.5	2.4	0	0	0	108.5	D499 H503 Y504	D499-D501 PolarHBondContact O-N 3.01Å; D501-H503 PolarHBondContact O-N 3.41Å; D501-H503 WeakPolarHBondContact OD1-CB 3.36Å; D501-H503 PolarHBondContact OD1-N 3.04Å; D501-H503 VanDerWaalsContact OD1-N 3.12Å; D501-Y504 WeakPolarHBondContact O-CB 3.41Å; D501-Y504 PolarHBondContact O-N 3.23Å
502	W	42.1	Very low	34.1	Very low	153 Å²	153	131.6 Å²	131.6	58%	0.58	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-71.9	-18.4	179.4	54.3	-88.4	0	0	0	112	Y500 Y504	Y500-W502 VanDerWaalsContact C-N 3.31Å; Y500-W502 PolarHBondContact O-N 2.69Å; W502-Y504 PolarHBondContact O-N 2.82Å
503	H	39.4	Very low	34.7	Very low	98 Å²	98	136.6 Å²	136.6	45%	0.454	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-70.5	-16.8	174.8	-72.3	82.2	0	0	0	112.7	D501 N505 I506	D501-H503 PolarHBondContact O-N 3.41Å; D501-H503 WeakPolarHBondContact OD1-CB 3.36Å; D501-H503 PolarHBondContact OD1-N 3.04Å; D501-H503 VanDerWaalsContact OD1-N 3.12Å; H503-N505 PolarHBondContact O-N 3.27Å; H503-I506 PolarHBondContact O-N 2.82Å
504	Y	31.9	Very low	35.3	Very low	163 Å²	163	140.4 Å²	140.4	64%	0.639	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-62.2	-12.1	178.7	-133.3	-82.3	0	0	0	113.7	D501 W502	D501-Y504 WeakPolarHBondContact O-CB 3.41Å; D501-Y504 PolarHBondContact O-N 3.23Å; W502-Y504 PolarHBondContact O-N 2.82Å
505	N	35.4	Very low	35.5	Very low	103 Å²	103	138.7 Å²	138.7	55%	0.551	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-90.8	-13.1	-177.2	-74	-12.6	0	0	0	115.2	H503 W515	H503-N505 PolarHBondContact O-N 3.27Å; N505-W515 VanDerWaalsContact OD1-CZ2 3.28Å; N505-W515 WeakPolarHBondContact OD1-CZ2 3.32Å
506	I	37.8	Very low	36.1	Very low	109 Å²	109	139.2 Å²	139.2	56%	0.559	65%	0.649	S	S	*	*	S	Bend	trans	-84.3	-26.1	-171	-58.2	177.2	0	0	0	112.1	H503	H503-I506 PolarHBondContact O-N 2.82Å
507	F	34.8	Very low	36.6	Very low	165 Å²	165	137.1 Å²	137.1	72%	0.724	65%	0.646	S	S	*	*	S	Bend	trans	-116.2	6.7	-158.8	-71.2	-69.4	0	0	0	120
508	H	29.1	Very low	36.9	Very low	133 Å²	133	138.8 Å²	138.8	62%	0.616	65%	0.648	S	S	*	*			trans	-142.7	102.1	176.1	-80.3	-65.2	0	0	0	115.9	S510	H508-S510 PolarHBondContact O-N 2.89Å
509	Q	41.7	Very low	37.4	Very low	195 Å²	195	138.9 Å²	138.9	91%	0.911	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-17.2	164.9	-69.1	-177	0.2	0	0	113.4	R511 P512	Q509-R511 PolarHBondContact O-N 2.78Å; Q509-P512 WeakPolarHBondContact O-CD 3.43Å
510	S	40.6	Very low	37.3	Very low	92 Å²	92	136.9 Å²	136.9	64%	0.643	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	3.6	-172.9	60.9	0	0	0	0	115.7	H508	H508-S510 PolarHBondContact O-N 2.89Å
511	R	34.6	Very low	37.8	Very low	133 Å²	133	132.4 Å²	132.4	50%	0.502	61%	0.61	S	S	.	*			trans	-118.5	42.1	179.8	-62.4	-169	-176.4	-163.1	1.5	117.7	Q509 R513	Q509-R511 PolarHBondContact O-N 2.78Å; R511-R513 PolarHBondContact O-N 2.8Å; R511-R513 VanDerWaalsContact O-N 3.16Å
512	P	35	Very low	38.4	Very low	90 Å²	90	131.7 Å²	131.7	58%	0.584	61%	0.609	S	S	*	*	H	α-helix	trans	-61.2	-27.5	177.3	-18	30.1	0	0	0	114.2	Q509	Q509-P512 WeakPolarHBondContact O-CD 3.43Å
513	R	39.1	Very low	38.7	Very low	233 Å²	233	128.9 Å²	128.9	88%	0.879	60%	0.601	S	S	*	*	H	α-helix	trans	-76.9	-29	-170.6	-80.5	-162.5	-179.7	-156.6	2.7	115.4	R511 W515	R511-R513 PolarHBondContact O-N 2.8Å; R511-R513 VanDerWaalsContact O-N 3.16Å; R513-W515 VanDerWaalsContact C-N 3.31Å; R513-W515 PolarHBondContact O-N 2.79Å
514	R	37.5	Very low	39.2	Very low	203 Å²	203	130.3 Å²	130.3	77%	0.766	61%	0.606	S	S	*	*	H	α-helix	trans	-77.5	-18.1	179.7	-88.3	-173.2	169.6	-176.9	-1.2	113.2
515	W	32.6	Very low	40.5	Very low	141 Å²	141	129.3 Å²	129.3	53%	0.534	61%	0.605	S	S	.	*	H	α-helix	trans	-69.7	-32.4	179.5	-105.1	-32.7	0	0	0	113.7	N505 R513 L517 N519	N505-W515 VanDerWaalsContact OD1-CZ2 3.28Å; N505-W515 WeakPolarHBondContact OD1-CZ2 3.32Å; R513-W515 VanDerWaalsContact C-N 3.31Å; R513-W515 PolarHBondContact O-N 2.79Å; W515-L517 VanDerWaalsContact C-N 3.3Å; W515-L517 PolarHBondContact O-N 2.83Å; W515-N519 PolarHBondContact O-N 2.98Å
516	N	40.4	Very low	41.3	Very low	116 Å²	116	127.5 Å²	127.5	62%	0.62	60%	0.595	S	S	*	*	H	α-helix	trans	-67.7	-30.5	-171.5	-122.1	-7.4	0	0	0	112.9
517	L	39.2	Very low	42.1	Very low	148 Å²	148	124.2 Å²	124.2	78%	0.775	58%	0.578	S	S	*	*	H	α-helix	trans	-81.6	-47.8	178.7	-96.6	85	0	0	0	113.7	W515 Y520	W515-L517 VanDerWaalsContact C-N 3.3Å; W515-L517 PolarHBondContact O-N 2.83Å; L517-Y520 PolarHBondContact O-N 2.89Å
518	K	40.8	Very low	43.3	Very low	172 Å²	172	120.7 Å²	120.7	75%	0.748	56%	0.564	S	S	*	*	H	α-helix	trans	-70.5	-37.3	-173.7	-99.1	-174.8	175.1	-174.8	0	112.4	Y520 S521	K518-Y520 VanDerWaalsContact C-N 3.32Å; K518-Y520 PolarHBondContact O-N 2.83Å; K518-S521 PolarHBondContact O-OG 2.82Å
519	N	41.3	Very low	44.4	Very low	57 Å²	57	119.8 Å²	119.8	31%	0.305	56%	0.56	S	S	.	*	H	α-helix	trans	-73.7	-20.7	177	-87.8	-34.3	0	0	0	113.7	W515 S521 V522 K523	W515-N519 PolarHBondContact O-N 2.98Å; N519-S521 PolarHBondContact O-N 2.92Å; N519-V522 PolarHBondContact O-N 3.23Å; N519-K523 WeakPolarHBondContact O-CB 3.41Å; N519-K523 WeakPolarHBondContact O-CG 3.35Å; N519-K523 PolarHBondContact O-N 3.36Å
520	Y	36.5	Very low	44.7	Very low	117 Å²	117	112.9 Å²	112.9	46%	0.459	53%	0.529	S	S	.	.	H	α-helix	trans	-61.9	-36.2	177.4	-134.4	-92.9	0	0	0	111.6	D126 L517 K518 K524	D126-Y520 PolarHBondContact OD2-OH 3.15Å; L517-Y520 PolarHBondContact O-N 2.89Å; K518-Y520 VanDerWaalsContact C-N 3.32Å; K518-Y520 PolarHBondContact O-N 2.83Å; Y520-K524 WeakPolarHBondContact O-CB 3.31Å; Y520-K524 PolarHBondContact O-N 2.87Å
521	S	47.1	Very low	45	Very low	69 Å²	69	113 Å²	113	48%	0.483	52%	0.519	S	S	.	.	H	α-helix	trans	-65.8	-41	177.2	71.5	0	0	0	0	112.8	K518 N519 K525	K518-S521 PolarHBondContact O-OG 2.82Å; N519-S521 PolarHBondContact O-N 2.92Å; S521-K525 WeakPolarHBondContact O-CB 3.49Å; S521-K525 WeakPolarHBondContact O-CG 3.4Å; S521-K525 PolarHBondContact O-N 3.05Å
522	V	49.1	Very low	45.8	Very low	76 Å²	76	115.2 Å²	115.2	46%	0.461	53%	0.528	S	S	.	.	H	α-helix	trans	-73.4	-44.3	178.9	-178.2	0	0	0	0	110.2	N519 K524 K525 L526	N519-V522 PolarHBondContact O-N 3.23Å; V522-K524 PolarHBondContact O-N 2.97Å; V522-K525 PolarHBondContact O-N 2.81Å; V522-L526 VanDerWaalsContact O-CB 3.23Å; V522-L526 WeakPolarHBondContact O-CB 3.12Å; V522-L526 PolarHBondContact O-N 3.22Å
523	K	47.9	Very low	46.3	Very low	93 Å²	93	116.2 Å²	116.2	40%	0.404	53%	0.532	S	S	.	.	H	α-helix	trans	-58.7	-47.1	175	-76.5	-175.2	175.9	-171.8	0	111.5	N519 L526 L527	N519-K523 WeakPolarHBondContact O-CB 3.41Å; N519-K523 WeakPolarHBondContact O-CG 3.35Å; N519-K523 PolarHBondContact O-N 3.36Å; K523-L526 PolarHBondContact O-N 3.23Å; K523-L527 WeakPolarHBondContact O-CB 3.43Å; K523-L527 PolarHBondContact O-N 2.69Å
524	K	51.4	Low	46.7	Very low	129 Å²	129	109.2 Å²	109.2	56%	0.561	51%	0.511	S	S	*	.	H	α-helix	trans	-65.3	-42.9	178.5	-168.5	175.8	-178.1	178.6	0	112	Y520 V522 L526 L527 E528	Y520-K524 WeakPolarHBondContact O-CB 3.31Å; Y520-K524 PolarHBondContact O-N 2.87Å; V522-K524 PolarHBondContact O-N 2.97Å; K524-L526 VanDerWaalsContact C-N 3.33Å; K524-L526 PolarHBondContact O-N 3.09Å; K524-L527 PolarHBondContact O-N 2.99Å; K524-E528 WeakPolarHBondContact O-CB 3.41Å; K524-E528 PolarHBondContact O-N 2.78Å
525	K	58.6	Low	47.2	Very low	141 Å²	141	104.8 Å²	104.8	61%	0.613	51%	0.511	S	S	*	.	H	α-helix	trans	-62.6	-40	174	-81.8	-175.9	176.2	-177.3	0	112.2	S521 V522 Q529	S521-K525 WeakPolarHBondContact O-CB 3.49Å; S521-K525 WeakPolarHBondContact O-CG 3.4Å; S521-K525 PolarHBondContact O-N 3.05Å; V522-K525 PolarHBondContact O-N 2.81Å; K525-Q529 WeakPolarHBondContact O-CB 3.34Å; K525-Q529 VanDerWaalsContact O-CG 3.24Å; K525-Q529 WeakPolarHBondContact O-CG 3.18Å; K525-Q529 PolarHBondContact O-N 3.22Å
526	L	53	Low	47.5	Very low	65 Å²	65	108.6 Å²	108.6	34%	0.34	54%	0.535	S	S	.	.	H	α-helix	trans	-65	-44.5	176.5	-171.8	75.1	0	0	0	110.7	F2 V522 K523 K524 Q529 I530	F2-L526 HydrophobicContact CZ-CD1 3.94Å; V522-L526 VanDerWaalsContact O-CB 3.23Å; V522-L526 WeakPolarHBondContact O-CB 3.12Å; V522-L526 PolarHBondContact O-N 3.22Å; K523-L526 PolarHBondContact O-N 3.23Å; K524-L526 VanDerWaalsContact C-N 3.33Å; K524-L526 PolarHBondContact O-N 3.09Å; L526-Q529 PolarHBondContact O-N 2.75Å; L526-I530 HydrophobicContact CG-CD1 4.04Å; L526-I530 VanDerWaalsContact O-CG1 3.26Å; L526-I530 WeakPolarHBondContact O-CG1 3.48Å; L526-I530 PolarHBondContact O-N 3.43Å
527	L	54.1	Low	47.8	Very low	40 Å²	40	108.3 Å²	108.3	21%	0.209	53%	0.53	C	S	.	.	H	α-helix	trans	-63.7	-46.5	178.3	-157.3	85.7	0	0	0	111.5	L130 K523 K524 Q529 I530 Q531	L130-L527 HydrophobicContact CD1-CD1 3.93Å; K523-L527 WeakPolarHBondContact O-CB 3.43Å; K523-L527 PolarHBondContact O-N 2.69Å; K524-L527 PolarHBondContact O-N 2.99Å; L527-Q529 VanDerWaalsContact C-N 3.31Å; L527-Q529 PolarHBondContact O-N 2.8Å; L527-I530 PolarHBondContact O-N 2.74Å; L527-Q531 PolarHBondContact O-N 3.35Å
528	E	58.6	Low	48.3	Very low	91 Å²	91	106.2 Å²	106.2	43%	0.425	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-40.4	174.4	-89.7	-175.6	163.6	0	0	112	K524 Q531 R532	K524-E528 WeakPolarHBondContact O-CB 3.41Å; K524-E528 PolarHBondContact O-N 2.78Å; E528-Q531 PolarHBondContact O-N 3.11Å; E528-R532 WeakPolarHBondContact O-CG 3.07Å; E528-R532 PolarHBondContact O-N 3.28Å
529	Q	53.9	Low	48.7	Very low	114 Å²	114	102.5 Å²	102.5	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-41	177.7	-78.9	179.6	-10.1	0	0	111.8	K525 L526 L527 R532 V533	K525-Q529 WeakPolarHBondContact O-CB 3.34Å; K525-Q529 VanDerWaalsContact O-CG 3.24Å; K525-Q529 WeakPolarHBondContact O-CG 3.18Å; K525-Q529 PolarHBondContact O-N 3.22Å; L526-Q529 PolarHBondContact O-N 2.75Å; L527-Q529 VanDerWaalsContact C-N 3.31Å; L527-Q529 PolarHBondContact O-N 2.8Å; Q529-R532 PolarHBondContact O-N 2.79Å; Q529-V533 WeakPolarHBondContact O-CG2 3.14Å; Q529-V533 PolarHBondContact O-N 3.06Å; Q529-V533 VanDerWaalsContact O-N 3.13Å
530	I	48	Very low	49.1	Very low	50 Å²	50	105.2 Å²	105.2	26%	0.256	52%	0.517	S	S	.	.	H	α-helix	trans	-66.1	-44	176.2	-68.3	165.5	0	0	0	110.6	I133 L526 L527 R532 V533 L534	I133-I530 HydrophobicContact CD1-CG2 4.2Å; I133-I530 HydrophobicContact CG2-CG2 3.89Å; L526-I530 HydrophobicContact CG-CD1 4.04Å; L526-I530 VanDerWaalsContact O-CG1 3.26Å; L526-I530 WeakPolarHBondContact O-CG1 3.48Å; L526-I530 PolarHBondContact O-N 3.43Å; L527-I530 PolarHBondContact O-N 2.74Å; I530-R532 PolarHBondContact O-N 2.8Å; I530-V533 PolarHBondContact O-N 3.03Å; I530-L534 HydrophobicContact CG2-CD1 3.72Å; I530-L534 HydrophobicContact CG2-CG 4.41Å; I530-L534 WeakPolarHBondContact O-CG 3.25Å; I530-L534 PolarHBondContact O-N 3.45Å
531	Q	47.2	Very low	49.9	Very low	94 Å²	94	104.4 Å²	104.4	44%	0.439	52%	0.52	S	S	.	.	H	α-helix	trans	-59.3	-44.2	174.9	-87.2	-179	-16.4	0	0	111.8	L527 E528 V533 L534 S535	L527-Q531 PolarHBondContact O-N 3.35Å; E528-Q531 PolarHBondContact O-N 3.11Å; Q531-V533 VanDerWaalsContact C-N 3.27Å; Q531-V533 PolarHBondContact O-N 3.15Å; Q531-L534 PolarHBondContact O-N 3.46Å; Q531-L534 VanDerWaalsContact O-N 3.11Å; Q531-S535 PolarHBondContact O-N 3.06Å; Q531-S535 PolarHBondContact O-OG 3.29Å
532	R	50.3	Low	50.1	Low	181 Å²	181	106.8 Å²	106.8	68%	0.683	52%	0.523	S	S	*	.	H	α-helix	trans	-61.2	-34.4	176.1	-77.4	-176.8	-169.4	-170.6	3.9	113.4	E528 Q529 I530	E528-R532 WeakPolarHBondContact O-CG 3.07Å; E528-R532 PolarHBondContact O-N 3.28Å; Q529-R532 PolarHBondContact O-N 2.79Å; I530-R532 PolarHBondContact O-N 2.8Å
533	V	45.5	Very low	50.2	Low	111 Å²	111	109 Å²	109	67%	0.673	53%	0.527	S	S	*	.	H	α-helix	trans	-75.1	-29.5	177	173.6	0	0	0	0	111.5	Q529 I530 Q531	Q529-V533 WeakPolarHBondContact O-CG2 3.14Å; Q529-V533 PolarHBondContact O-N 3.06Å; Q529-V533 VanDerWaalsContact O-N 3.13Å; I530-V533 PolarHBondContact O-N 3.03Å; Q531-V533 VanDerWaalsContact C-N 3.27Å; Q531-V533 PolarHBondContact O-N 3.15Å
534	L	46.9	Very low	50.3	Low	85 Å²	85	110.2 Å²	110.2	45%	0.445	54%	0.537	S	S	.	.	H	α-helix	trans	-87	-24.6	179.7	-73	168.8	0	0	0	114.2	I133 I530 Q531 H536	I133-L534 HydrophobicContact CG1-CD1 4.31Å; I133-L534 HydrophobicContact CG2-CD1 4.11Å; I530-L534 HydrophobicContact CG2-CD1 3.72Å; I530-L534 HydrophobicContact CG2-CG 4.41Å; I530-L534 WeakPolarHBondContact O-CG 3.25Å; I530-L534 PolarHBondContact O-N 3.45Å; Q531-L534 PolarHBondContact O-N 3.46Å; Q531-L534 VanDerWaalsContact O-N 3.11Å; L534-H536 PolarHBondContact O-N 3.42Å
535	S	49.3	Very low	50.2	Low	110 Å²	110	108.7 Å²	108.7	77%	0.769	54%	0.535	S	S	*	.			trans	-76.6	-6.9	173.1	-62.6	0	0	0	0	113.4	Q531	Q531-S535 PolarHBondContact O-N 3.06Å; Q531-S535 PolarHBondContact O-OG 3.29Å
536	H	37.6	Very low	49.5	Very low	222 Å²	222	105.7 Å²	105.7	100%	1.028	53%	0.527	S	S	*	.			trans	-100.6	0	168.8	-98	-63.7	0	0	0	110.1	L534	L534-H536 PolarHBondContact O-N 3.42Å

Retrieved 536 of 536 residues in 59.4 ms (Link to these results)

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