A0A075F5C6_MOUSE Loading...

Heat shock factor 1

AlphaFold DB , UniProt , Accession A0A075F5C6, Species MOUSE (Mus musculus, Mouse), Gene Hsf1, Length 531 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	40.8	Very low	40.3	Very low	233 Å²	233	120.4 Å²	120.4	100%	1.148	82%	0.819	S	S	*	*				0	86.7	0	-91.8	-168.4	178.3	0	0	104.8
2	D	36.6	Very low	41.3	Very low	157 Å²	157	121.1 Å²	121.1	84%	0.84	82%	0.82	S	S	*	*			trans	-101.8	121.3	-162.9	-59.8	-101.1	0	0	0	107
3	L	38.4	Very low	43.1	Very low	170 Å²	170	118.3 Å²	118.3	89%	0.89	80%	0.803	S	S	*	*			trans	-105.3	88.8	174.1	-73.3	176.8	0	0	0	108.2	V5	L3-V5 PolarHBondContact O-N 3.43Å; L3-V5 VanDerWaalsContact O-N 3.13Å
4	A	39.7	Very low	45.9	Very low	101 Å²	101	120.1 Å²	120.1	84%	0.835	80%	0.8	S	S	*	*			trans	-65.5	108.2	170.5	0	0	0	0	0	109.4	G6	A4-G6 PolarHBondContact O-N 2.8Å; A4-G6 VanDerWaalsContact O-N 3.11Å
5	V	43.2	Very low	48.9	Very low	144 Å²	144	113.7 Å²	113.7	87%	0.873	76%	0.757	S	S	*	*			trans	-72	101	164.9	178.5	0	0	0	0	107	L3	L3-V5 PolarHBondContact O-N 3.43Å; L3-V5 VanDerWaalsContact O-N 3.13Å
6	G	33.2	Very low	51.7	Low	52 Å²	52	109.3 Å²	109.3	54%	0.536	73%	0.727	S	S	.	*	P	Polyproline II helix	trans	-64.3	148.8	178.6	0	0	0	0	0	111.9	A4 G8	A4-G6 PolarHBondContact O-N 2.8Å; A4-G6 VanDerWaalsContact O-N 3.11Å; G6-G8 PolarHBondContact O-N 3.13Å
7	P	47.1	Very low	54.2	Low	135 Å²	135	107.1 Å²	107.1	88%	0.877	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-64.6	118.5	176.7	27.4	-33.5	0	0	0	109.7	A9	P7-A9 PolarHBondContact O-N 3.11Å
8	G	37.6	Very low	56.5	Low	75 Å²	75	102.1 Å²	102.1	77%	0.773	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-61.7	118.7	173.3	0	0	0	0	0	109.9	G6 A10	G6-G8 PolarHBondContact O-N 3.13Å; G8-A10 VanDerWaalsContact C-N 3.31Å; G8-A10 PolarHBondContact O-N 3.18Å
9	A	41.1	Very low	58.6	Low	107 Å²	107	96.7 Å²	96.7	88%	0.884	65%	0.648	S	S	*	*			trans	-71.5	84.8	-179.5	0	0	0	0	0	110.8	P7 G11	P7-A9 PolarHBondContact O-N 3.11Å; A9-G11 PolarHBondContact O-N 3.27Å
10	A	41.7	Very low	60.4	Low	95 Å²	95	93.9 Å²	93.9	79%	0.785	63%	0.627	S	S	*	*			trans	-59	126.6	165	0	0	0	0	0	108.9	G8	G8-A10 VanDerWaalsContact C-N 3.31Å; G8-A10 PolarHBondContact O-N 3.18Å
11	G	44.4	Very low	62.1	Low	55 Å²	55	94 Å²	94	57%	0.567	62%	0.618	S	S	*	*			trans	-60.1	161.5	167.8	0	0	0	0	0	110.7	A9 S13	A9-G11 PolarHBondContact O-N 3.27Å; G11-S13 PolarHBondContact O-N 3.24Å
12	P	51.7	Low	64.8	Low	129 Å²	129	83 Å²	83	84%	0.838	56%	0.563	S	S	*	*			trans	-56.6	109.1	-178.9	24.3	-34	0	0	0	109.7	N14	P12-N14 PolarHBondContact O-N 3.5Å
13	S	64.4	Low	67.7	Low	85 Å²	85	77.5 Å²	77.5	59%	0.594	53%	0.531	S	S	*	.			trans	-64	129.7	-175.4	54.4	0	0	0	0	109.3	G11 V15	G11-S13 PolarHBondContact O-N 3.24Å; S13-V15 PolarHBondContact O-N 2.71Å
14	N	82.9	Confident	70.4	Confident	143 Å²	143	72.6 Å²	72.6	77%	0.765	51%	0.508	S	S	*	.			trans	-72.5	21.7	178.1	-69.6	-62.3	0	0	0	112.8	P12 P16	P12-N14 PolarHBondContact O-N 3.5Å; N14-P16 WeakPolarHBondContact O-CD 3.08Å
15	V	91.3	Very high	73.1	Confident	24 Å²	24	67.8 Å²	67.8	15%	0.145	47%	0.468	C	S	.	.	S	Bend	trans	-86.9	118.5	178.5	-179.6	0	0	0	0	108.4	S13 A17 L19 T20 L112 E113	S13-V15 PolarHBondContact O-N 2.71Å; V15-A17 PolarHBondContact O-N 2.89Å; V15-L19 HydrophobicContact CG1-CB 3.95Å; V15-T20 WeakPolarHBondContact CG1-OG1 3.32Å; V15-L112 HydrophobicContact CG1-CB 3.72Å; V15-L112 HydrophobicContact CG1-CD1 4.26Å; V15-L112 HydrophobicContact CG2-CB 4.07Å; V15-E113 HydrophobicContact CG2-CB 4.11Å
16	P	93.6	Very high	75.6	Confident	43 Å²	43	60.9 Å²	60.9	28%	0.279	43%	0.426	S	S	.	.			trans	-56.1	128.5	172.9	-28.5	35.6	0	0	0	112.1	N14 F18 L19 Y76	N14-P16 WeakPolarHBondContact O-CD 3.08Å; P16-F18 PolarHBondContact O-N 3.4Å; P16-L19 HydrophobicContact CG-CD1 4.49Å; P16-L19 WeakPolarHBondContact O-CB 3.28Å; P16-L19 PolarHBondContact O-N 2.87Å; P16-Y76 HydrophobicContact CB-CE1 3.96Å; P16-Y76 VanDerWaalsContact CB-OH 3.27Å; P16-Y76 WeakPolarHBondContact CB-OH 3.2Å; P16-Y76 HydrophobicContact CG-CE1 3.86Å
17	A	93.3	Very high	78.5	Confident	72 Å²	72	60.6 Å²	60.6	60%	0.595	42%	0.416	S	S	*	.	H	α-helix	trans	-56.8	-15	-173.1	0	0	0	0	0	116	V15 K21	V15-A17 PolarHBondContact O-N 2.89Å; A17-K21 WeakPolarHBondContact O-CB 3.48Å; A17-K21 VanDerWaalsContact O-CG 3.25Å; A17-K21 WeakPolarHBondContact O-CG 3.42Å; A17-K21 PolarHBondContact O-N 3.32Å
18	F	96.2	Very high	80.8	Confident	18 Å²	18	56.1 Å²	56.1	8%	0.079	39%	0.385	C	S	.	.	H	α-helix	trans	-63.6	-42.4	167.9	171	-97.1	0	0	0	112	P16 L22 F61 F69 Q72 L73 Y76	P16-F18 PolarHBondContact O-N 3.4Å; F18-L22 HydrophobicContact CE1-CD2 4.07Å; F18-L22 HydrophobicContact CZ-CD2 4.31Å; F18-L22 VanDerWaalsContact O-CB 3.29Å; F18-L22 WeakPolarHBondContact O-CB 3.35Å; F18-L22 PolarHBondContact O-N 3.44Å; F18-F61 HydrophobicContact CD2-CD1 4.29Å; F18-F61 AromaticContact CD2-CE1 3.53Å; F18-F61 HydrophobicContact CD2-CE1 3.53Å; F18-F61 HydrophobicContact CD2-CZ 4.03Å; F18-F61 AromaticContact CE2-CE1 3.92Å; F18-F61 HydrophobicContact CE2-CE1 3.92Å; F18-F61 AromaticContact CE2-CZ 3.98Å; F18-F61 HydrophobicContact CE2-CZ 3.98Å; F18-F69 HydrophobicContact CE2-CD2 4.14Å; F18-F69 HydrophobicContact CE2-CE2 4.38Å; F18-F69 HydrophobicContact CZ-CD2 4.45Å; F18-F69 HydrophobicContact CZ-CE2 4.44Å; F18-Q72 HydrophobicContact CD1-CB 4.27Å; F18-Q72 HydrophobicContact CD2-CB 3.75Å; F18-Q72 HydrophobicContact CD2-CG 4.11Å; F18-Q72 HydrophobicContact CE1-CB 3.94Å; F18-Q72 HydrophobicContact CE2-CB 3.38Å; F18-Q72 HydrophobicContact CE2-CG 4.12Å; F18-Q72 HydrophobicContact CG-CB 4.19Å; F18-Q72 HydrophobicContact CZ-CB 3.49Å; F18-Q72 VanDerWaalsContact CZ-CB 3.49Å; F18-L73 HydrophobicContact CE1-CD2 4.07Å; F18-L73 HydrophobicContact CZ-CD2 3.86Å; F18-L73 HydrophobicContact CZ-CG 4.16Å; F18-Y76 HydrophobicContact CB-CE2 4Å; F18-Y76 AromaticContact CD1-CD2 3.35Å; F18-Y76 HydrophobicContact CD1-CD2 3.35Å; F18-Y76 AromaticContact CD1-CE2 3.42Å; F18-Y76 HydrophobicContact CD1-CE2 3.42Å; F18-Y76 VanDerWaalsContact CD1-CE2 3.42Å; F18-Y76 HydrophobicContact CD1-CG 4.41Å; F18-Y76 AromaticContact CE1-CD2 3.73Å; F18-Y76 HydrophobicContact CE1-CD2 3.73Å; F18-Y76 HydrophobicContact CE1-CE2 4.21Å; F18-Y76 HydrophobicContact CG-CD2 4.29Å; F18-Y76 AromaticContact CG-CE2 3.92Å; F18-Y76 HydrophobicContact CG-CE2 3.92Å
19	L	96.6	Very high	83.5	Confident	0 Å²	0	57 Å²	57	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-74.5	-42.2	-175.7	-64.2	174.2	0	0	0	112.1	V15 P16 K21 L22 W23 Y76 F78 I115	V15-L19 HydrophobicContact CG1-CB 3.95Å; P16-L19 HydrophobicContact CG-CD1 4.49Å; P16-L19 WeakPolarHBondContact O-CB 3.28Å; P16-L19 PolarHBondContact O-N 2.87Å; L19-K21 VanDerWaalsContact C-N 3.33Å; L19-K21 PolarHBondContact O-N 2.92Å; L19-L22 PolarHBondContact O-N 2.96Å; L19-W23 WeakPolarHBondContact O-CB 3.45Å; L19-W23 PolarHBondContact O-N 2.99Å; L19-Y76 HydrophobicContact CD1-CD1 3.97Å; L19-Y76 HydrophobicContact CD1-CE1 4.22Å; L19-Y76 HydrophobicContact CD1-CG 4.42Å; L19-Y76 HydrophobicContact CD2-CD1 4.28Å; L19-Y76 HydrophobicContact CD2-CD2 4.14Å; L19-Y76 HydrophobicContact CD2-CG 3.89Å; L19-Y76 HydrophobicContact CG-CD1 4.26Å; L19-Y76 HydrophobicContact CG-CD2 4.48Å; L19-Y76 HydrophobicContact CG-CE1 4.47Å; L19-Y76 HydrophobicContact CG-CG 4.29Å; L19-F78 HydrophobicContact CD2-CE2 3.73Å; L19-F78 HydrophobicContact CD2-CZ 4.14Å; L19-I115 HydrophobicContact CD1-CB 3.63Å; L19-I115 HydrophobicContact CD1-CD1 4.38Å; L19-I115 HydrophobicContact CD1-CG2 3.78Å; L19-I115 HydrophobicContact CD2-CD1 4.32Å; L19-I115 HydrophobicContact CD2-CG2 4.07Å
20	T	95	Very high	86	Confident	40 Å²	40	59.3 Å²	59.3	25%	0.245	37%	0.374	C	S	.	.	H	α-helix	trans	-56.2	-50.4	171.6	-44.6	0	0	0	0	109.9	V15 L22 W23 T24	V15-T20 WeakPolarHBondContact CG1-OG1 3.32Å; T20-L22 PolarHBondContact O-N 2.86Å; T20-W23 PolarHBondContact O-N 3.27Å; T20-T24 PolarHBondContact O-N 3.3Å; T20-T24 PolarHBondContact O-OG1 3.07Å
21	K	96	Very high	88.4	Confident	97 Å²	97	55.2 Å²	55.2	42%	0.422	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-39.3	177.9	-76	-178.3	162.3	-158.3	0	113.6	A17 L19 L25 Y60 F61	A17-K21 WeakPolarHBondContact O-CB 3.48Å; A17-K21 VanDerWaalsContact O-CG 3.25Å; A17-K21 WeakPolarHBondContact O-CG 3.42Å; A17-K21 PolarHBondContact O-N 3.32Å; L19-K21 VanDerWaalsContact C-N 3.33Å; L19-K21 PolarHBondContact O-N 2.92Å; K21-L25 WeakPolarHBondContact O-CB 3.47Å; K21-L25 PolarHBondContact O-N 2.84Å; K21-Y60 WeakPolarHBondContact CD-O 3.48Å; K21-Y60 WeakPolarHBondContact CE-O 3.47Å; K21-Y60 PolarHBondContact NZ-O 2.68Å; K21-F61 HydrophobicContact CB-CE1 4Å; K21-F61 HydrophobicContact CB-CZ 4.12Å; K21-F61 HydrophobicContact CD-CE1 4.36Å
22	L	97.2	Very high	90.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.2	-43.7	174.8	179	68.1	0	0	0	111.2	F18 L19 T20 L25 V26 F44 F69 L73 F78 F104	F18-L22 HydrophobicContact CE1-CD2 4.07Å; F18-L22 HydrophobicContact CZ-CD2 4.31Å; F18-L22 VanDerWaalsContact O-CB 3.29Å; F18-L22 WeakPolarHBondContact O-CB 3.35Å; F18-L22 PolarHBondContact O-N 3.44Å; L19-L22 PolarHBondContact O-N 2.96Å; T20-L22 PolarHBondContact O-N 2.86Å; L22-L25 PolarHBondContact O-N 2.79Å; L22-V26 HydrophobicContact CD1-CG2 4.03Å; L22-V26 HydrophobicContact CG-CG2 4.37Å; L22-V26 WeakPolarHBondContact O-CB 3.5Å; L22-V26 WeakPolarHBondContact O-CG2 3.45Å; L22-V26 PolarHBondContact O-N 3.2Å; L22-F44 HydrophobicContact CD1-CE1 4.39Å; L22-F44 HydrophobicContact CD1-CE2 4.28Å; L22-F44 HydrophobicContact CD1-CZ 3.9Å; L22-F44 HydrophobicContact CD2-CE1 4.23Å; L22-F44 HydrophobicContact CD2-CZ 4.32Å; L22-F69 HydrophobicContact CD1-CE2 3.72Å; L22-F69 HydrophobicContact CD1-CZ 3.62Å; L22-L73 HydrophobicContact CD1-CD2 4.32Å; L22-L73 HydrophobicContact CD2-CD2 3.51Å; L22-F78 HydrophobicContact CD2-CE1 4.03Å; L22-F78 HydrophobicContact CD2-CE2 4.28Å; L22-F78 HydrophobicContact CD2-CZ 3.7Å; L22-F104 HydrophobicContact CB-CE2 4.41Å; L22-F104 HydrophobicContact CD2-CD2 4.48Å; L22-F104 HydrophobicContact CD2-CE2 3.82Å; L22-F104 HydrophobicContact CD2-CZ 3.92Å; L22-F104 HydrophobicContact CG-CE2 3.92Å; L22-F104 HydrophobicContact CG-CZ 3.72Å
23	W	96.8	Very high	92.8	Very high	42 Å²	42	53.9 Å²	53.9	16%	0.159	32%	0.324	C	S	.	.	H	α-helix	trans	-68.4	-42.4	180	-170.1	93.1	0	0	0	112.2	L19 T20 S27 W37 F104 L105 E109 L112	L19-W23 WeakPolarHBondContact O-CB 3.45Å; L19-W23 PolarHBondContact O-N 2.99Å; T20-W23 PolarHBondContact O-N 3.27Å; W23-S27 VanDerWaalsContact O-CB 3.27Å; W23-S27 WeakPolarHBondContact O-CB 3.43Å; W23-S27 PolarHBondContact O-N 3.13Å; W23-S27 PolarHBondContact O-OG 3.14Å; W23-W37 AromaticContact CD1-CH2 3.79Å; W23-W37 AromaticContact CD1-CZ2 3.68Å; W23-W37 HydrophobicContact CG-CZ2 4.36Å; W23-W37 AromaticContact NE1-CH2 3.9Å; W23-W37 AromaticContact NE1-CZ2 3.63Å; W23-F104 HydrophobicContact CB-CE2 3.85Å; W23-F104 HydrophobicContact CB-CZ 4.2Å; W23-F104 AromaticContact CD1-CE2 4Å; W23-F104 HydrophobicContact CG-CE2 4.36Å; W23-L105 PolarHBondContact NE1-O 3.03Å; W23-L105 VanDerWaalsContact NE1-O 3.13Å; W23-E109 HydrophobicContact CD2-CB 4.23Å; W23-E109 HydrophobicContact CD2-CG 4.11Å; W23-E109 HydrophobicContact CE3-CB 4.39Å; W23-E109 HydrophobicContact CE3-CG 4.1Å; W23-E109 HydrophobicContact CH2-CB 4.23Å; W23-E109 HydrophobicContact CZ2-CB 4.05Å; W23-E109 HydrophobicContact CZ3-CB 4.39Å; W23-E109 HydrophobicContact CZ3-CG 4.44Å; W23-L112 HydrophobicContact CB-CD1 3.69Å; W23-L112 HydrophobicContact CB-CD2 4.33Å; W23-L112 HydrophobicContact CG-CD1 3.96Å; W23-L112 HydrophobicContact CG-CD2 4.47Å
24	T	95.1	Very high	94.3	Very high	67 Å²	67	50.7 Å²	50.7	41%	0.411	30%	0.3	S	S	.	.	H	α-helix	trans	-59.6	-48.9	171.3	-50.8	0	0	0	0	110.6	T20 S27 D28	T20-T24 PolarHBondContact O-N 3.3Å; T20-T24 PolarHBondContact O-OG1 3.07Å; T24-S27 CarbonylContact O-C 3.5Å; T24-S27 PolarHBondContact O-N 3.13Å; T24-S27 VanDerWaalsContact O-N 3.14Å; T24-D28 WeakPolarHBondContact O-CB 3.35Å; T24-D28 PolarHBondContact O-N 3.18Å; T24-D28 VanDerWaalsContact O-N 3.13Å
25	L	96.1	Very high	94.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.5	-52	-179.3	171.5	59.8	0	0	0	112.5	K21 L22 S27 D28 T31 I35 F52 V56 Y60 F61	K21-L25 WeakPolarHBondContact O-CB 3.47Å; K21-L25 PolarHBondContact O-N 2.84Å; L22-L25 PolarHBondContact O-N 2.79Å; L25-S27 PolarHBondContact O-N 3.16Å; L25-S27 VanDerWaalsContact O-N 3.16Å; L25-D28 WeakPolarHBondContact O-CB 3.03Å; L25-D28 PolarHBondContact O-N 2.92Å; L25-D28 VanDerWaalsContact O-N 3.13Å; L25-T31 HydrophobicContact CD1-CG2 3.96Å; L25-T31 PolarHBondContact O-OG1 3.17Å; L25-I35 HydrophobicContact CD1-CG2 3.76Å; L25-I35 HydrophobicContact CD2-CD1 4.06Å; L25-I35 HydrophobicContact CD2-CG2 4.44Å; L25-I35 HydrophobicContact CG-CD1 4.19Å; L25-I35 HydrophobicContact CG-CG2 3.88Å; L25-F52 HydrophobicContact CD2-CE2 4.18Å; L25-F52 HydrophobicContact CD2-CZ 4.32Å; L25-V56 HydrophobicContact CD1-CG1 3.44Å; L25-V56 VanDerWaalsContact CD1-CG1 3.44Å; L25-V56 HydrophobicContact CD2-CG1 4.13Å; L25-V56 HydrophobicContact CG-CG1 4.41Å; L25-Y60 HydrophobicContact CB-CD1 3.96Å; L25-Y60 HydrophobicContact CB-CE1 3.98Å; L25-Y60 HydrophobicContact CB-CG 4.41Å; L25-Y60 HydrophobicContact CD1-CD1 4.38Å; L25-Y60 HydrophobicContact CD1-CD2 3.88Å; L25-Y60 HydrophobicContact CD1-CE1 4.09Å; L25-Y60 HydrophobicContact CD1-CE2 3.6Å; L25-Y60 HydrophobicContact CD1-CG 4.31Å; L25-Y60 HydrophobicContact CD2-CG 4.45Å; L25-F61 HydrophobicContact CD2-CE2 4.25Å
26	V	96.9	Very high	95.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-19	180	179.3	0	0	0	0	111.9	L22 I35 W37 F44 F104	L22-V26 HydrophobicContact CD1-CG2 4.03Å; L22-V26 HydrophobicContact CG-CG2 4.37Å; L22-V26 WeakPolarHBondContact O-CB 3.5Å; L22-V26 WeakPolarHBondContact O-CG2 3.45Å; L22-V26 PolarHBondContact O-N 3.2Å; V26-I35 HydrophobicContact CG2-CD1 3.68Å; V26-I35 HydrophobicContact CG2-CG1 3.84Å; V26-W37 HydrophobicContact CB-CZ2 4.35Å; V26-W37 HydrophobicContact CG1-CB 4.46Å; V26-W37 HydrophobicContact CG1-CD2 3.51Å; V26-W37 HydrophobicContact CG1-CE3 4.03Å; V26-W37 HydrophobicContact CG1-CG 3.71Å; V26-W37 HydrophobicContact CG1-CZ2 4.05Å; V26-W37 PolarHBondContact O-NE1 2.92Å; V26-F44 HydrophobicContact CB-CB 4.48Å; V26-F44 HydrophobicContact CG1-CB 3.42Å; V26-F44 VanDerWaalsContact CG1-CB 3.42Å; V26-F44 HydrophobicContact CG1-CG 4.1Å; V26-F44 HydrophobicContact CG2-CB 4.09Å; V26-F44 HydrophobicContact CG2-CD1 4.3Å; V26-F44 HydrophobicContact CG2-CD2 3.91Å; V26-F44 HydrophobicContact CG2-CE2 4.4Å; V26-F44 HydrophobicContact CG2-CG 3.85Å; V26-F104 HydrophobicContact CG2-CE1 4.41Å; V26-F104 HydrophobicContact CG2-CZ 4.26Å
27	S	94.3	Very high	95.4	Very high	45 Å²	45	42.8 Å²	42.8	32%	0.315	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	6.6	178.2	-48.7	0	0	0	0	113.9	W23 T24 L25 W37	W23-S27 VanDerWaalsContact O-CB 3.27Å; W23-S27 WeakPolarHBondContact O-CB 3.43Å; W23-S27 PolarHBondContact O-N 3.13Å; W23-S27 PolarHBondContact O-OG 3.14Å; T24-S27 CarbonylContact O-C 3.5Å; T24-S27 PolarHBondContact O-N 3.13Å; T24-S27 VanDerWaalsContact O-N 3.14Å; L25-S27 PolarHBondContact O-N 3.16Å; L25-S27 VanDerWaalsContact O-N 3.16Å; S27-W37 PolarHBondContact OG-NE1 2.93Å
28	D	94.6	Very high	95.5	Very high	42 Å²	42	39.5 Å²	39.5	23%	0.225	23%	0.227	C	C	.	.			trans	-96.9	108.4	-176.3	-170.4	-16.3	0	0	0	110.2	T24 L25 D30 T31 D32 Y60	T24-D28 WeakPolarHBondContact O-CB 3.35Å; T24-D28 PolarHBondContact O-N 3.18Å; T24-D28 VanDerWaalsContact O-N 3.13Å; L25-D28 WeakPolarHBondContact O-CB 3.03Å; L25-D28 PolarHBondContact O-N 2.92Å; L25-D28 VanDerWaalsContact O-N 3.13Å; D28-D30 PolarHBondContact O-N 3.14Å; D28-D30 PolarHBondContact OD1-N 2.91Å; D28-T31 HydrophobicContact CB-CG2 4.4Å; D28-T31 WeakPolarHBondContact O-CA 3.27Å; D28-T31 PolarHBondContact O-N 3Å; D28-T31 PolarHBondContact O-OG1 3.4Å; D28-D32 PolarHBondContact O-N 2.93Å; D28-Y60 PolarHBondContact OD2-OH 3.01Å
29	P	94.1	Very high	95.4	Very high	94 Å²	94	44.3 Å²	44.3	61%	0.61	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-19.5	-173.6	28.7	-36.1	0	0	0	113.4	T31 D32	P29-T31 PolarHBondContact O-N 3.19Å; P29-D32 PolarHBondContact O-N 2.73Å
30	D	93.1	Very high	95.3	Very high	155 Å²	155	48.5 Å²	48.5	83%	0.829	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.5	171.7	-76.1	-1.7	0	0	0	111.9	D28	D28-D30 PolarHBondContact O-N 3.14Å; D28-D30 PolarHBondContact OD1-N 2.91Å
31	T	93.4	Very high	95.3	Very high	9 Å²	9	46.9 Å²	46.9	6%	0.055	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-5	179	72.3	0	0	0	0	115	L25 D28 P29 A33 L34 I35	L25-T31 HydrophobicContact CD1-CG2 3.96Å; L25-T31 PolarHBondContact O-OG1 3.17Å; D28-T31 HydrophobicContact CB-CG2 4.4Å; D28-T31 WeakPolarHBondContact O-CA 3.27Å; D28-T31 PolarHBondContact O-N 3Å; D28-T31 PolarHBondContact O-OG1 3.4Å; P29-T31 PolarHBondContact O-N 3.19Å; T31-A33 PolarHBondContact O-N 2.78Å; T31-L34 PolarHBondContact O-N 3.34Å; T31-I35 CarbonylContact C-O 3.51Å; T31-I35 PolarHBondContact O-N 3.06Å
32	D	94.1	Very high	95.3	Very high	73 Å²	73	45.1 Å²	45.1	39%	0.39	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-27.8	-178.8	-93.5	-28	0	0	0	113.6	D28 P29 L34 I35 C36	D28-D32 PolarHBondContact O-N 2.93Å; P29-D32 PolarHBondContact O-N 2.73Å; D32-L34 PolarHBondContact O-N 3.15Å; D32-I35 WeakPolarHBondContact CA-O 3.09Å; D32-C36 HydrophobicContact CB-CB 4.21Å; D32-C36 WeakPolarHBondContact OD1-CB 3.5Å
33	A	94	Very high	95.3	Very high	82 Å²	82	45.1 Å²	45.1	68%	0.678	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.2	176.9	0	0	0	0	0	114.7	T31	T31-A33 PolarHBondContact O-N 2.78Å
34	L	95	Very high	95.3	Very high	18 Å²	18	43.1 Å²	43.1	9%	0.094	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	-26	-178.5	-68.3	174.7	0	0	0	112.9	T31 D32 V46 F47 D48 Q51 F52 V56	T31-L34 PolarHBondContact O-N 3.34Å; D32-L34 PolarHBondContact O-N 3.15Å; L34-V46 WeakPolarHBondContact O-CA 3.34Å; L34-F47 PolarHBondContact O-N 2.87Å; L34-D48 HydrophobicContact CD2-CB 4.26Å; L34-Q51 HydrophobicContact CD1-CG 4.09Å; L34-Q51 HydrophobicContact CD2-CB 4.18Å; L34-Q51 HydrophobicContact CD2-CG 4.22Å; L34-F52 HydrophobicContact CB-CB 4.38Å; L34-F52 HydrophobicContact CB-CD2 4.37Å; L34-V56 HydrophobicContact CB-CG2 4.31Å; L34-V56 HydrophobicContact CD1-CG2 3.66Å
35	I	96.9	Very high	95.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	123.4	174.4	-177.2	163.4	0	0	0	109.7	L25 V26 T31 D32 F44 H45 V46 F52 F69	L25-I35 HydrophobicContact CD1-CG2 3.76Å; L25-I35 HydrophobicContact CD2-CD1 4.06Å; L25-I35 HydrophobicContact CD2-CG2 4.44Å; L25-I35 HydrophobicContact CG-CD1 4.19Å; L25-I35 HydrophobicContact CG-CG2 3.88Å; V26-I35 HydrophobicContact CG2-CD1 3.68Å; V26-I35 HydrophobicContact CG2-CG1 3.84Å; T31-I35 CarbonylContact C-O 3.51Å; T31-I35 PolarHBondContact O-N 3.06Å; D32-I35 WeakPolarHBondContact CA-O 3.09Å; I35-F44 HydrophobicContact CD1-CD2 3.94Å; I35-F44 HydrophobicContact CD1-CE2 3.96Å; I35-F44 HydrophobicContact CG1-CD2 4.05Å; I35-H45 WeakPolarHBondContact CA-O 3.1Å; I35-V46 HydrophobicContact CD1-CG2 3.98Å; I35-V46 HydrophobicContact CG1-CG2 4.16Å; I35-F52 HydrophobicContact CB-CD2 4.11Å; I35-F52 HydrophobicContact CB-CE2 3.81Å; I35-F52 HydrophobicContact CD1-CE2 3.73Å; I35-F52 HydrophobicContact CD1-CZ 3.96Å; I35-F52 HydrophobicContact CG1-CE2 4.37Å; I35-F52 HydrophobicContact CG2-CD2 4.17Å; I35-F52 HydrophobicContact CG2-CE2 3.78Å; I35-F69 HydrophobicContact CD1-CZ 4.28Å
36	C	96.6	Very high	95.4	Very high	23 Å²	23	41.3 Å²	41.3	16%	0.155	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	160.3	-177.3	71.1	0	0	0	0	112.6	D32 F44 H45	D32-C36 HydrophobicContact CB-CB 4.21Å; D32-C36 WeakPolarHBondContact OD1-CB 3.5Å; C36-F44 CarbonylContact O-C 3.59Å; C36-F44 WeakPolarHBondContact O-CA 3.22Å; C36-F44 VanDerWaalsContact O-CB 3.3Å; C36-F44 WeakPolarHBondContact O-CB 3.49Å; C36-H45 PolarHBondContact N-O 3.42Å; C36-H45 PolarHBondContact O-N 3.26Å
37	W	97.7	Very high	95.3	Very high	21 Å²	21	43.5 Å²	43.5	8%	0.08	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	141	169.5	-70.6	102.4	0	0	0	111.7	W23 V26 S27 F104 L105 R106	W23-W37 AromaticContact CD1-CH2 3.79Å; W23-W37 AromaticContact CD1-CZ2 3.68Å; W23-W37 HydrophobicContact CG-CZ2 4.36Å; W23-W37 AromaticContact NE1-CH2 3.9Å; W23-W37 AromaticContact NE1-CZ2 3.63Å; V26-W37 HydrophobicContact CB-CZ2 4.35Å; V26-W37 HydrophobicContact CG1-CB 4.46Å; V26-W37 HydrophobicContact CG1-CD2 3.51Å; V26-W37 HydrophobicContact CG1-CE3 4.03Å; V26-W37 HydrophobicContact CG1-CG 3.71Å; V26-W37 HydrophobicContact CG1-CZ2 4.05Å; V26-W37 PolarHBondContact O-NE1 2.92Å; S27-W37 PolarHBondContact OG-NE1 2.93Å; W37-F104 HydrophobicContact CE3-CE1 4.46Å; W37-F104 AromaticContact CH2-CD1 3.56Å; W37-F104 HydrophobicContact CH2-CD1 3.56Å; W37-F104 AromaticContact CH2-CE1 3.22Å; W37-F104 HydrophobicContact CH2-CE1 3.22Å; W37-F104 HydrophobicContact CH2-CG 4.34Å; W37-F104 AromaticContact CH2-CZ 3.75Å; W37-F104 HydrophobicContact CH2-CZ 3.75Å; W37-F104 HydrophobicContact CZ2-CE1 4.05Å; W37-F104 HydrophobicContact CZ2-CZ 4.27Å; W37-F104 AromaticContact CZ3-CD1 3.59Å; W37-F104 HydrophobicContact CZ3-CD1 3.59Å; W37-F104 AromaticContact CZ3-CE1 3.48Å; W37-F104 HydrophobicContact CZ3-CE1 3.48Å; W37-F104 VanDerWaalsContact CZ3-CE1 3.48Å; W37-F104 HydrophobicContact CZ3-CZ 4.44Å; W37-L105 VanDerWaalsContact CH2-C 3.4Å; W37-R106 VanDerWaalsContact CB-NH1 3.34Å; W37-R106 HydrophobicContact CD2-CB 3.59Å; W37-R106 HydrophobicContact CD2-CG 3.99Å; W37-R106 HydrophobicContact CE3-CB 3.84Å; W37-R106 HydrophobicContact CG-CB 3.97Å; W37-R106 HydrophobicContact CG-CG 3.91Å; W37-R106 HydrophobicContact CH2-CB 4.47Å; W37-R106 HydrophobicContact CZ2-CB 4.26Å; W37-R106 HydrophobicContact CZ3-CB 4.27Å
38	S	95.9	Very high	95.2	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.021	26%	0.259	C	S	.	.			trans	-59.1	160.1	167.3	65.4	0	0	0	0	111.7	S40 G41 S43 R106	S38-S40 PolarHBondContact O-N 2.85Å; S38-S40 PolarHBondContact OG-OG 3.34Å; S38-G41 WeakPolarHBondContact O-CA 3.48Å; S38-G41 PolarHBondContact O-N 3.37Å; S38-G41 PolarHBondContact OG-N 2.8Å; S38-S43 WeakPolarHBondContact CB-OG 3.34Å; S38-S43 PolarHBondContact N-O 3.17Å; S38-S43 PolarHBondContact OG-N 2.95Å; S38-S43 PolarHBondContact OG-O 3.38Å; S38-S43 VanDerWaalsContact OG-O 3.14Å; S38-S43 PolarHBondContact OG-OG 2.89Å; S38-R106 PolarHBondContact O-NH1 3.38Å
39	P	94.1	Very high	95.2	Very high	120 Å²	120	44 Å²	44	78%	0.779	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-39.3	-179.9	-27.9	36.1	0	0	0	113	R106	P39-R106 PolarHBondContact O-NH2 3.12Å
40	S	94.1	Very high	95.2	Very high	88 Å²	88	42.2 Å²	42.2	62%	0.615	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-16.9	175.1	39.1	0	0	0	0	114.7	S38 N42	S38-S40 PolarHBondContact O-N 2.85Å; S38-S40 PolarHBondContact OG-OG 3.34Å; S40-N42 VanDerWaalsContact C-N 3.26Å; S40-N42 VanDerWaalsContact CB-OD1 3.24Å; S40-N42 WeakPolarHBondContact CB-OD1 3.12Å; S40-N42 PolarHBondContact O-N 2.87Å; S40-N42 PolarHBondContact OG-OD1 3.22Å
41	G	95.1	Very high	95.3	Very high	5 Å²	5	39 Å²	39	5%	0.052	24%	0.241	C	C	.	.	S	Bend	trans	69.4	19.5	176.3	0	0	0	0	0	114.8	S38 L105 R106	S38-G41 WeakPolarHBondContact O-CA 3.48Å; S38-G41 PolarHBondContact O-N 3.37Å; S38-G41 PolarHBondContact OG-N 2.8Å; G41-L105 WeakPolarHBondContact O-CA 3.41Å; G41-R106 PolarHBondContact O-N 2.91Å
42	N	96.3	Very high	95.4	Very high	60 Å²	60	38.6 Å²	38.6	32%	0.321	24%	0.239	S	C	.	.	S	Bend	trans	-108.5	11.6	178	65.8	-31.6	0	0	0	113.1	S40 Q100 L105	S40-N42 VanDerWaalsContact C-N 3.26Å; S40-N42 VanDerWaalsContact CB-OD1 3.24Å; S40-N42 WeakPolarHBondContact CB-OD1 3.12Å; S40-N42 PolarHBondContact O-N 2.87Å; S40-N42 PolarHBondContact OG-OD1 3.22Å; N42-Q100 PolarHBondContact ND2-NE2 2.88Å; N42-Q100 WeakPolarHBondContact O-CG 3.41Å; N42-Q100 PolarHBondContact O-NE2 3.18Å; N42-Q100 VanDerWaalsContact O-NE2 3.1Å; N42-L105 HydrophobicContact CB-CD2 3.83Å
43	S	97.1	Very high	95.5	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.007	22%	0.224	C	C	.	.	S	Bend	trans	-168	171.5	-177.7	47.7	0	0	0	0	109	S38 E98 F99	S38-S43 WeakPolarHBondContact CB-OG 3.34Å; S38-S43 PolarHBondContact N-O 3.17Å; S38-S43 PolarHBondContact OG-N 2.95Å; S38-S43 PolarHBondContact OG-O 3.38Å; S38-S43 VanDerWaalsContact OG-O 3.14Å; S38-S43 PolarHBondContact OG-OG 2.89Å; S43-E98 WeakPolarHBondContact CB-OE1 3.15Å; S43-E98 PolarHBondContact OG-OE1 3.28Å; S43-F99 WeakPolarHBondContact CA-O 3.36Å; S43-F99 WeakPolarHBondContact CB-O 3.36Å
44	F	97.6	Very high	95.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	146.1	177.4	70	-90.7	0	0	0	111.7	L22 V26 I35 C36 V46 F69 L73 F78 E98 F99 F104	L22-F44 HydrophobicContact CD1-CE1 4.39Å; L22-F44 HydrophobicContact CD1-CE2 4.28Å; L22-F44 HydrophobicContact CD1-CZ 3.9Å; L22-F44 HydrophobicContact CD2-CE1 4.23Å; L22-F44 HydrophobicContact CD2-CZ 4.32Å; V26-F44 HydrophobicContact CB-CB 4.48Å; V26-F44 HydrophobicContact CG1-CB 3.42Å; V26-F44 VanDerWaalsContact CG1-CB 3.42Å; V26-F44 HydrophobicContact CG1-CG 4.1Å; V26-F44 HydrophobicContact CG2-CB 4.09Å; V26-F44 HydrophobicContact CG2-CD1 4.3Å; V26-F44 HydrophobicContact CG2-CD2 3.91Å; V26-F44 HydrophobicContact CG2-CE2 4.4Å; V26-F44 HydrophobicContact CG2-CG 3.85Å; I35-F44 HydrophobicContact CD1-CD2 3.94Å; I35-F44 HydrophobicContact CD1-CE2 3.96Å; I35-F44 HydrophobicContact CG1-CD2 4.05Å; C36-F44 CarbonylContact O-C 3.59Å; C36-F44 WeakPolarHBondContact O-CA 3.22Å; C36-F44 VanDerWaalsContact O-CB 3.3Å; C36-F44 WeakPolarHBondContact O-CB 3.49Å; F44-V46 HydrophobicContact CD2-CG2 3.87Å; F44-V46 HydrophobicContact CE2-CG2 3.65Å; F44-F69 HydrophobicContact CE2-CZ 4.37Å; F44-L73 HydrophobicContact CE1-CD2 4.35Å; F44-L73 HydrophobicContact CZ-CD1 3.97Å; F44-L73 HydrophobicContact CZ-CD2 3.84Å; F44-F78 AromaticContact CE1-CD1 3.94Å; F44-F78 HydrophobicContact CE1-CD1 3.94Å; F44-F78 AromaticContact CE1-CE1 3.8Å; F44-F78 HydrophobicContact CE1-CE1 3.8Å; F44-E98 CarbonylContact O-C 3.45Å; F44-E98 VanDerWaalsContact O-CA 3.28Å; F44-E98 WeakPolarHBondContact O-CA 3.46Å; F44-F99 HydrophobicContact CD1-CB 4.29Å; F44-F99 HydrophobicContact CE1-CB 3.73Å; F44-F99 HydrophobicContact CE2-CB 4.11Å; F44-F99 AromaticContact CE2-CD2 3.92Å; F44-F99 HydrophobicContact CE2-CD2 3.92Å; F44-F99 HydrophobicContact CE2-CG 4.43Å; F44-F99 HydrophobicContact CZ-CB 3.62Å; F44-F99 HydrophobicContact CZ-CD2 4.05Å; F44-F99 HydrophobicContact CZ-CG 4.15Å; F44-F99 PolarHBondContact N-O 3.4Å; F44-F99 PolarHBondContact O-N 2.69Å; F44-F104 HydrophobicContact CD1-CD1 4.03Å; F44-F104 AromaticContact CD1-CE1 3.6Å; F44-F104 HydrophobicContact CD1-CE1 3.6Å; F44-F104 HydrophobicContact CD1-CZ 4.49Å; F44-F104 HydrophobicContact CE1-CD1 4.38Å; F44-F104 HydrophobicContact CE1-CE1 4.02Å; F44-F104 HydrophobicContact CG-CE1 4.48Å
45	H	96.3	Very high	95.6	Very high	27 Å²	27	41.7 Å²	41.7	13%	0.125	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	149.1	178	-65.3	-104.1	0	0	0	109.9	I35 C36 F47 D96	I35-H45 WeakPolarHBondContact CA-O 3.1Å; C36-H45 PolarHBondContact N-O 3.42Å; C36-H45 PolarHBondContact O-N 3.26Å; H45-F47 HydrophobicContact CB-CE1 3.96Å; H45-F47 HydrophobicContact CB-CE2 4.08Å; H45-F47 HydrophobicContact CB-CZ 3.6Å; H45-D96 WeakPolarHBondContact CB-OD1 3.44Å; H45-D96 IonicContact CE1-OD2 3.16Å; H45-D96 IonicContact CG-OD1 2.88Å; H45-D96 IonicContact CG-OD2 2.7Å; H45-D96 IonicContact ND1-OD1 3.64Å; H45-D96 PolarHBondContact ND1-OD1 3.13Å; H45-D96 VanDerWaalsContact ND1-OD1 3.12Å; H45-D96 IonicContact ND1-OD2 2.77Å; H45-D96 PolarHBondContact ND1-OD2 3.45Å
46	V	96.4	Very high	95.5	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	114.7	170.6	-172.4	0	0	0	0	107.9	L34 I35 F44 F52 M66 F69 T97 F99	L34-V46 WeakPolarHBondContact O-CA 3.34Å; I35-V46 HydrophobicContact CD1-CG2 3.98Å; I35-V46 HydrophobicContact CG1-CG2 4.16Å; F44-V46 HydrophobicContact CD2-CG2 3.87Å; F44-V46 HydrophobicContact CE2-CG2 3.65Å; V46-F52 HydrophobicContact CG1-CB 4.27Å; V46-F52 HydrophobicContact CG1-CD1 3.74Å; V46-F52 HydrophobicContact CG1-CD2 4.03Å; V46-F52 HydrophobicContact CG1-CE1 3.99Å; V46-F52 HydrophobicContact CG1-CE2 4.3Å; V46-F52 HydrophobicContact CG1-CG 3.74Å; V46-F52 HydrophobicContact CG1-CZ 4.27Å; V46-M66 HydrophobicContact CG1-CE 3.92Å; V46-F69 HydrophobicContact CG2-CE1 4.47Å; V46-T97 PolarHBondContact N-O 2.95Å; V46-T97 PolarHBondContact O-N 3.39Å; V46-F99 HydrophobicContact CG2-CD2 4.22Å; V46-F99 HydrophobicContact CG2-CE2 4.32Å
47	F	94.8	Very high	95.5	Very high	46 Å²	46	40.8 Å²	40.8	20%	0.202	23%	0.23	C	C	.	.			trans	-97	159.4	-178.3	-53.2	-64.9	0	0	0	111.4	L34 H45 Q49 D96	L34-F47 PolarHBondContact O-N 2.87Å; H45-F47 HydrophobicContact CB-CE1 3.96Å; H45-F47 HydrophobicContact CB-CE2 4.08Å; H45-F47 HydrophobicContact CB-CZ 3.6Å; F47-Q49 VanDerWaalsContact C-N 3.31Å; F47-Q49 PolarHBondContact O-N 2.89Å; F47-Q49 VanDerWaalsContact O-N 3.14Å; F47-D96 HydrophobicContact CD1-CB 3.89Å; F47-D96 HydrophobicContact CE1-CB 3.96Å
48	D	92.9	Very high	95.4	Very high	38 Å²	38	43 Å²	43	20%	0.203	25%	0.246	C	C	.	.	S	Bend	trans	41.6	57.6	168.1	-59.9	-20.2	0	0	0	112.6	L34 G50 Q51 F52 R94	L34-D48 HydrophobicContact CD2-CB 4.26Å; D48-G50 PolarHBondContact O-N 3.21Å; D48-Q51 WeakPolarHBondContact O-CA 3.21Å; D48-Q51 WeakPolarHBondContact O-CB 3.21Å; D48-Q51 PolarHBondContact O-N 3.27Å; D48-F52 PolarHBondContact O-N 2.85Å; D48-R94 IonicContact OD1-NE 3.85Å; D48-R94 IonicContact OD2-CZ 3.48Å; D48-R94 IonicContact OD2-NE 3.44Å; D48-R94 PolarHBondContact OD2-NE 2.77Å; D48-R94 IonicContact OD2-NH2 2.68Å; D48-R94 PolarHBondContact OD2-NH2 2.88Å
49	Q	93.5	Very high	95.3	Very high	59 Å²	59	50.2 Å²	50.2	28%	0.276	28%	0.277	S	S	.	.	H	α-helix	trans	-49.7	-32.8	-161.2	-64.8	-179.5	48.9	0	0	114.9	F47 A53 M66 T97	F47-Q49 VanDerWaalsContact C-N 3.31Å; F47-Q49 PolarHBondContact O-N 2.89Å; F47-Q49 VanDerWaalsContact O-N 3.14Å; Q49-A53 WeakPolarHBondContact O-CB 3.49Å; Q49-A53 PolarHBondContact O-N 3.01Å; Q49-M66 HydrophobicContact CB-CE 3.57Å; Q49-M66 HydrophobicContact CG-CE 3.73Å; Q49-T97 PolarHBondContact NE2-OG1 3.19Å
50	G	94.2	Very high	95.3	Very high	58 Å²	58	46.5 Å²	46.5	60%	0.598	25%	0.248	S	C	*	.	H	α-helix	trans	-67.9	-36.6	175.7	0	0	0	0	0	114	D48 K54	D48-G50 PolarHBondContact O-N 3.21Å; G50-K54 WeakPolarHBondContact O-CB 3.45Å; G50-K54 PolarHBondContact O-N 3.48Å
51	Q	94.6	Very high	95.4	Very high	88 Å²	88	43.5 Å²	43.5	41%	0.411	22%	0.224	S	C	.	.	H	α-helix	trans	-72.9	-48.5	175.3	-171	177.5	-7.7	0	0	110.5	L34 D48 A53 K54 E55	L34-Q51 HydrophobicContact CD1-CG 4.09Å; L34-Q51 HydrophobicContact CD2-CB 4.18Å; L34-Q51 HydrophobicContact CD2-CG 4.22Å; D48-Q51 WeakPolarHBondContact O-CA 3.21Å; D48-Q51 WeakPolarHBondContact O-CB 3.21Å; D48-Q51 PolarHBondContact O-N 3.27Å; Q51-A53 VanDerWaalsContact C-N 3.27Å; Q51-A53 PolarHBondContact O-N 3.42Å; Q51-K54 PolarHBondContact O-N 3.28Å; Q51-E55 HydrophobicContact CG-CG 4.32Å; Q51-E55 VanDerWaalsContact CG-OE2 3.28Å; Q51-E55 WeakPolarHBondContact CG-OE2 3.29Å; Q51-E55 PolarHBondContact NE2-OE2 2.82Å; Q51-E55 WeakPolarHBondContact O-CB 3.3Å; Q51-E55 PolarHBondContact O-N 2.88Å
52	F	96.4	Very high	95.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-52	-46.4	172.5	170.3	-95	0	0	0	112	L25 L34 I35 V46 D48 K54 V56 L57 M66 F69	L25-F52 HydrophobicContact CD2-CE2 4.18Å; L25-F52 HydrophobicContact CD2-CZ 4.32Å; L34-F52 HydrophobicContact CB-CB 4.38Å; L34-F52 HydrophobicContact CB-CD2 4.37Å; I35-F52 HydrophobicContact CB-CD2 4.11Å; I35-F52 HydrophobicContact CB-CE2 3.81Å; I35-F52 HydrophobicContact CD1-CE2 3.73Å; I35-F52 HydrophobicContact CD1-CZ 3.96Å; I35-F52 HydrophobicContact CG1-CE2 4.37Å; I35-F52 HydrophobicContact CG2-CD2 4.17Å; I35-F52 HydrophobicContact CG2-CE2 3.78Å; V46-F52 HydrophobicContact CG1-CB 4.27Å; V46-F52 HydrophobicContact CG1-CD1 3.74Å; V46-F52 HydrophobicContact CG1-CD2 4.03Å; V46-F52 HydrophobicContact CG1-CE1 3.99Å; V46-F52 HydrophobicContact CG1-CE2 4.3Å; V46-F52 HydrophobicContact CG1-CG 3.74Å; V46-F52 HydrophobicContact CG1-CZ 4.27Å; D48-F52 PolarHBondContact O-N 2.85Å; F52-K54 VanDerWaalsContact C-N 3.31Å; F52-K54 PolarHBondContact O-N 3.12Å; F52-V56 HydrophobicContact CD2-CB 3.73Å; F52-V56 HydrophobicContact CD2-CG1 3.9Å; F52-V56 HydrophobicContact CD2-CG2 4.03Å; F52-V56 HydrophobicContact CE2-CB 4Å; F52-V56 HydrophobicContact CE2-CG1 3.69Å; F52-V56 HydrophobicContact CG-CB 4.39Å; F52-V56 WeakPolarHBondContact O-CA 3.34Å; F52-V56 WeakPolarHBondContact O-CB 3.34Å; F52-V56 PolarHBondContact O-N 2.88Å; F52-L57 HydrophobicContact CD1-CD1 4.48Å; F52-L57 HydrophobicContact CD1-CD2 4.39Å; F52-L57 HydrophobicContact CD1-CG 4.08Å; F52-L57 HydrophobicContact CE1-CD1 4.14Å; F52-L57 HydrophobicContact CE1-CD2 3.48Å; F52-L57 VanDerWaalsContact CE1-CD2 3.48Å; F52-L57 HydrophobicContact CE1-CG 3.65Å; F52-L57 HydrophobicContact CZ-CD2 3.64Å; F52-L57 HydrophobicContact CZ-CG 4.17Å; F52-L57 PolarHBondContact O-N 2.89Å; F52-M66 HydrophobicContact CD1-CE 3.48Å; F52-M66 VanDerWaalsContact CD1-CE 3.48Å; F52-M66 HydrophobicContact CD1-SD 4.32Å; F52-M66 HydrophobicContact CE1-CE 3.89Å; F52-M66 HydrophobicContact CE1-SD 4.21Å; F52-F69 HydrophobicContact CE1-CD1 4.04Å; F52-F69 AromaticContact CE1-CE1 3.99Å; F52-F69 HydrophobicContact CE1-CE1 3.99Å; F52-F69 HydrophobicContact CE1-CG 4.4Å; F52-F69 HydrophobicContact CE1-CZ 4.31Å; F52-F69 HydrophobicContact CZ-CD1 4.42Å; F52-F69 HydrophobicContact CZ-CE1 4Å; F52-F69 HydrophobicContact CZ-CE2 4.21Å; F52-F69 AromaticContact CZ-CZ 3.88Å; F52-F69 HydrophobicContact CZ-CZ 3.88Å
53	A	96.5	Very high	95.3	Very high	10 Å²	10	53.8 Å²	53.8	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-33.7	179.4	0	0	0	0	0	113.4	Q49 Q51 L57 N64 M66	Q49-A53 WeakPolarHBondContact O-CB 3.49Å; Q49-A53 PolarHBondContact O-N 3.01Å; Q51-A53 VanDerWaalsContact C-N 3.27Å; Q51-A53 PolarHBondContact O-N 3.42Å; A53-L57 HydrophobicContact CB-CD1 4.15Å; A53-N64 WeakPolarHBondContact CB-O 3.46Å; A53-N64 CarbonylContact O-C 3.49Å; A53-N64 VanDerWaalsContact O-CA 3.22Å; A53-N64 WeakPolarHBondContact O-CA 3.18Å; A53-N64 WeakPolarHBondContact O-CB 3.39Å; A53-N64 VanDerWaalsContact O-O 3.09Å; A53-M66 HydrophobicContact CB-CB 4.22Å
54	K	95.8	Very high	95.2	Very high	148 Å²	148	58.9 Å²	58.9	64%	0.643	29%	0.293	S	S	*	.	H	α-helix	trans	-83.5	-39.2	-179.5	-175.5	-172.9	174.5	-161.6	0	113.6	G50 Q51 F52 P58	G50-K54 WeakPolarHBondContact O-CB 3.45Å; G50-K54 PolarHBondContact O-N 3.48Å; Q51-K54 PolarHBondContact O-N 3.28Å; F52-K54 VanDerWaalsContact C-N 3.31Å; F52-K54 PolarHBondContact O-N 3.12Å; K54-P58 WeakPolarHBondContact O-CG 3.47Å
55	E	94.6	Very high	95.2	Very high	80 Å²	80	62.8 Å²	62.8	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-110.6	-23.7	-164.8	-66.6	174.5	-169.5	0	0	113.9	Q51 K59	Q51-E55 HydrophobicContact CG-CG 4.32Å; Q51-E55 VanDerWaalsContact CG-OE2 3.28Å; Q51-E55 WeakPolarHBondContact CG-OE2 3.29Å; Q51-E55 PolarHBondContact NE2-OE2 2.82Å; Q51-E55 WeakPolarHBondContact O-CB 3.3Å; Q51-E55 PolarHBondContact O-N 2.88Å; E55-K59 WeakPolarHBondContact O-CD 3.28Å; E55-K59 WeakPolarHBondContact O-CE 3.43Å; E55-K59 PolarHBondContact O-NZ 2.89Å
56	V	95.8	Very high	95.2	Very high	4 Å²	4	62.8 Å²	62.8	2%	0.024	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-52.2	-177.9	-177	0	0	0	0	110.8	L25 L34 F52 K59 Y60	L25-V56 HydrophobicContact CD1-CG1 3.44Å; L25-V56 VanDerWaalsContact CD1-CG1 3.44Å; L25-V56 HydrophobicContact CD2-CG1 4.13Å; L25-V56 HydrophobicContact CG-CG1 4.41Å; L34-V56 HydrophobicContact CB-CG2 4.31Å; L34-V56 HydrophobicContact CD1-CG2 3.66Å; F52-V56 HydrophobicContact CD2-CB 3.73Å; F52-V56 HydrophobicContact CD2-CG1 3.9Å; F52-V56 HydrophobicContact CD2-CG2 4.03Å; F52-V56 HydrophobicContact CE2-CB 4Å; F52-V56 HydrophobicContact CE2-CG1 3.69Å; F52-V56 HydrophobicContact CG-CB 4.39Å; F52-V56 WeakPolarHBondContact O-CA 3.34Å; F52-V56 WeakPolarHBondContact O-CB 3.34Å; F52-V56 PolarHBondContact O-N 2.88Å; V56-K59 WeakPolarHBondContact O-CB 3.45Å; V56-K59 PolarHBondContact O-N 3.03Å; V56-Y60 HydrophobicContact CG1-CD2 4.23Å; V56-Y60 HydrophobicContact CG1-CE2 4.26Å
57	L	95.8	Very high	95.1	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-53.2	-42.1	-176.9	-70.3	-176.4	0	0	0	114.3	F52 A53 K59 Y60 F61 H63 F69	F52-L57 HydrophobicContact CD1-CD1 4.48Å; F52-L57 HydrophobicContact CD1-CD2 4.39Å; F52-L57 HydrophobicContact CD1-CG 4.08Å; F52-L57 HydrophobicContact CE1-CD1 4.14Å; F52-L57 HydrophobicContact CE1-CD2 3.48Å; F52-L57 VanDerWaalsContact CE1-CD2 3.48Å; F52-L57 HydrophobicContact CE1-CG 3.65Å; F52-L57 HydrophobicContact CZ-CD2 3.64Å; F52-L57 HydrophobicContact CZ-CG 4.17Å; F52-L57 PolarHBondContact O-N 2.89Å; A53-L57 HydrophobicContact CB-CD1 4.15Å; L57-K59 VanDerWaalsContact C-N 3.26Å; L57-K59 PolarHBondContact O-N 3.49Å; L57-Y60 PolarHBondContact O-N 3.06Å; L57-F61 HydrophobicContact CD2-CD2 3.71Å; L57-F61 HydrophobicContact CD2-CE2 4.07Å; L57-F61 WeakPolarHBondContact O-CA 3.48Å; L57-F61 WeakPolarHBondContact O-CB 3.42Å; L57-F61 PolarHBondContact O-N 3.25Å; L57-F61 VanDerWaalsContact O-O 3.07Å; L57-H63 CarbonylContact C-O 3.43Å; L57-H63 WeakPolarHBondContact CB-O 3.25Å; L57-F69 HydrophobicContact CD1-CB 4.04Å; L57-F69 HydrophobicContact CD2-CB 3.95Å; L57-F69 HydrophobicContact CD2-CD2 3.59Å; L57-F69 HydrophobicContact CD2-CE2 4.21Å; L57-F69 HydrophobicContact CD2-CG 3.83Å
58	P	95.9	Very high	95.2	Very high	66 Å²	66	65.6 Å²	65.6	43%	0.429	34%	0.343	S	S	.	.	H	α-helix	trans	-67.7	-19.8	-179.9	-24	37.5	0	0	0	115.1	K54 F61 N64	K54-P58 WeakPolarHBondContact O-CG 3.47Å; P58-F61 CarbonylContact C-O 3.52Å; P58-F61 WeakPolarHBondContact CA-O 3.46Å; P58-N64 HydrophobicContact CG-CB 3.89Å
59	K	94.3	Very high	95.4	Very high	155 Å²	155	63.8 Å²	63.8	67%	0.674	33%	0.333	S	S	*	.	H	α-helix	trans	-74.8	-40.6	176.8	-63	172.9	178.8	167.5	0	111.1	E55 V56 L57	E55-K59 WeakPolarHBondContact O-CD 3.28Å; E55-K59 WeakPolarHBondContact O-CE 3.43Å; E55-K59 PolarHBondContact O-NZ 2.89Å; V56-K59 WeakPolarHBondContact O-CB 3.45Å; V56-K59 PolarHBondContact O-N 3.03Å; L57-K59 VanDerWaalsContact C-N 3.26Å; L57-K59 PolarHBondContact O-N 3.49Å
60	Y	93.6	Very high	95.6	Very high	42 Å²	42	62.7 Å²	62.7	17%	0.165	33%	0.33	C	S	.	.	H	α-helix	trans	-98.5	-31	-175.1	-61.9	-103.1	0	0	0	112.3	K21 L25 D28 V56 L57	K21-Y60 WeakPolarHBondContact CD-O 3.48Å; K21-Y60 WeakPolarHBondContact CE-O 3.47Å; K21-Y60 PolarHBondContact NZ-O 2.68Å; L25-Y60 HydrophobicContact CB-CD1 3.96Å; L25-Y60 HydrophobicContact CB-CE1 3.98Å; L25-Y60 HydrophobicContact CB-CG 4.41Å; L25-Y60 HydrophobicContact CD1-CD1 4.38Å; L25-Y60 HydrophobicContact CD1-CD2 3.88Å; L25-Y60 HydrophobicContact CD1-CE1 4.09Å; L25-Y60 HydrophobicContact CD1-CE2 3.6Å; L25-Y60 HydrophobicContact CD1-CG 4.31Å; L25-Y60 HydrophobicContact CD2-CG 4.45Å; D28-Y60 PolarHBondContact OD2-OH 3.01Å; V56-Y60 HydrophobicContact CG1-CD2 4.23Å; V56-Y60 HydrophobicContact CG1-CE2 4.26Å; L57-Y60 PolarHBondContact O-N 3.06Å
61	F	95.3	Very high	95.6	Very high	25 Å²	25	68.3 Å²	68.3	11%	0.11	33%	0.334	C	S	.	.	S	Bend	trans	-127.9	156	-173.5	-53.3	-75	0	0	0	112	F18 K21 L25 L57 P58 H63 F69	F18-F61 HydrophobicContact CD2-CD1 4.29Å; F18-F61 AromaticContact CD2-CE1 3.53Å; F18-F61 HydrophobicContact CD2-CE1 3.53Å; F18-F61 HydrophobicContact CD2-CZ 4.03Å; F18-F61 AromaticContact CE2-CE1 3.92Å; F18-F61 HydrophobicContact CE2-CE1 3.92Å; F18-F61 AromaticContact CE2-CZ 3.98Å; F18-F61 HydrophobicContact CE2-CZ 3.98Å; K21-F61 HydrophobicContact CB-CE1 4Å; K21-F61 HydrophobicContact CB-CZ 4.12Å; K21-F61 HydrophobicContact CD-CE1 4.36Å; L25-F61 HydrophobicContact CD2-CE2 4.25Å; L57-F61 HydrophobicContact CD2-CD2 3.71Å; L57-F61 HydrophobicContact CD2-CE2 4.07Å; L57-F61 WeakPolarHBondContact O-CA 3.48Å; L57-F61 WeakPolarHBondContact O-CB 3.42Å; L57-F61 PolarHBondContact O-N 3.25Å; L57-F61 VanDerWaalsContact O-O 3.07Å; P58-F61 CarbonylContact C-O 3.52Å; P58-F61 WeakPolarHBondContact CA-O 3.46Å; F61-H63 PolarHBondContact O-N 3.36Å; F61-F69 AromaticContact CE2-CD2 4Å; F61-F69 HydrophobicContact CE2-CD2 4Å; F61-F69 HydrophobicContact CE2-CE2 4.01Å; F61-F69 HydrophobicContact CZ-CD2 4.45Å; F61-F69 HydrophobicContact CZ-CE2 4.35Å
62	K	94.2	Very high	95.7	Very high	223 Å²	223	66.4 Å²	66.4	97%	0.97	33%	0.325	S	S	*	.	S	Bend	trans	-79.3	33.4	-178.8	-62.4	-169.7	176.6	-172.6	0	113.5
63	H	95.6	Very high	95.7	Very high	58 Å²	58	66.4 Å²	66.4	27%	0.269	33%	0.325	S	S	.	.			trans	-160	155.7	179.8	59.1	53.2	0	0	0	112.1	L57 F61 S68	L57-H63 CarbonylContact C-O 3.43Å; L57-H63 WeakPolarHBondContact CB-O 3.25Å; F61-H63 PolarHBondContact O-N 3.36Å; H63-S68 WeakPolarHBondContact NE2-CB 3.35Å
64	N	96	Very high	95.6	Very high	109 Å²	109	70 Å²	70	58%	0.583	34%	0.342	S	S	*	.			trans	-101.3	12.7	171.1	66.4	-21.1	0	0	0	113.4	A53 P58	A53-N64 WeakPolarHBondContact CB-O 3.46Å; A53-N64 CarbonylContact O-C 3.49Å; A53-N64 VanDerWaalsContact O-CA 3.22Å; A53-N64 WeakPolarHBondContact O-CA 3.18Å; A53-N64 WeakPolarHBondContact O-CB 3.39Å; A53-N64 VanDerWaalsContact O-O 3.09Å; P58-N64 HydrophobicContact CG-CB 3.89Å
65	N	96.3	Very high	95.6	Very high	81 Å²	81	65 Å²	65	43%	0.433	32%	0.322	S	S	.	.			trans	-97.8	117.1	-170.8	-170.9	-26.2	0	0	0	112.1	A67 S68 F69	N65-A67 VanDerWaalsContact C-N 3.34Å; N65-A67 PolarHBondContact O-N 3.21Å; N65-A67 WeakPolarHBondContact OD1-CB 3.38Å; N65-A67 PolarHBondContact OD1-N 3.35Å; N65-S68 WeakPolarHBondContact O-CB 3.24Å; N65-S68 PolarHBondContact O-N 3.42Å; N65-F69 PolarHBondContact O-N 2.86Å
66	M	96.1	Very high	95.6	Very high	27 Å²	27	62 Å²	62	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-40.6	176.1	-179.6	57.2	97.7	0	0	112.9	V46 Q49 F52 A53 S68 F69 V70	V46-M66 HydrophobicContact CG1-CE 3.92Å; Q49-M66 HydrophobicContact CB-CE 3.57Å; Q49-M66 HydrophobicContact CG-CE 3.73Å; F52-M66 HydrophobicContact CD1-CE 3.48Å; F52-M66 VanDerWaalsContact CD1-CE 3.48Å; F52-M66 HydrophobicContact CD1-SD 4.32Å; F52-M66 HydrophobicContact CE1-CE 3.89Å; F52-M66 HydrophobicContact CE1-SD 4.21Å; A53-M66 HydrophobicContact CB-CB 4.22Å; M66-S68 PolarHBondContact O-N 3.25Å; M66-F69 WeakPolarHBondContact O-CB 2.99Å; M66-F69 PolarHBondContact O-N 3.16Å; M66-F69 HydrophobicContact SD-CB 4.44Å; M66-F69 HydrophobicContact SD-CD1 3.82Å; M66-V70 HydrophobicContact CG-CG2 4.13Å; M66-V70 WeakPolarHBondContact O-CG2 3.18Å; M66-V70 PolarHBondContact O-N 2.65Å; M66-V70 HydrophobicContact SD-CG2 3.89Å
67	A	95.9	Very high	95.6	Very high	64 Å²	64	62.9 Å²	62.9	53%	0.529	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-31	180	0	0	0	0	0	112.1	N65 R71	N65-A67 VanDerWaalsContact C-N 3.34Å; N65-A67 PolarHBondContact O-N 3.21Å; N65-A67 WeakPolarHBondContact OD1-CB 3.38Å; N65-A67 PolarHBondContact OD1-N 3.35Å; A67-R71 WeakPolarHBondContact O-CB 3.25Å; A67-R71 PolarHBondContact O-N 2.87Å
68	S	96.1	Very high	95.7	Very high	42 Å²	42	63.2 Å²	63.2	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-69.2	-38.9	173.1	-61.4	0	0	0	0	112.4	H63 N65 M66 Q72	H63-S68 WeakPolarHBondContact NE2-CB 3.35Å; N65-S68 WeakPolarHBondContact O-CB 3.24Å; N65-S68 PolarHBondContact O-N 3.42Å; M66-S68 PolarHBondContact O-N 3.25Å; S68-Q72 WeakPolarHBondContact O-CG 3.34Å; S68-Q72 PolarHBondContact O-N 3.04Å; S68-Q72 VanDerWaalsContact O-N 3.09Å
69	F	97.4	Very high	95.7	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-50.6	174.4	176.6	-102.9	0	0	0	111.4	F18 L22 I35 F44 V46 F52 L57 F61 N65 M66 R71 Q72 L73	F18-F69 HydrophobicContact CE2-CD2 4.14Å; F18-F69 HydrophobicContact CE2-CE2 4.38Å; F18-F69 HydrophobicContact CZ-CD2 4.45Å; F18-F69 HydrophobicContact CZ-CE2 4.44Å; L22-F69 HydrophobicContact CD1-CE2 3.72Å; L22-F69 HydrophobicContact CD1-CZ 3.62Å; I35-F69 HydrophobicContact CD1-CZ 4.28Å; F44-F69 HydrophobicContact CE2-CZ 4.37Å; V46-F69 HydrophobicContact CG2-CE1 4.47Å; F52-F69 HydrophobicContact CE1-CD1 4.04Å; F52-F69 AromaticContact CE1-CE1 3.99Å; F52-F69 HydrophobicContact CE1-CE1 3.99Å; F52-F69 HydrophobicContact CE1-CG 4.4Å; F52-F69 HydrophobicContact CE1-CZ 4.31Å; F52-F69 HydrophobicContact CZ-CD1 4.42Å; F52-F69 HydrophobicContact CZ-CE1 4Å; F52-F69 HydrophobicContact CZ-CE2 4.21Å; F52-F69 AromaticContact CZ-CZ 3.88Å; F52-F69 HydrophobicContact CZ-CZ 3.88Å; L57-F69 HydrophobicContact CD1-CB 4.04Å; L57-F69 HydrophobicContact CD2-CB 3.95Å; L57-F69 HydrophobicContact CD2-CD2 3.59Å; L57-F69 HydrophobicContact CD2-CE2 4.21Å; L57-F69 HydrophobicContact CD2-CG 3.83Å; F61-F69 AromaticContact CE2-CD2 4Å; F61-F69 HydrophobicContact CE2-CD2 4Å; F61-F69 HydrophobicContact CE2-CE2 4.01Å; F61-F69 HydrophobicContact CZ-CD2 4.45Å; F61-F69 HydrophobicContact CZ-CE2 4.35Å; N65-F69 PolarHBondContact O-N 2.86Å; M66-F69 WeakPolarHBondContact O-CB 2.99Å; M66-F69 PolarHBondContact O-N 3.16Å; M66-F69 HydrophobicContact SD-CB 4.44Å; M66-F69 HydrophobicContact SD-CD1 3.82Å; F69-R71 VanDerWaalsContact C-N 3.32Å; F69-R71 PolarHBondContact O-N 3.33Å; F69-Q72 WeakPolarHBondContact O-CB 3.35Å; F69-Q72 PolarHBondContact O-N 3.42Å; F69-Q72 VanDerWaalsContact O-N 3.08Å; F69-L73 HydrophobicContact CD1-CD1 4.01Å; F69-L73 HydrophobicContact CE1-CD1 3.62Å; F69-L73 HydrophobicContact CE1-CG 4.37Å; F69-L73 HydrophobicContact CZ-CD1 4.13Å; F69-L73 PolarHBondContact O-N 3.14Å
70	V	96.5	Very high	95.8	Very high	36 Å²	36	67 Å²	67	22%	0.218	32%	0.324	C	S	.	.	H	α-helix	trans	-62.6	-37	176.5	178.3	0	0	0	0	111.8	M66 Q72 L73 N74 F99	M66-V70 HydrophobicContact CG-CG2 4.13Å; M66-V70 WeakPolarHBondContact O-CG2 3.18Å; M66-V70 PolarHBondContact O-N 2.65Å; M66-V70 HydrophobicContact SD-CG2 3.89Å; V70-Q72 VanDerWaalsContact C-N 3.34Å; V70-Q72 PolarHBondContact O-N 3.03Å; V70-L73 PolarHBondContact O-N 2.89Å; V70-N74 WeakPolarHBondContact O-CB 3.43Å; V70-N74 VanDerWaalsContact O-CG 3.27Å; V70-N74 PolarHBondContact O-N 2.51Å; V70-N74 PolarHBondContact O-ND2 3.45Å; V70-F99 HydrophobicContact CG1-CE1 4.35Å; V70-F99 HydrophobicContact CG1-CZ 4.32Å; V70-F99 HydrophobicContact CG2-CZ 3.87Å
71	R	95.3	Very high	95.7	Very high	176 Å²	176	67.1 Å²	67.1	66%	0.664	33%	0.328	S	S	*	.	H	α-helix	trans	-59.9	-42.9	172.3	-179.8	174.5	-177.9	145.1	1.6	111.8	A67 F69 N74 M75	A67-R71 WeakPolarHBondContact O-CB 3.25Å; A67-R71 PolarHBondContact O-N 2.87Å; F69-R71 VanDerWaalsContact C-N 3.32Å; F69-R71 PolarHBondContact O-N 3.33Å; R71-N74 PolarHBondContact O-N 2.74Å; R71-M75 WeakPolarHBondContact O-CG 3.46Å; R71-M75 PolarHBondContact O-N 2.95Å
72	Q	95.6	Very high	95.2	Very high	48 Å²	48	71 Å²	71	22%	0.224	35%	0.353	C	S	.	.	H	α-helix	trans	-64.8	-45.7	176.6	-74.1	-79.5	104	0	0	111.4	F18 S68 F69 V70 N74 M75 Y76	F18-Q72 HydrophobicContact CD1-CB 4.27Å; F18-Q72 HydrophobicContact CD2-CB 3.75Å; F18-Q72 HydrophobicContact CD2-CG 4.11Å; F18-Q72 HydrophobicContact CE1-CB 3.94Å; F18-Q72 HydrophobicContact CE2-CB 3.38Å; F18-Q72 HydrophobicContact CE2-CG 4.12Å; F18-Q72 HydrophobicContact CG-CB 4.19Å; F18-Q72 HydrophobicContact CZ-CB 3.49Å; F18-Q72 VanDerWaalsContact CZ-CB 3.49Å; S68-Q72 WeakPolarHBondContact O-CG 3.34Å; S68-Q72 PolarHBondContact O-N 3.04Å; S68-Q72 VanDerWaalsContact O-N 3.09Å; F69-Q72 WeakPolarHBondContact O-CB 3.35Å; F69-Q72 PolarHBondContact O-N 3.42Å; F69-Q72 VanDerWaalsContact O-N 3.08Å; V70-Q72 VanDerWaalsContact C-N 3.34Å; V70-Q72 PolarHBondContact O-N 3.03Å; Q72-N74 VanDerWaalsContact C-N 3.34Å; Q72-N74 PolarHBondContact O-N 3.14Å; Q72-M75 PolarHBondContact O-N 3.1Å; Q72-M75 VanDerWaalsContact O-N 3.1Å; Q72-Y76 WeakPolarHBondContact O-CD2 3.43Å; Q72-Y76 PolarHBondContact O-N 2.85Å
73	L	96.8	Very high	94.3	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-52.5	-50.4	172.9	-68.5	177.4	0	0	0	111.7	F18 L22 F44 F69 V70 M75 Y76 G77 F78 F99	F18-L73 HydrophobicContact CE1-CD2 4.07Å; F18-L73 HydrophobicContact CZ-CD2 3.86Å; F18-L73 HydrophobicContact CZ-CG 4.16Å; L22-L73 HydrophobicContact CD1-CD2 4.32Å; L22-L73 HydrophobicContact CD2-CD2 3.51Å; F44-L73 HydrophobicContact CE1-CD2 4.35Å; F44-L73 HydrophobicContact CZ-CD1 3.97Å; F44-L73 HydrophobicContact CZ-CD2 3.84Å; F69-L73 HydrophobicContact CD1-CD1 4.01Å; F69-L73 HydrophobicContact CE1-CD1 3.62Å; F69-L73 HydrophobicContact CE1-CG 4.37Å; F69-L73 HydrophobicContact CZ-CD1 4.13Å; F69-L73 PolarHBondContact O-N 3.14Å; V70-L73 PolarHBondContact O-N 2.89Å; L73-M75 VanDerWaalsContact C-N 3.32Å; L73-M75 PolarHBondContact O-N 3.31Å; L73-Y76 CarbonylContact O-C 3.57Å; L73-Y76 WeakPolarHBondContact O-CA 3.3Å; L73-Y76 PolarHBondContact O-N 3.35Å; L73-G77 PolarHBondContact O-N 2.8Å; L73-G77 VanDerWaalsContact O-N 3.17Å; L73-F78 HydrophobicContact CB-CB 3.96Å; L73-F78 HydrophobicContact CB-CG 4.32Å; L73-F78 HydrophobicContact CD2-CB 4.38Å; L73-F78 HydrophobicContact CD2-CD1 4.06Å; L73-F78 HydrophobicContact CD2-CD2 4.03Å; L73-F78 HydrophobicContact CD2-CE1 4.35Å; L73-F78 HydrophobicContact CD2-CE2 4.33Å; L73-F78 HydrophobicContact CD2-CG 3.9Å; L73-F78 HydrophobicContact CD2-CZ 4.48Å; L73-F78 WeakPolarHBondContact O-CB 3.37Å; L73-F78 WeakPolarHBondContact O-CD2 3.39Å; L73-F78 PolarHBondContact O-N 3.24Å; L73-F78 VanDerWaalsContact O-N 3.12Å; L73-F99 HydrophobicContact CD1-CB 4.45Å; L73-F99 HydrophobicContact CD1-CD1 3.85Å; L73-F99 HydrophobicContact CD1-CD2 3.77Å; L73-F99 HydrophobicContact CD1-CE1 3.94Å; L73-F99 HydrophobicContact CD1-CE2 3.84Å; L73-F99 HydrophobicContact CD1-CG 3.77Å; L73-F99 HydrophobicContact CD1-CZ 3.94Å
74	N	95.8	Very high	93.1	Very high	85 Å²	85	69.9 Å²	69.9	46%	0.455	36%	0.355	S	S	.	.	H	α-helix	trans	-61.5	-36.6	177.7	-69.8	-18.4	0	0	0	112.8	V70 R71 Q72 Y76 G77	V70-N74 WeakPolarHBondContact O-CB 3.43Å; V70-N74 VanDerWaalsContact O-CG 3.27Å; V70-N74 PolarHBondContact O-N 2.51Å; V70-N74 PolarHBondContact O-ND2 3.45Å; R71-N74 PolarHBondContact O-N 2.74Å; Q72-N74 VanDerWaalsContact C-N 3.34Å; Q72-N74 PolarHBondContact O-N 3.14Å; N74-Y76 VanDerWaalsContact C-N 3.26Å; N74-Y76 PolarHBondContact O-N 3.17Å; N74-G77 PolarHBondContact O-N 2.86Å
75	M	94.3	Very high	91.6	Very high	45 Å²	45	72.1 Å²	72.1	22%	0.222	36%	0.362	C	S	.	.	H	α-helix	trans	-69.4	-20.6	174.3	-72.1	-163.3	85.7	0	0	113.6	R71 Q72 L73 R117 K118	R71-M75 WeakPolarHBondContact O-CG 3.46Å; R71-M75 PolarHBondContact O-N 2.95Å; Q72-M75 PolarHBondContact O-N 3.1Å; Q72-M75 VanDerWaalsContact O-N 3.1Å; L73-M75 VanDerWaalsContact C-N 3.32Å; L73-M75 PolarHBondContact O-N 3.31Å; M75-R117 HydrophobicContact CB-CG 4.31Å; M75-R117 HydrophobicContact CE-CG 4.5Å; M75-R117 CarbonylContact O-C 3.59Å; M75-R117 WeakPolarHBondContact O-CA 3.33Å; M75-R117 PolarHBondContact SD-NH2 3.46Å; M75-K118 PolarHBondContact O-N 3.13Å
76	Y	95.9	Very high	89.6	Confident	16 Å²	16	77.5 Å²	77.5	6%	0.063	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	11.7	172	-70.2	-68.9	0	0	0	113.2	P16 F18 L19 Q72 L73 N74 F78 I115 R117	P16-Y76 HydrophobicContact CB-CE1 3.96Å; P16-Y76 VanDerWaalsContact CB-OH 3.27Å; P16-Y76 WeakPolarHBondContact CB-OH 3.2Å; P16-Y76 HydrophobicContact CG-CE1 3.86Å; F18-Y76 HydrophobicContact CB-CE2 4Å; F18-Y76 AromaticContact CD1-CD2 3.35Å; F18-Y76 HydrophobicContact CD1-CD2 3.35Å; F18-Y76 AromaticContact CD1-CE2 3.42Å; F18-Y76 HydrophobicContact CD1-CE2 3.42Å; F18-Y76 VanDerWaalsContact CD1-CE2 3.42Å; F18-Y76 HydrophobicContact CD1-CG 4.41Å; F18-Y76 AromaticContact CE1-CD2 3.73Å; F18-Y76 HydrophobicContact CE1-CD2 3.73Å; F18-Y76 HydrophobicContact CE1-CE2 4.21Å; F18-Y76 HydrophobicContact CG-CD2 4.29Å; F18-Y76 AromaticContact CG-CE2 3.92Å; F18-Y76 HydrophobicContact CG-CE2 3.92Å; L19-Y76 HydrophobicContact CD1-CD1 3.97Å; L19-Y76 HydrophobicContact CD1-CE1 4.22Å; L19-Y76 HydrophobicContact CD1-CG 4.42Å; L19-Y76 HydrophobicContact CD2-CD1 4.28Å; L19-Y76 HydrophobicContact CD2-CD2 4.14Å; L19-Y76 HydrophobicContact CD2-CG 3.89Å; L19-Y76 HydrophobicContact CG-CD1 4.26Å; L19-Y76 HydrophobicContact CG-CD2 4.48Å; L19-Y76 HydrophobicContact CG-CE1 4.47Å; L19-Y76 HydrophobicContact CG-CG 4.29Å; Q72-Y76 WeakPolarHBondContact O-CD2 3.43Å; Q72-Y76 PolarHBondContact O-N 2.85Å; L73-Y76 CarbonylContact O-C 3.57Å; L73-Y76 WeakPolarHBondContact O-CA 3.3Å; L73-Y76 PolarHBondContact O-N 3.35Å; N74-Y76 VanDerWaalsContact C-N 3.26Å; N74-Y76 PolarHBondContact O-N 3.17Å; Y76-F78 VanDerWaalsContact C-N 3.3Å; Y76-F78 PolarHBondContact O-N 3.37Å; Y76-I115 HydrophobicContact CD1-CG2 4.27Å; Y76-I115 HydrophobicContact CG-CG2 4.47Å; Y76-I115 WeakPolarHBondContact O-CG2 3.47Å; Y76-R117 HydrophobicContact CD1-CB 4.06Å; Y76-R117 HydrophobicContact CD1-CG 4.34Å; Y76-R117 HydrophobicContact CE1-CB 3.55Å; Y76-R117 HydrophobicContact CE1-CG 3.84Å
77	G	95.4	Very high	87.8	Confident	23 Å²	23	78.9 Å²	78.9	24%	0.237	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	8	172.7	0	0	0	0	0	115.5	L73 N74	L73-G77 PolarHBondContact O-N 2.8Å; L73-G77 VanDerWaalsContact O-N 3.17Å; N74-G77 PolarHBondContact O-N 2.86Å
78	F	97.4	Very high	85.9	Confident	6 Å²	6	80.4 Å²	80.4	3%	0.026	43%	0.428	C	S	.	.			trans	-60.2	152.2	169.5	-70.9	-105.8	0	0	0	110.4	L19 L22 F44 L73 Y76 Q100 H101 F104 I115	L19-F78 HydrophobicContact CD2-CE2 3.73Å; L19-F78 HydrophobicContact CD2-CZ 4.14Å; L22-F78 HydrophobicContact CD2-CE1 4.03Å; L22-F78 HydrophobicContact CD2-CE2 4.28Å; L22-F78 HydrophobicContact CD2-CZ 3.7Å; F44-F78 AromaticContact CE1-CD1 3.94Å; F44-F78 HydrophobicContact CE1-CD1 3.94Å; F44-F78 AromaticContact CE1-CE1 3.8Å; F44-F78 HydrophobicContact CE1-CE1 3.8Å; L73-F78 HydrophobicContact CB-CB 3.96Å; L73-F78 HydrophobicContact CB-CG 4.32Å; L73-F78 HydrophobicContact CD2-CB 4.38Å; L73-F78 HydrophobicContact CD2-CD1 4.06Å; L73-F78 HydrophobicContact CD2-CD2 4.03Å; L73-F78 HydrophobicContact CD2-CE1 4.35Å; L73-F78 HydrophobicContact CD2-CE2 4.33Å; L73-F78 HydrophobicContact CD2-CG 3.9Å; L73-F78 HydrophobicContact CD2-CZ 4.48Å; L73-F78 WeakPolarHBondContact O-CB 3.37Å; L73-F78 WeakPolarHBondContact O-CD2 3.39Å; L73-F78 PolarHBondContact O-N 3.24Å; L73-F78 VanDerWaalsContact O-N 3.12Å; Y76-F78 VanDerWaalsContact C-N 3.3Å; Y76-F78 PolarHBondContact O-N 3.37Å; F78-Q100 WeakPolarHBondContact CA-O 3.4Å; F78-H101 HydrophobicContact CD1-CB 3.53Å; F78-H101 HydrophobicContact CD2-CB 4.14Å; F78-H101 HydrophobicContact CE1-CB 3.6Å; F78-H101 HydrophobicContact CE2-CB 4.2Å; F78-H101 HydrophobicContact CG-CB 3.81Å; F78-H101 HydrophobicContact CZ-CB 3.95Å; F78-F104 HydrophobicContact CE1-CB 3.77Å; F78-F104 AromaticContact CE1-CD1 3.83Å; F78-F104 HydrophobicContact CE1-CD1 3.83Å; F78-F104 AromaticContact CE1-CD2 3.97Å; F78-F104 HydrophobicContact CE1-CD2 3.97Å; F78-F104 HydrophobicContact CE1-CE1 4.42Å; F78-F104 AromaticContact CE1-CG 3.58Å; F78-F104 HydrophobicContact CE1-CG 3.58Å; F78-F104 HydrophobicContact CZ-CB 3.86Å; F78-F104 HydrophobicContact CZ-CD1 4.33Å; F78-F104 AromaticContact CZ-CD2 3.61Å; F78-F104 HydrophobicContact CZ-CD2 3.61Å; F78-F104 HydrophobicContact CZ-CE2 4.23Å; F78-F104 AromaticContact CZ-CG 3.67Å; F78-F104 HydrophobicContact CZ-CG 3.67Å; F78-I115 HydrophobicContact CE2-CG2 4.27Å; F78-I115 HydrophobicContact CZ-CD1 4.3Å
79	R	96.2	Very high	84.1	Confident	194 Å²	194	86.5 Å²	86.5	73%	0.732	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	134.8	178.4	-61	178.3	-178.7	-91.3	4.1	108.8	F99 Q100	R79-F99 WeakPolarHBondContact O-CA 3.29Å; R79-Q100 PolarHBondContact N-O 3.26Å; R79-Q100 PolarHBondContact O-N 3.39Å
80	K	95.6	Very high	82.3	Confident	108 Å²	108	92.4 Å²	92.4	47%	0.47	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	129.6	164.7	171.8	164.7	179.6	155.4	0	108.1	T97 E98 F99	K80-T97 HydrophobicContact CD-CG2 3.58Å; K80-T97 HydrophobicContact CG-CG2 4.04Å; K80-T97 PolarHBondContact NZ-OG1 3.09Å; K80-E98 WeakPolarHBondContact CA-O 3.4Å; K80-F99 HydrophobicContact CB-CD1 4.09Å; K80-F99 HydrophobicContact CB-CE1 3.89Å
81	V	93	Very high	80.5	Confident	44 Å²	44	98.3 Å²	98.3	27%	0.267	52%	0.515	S	S	.	.			trans	-81	139.7	168.7	-174.2	0	0	0	0	108.1	E98 Q100	V81-E98 HydrophobicContact CB-CB 4.11Å; V81-E98 HydrophobicContact CB-CG 4.15Å; V81-E98 WeakPolarHBondContact CB-OE2 3.25Å; V81-E98 VanDerWaalsContact CG1-OE2 3.3Å; V81-E98 WeakPolarHBondContact CG1-OE2 3.45Å; V81-E98 HydrophobicContact CG2-CB 4.41Å; V81-E98 HydrophobicContact CG2-CG 3.94Å; V81-E98 WeakPolarHBondContact CG2-OE2 3.39Å; V81-E98 PolarHBondContact N-O 3.05Å; V81-Q100 HydrophobicContact CG2-CB 3.98Å
82	V	84.6	Confident	78.9	Confident	105 Å²	105	94.3 Å²	94.3	64%	0.636	51%	0.512	S	S	*	.			trans	-112.1	104	-179.4	-178.2	0	0	0	0	108	I84	V82-I84 HydrophobicContact CG1-CG1 4.15Å; V82-I84 PolarHBondContact O-N 3.12Å
83	H	74.9	Confident	77.4	Confident	101 Å²	101	101.4 Å²	101.4	47%	0.468	55%	0.545	S	S	.	.			trans	-70.9	105.5	170.4	-70	92.5	0	0	0	108.7	E85 E98	H83-E85 HydrophobicContact CB-CG 4.41Å; H83-E85 IonicContact CD2-OE1 3.98Å; H83-E85 PolarHBondContact O-N 2.92Å; H83-E85 VanDerWaalsContact O-N 3.12Å; H83-E98 IonicContact CE1-OE2 3.18Å; H83-E98 PolarHBondContact CE1-OE2 3.18Å; H83-E98 IonicContact NE2-OE2 2.63Å
84	I	70.3	Confident	76.1	Confident	157 Å²	157	108.3 Å²	108.3	81%	0.805	57%	0.571	S	S	*	*			trans	-87.7	62	179.3	-47.2	179.4	0	0	0	108.8	V82 Q86	V82-I84 HydrophobicContact CG1-CG1 4.15Å; V82-I84 PolarHBondContact O-N 3.12Å; I84-Q86 PolarHBondContact O-N 3.27Å
85	E	64.9	Low	75.5	Confident	156 Å²	156	107.9 Å²	107.9	73%	0.729	57%	0.569	S	S	*	*			trans	-85.9	97.2	-178.4	-69.5	-171.3	-155.8	0	0	111.2	H83 G87	H83-E85 HydrophobicContact CB-CG 4.41Å; H83-E85 IonicContact CD2-OE1 3.98Å; H83-E85 PolarHBondContact O-N 2.92Å; H83-E85 VanDerWaalsContact O-N 3.12Å; E85-G87 PolarHBondContact O-N 2.77Å
86	Q	54.5	Low	75.3	Confident	195 Å²	195	108.5 Å²	108.5	91%	0.911	57%	0.573	S	S	*	*	S	Bend	trans	37.6	74.1	148.3	-63.2	-177.8	-14.3	0	0	117.7	I84	I84-Q86 PolarHBondContact O-N 3.27Å
87	G	57.1	Low	75.2	Confident	55 Å²	55	108.1 Å²	108.1	57%	0.567	57%	0.572	S	S	*	*			trans	88.1	115	161.2	0	0	0	0	0	114.3	E85 L89	E85-G87 PolarHBondContact O-N 2.77Å; G87-L89 PolarHBondContact O-N 3Å
88	G	55.9	Low	75.2	Confident	97 Å²	97	108 Å²	108	100%	1	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	42.5	-174.3	0	0	0	0	0	116.3
89	L	58.3	Low	75.2	Confident	170 Å²	170	108 Å²	108	89%	0.89	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	-25.3	176.6	-165.5	66.2	0	0	0	112.8	G87 K91	G87-L89 PolarHBondContact O-N 3Å; L89-K91 PolarHBondContact O-N 3.33Å
90	V	60	Low	75.3	Confident	124 Å²	124	102.3 Å²	102.3	75%	0.752	55%	0.547	S	S	*	.	S	Bend	trans	-87.1	108.6	170.3	-176.9	0	0	0	0	108.3
91	K	58.7	Low	75.4	Confident	159 Å²	159	98.5 Å²	98.5	69%	0.691	53%	0.531	S	S	*	.			trans	-63.2	130.4	167.1	-171.6	-170.3	175.3	-167	0	107.8	L89 E93	L89-K91 PolarHBondContact O-N 3.33Å; K91-E93 PolarHBondContact O-N 3.39Å
92	P	62.2	Low	75.5	Confident	93 Å²	93	101.3 Å²	101.3	60%	0.604	55%	0.55	S	S	*	*			trans	-50.6	137.5	172.1	-28.4	36.1	0	0	0	111.3	R94	P92-R94 WeakPolarHBondContact CB-O 3.46Å; P92-R94 PolarHBondContact O-N 3.08Å; P92-R94 VanDerWaalsContact O-N 3.15Å
93	E	63.3	Low	76	Confident	197 Å²	197	98.1 Å²	98.1	92%	0.921	53%	0.532	S	S	*	.	S	Bend	trans	-60.2	-27.7	-176.5	-170.4	179.5	156	0	0	112	K91	K91-E93 PolarHBondContact O-N 3.39Å
94	R	69.8	Low	77.1	Confident	145 Å²	145	93.3 Å²	93.3	55%	0.547	51%	0.51	S	S	.	.	S	Bend	trans	-135.3	154	176.3	-48.5	-162.3	77.1	128.5	-0.5	110.9	D48 P92 D96	D48-R94 IonicContact OD1-NE 3.85Å; D48-R94 IonicContact OD2-CZ 3.48Å; D48-R94 IonicContact OD2-NE 3.44Å; D48-R94 PolarHBondContact OD2-NE 2.77Å; D48-R94 IonicContact OD2-NH2 2.68Å; D48-R94 PolarHBondContact OD2-NH2 2.88Å; P92-R94 WeakPolarHBondContact CB-O 3.46Å; P92-R94 PolarHBondContact O-N 3.08Å; P92-R94 VanDerWaalsContact O-N 3.15Å; R94-D96 PolarHBondContact O-N 3.09Å
95	D	83.1	Confident	78.3	Confident	76 Å²	76	87.6 Å²	87.6	41%	0.406	48%	0.481	S	S	.	.			trans	-78.9	60.7	178.8	-73.7	-18.1	0	0	0	111.5
96	D	89.8	Confident	79.8	Confident	58 Å²	58	85.6 Å²	85.6	31%	0.31	47%	0.466	S	S	.	.			trans	-67.7	143.7	174.2	-171.2	6.8	0	0	0	111.5	H45 F47 R94	H45-D96 WeakPolarHBondContact CB-OD1 3.44Å; H45-D96 IonicContact CE1-OD2 3.16Å; H45-D96 IonicContact CG-OD1 2.88Å; H45-D96 IonicContact CG-OD2 2.7Å; H45-D96 IonicContact ND1-OD1 3.64Å; H45-D96 PolarHBondContact ND1-OD1 3.13Å; H45-D96 VanDerWaalsContact ND1-OD1 3.12Å; H45-D96 IonicContact ND1-OD2 2.77Å; H45-D96 PolarHBondContact ND1-OD2 3.45Å; F47-D96 HydrophobicContact CD1-CB 3.89Å; F47-D96 HydrophobicContact CE1-CB 3.96Å; R94-D96 PolarHBondContact O-N 3.09Å
97	T	93.8	Very high	81.6	Confident	8 Å²	8	79 Å²	79	5%	0.049	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	107.7	166.9	-73.6	0	0	0	0	110.1	V46 Q49 K80 F99	V46-T97 PolarHBondContact N-O 2.95Å; V46-T97 PolarHBondContact O-N 3.39Å; Q49-T97 PolarHBondContact NE2-OG1 3.19Å; K80-T97 HydrophobicContact CD-CG2 3.58Å; K80-T97 HydrophobicContact CG-CG2 4.04Å; K80-T97 PolarHBondContact NZ-OG1 3.09Å; T97-F99 HydrophobicContact CG2-CD2 4.13Å; T97-F99 HydrophobicContact CG2-CE1 4.37Å; T97-F99 HydrophobicContact CG2-CE2 3.49Å; T97-F99 VanDerWaalsContact CG2-CE2 3.49Å; T97-F99 HydrophobicContact CG2-CZ 3.62Å
98	E	95.9	Very high	83.3	Confident	20 Å²	20	80.2 Å²	80.2	9%	0.093	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	138.7	173.4	-175.7	-169.2	-169.4	0	0	112	S43 F44 K80 V81 H83	S43-E98 WeakPolarHBondContact CB-OE1 3.15Å; S43-E98 PolarHBondContact OG-OE1 3.28Å; F44-E98 CarbonylContact O-C 3.45Å; F44-E98 VanDerWaalsContact O-CA 3.28Å; F44-E98 WeakPolarHBondContact O-CA 3.46Å; K80-E98 WeakPolarHBondContact CA-O 3.4Å; V81-E98 HydrophobicContact CB-CB 4.11Å; V81-E98 HydrophobicContact CB-CG 4.15Å; V81-E98 WeakPolarHBondContact CB-OE2 3.25Å; V81-E98 VanDerWaalsContact CG1-OE2 3.3Å; V81-E98 WeakPolarHBondContact CG1-OE2 3.45Å; V81-E98 HydrophobicContact CG2-CB 4.41Å; V81-E98 HydrophobicContact CG2-CG 3.94Å; V81-E98 WeakPolarHBondContact CG2-OE2 3.39Å; V81-E98 PolarHBondContact N-O 3.05Å; H83-E98 IonicContact CE1-OE2 3.18Å; H83-E98 PolarHBondContact CE1-OE2 3.18Å; H83-E98 IonicContact NE2-OE2 2.63Å
99	F	97.6	Very high	85.1	Confident	7 Å²	7	79.7 Å²	79.7	3%	0.031	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	140.6	169.2	-66.2	-82.6	0	0	0	111.7	S43 F44 V46 V70 L73 R79 K80 T97	S43-F99 WeakPolarHBondContact CA-O 3.36Å; S43-F99 WeakPolarHBondContact CB-O 3.36Å; F44-F99 HydrophobicContact CD1-CB 4.29Å; F44-F99 HydrophobicContact CE1-CB 3.73Å; F44-F99 HydrophobicContact CE2-CB 4.11Å; F44-F99 AromaticContact CE2-CD2 3.92Å; F44-F99 HydrophobicContact CE2-CD2 3.92Å; F44-F99 HydrophobicContact CE2-CG 4.43Å; F44-F99 HydrophobicContact CZ-CB 3.62Å; F44-F99 HydrophobicContact CZ-CD2 4.05Å; F44-F99 HydrophobicContact CZ-CG 4.15Å; F44-F99 PolarHBondContact N-O 3.4Å; F44-F99 PolarHBondContact O-N 2.69Å; V46-F99 HydrophobicContact CG2-CD2 4.22Å; V46-F99 HydrophobicContact CG2-CE2 4.32Å; V70-F99 HydrophobicContact CG1-CE1 4.35Å; V70-F99 HydrophobicContact CG1-CZ 4.32Å; V70-F99 HydrophobicContact CG2-CZ 3.87Å; L73-F99 HydrophobicContact CD1-CB 4.45Å; L73-F99 HydrophobicContact CD1-CD1 3.85Å; L73-F99 HydrophobicContact CD1-CD2 3.77Å; L73-F99 HydrophobicContact CD1-CE1 3.94Å; L73-F99 HydrophobicContact CD1-CE2 3.84Å; L73-F99 HydrophobicContact CD1-CG 3.77Å; L73-F99 HydrophobicContact CD1-CZ 3.94Å; R79-F99 WeakPolarHBondContact O-CA 3.29Å; K80-F99 HydrophobicContact CB-CD1 4.09Å; K80-F99 HydrophobicContact CB-CE1 3.89Å; T97-F99 HydrophobicContact CG2-CD2 4.13Å; T97-F99 HydrophobicContact CG2-CE1 4.37Å; T97-F99 HydrophobicContact CG2-CE2 3.49Å; T97-F99 VanDerWaalsContact CG2-CE2 3.49Å; T97-F99 HydrophobicContact CG2-CZ 3.62Å
100	Q	97.3	Very high	86.7	Confident	74 Å²	74	77 Å²	77	35%	0.346	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	144.3	-179.9	176.6	162.3	87.4	0	0	112.3	N42 F78 R79 V81	N42-Q100 PolarHBondContact ND2-NE2 2.88Å; N42-Q100 WeakPolarHBondContact O-CG 3.41Å; N42-Q100 PolarHBondContact O-NE2 3.18Å; N42-Q100 VanDerWaalsContact O-NE2 3.1Å; F78-Q100 WeakPolarHBondContact CA-O 3.4Å; R79-Q100 PolarHBondContact N-O 3.26Å; R79-Q100 PolarHBondContact O-N 3.39Å; V81-Q100 HydrophobicContact CG2-CB 3.98Å
101	H	97.8	Very high	88.3	Confident	28 Å²	28	73.1 Å²	73.1	13%	0.13	37%	0.371	C	S	.	.			trans	-145.5	133.2	162.8	-179.1	-89.9	0	0	0	109.9	F78 C103 F104	F78-H101 HydrophobicContact CD1-CB 3.53Å; F78-H101 HydrophobicContact CD2-CB 4.14Å; F78-H101 HydrophobicContact CE1-CB 3.6Å; F78-H101 HydrophobicContact CE2-CB 4.2Å; F78-H101 HydrophobicContact CG-CB 3.81Å; F78-H101 HydrophobicContact CZ-CB 3.95Å; H101-C103 VanDerWaalsContact C-N 3.25Å; H101-C103 PolarHBondContact ND1-N 3.16Å; H101-C103 VanDerWaalsContact ND1-N 3.19Å; H101-C103 PolarHBondContact O-N 2.94Å; H101-C103 VanDerWaalsContact O-N 3.09Å; H101-F104 HydrophobicContact CB-CB 3.96Å; H101-F104 PolarHBondContact O-N 2.69Å
102	P	96.1	Very high	90	Very high	103 Å²	103	65.6 Å²	65.6	67%	0.669	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.3	-172.3	-28.6	36.1	0	0	0	115.9
103	C	95.6	Very high	91.5	Very high	37 Å²	37	66 Å²	66	25%	0.25	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	14.4	178.5	-46.3	0	0	0	0	113.5	H101 L111 N114 I115	H101-C103 VanDerWaalsContact C-N 3.25Å; H101-C103 PolarHBondContact ND1-N 3.16Å; H101-C103 VanDerWaalsContact ND1-N 3.19Å; H101-C103 PolarHBondContact O-N 2.94Å; H101-C103 VanDerWaalsContact O-N 3.09Å; C103-L111 HydrophobicContact CB-CB 4.24Å; C103-L111 CarbonylContact O-C 3.46Å; C103-L111 VanDerWaalsContact O-CB 3.25Å; C103-L111 WeakPolarHBondContact O-CB 3.47Å; C103-N114 HydrophobicContact CB-CB 4.28Å; C103-I115 HydrophobicContact CB-CG1 3.93Å
104	F	97.3	Very high	92.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.31	C	S	.	.			trans	-114	89.7	177.1	-172.5	-94.1	0	0	0	109.2	L22 W23 V26 W37 F44 F78 H101 L112 I115	L22-F104 HydrophobicContact CB-CE2 4.41Å; L22-F104 HydrophobicContact CD2-CD2 4.48Å; L22-F104 HydrophobicContact CD2-CE2 3.82Å; L22-F104 HydrophobicContact CD2-CZ 3.92Å; L22-F104 HydrophobicContact CG-CE2 3.92Å; L22-F104 HydrophobicContact CG-CZ 3.72Å; W23-F104 HydrophobicContact CB-CE2 3.85Å; W23-F104 HydrophobicContact CB-CZ 4.2Å; W23-F104 AromaticContact CD1-CE2 4Å; W23-F104 HydrophobicContact CG-CE2 4.36Å; V26-F104 HydrophobicContact CG2-CE1 4.41Å; V26-F104 HydrophobicContact CG2-CZ 4.26Å; W37-F104 HydrophobicContact CE3-CE1 4.46Å; W37-F104 AromaticContact CH2-CD1 3.56Å; W37-F104 HydrophobicContact CH2-CD1 3.56Å; W37-F104 AromaticContact CH2-CE1 3.22Å; W37-F104 HydrophobicContact CH2-CE1 3.22Å; W37-F104 HydrophobicContact CH2-CG 4.34Å; W37-F104 AromaticContact CH2-CZ 3.75Å; W37-F104 HydrophobicContact CH2-CZ 3.75Å; W37-F104 HydrophobicContact CZ2-CE1 4.05Å; W37-F104 HydrophobicContact CZ2-CZ 4.27Å; W37-F104 AromaticContact CZ3-CD1 3.59Å; W37-F104 HydrophobicContact CZ3-CD1 3.59Å; W37-F104 AromaticContact CZ3-CE1 3.48Å; W37-F104 HydrophobicContact CZ3-CE1 3.48Å; W37-F104 VanDerWaalsContact CZ3-CE1 3.48Å; W37-F104 HydrophobicContact CZ3-CZ 4.44Å; F44-F104 HydrophobicContact CD1-CD1 4.03Å; F44-F104 AromaticContact CD1-CE1 3.6Å; F44-F104 HydrophobicContact CD1-CE1 3.6Å; F44-F104 HydrophobicContact CD1-CZ 4.49Å; F44-F104 HydrophobicContact CE1-CD1 4.38Å; F44-F104 HydrophobicContact CE1-CE1 4.02Å; F44-F104 HydrophobicContact CG-CE1 4.48Å; F78-F104 HydrophobicContact CE1-CB 3.77Å; F78-F104 AromaticContact CE1-CD1 3.83Å; F78-F104 HydrophobicContact CE1-CD1 3.83Å; F78-F104 AromaticContact CE1-CD2 3.97Å; F78-F104 HydrophobicContact CE1-CD2 3.97Å; F78-F104 HydrophobicContact CE1-CE1 4.42Å; F78-F104 AromaticContact CE1-CG 3.58Å; F78-F104 HydrophobicContact CE1-CG 3.58Å; F78-F104 HydrophobicContact CZ-CB 3.86Å; F78-F104 HydrophobicContact CZ-CD1 4.33Å; F78-F104 AromaticContact CZ-CD2 3.61Å; F78-F104 HydrophobicContact CZ-CD2 3.61Å; F78-F104 HydrophobicContact CZ-CE2 4.23Å; F78-F104 AromaticContact CZ-CG 3.67Å; F78-F104 HydrophobicContact CZ-CG 3.67Å; H101-F104 HydrophobicContact CB-CB 3.96Å; H101-F104 PolarHBondContact O-N 2.69Å; F104-L112 HydrophobicContact CD2-CD2 3.44Å; F104-L112 VanDerWaalsContact CD2-CD2 3.44Å; F104-L112 HydrophobicContact CE2-CD2 3.85Å; F104-I115 HydrophobicContact CB-CD1 3.94Å; F104-I115 HydrophobicContact CD2-CD1 4.11Å
105	L	95.9	Very high	94.1	Very high	38 Å²	38	53.9 Å²	53.9	20%	0.199	29%	0.285	C	S	.	.			trans	-123.4	146	-172.3	-51.1	179.8	0	0	0	111.8	W23 W37 G41 N42 G107 Q108 L111	W23-L105 PolarHBondContact NE1-O 3.03Å; W23-L105 VanDerWaalsContact NE1-O 3.13Å; W37-L105 VanDerWaalsContact CH2-C 3.4Å; G41-L105 WeakPolarHBondContact O-CA 3.41Å; N42-L105 HydrophobicContact CB-CD2 3.83Å; L105-G107 PolarHBondContact O-N 3.21Å; L105-Q108 HydrophobicContact CB-CB 4.23Å; L105-Q108 HydrophobicContact CB-CG 4.47Å; L105-Q108 PolarHBondContact O-N 3.36Å; L105-L111 HydrophobicContact CD1-CD1 3.71Å; L105-L111 HydrophobicContact CG-CD1 4.17Å
106	R	95.8	Very high	94.5	Very high	113 Å²	113	56.7 Å²	56.7	43%	0.426	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	129.2	175.2	-173.4	167.8	58.9	-139.6	-7.4	110	W37 S38 P39 G41 Q108	W37-R106 VanDerWaalsContact CB-NH1 3.34Å; W37-R106 HydrophobicContact CD2-CB 3.59Å; W37-R106 HydrophobicContact CD2-CG 3.99Å; W37-R106 HydrophobicContact CE3-CB 3.84Å; W37-R106 HydrophobicContact CG-CB 3.97Å; W37-R106 HydrophobicContact CG-CG 3.91Å; W37-R106 HydrophobicContact CH2-CB 4.47Å; W37-R106 HydrophobicContact CZ2-CB 4.26Å; W37-R106 HydrophobicContact CZ3-CB 4.27Å; S38-R106 PolarHBondContact O-NH1 3.38Å; P39-R106 PolarHBondContact O-NH2 3.12Å; G41-R106 PolarHBondContact O-N 2.91Å; R106-Q108 VanDerWaalsContact C-N 3.29Å; R106-Q108 PolarHBondContact O-N 2.89Å
107	G	92.9	Very high	94.6	Very high	58 Å²	58	59.8 Å²	59.8	60%	0.598	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	9.4	179.3	0	0	0	0	0	116.1	L105	L105-G107 PolarHBondContact O-N 3.21Å
108	Q	92.4	Very high	94.3	Very high	79 Å²	79	66 Å²	66	37%	0.369	33%	0.327	S	S	.	.			trans	-126.7	58.4	-179.8	-58.4	-170	45.9	0	0	112.3	L105 R106 Q110 L111	L105-Q108 HydrophobicContact CB-CB 4.23Å; L105-Q108 HydrophobicContact CB-CG 4.47Å; L105-Q108 PolarHBondContact O-N 3.36Å; R106-Q108 VanDerWaalsContact C-N 3.29Å; R106-Q108 PolarHBondContact O-N 2.89Å; Q108-Q110 VanDerWaalsContact C-OE1 3.29Å; Q108-Q110 PolarHBondContact O-N 3.43Å; Q108-Q110 VanDerWaalsContact O-N 3.16Å; Q108-L111 HydrophobicContact CB-CD1 4.02Å; Q108-L111 HydrophobicContact CB-CG 4.18Å; Q108-L111 PolarHBondContact O-N 2.96Å
109	E	93.8	Very high	93.4	Very high	86 Å²	86	70.5 Å²	70.5	40%	0.402	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-56.2	-30.8	-178.7	-163.8	-174.9	175.6	0	0	112.9	W23 L111 L112	W23-E109 HydrophobicContact CD2-CB 4.23Å; W23-E109 HydrophobicContact CD2-CG 4.11Å; W23-E109 HydrophobicContact CE3-CB 4.39Å; W23-E109 HydrophobicContact CE3-CG 4.1Å; W23-E109 HydrophobicContact CH2-CB 4.23Å; W23-E109 HydrophobicContact CZ2-CB 4.05Å; W23-E109 HydrophobicContact CZ3-CB 4.39Å; W23-E109 HydrophobicContact CZ3-CG 4.44Å; E109-L111 PolarHBondContact O-N 3.1Å; E109-L111 VanDerWaalsContact O-N 3.14Å; E109-L112 HydrophobicContact CG-CD1 3.65Å; E109-L112 HydrophobicContact CG-CG 4.39Å; E109-L112 VanDerWaalsContact O-CB 3.25Å; E109-L112 WeakPolarHBondContact O-CB 3.16Å; E109-L112 WeakPolarHBondContact O-CG 3.5Å; E109-L112 PolarHBondContact O-N 2.94Å
110	Q	91.9	Very high	91.6	Very high	115 Å²	115	76 Å²	76	54%	0.537	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-57.3	-29.9	176.2	70.4	-75.5	-2.9	0	0	113.3	Q108 L112 E113	Q108-Q110 VanDerWaalsContact C-OE1 3.29Å; Q108-Q110 PolarHBondContact O-N 3.43Å; Q108-Q110 VanDerWaalsContact O-N 3.16Å; Q110-L112 PolarHBondContact O-N 3.39Å; Q110-E113 WeakPolarHBondContact O-CG 3.36Å; Q110-E113 PolarHBondContact O-N 3.02Å
111	L	93.4	Very high	89.1	Confident	42 Å²	42	74.3 Å²	74.3	22%	0.22	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-70.6	-15.6	179.5	-66.2	-177.4	0	0	0	113.5	C103 L105 Q108 E109 E113 N114	C103-L111 HydrophobicContact CB-CB 4.24Å; C103-L111 CarbonylContact O-C 3.46Å; C103-L111 VanDerWaalsContact O-CB 3.25Å; C103-L111 WeakPolarHBondContact O-CB 3.47Å; L105-L111 HydrophobicContact CD1-CD1 3.71Å; L105-L111 HydrophobicContact CG-CD1 4.17Å; Q108-L111 HydrophobicContact CB-CD1 4.02Å; Q108-L111 HydrophobicContact CB-CG 4.18Å; Q108-L111 PolarHBondContact O-N 2.96Å; E109-L111 PolarHBondContact O-N 3.1Å; E109-L111 VanDerWaalsContact O-N 3.14Å; L111-E113 PolarHBondContact O-N 3.06Å; L111-N114 WeakPolarHBondContact O-CB 3.49Å; L111-N114 PolarHBondContact O-N 3.34Å
112	L	94.1	Very high	87.1	Confident	1 Å²	1	78.2 Å²	78.2	1%	0.005	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-60	-26.3	176.1	-60.5	-179.2	0	0	0	112.4	V15 W23 F104 E109 Q110 N114 I115	V15-L112 HydrophobicContact CG1-CB 3.72Å; V15-L112 HydrophobicContact CG1-CD1 4.26Å; V15-L112 HydrophobicContact CG2-CB 4.07Å; W23-L112 HydrophobicContact CB-CD1 3.69Å; W23-L112 HydrophobicContact CB-CD2 4.33Å; W23-L112 HydrophobicContact CG-CD1 3.96Å; W23-L112 HydrophobicContact CG-CD2 4.47Å; F104-L112 HydrophobicContact CD2-CD2 3.44Å; F104-L112 VanDerWaalsContact CD2-CD2 3.44Å; F104-L112 HydrophobicContact CE2-CD2 3.85Å; E109-L112 HydrophobicContact CG-CD1 3.65Å; E109-L112 HydrophobicContact CG-CG 4.39Å; E109-L112 VanDerWaalsContact O-CB 3.25Å; E109-L112 WeakPolarHBondContact O-CB 3.16Å; E109-L112 WeakPolarHBondContact O-CG 3.5Å; E109-L112 PolarHBondContact O-N 2.94Å; Q110-L112 PolarHBondContact O-N 3.39Å; L112-N114 PolarHBondContact O-N 3.43Å; L112-I115 HydrophobicContact CD2-CD1 3.78Å; L112-I115 PolarHBondContact O-N 3.47Å; L112-I115 VanDerWaalsContact O-N 3.16Å
113	E	94	Very high	85.1	Confident	102 Å²	102	78 Å²	78	48%	0.477	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-64.9	-25.9	177.5	82.3	-175.4	159.3	0	0	112.5	V15 Q110 L111 I115 K116	V15-E113 HydrophobicContact CG2-CB 4.11Å; Q110-E113 WeakPolarHBondContact O-CG 3.36Å; Q110-E113 PolarHBondContact O-N 3.02Å; L111-E113 PolarHBondContact O-N 3.06Å; E113-I115 VanDerWaalsContact C-N 3.32Å; E113-K116 VanDerWaalsContact O-CE 3.29Å; E113-K116 WeakPolarHBondContact O-CE 3.27Å; E113-K116 PolarHBondContact O-NZ 3.42Å
114	N	92.3	Very high	82.9	Confident	85 Å²	85	81.3 Å²	81.3	46%	0.455	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-80.6	-13.8	179.2	-64.7	-59.5	0	0	0	112.7	C103 L111 L112 K116	C103-N114 HydrophobicContact CB-CB 4.28Å; L111-N114 WeakPolarHBondContact O-CB 3.49Å; L111-N114 PolarHBondContact O-N 3.34Å; L112-N114 PolarHBondContact O-N 3.43Å; N114-K116 PolarHBondContact O-N 3.11Å; N114-K116 VanDerWaalsContact O-N 3.11Å
115	I	94.6	Very high	80.9	Confident	1 Å²	1	85.3 Å²	85.3	1%	0.005	45%	0.453	C	S	.	.			trans	-81.7	90.4	178.9	-47.6	-178	0	0	0	109.6	L19 Y76 F78 C103 F104 L112 E113	L19-I115 HydrophobicContact CD1-CB 3.63Å; L19-I115 HydrophobicContact CD1-CD1 4.38Å; L19-I115 HydrophobicContact CD1-CG2 3.78Å; L19-I115 HydrophobicContact CD2-CD1 4.32Å; L19-I115 HydrophobicContact CD2-CG2 4.07Å; Y76-I115 HydrophobicContact CD1-CG2 4.27Å; Y76-I115 HydrophobicContact CG-CG2 4.47Å; Y76-I115 WeakPolarHBondContact O-CG2 3.47Å; F78-I115 HydrophobicContact CE2-CG2 4.27Å; F78-I115 HydrophobicContact CZ-CD1 4.3Å; C103-I115 HydrophobicContact CB-CG1 3.93Å; F104-I115 HydrophobicContact CB-CD1 3.94Å; F104-I115 HydrophobicContact CD2-CD1 4.11Å; L112-I115 HydrophobicContact CD2-CD1 3.78Å; L112-I115 PolarHBondContact O-N 3.47Å; L112-I115 VanDerWaalsContact O-N 3.16Å; E113-I115 VanDerWaalsContact C-N 3.32Å
116	K	92.2	Very high	78.8	Confident	136 Å²	136	90.1 Å²	90.1	59%	0.591	47%	0.472	S	S	*	.			trans	-84.5	142.3	178.7	-54.2	-50	-172.8	-171.2	0	111.7	E113 N114 K118	E113-K116 VanDerWaalsContact O-CE 3.29Å; E113-K116 WeakPolarHBondContact O-CE 3.27Å; E113-K116 PolarHBondContact O-NZ 3.42Å; N114-K116 PolarHBondContact O-N 3.11Å; N114-K116 VanDerWaalsContact O-N 3.11Å; K116-K118 PolarHBondContact O-N 3.2Å
117	R	91.9	Very high	76.8	Confident	123 Å²	123	89.6 Å²	89.6	46%	0.464	49%	0.486	S	S	.	.			trans	-67	129.6	173	-160.6	-176.8	-170.6	-165.5	6.1	109.5	M75 Y76 V119	M75-R117 HydrophobicContact CB-CG 4.31Å; M75-R117 HydrophobicContact CE-CG 4.5Å; M75-R117 CarbonylContact O-C 3.59Å; M75-R117 WeakPolarHBondContact O-CA 3.33Å; M75-R117 PolarHBondContact SD-NH2 3.46Å; Y76-R117 HydrophobicContact CD1-CB 4.06Å; Y76-R117 HydrophobicContact CD1-CG 4.34Å; Y76-R117 HydrophobicContact CE1-CB 3.55Å; Y76-R117 HydrophobicContact CE1-CG 3.84Å; R117-V119 PolarHBondContact O-N 3.17Å; R117-V119 VanDerWaalsContact O-N 3.13Å
118	K	88.6	Confident	74.9	Confident	138 Å²	138	93.7 Å²	93.7	60%	0.6	49%	0.489	S	S	*	.			trans	-66.3	109.4	170.7	-61	-178.3	68.9	178.9	0	108.8	M75 K116	M75-K118 PolarHBondContact O-N 3.13Å; K116-K118 PolarHBondContact O-N 3.2Å
119	V	76.7	Confident	73.2	Confident	115 Å²	115	93.6 Å²	93.6	70%	0.697	49%	0.492	S	S	*	.			trans	-88.3	126.3	175.2	179.7	0	0	0	0	108.8	R117 S121	R117-V119 PolarHBondContact O-N 3.17Å; R117-V119 VanDerWaalsContact O-N 3.13Å; V119-S121 VanDerWaalsContact C-N 3.27Å; V119-S121 PolarHBondContact O-N 2.8Å
120	T	58.2	Low	71.7	Confident	122 Å²	122	93.9 Å²	93.9	75%	0.748	50%	0.495	S	S	*	.			trans	-78.7	76.6	172.9	-45.4	0	0	0	0	109.6	V122	T120-V122 HydrophobicContact CG2-CG2 4.15Å; T120-V122 PolarHBondContact O-N 3.36Å
121	S	46.4	Very low	70.4	Confident	39 Å²	39	94.4 Å²	94.4	27%	0.273	50%	0.495	S	S	.	.			trans	-79.8	80	-176.3	51.7	0	0	0	0	112.4	V119 S123	V119-S121 VanDerWaalsContact C-N 3.27Å; V119-S121 PolarHBondContact O-N 2.8Å; S121-S123 PolarHBondContact O-N 3.28Å
122	V	55.2	Low	69.1	Low	110 Å²	110	96.7 Å²	96.7	67%	0.667	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.6	-174.8	-177.2	0	0	0	0	114.2	T120 K126	T120-V122 HydrophobicContact CG2-CG2 4.15Å; T120-V122 PolarHBondContact O-N 3.36Å; V122-K126 WeakPolarHBondContact O-CE 3.44Å
123	S	54.1	Low	68.2	Low	97 Å²	97	103.3 Å²	103.3	68%	0.678	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-45.5	-172.1	49.6	0	0	0	0	115.1	S121	S121-S123 PolarHBondContact O-N 3.28Å
124	T	50	Low	67.5	Low	108 Å²	108	103.9 Å²	103.9	66%	0.663	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-28.8	-168.9	46.7	0	0	0	0	114.6	K126	T124-K126 PolarHBondContact O-N 2.9Å
125	L	54.3	Low	67	Low	84 Å²	84	103.3 Å²	103.3	44%	0.44	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.8	-176.1	-70.7	175.2	0	0	0	113.7	S127 E128 D129	L125-S127 VanDerWaalsContact C-N 3.32Å; L125-S127 PolarHBondContact O-N 3.14Å; L125-S127 VanDerWaalsContact O-N 3.1Å; L125-E128 PolarHBondContact O-N 3.12Å; L125-E128 VanDerWaalsContact O-N 3.13Å; L125-D129 WeakPolarHBondContact CB-OD2 3.41Å; L125-D129 WeakPolarHBondContact O-CB 3.42Å; L125-D129 PolarHBondContact O-N 3.11Å
126	K	52.7	Low	66.6	Low	139 Å²	139	106.4 Å²	106.4	60%	0.604	55%	0.553	S	S	*	*	H	α-helix	trans	-53.6	-40.5	-164.9	-67.5	-173.1	177.8	-175.6	0	114.6	V122 T124 I130	V122-K126 WeakPolarHBondContact O-CE 3.44Å; T124-K126 PolarHBondContact O-N 2.9Å; K126-I130 WeakPolarHBondContact O-CB 3.22Å; K126-I130 WeakPolarHBondContact O-CD1 3.42Å; K126-I130 WeakPolarHBondContact O-CG1 3.21Å; K126-I130 PolarHBondContact O-N 2.84Å
127	S	53.3	Low	66.5	Low	102 Å²	102	103.3 Å²	103.3	71%	0.713	55%	0.546	S	S	*	.	H	α-helix	trans	-71.7	-46.4	-179.5	-162.5	0	0	0	0	112.3	L125 K131	L125-S127 VanDerWaalsContact C-N 3.32Å; L125-S127 PolarHBondContact O-N 3.14Å; L125-S127 VanDerWaalsContact O-N 3.1Å; S127-K131 PolarHBondContact O-N 3.05Å; S127-K131 VanDerWaalsContact O-N 3.17Å
128	E	53.6	Low	66.5	Low	143 Å²	143	101.1 Å²	101.1	67%	0.668	55%	0.546	S	S	*	.	H	α-helix	trans	-79.7	-40.3	-172.1	-139.8	166.8	153.2	0	0	111.8	L125 I130 K131 I132	L125-E128 PolarHBondContact O-N 3.12Å; L125-E128 VanDerWaalsContact O-N 3.13Å; E128-I130 VanDerWaalsContact C-N 3.34Å; E128-I130 PolarHBondContact O-N 2.97Å; E128-K131 PolarHBondContact O-N 2.84Å; E128-I132 HydrophobicContact CG-CD1 4.27Å; E128-I132 WeakPolarHBondContact O-CB 3.41Å; E128-I132 VanDerWaalsContact O-CG1 3.28Å; E128-I132 WeakPolarHBondContact O-CG1 3.26Å; E128-I132 PolarHBondContact O-N 2.98Å
129	D	55.5	Low	66.6	Low	78 Å²	78	102.6 Å²	102.6	42%	0.417	55%	0.548	S	S	.	.	H	α-helix	trans	-67.3	-29.6	170.8	-97.2	-57	0	0	0	112.6	L125 R133	L125-D129 WeakPolarHBondContact CB-OD2 3.41Å; L125-D129 WeakPolarHBondContact O-CB 3.42Å; L125-D129 PolarHBondContact O-N 3.11Å; D129-R133 WeakPolarHBondContact O-CB 3.21Å; D129-R133 PolarHBondContact O-N 2.7Å
130	I	62.3	Low	67.3	Low	92 Å²	92	102.5 Å²	102.5	47%	0.472	54%	0.543	S	S	.	.	H	α-helix	trans	-62.5	-49.1	169	-78.4	168.3	0	0	0	109.5	K126 E128 R133 Q134	K126-I130 WeakPolarHBondContact O-CB 3.22Å; K126-I130 WeakPolarHBondContact O-CD1 3.42Å; K126-I130 WeakPolarHBondContact O-CG1 3.21Å; K126-I130 PolarHBondContact O-N 2.84Å; E128-I130 VanDerWaalsContact C-N 3.34Å; E128-I130 PolarHBondContact O-N 2.97Å; I130-R133 PolarHBondContact O-N 2.99Å; I130-Q134 WeakPolarHBondContact O-CB 3.45Å; I130-Q134 PolarHBondContact O-N 2.91Å
131	K	65	Low	68.9	Low	125 Å²	125	102.1 Å²	102.1	54%	0.543	54%	0.535	S	S	.	.	H	α-helix	trans	-67.3	-48.1	-177.7	-166.3	-173.3	179.3	-61.9	0	112.4	S127 E128 R133 Q134 D135	S127-K131 PolarHBondContact O-N 3.05Å; S127-K131 VanDerWaalsContact O-N 3.17Å; E128-K131 PolarHBondContact O-N 2.84Å; K131-R133 VanDerWaalsContact C-N 3.26Å; K131-R133 PolarHBondContact O-N 2.97Å; K131-Q134 WeakPolarHBondContact O-CB 3.4Å; K131-Q134 PolarHBondContact O-N 3.32Å; K131-Q134 VanDerWaalsContact O-N 3.1Å; K131-D135 IonicContact NZ-OD1 2.69Å; K131-D135 PolarHBondContact NZ-OD1 3.05Å; K131-D135 IonicContact NZ-OD2 3.85Å; K131-D135 PolarHBondContact NZ-OD2 2.75Å; K131-D135 VanDerWaalsContact O-CG 3.29Å; K131-D135 PolarHBondContact O-N 2.97Å
132	I	67.1	Low	71.2	Confident	90 Å²	90	104.4 Å²	104.4	46%	0.462	55%	0.548	S	S	.	.	H	α-helix	trans	-59.4	-39.7	178.4	-68.7	165.6	0	0	0	110.6	E128 S136	E128-I132 HydrophobicContact CG-CD1 4.27Å; E128-I132 WeakPolarHBondContact O-CB 3.41Å; E128-I132 VanDerWaalsContact O-CG1 3.28Å; E128-I132 WeakPolarHBondContact O-CG1 3.26Å; E128-I132 PolarHBondContact O-N 2.98Å; I132-S136 VanDerWaalsContact O-CB 3.24Å; I132-S136 WeakPolarHBondContact O-CB 3.38Å; I132-S136 PolarHBondContact O-N 3.12Å; I132-S136 PolarHBondContact O-OG 2.89Å
133	R	74	Confident	73	Confident	140 Å²	140	102.7 Å²	102.7	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-70.4	-36.9	174.9	-175.4	167.6	48.2	78.2	3.8	112.8	D129 I130 K131 S136 V137	D129-R133 WeakPolarHBondContact O-CB 3.21Å; D129-R133 PolarHBondContact O-N 2.7Å; I130-R133 PolarHBondContact O-N 2.99Å; K131-R133 VanDerWaalsContact C-N 3.26Å; K131-R133 PolarHBondContact O-N 2.97Å; R133-S136 PolarHBondContact O-N 2.88Å; R133-V137 HydrophobicContact CG-CG2 4.49Å; R133-V137 WeakPolarHBondContact O-CB 3.44Å; R133-V137 VanDerWaalsContact O-CG2 3.29Å; R133-V137 WeakPolarHBondContact O-CG2 3.42Å; R133-V137 PolarHBondContact O-N 3.12Å
134	Q	80	Confident	74.9	Confident	115 Å²	115	102.1 Å²	102.1	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-62.3	-48.9	173.6	-166.8	75.8	15.5	0	0	111.1	I130 K131 S136 V137 T138	I130-Q134 WeakPolarHBondContact O-CB 3.45Å; I130-Q134 PolarHBondContact O-N 2.91Å; K131-Q134 WeakPolarHBondContact O-CB 3.4Å; K131-Q134 PolarHBondContact O-N 3.32Å; K131-Q134 VanDerWaalsContact O-N 3.1Å; Q134-S136 VanDerWaalsContact C-N 3.31Å; Q134-S136 PolarHBondContact O-N 3.08Å; Q134-V137 PolarHBondContact O-N 3.1Å; Q134-T138 WeakPolarHBondContact O-CB 3.46Å; Q134-T138 PolarHBondContact O-N 3.07Å; Q134-T138 PolarHBondContact O-OG1 3.45Å
135	D	80.7	Confident	76.9	Confident	73 Å²	73	103.1 Å²	103.1	39%	0.39	52%	0.524	S	S	.	.	H	α-helix	trans	-62.1	-39.9	176.5	-63.8	-30.4	0	0	0	110.7	K131 T138 R139	K131-D135 IonicContact NZ-OD1 2.69Å; K131-D135 PolarHBondContact NZ-OD1 3.05Å; K131-D135 IonicContact NZ-OD2 3.85Å; K131-D135 PolarHBondContact NZ-OD2 2.75Å; K131-D135 VanDerWaalsContact O-CG 3.29Å; K131-D135 PolarHBondContact O-N 2.97Å; D135-T138 PolarHBondContact O-N 3.28Å; D135-R139 WeakPolarHBondContact O-CG 3.41Å; D135-R139 PolarHBondContact O-N 3.42Å
136	S	86.6	Confident	78.8	Confident	66 Å²	66	103.6 Å²	103.6	46%	0.462	53%	0.527	S	S	.	.	H	α-helix	trans	-67.5	-41.9	177.1	-61.1	0	0	0	0	113.2	I132 R133 Q134 R139 L140	I132-S136 VanDerWaalsContact O-CB 3.24Å; I132-S136 WeakPolarHBondContact O-CB 3.38Å; I132-S136 PolarHBondContact O-N 3.12Å; I132-S136 PolarHBondContact O-OG 2.89Å; R133-S136 PolarHBondContact O-N 2.88Å; Q134-S136 VanDerWaalsContact C-N 3.31Å; Q134-S136 PolarHBondContact O-N 3.08Å; S136-R139 PolarHBondContact O-N 3.5Å; S136-L140 WeakPolarHBondContact O-CB 3.44Å; S136-L140 PolarHBondContact O-N 2.92Å
137	V	89.7	Confident	80.8	Confident	71 Å²	71	103.3 Å²	103.3	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-66.7	-40.1	175.3	167.3	0	0	0	0	110.6	R133 Q134 R139 L140 L141	R133-V137 HydrophobicContact CG-CG2 4.49Å; R133-V137 WeakPolarHBondContact O-CB 3.44Å; R133-V137 VanDerWaalsContact O-CG2 3.29Å; R133-V137 WeakPolarHBondContact O-CG2 3.42Å; R133-V137 PolarHBondContact O-N 3.12Å; Q134-V137 PolarHBondContact O-N 3.1Å; V137-R139 VanDerWaalsContact C-N 3.33Å; V137-R139 PolarHBondContact O-N 3.43Å; V137-L140 PolarHBondContact O-N 2.88Å; V137-L141 HydrophobicContact CG1-CD1 3.99Å; V137-L141 HydrophobicContact CG1-CG 4.39Å; V137-L141 WeakPolarHBondContact O-CB 3.42Å; V137-L141 WeakPolarHBondContact O-CG 3.03Å; V137-L141 PolarHBondContact O-N 2.96Å
138	T	91.8	Very high	82.6	Confident	76 Å²	76	103.7 Å²	103.7	47%	0.466	52%	0.518	S	S	.	.	H	α-helix	trans	-62.4	-40.9	175.7	-55.6	0	0	0	0	111.4	Q134 D135 T142	Q134-T138 WeakPolarHBondContact O-CB 3.46Å; Q134-T138 PolarHBondContact O-N 3.07Å; Q134-T138 PolarHBondContact O-OG1 3.45Å; D135-T138 PolarHBondContact O-N 3.28Å; T138-T142 PolarHBondContact O-N 3.21Å; T138-T142 VanDerWaalsContact O-N 3.08Å; T138-T142 PolarHBondContact O-OG1 2.97Å
139	R	90.6	Very high	84.5	Confident	170 Å²	170	98.7 Å²	98.7	64%	0.642	50%	0.504	S	S	*	.	H	α-helix	trans	-62.9	-47.6	170.6	-77.1	-168.2	61.1	-154.3	-12.7	112.3	D135 S136 V137 L141 T142 D143	D135-R139 WeakPolarHBondContact O-CG 3.41Å; D135-R139 PolarHBondContact O-N 3.42Å; S136-R139 PolarHBondContact O-N 3.5Å; V137-R139 VanDerWaalsContact C-N 3.33Å; V137-R139 PolarHBondContact O-N 3.43Å; R139-L141 VanDerWaalsContact C-N 3.31Å; R139-L141 PolarHBondContact O-N 3.49Å; R139-T142 CarbonylContact O-C 3.44Å; R139-T142 WeakPolarHBondContact O-CA 3.35Å; R139-T142 WeakPolarHBondContact O-CB 3.29Å; R139-T142 PolarHBondContact O-N 2.83Å; R139-D143 PolarHBondContact O-N 2.78Å
140	L	92.3	Very high	86.3	Confident	113 Å²	113	100.9 Å²	100.9	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-58.4	-42.8	179.1	-161.7	86.1	0	0	0	111.8	S136 V137 T142 D143 V144	S136-L140 WeakPolarHBondContact O-CB 3.44Å; S136-L140 PolarHBondContact O-N 2.92Å; V137-L140 PolarHBondContact O-N 2.88Å; L140-T142 VanDerWaalsContact C-N 3.33Å; L140-T142 PolarHBondContact O-N 3.19Å; L140-D143 PolarHBondContact O-N 3.38Å; L140-V144 WeakPolarHBondContact O-CB 3.4Å; L140-V144 VanDerWaalsContact O-CG2 3.26Å; L140-V144 WeakPolarHBondContact O-CG2 3.49Å; L140-V144 PolarHBondContact O-N 3.01Å
141	L	93	Very high	87.8	Confident	113 Å²	113	100.6 Å²	100.6	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-63.5	-38.1	174.8	-71.1	168.7	0	0	0	112.1	V137 R139 Q145	V137-L141 HydrophobicContact CG1-CD1 3.99Å; V137-L141 HydrophobicContact CG1-CG 4.39Å; V137-L141 WeakPolarHBondContact O-CB 3.42Å; V137-L141 WeakPolarHBondContact O-CG 3.03Å; V137-L141 PolarHBondContact O-N 2.96Å; R139-L141 VanDerWaalsContact C-N 3.31Å; R139-L141 PolarHBondContact O-N 3.49Å; L141-Q145 WeakPolarHBondContact O-CB 3.45Å; L141-Q145 PolarHBondContact O-N 3.42Å
142	T	92.9	Very high	89.2	Confident	87 Å²	87	99.6 Å²	99.6	53%	0.534	50%	0.504	S	S	.	.	H	α-helix	trans	-66.6	-44	175.3	-53.2	0	0	0	0	111.4	T138 R139 L140 Q145 L146	T138-T142 PolarHBondContact O-N 3.21Å; T138-T142 VanDerWaalsContact O-N 3.08Å; T138-T142 PolarHBondContact O-OG1 2.97Å; R139-T142 CarbonylContact O-C 3.44Å; R139-T142 WeakPolarHBondContact O-CA 3.35Å; R139-T142 WeakPolarHBondContact O-CB 3.29Å; R139-T142 PolarHBondContact O-N 2.83Å; L140-T142 VanDerWaalsContact C-N 3.33Å; L140-T142 PolarHBondContact O-N 3.19Å; T142-Q145 PolarHBondContact O-N 3.25Å; T142-L146 WeakPolarHBondContact O-CB 3.5Å; T142-L146 PolarHBondContact O-N 3.27Å
143	D	93.5	Very high	90.6	Very high	75 Å²	75	99.6 Å²	99.6	40%	0.401	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-39.6	177.8	-70.5	-33.9	0	0	0	111.1	R139 L140 L146 M147	R139-D143 PolarHBondContact O-N 2.78Å; L140-D143 PolarHBondContact O-N 3.38Å; D143-L146 PolarHBondContact O-N 2.87Å; D143-M147 WeakPolarHBondContact O-CB 3.5Å; D143-M147 WeakPolarHBondContact O-CG 3.48Å; D143-M147 PolarHBondContact O-N 3Å
144	V	94.8	Very high	91.6	Very high	84 Å²	84	98 Å²	98	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-63.7	-44.3	172.6	166.3	0	0	0	0	111.6	L140 L146 M147 K148	L140-V144 WeakPolarHBondContact O-CB 3.4Å; L140-V144 VanDerWaalsContact O-CG2 3.26Å; L140-V144 WeakPolarHBondContact O-CG2 3.49Å; L140-V144 PolarHBondContact O-N 3.01Å; V144-L146 VanDerWaalsContact C-N 3.33Å; V144-L146 PolarHBondContact O-N 3.39Å; V144-M147 PolarHBondContact O-N 3.42Å; V144-K148 PolarHBondContact O-N 3.29Å
145	Q	92.3	Very high	92.4	Very high	130 Å²	130	96 Å²	96	61%	0.607	50%	0.504	S	S	*	.	H	α-helix	trans	-65	-38.2	177.4	-166.9	69.1	4.9	0	0	111.6	L141 T142 K148 G149	L141-Q145 WeakPolarHBondContact O-CB 3.45Å; L141-Q145 PolarHBondContact O-N 3.42Å; T142-Q145 PolarHBondContact O-N 3.25Å; Q145-K148 PolarHBondContact O-N 3.06Å; Q145-G149 PolarHBondContact O-N 3.15Å; Q145-G149 VanDerWaalsContact O-N 3.09Å
146	L	93.8	Very high	93.2	Very high	94 Å²	94	96.4 Å²	96.4	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-37.6	172.9	179.1	62.1	0	0	0	112	T142 D143 V144 K150	T142-L146 WeakPolarHBondContact O-CB 3.5Å; T142-L146 PolarHBondContact O-N 3.27Å; D143-L146 PolarHBondContact O-N 2.87Å; V144-L146 VanDerWaalsContact C-N 3.33Å; V144-L146 PolarHBondContact O-N 3.39Å; L146-K150 HydrophobicContact CG-CD 4.47Å; L146-K150 VanDerWaalsContact O-CG 3.31Å; L146-K150 WeakPolarHBondContact O-CG 3.46Å; L146-K150 PolarHBondContact O-N 3.1Å; L146-K150 VanDerWaalsContact O-N 3.08Å
147	M	93.1	Very high	93.7	Very high	132 Å²	132	100.2 Å²	100.2	65%	0.65	52%	0.521	S	S	*	.	H	α-helix	trans	-66.8	-38.4	172.6	-77.2	-162.7	70.1	0	0	112.1	D143 V144 K150 Q151	D143-M147 WeakPolarHBondContact O-CB 3.5Å; D143-M147 WeakPolarHBondContact O-CG 3.48Å; D143-M147 PolarHBondContact O-N 3Å; V144-M147 PolarHBondContact O-N 3.42Å; M147-K150 PolarHBondContact O-N 3.31Å; M147-Q151 WeakPolarHBondContact O-CB 3.48Å; M147-Q151 PolarHBondContact O-N 3.22Å
148	K	93	Very high	94.1	Very high	111 Å²	111	102 Å²	102	48%	0.483	53%	0.528	S	S	.	.	H	α-helix	trans	-60.2	-47.6	174.4	-169.6	178	-173	-83.2	0	111.6	V144 Q145 K150 Q151 E152	V144-K148 PolarHBondContact O-N 3.29Å; Q145-K148 PolarHBondContact O-N 3.06Å; K148-K150 VanDerWaalsContact C-N 3.31Å; K148-K150 PolarHBondContact O-N 3.43Å; K148-Q151 WeakPolarHBondContact O-CB 3.48Å; K148-Q151 PolarHBondContact O-N 3.16Å; K148-Q151 VanDerWaalsContact O-N 3.14Å; K148-E152 IonicContact NZ-OE1 3.68Å; K148-E152 PolarHBondContact NZ-OE1 2.9Å; K148-E152 WeakPolarHBondContact O-CG 3.44Å; K148-E152 PolarHBondContact O-N 3.44Å
149	G	92.6	Very high	94.4	Very high	37 Å²	37	102.7 Å²	102.7	38%	0.381	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-31.9	175.7	0	0	0	0	0	113.8	Q145 C153	Q145-G149 PolarHBondContact O-N 3.15Å; Q145-G149 VanDerWaalsContact O-N 3.09Å; G149-C153 WeakPolarHBondContact O-CB 3.44Å; G149-C153 PolarHBondContact O-N 3.21Å; G149-C153 VanDerWaalsContact O-N 3.16Å
150	K	94	Very high	94.7	Very high	125 Å²	125	96.9 Å²	96.9	54%	0.543	52%	0.516	S	S	.	.	H	α-helix	trans	-69.7	-38.8	171.3	-74.2	170	-179.6	174.3	0	112.3	L146 M147 K148 C153 M154	L146-K150 HydrophobicContact CG-CD 4.47Å; L146-K150 VanDerWaalsContact O-CG 3.31Å; L146-K150 WeakPolarHBondContact O-CG 3.46Å; L146-K150 PolarHBondContact O-N 3.1Å; L146-K150 VanDerWaalsContact O-N 3.08Å; M147-K150 PolarHBondContact O-N 3.31Å; K148-K150 VanDerWaalsContact C-N 3.31Å; K148-K150 PolarHBondContact O-N 3.43Å; K150-C153 PolarHBondContact O-N 3.42Å; K150-M154 WeakPolarHBondContact O-CB 3.34Å; K150-M154 PolarHBondContact O-N 2.87Å
151	Q	92.8	Very high	95	Very high	86 Å²	86	96.6 Å²	96.6	40%	0.402	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-51.6	176.5	-175.3	59.7	43.9	0	0	110.3	M147 K148 C153 M154 D155	M147-Q151 WeakPolarHBondContact O-CB 3.48Å; M147-Q151 PolarHBondContact O-N 3.22Å; K148-Q151 WeakPolarHBondContact O-CB 3.48Å; K148-Q151 PolarHBondContact O-N 3.16Å; K148-Q151 VanDerWaalsContact O-N 3.14Å; Q151-C153 VanDerWaalsContact C-N 3.28Å; Q151-C153 PolarHBondContact O-N 2.86Å; Q151-M154 CarbonylContact O-C 3.59Å; Q151-M154 WeakPolarHBondContact O-CA 3.47Å; Q151-M154 WeakPolarHBondContact O-CB 3.15Å; Q151-M154 PolarHBondContact O-N 2.72Å; Q151-D155 WeakPolarHBondContact CG-OD2 3.28Å; Q151-D155 PolarHBondContact NE2-OD1 2.8Å; Q151-D155 PolarHBondContact NE2-OD2 2.97Å; Q151-D155 VanDerWaalsContact O-CG 3.31Å; Q151-D155 PolarHBondContact O-N 3.07Å
152	E	95.1	Very high	95.2	Very high	103 Å²	103	97.6 Å²	97.6	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-55.9	-39.8	175.8	-69.8	165.8	178.2	0	0	112.6	K148 S156	K148-E152 IonicContact NZ-OE1 3.68Å; K148-E152 PolarHBondContact NZ-OE1 2.9Å; K148-E152 WeakPolarHBondContact O-CG 3.44Å; K148-E152 PolarHBondContact O-N 3.44Å; E152-S156 VanDerWaalsContact O-CB 3.29Å; E152-S156 WeakPolarHBondContact O-CB 3.45Å; E152-S156 PolarHBondContact O-N 2.81Å
153	C	95.4	Very high	95.4	Very high	90 Å²	90	98.2 Å²	98.2	61%	0.608	51%	0.509	S	S	*	.	H	α-helix	trans	-66.5	-41.3	174	-177	0	0	0	0	112.7	G149 K150 Q151 K157	G149-C153 WeakPolarHBondContact O-CB 3.44Å; G149-C153 PolarHBondContact O-N 3.21Å; G149-C153 VanDerWaalsContact O-N 3.16Å; K150-C153 PolarHBondContact O-N 3.42Å; Q151-C153 VanDerWaalsContact C-N 3.28Å; Q151-C153 PolarHBondContact O-N 2.86Å; C153-K157 PolarHBondContact O-N 3.04Å
154	M	95.9	Very high	95.6	Very high	106 Å²	106	100.7 Å²	100.7	52%	0.522	52%	0.518	S	S	.	.	H	α-helix	trans	-68	-42.7	177.8	-177.3	166.2	63.2	0	0	112	K150 Q151 K157 L158	K150-M154 WeakPolarHBondContact O-CB 3.34Å; K150-M154 PolarHBondContact O-N 2.87Å; Q151-M154 CarbonylContact O-C 3.59Å; Q151-M154 WeakPolarHBondContact O-CA 3.47Å; Q151-M154 WeakPolarHBondContact O-CB 3.15Å; Q151-M154 PolarHBondContact O-N 2.72Å; M154-K157 PolarHBondContact O-N 3.19Å; M154-L158 WeakPolarHBondContact O-CB 3.49Å; M154-L158 PolarHBondContact O-N 3.1Å
155	D	96.5	Very high	95.8	Very high	75 Å²	75	100.6 Å²	100.6	40%	0.401	52%	0.515	S	S	.	.	H	α-helix	trans	-66.3	-40.3	178.1	-66.4	-33.2	0	0	0	111.4	Q151 L158 L159	Q151-D155 WeakPolarHBondContact CG-OD2 3.28Å; Q151-D155 PolarHBondContact NE2-OD1 2.8Å; Q151-D155 PolarHBondContact NE2-OD2 2.97Å; Q151-D155 VanDerWaalsContact O-CG 3.31Å; Q151-D155 PolarHBondContact O-N 3.07Å; D155-L158 PolarHBondContact O-N 3.04Å; D155-L159 WeakPolarHBondContact O-CB 3.44Å; D155-L159 PolarHBondContact O-N 3.08Å
156	S	97.9	Very high	96	Very high	81 Å²	81	98.7 Å²	98.7	57%	0.566	51%	0.506	S	S	*	.	H	α-helix	trans	-59.2	-45.2	171.2	-178.9	0	0	0	0	112	E152 L159 A160	E152-S156 VanDerWaalsContact O-CB 3.29Å; E152-S156 WeakPolarHBondContact O-CB 3.45Å; E152-S156 PolarHBondContact O-N 2.81Å; S156-L159 PolarHBondContact O-N 2.92Å; S156-A160 PolarHBondContact O-N 3.1Å
157	K	97.3	Very high	96.2	Very high	146 Å²	146	95.7 Å²	95.7	64%	0.635	49%	0.494	S	S	*	.	H	α-helix	trans	-65.3	-38.6	175.7	-173.7	179.3	179.2	-176.7	0	112.5	C153 M154 A160 M161	C153-K157 PolarHBondContact O-N 3.04Å; M154-K157 PolarHBondContact O-N 3.19Å; K157-A160 PolarHBondContact O-N 2.6Å; K157-M161 WeakPolarHBondContact O-CB 3.24Å; K157-M161 PolarHBondContact O-N 3.13Å
158	L	97.6	Very high	96.4	Very high	109 Å²	109	94.3 Å²	94.3	57%	0.571	49%	0.489	S	S	*	.	H	α-helix	trans	-65.7	-41.5	176.8	-174.4	153.8	0	0	0	110.9	M154 D155 M161 K162	M154-L158 WeakPolarHBondContact O-CB 3.49Å; M154-L158 PolarHBondContact O-N 3.1Å; D155-L158 PolarHBondContact O-N 3.04Å; L158-M161 PolarHBondContact O-N 3.1Å; L158-K162 WeakPolarHBondContact O-CB 3.42Å; L158-K162 PolarHBondContact O-N 2.68Å
159	L	97.4	Very high	96.7	Very high	90 Å²	90	96.7 Å²	96.7	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-64.7	-44.2	175.6	-175.9	61.7	0	0	0	111.9	D155 S156 K162 H163	D155-L159 WeakPolarHBondContact O-CB 3.44Å; D155-L159 PolarHBondContact O-N 3.08Å; S156-L159 PolarHBondContact O-N 2.92Å; L159-K162 WeakPolarHBondContact O-CB 3.29Å; L159-K162 PolarHBondContact O-N 3.4Å; L159-H163 PolarHBondContact O-CD2 3.45Å; L159-H163 PolarHBondContact O-N 2.87Å; L159-H163 VanDerWaalsContact O-N 3.07Å
160	A	97.6	Very high	97	Very high	47 Å²	47	101.7 Å²	101.7	39%	0.388	50%	0.503	S	S	.	.	H	α-helix	trans	-59	-49.6	173.8	0	0	0	0	0	111.6	S156 K157 K162 H163 E164	S156-A160 PolarHBondContact O-N 3.1Å; K157-A160 PolarHBondContact O-N 2.6Å; A160-K162 VanDerWaalsContact C-N 3.28Å; A160-K162 PolarHBondContact O-N 2.95Å; A160-H163 PolarHBondContact O-N 2.87Å; A160-H163 VanDerWaalsContact O-N 3.1Å; A160-E164 PolarHBondContact O-N 3.38Å
161	M	97.9	Very high	97.1	Very high	107 Å²	107	101.6 Å²	101.6	53%	0.527	50%	0.504	S	S	.	.	H	α-helix	trans	-61	-35.3	177.3	-172.2	-176.5	-63.6	0	0	112.5	K157 L158 E164 N165	K157-M161 WeakPolarHBondContact O-CB 3.24Å; K157-M161 PolarHBondContact O-N 3.13Å; L158-M161 PolarHBondContact O-N 3.1Å; M161-E164 PolarHBondContact O-N 3.18Å; M161-N165 VanDerWaalsContact O-CB 3.23Å; M161-N165 WeakPolarHBondContact O-CB 3.35Å; M161-N165 PolarHBondContact O-N 3.1Å
162	K	97.8	Very high	97.4	Very high	135 Å²	135	100.3 Å²	100.3	59%	0.587	50%	0.502	S	S	*	.	H	α-helix	trans	-63	-43.6	173.6	179	-179	175.1	-177.4	0	111.6	L158 L159 A160 N165 E166	L158-K162 WeakPolarHBondContact O-CB 3.42Å; L158-K162 PolarHBondContact O-N 2.68Å; L159-K162 WeakPolarHBondContact O-CB 3.29Å; L159-K162 PolarHBondContact O-N 3.4Å; A160-K162 VanDerWaalsContact C-N 3.28Å; A160-K162 PolarHBondContact O-N 2.95Å; K162-N165 PolarHBondContact O-N 2.87Å; K162-E166 WeakPolarHBondContact O-CB 3.4Å; K162-E166 PolarHBondContact O-N 3.33Å
163	H	98	Very high	97.5	Very high	99 Å²	99	98.1 Å²	98.1	46%	0.458	50%	0.501	S	S	.	.	H	α-helix	trans	-69.1	-37.2	176.8	-70.7	-58.1	0	0	0	113	L159 A160 E166 A167	L159-H163 PolarHBondContact O-CD2 3.45Å; L159-H163 PolarHBondContact O-N 2.87Å; L159-H163 VanDerWaalsContact O-N 3.07Å; A160-H163 PolarHBondContact O-N 2.87Å; A160-H163 VanDerWaalsContact O-N 3.1Å; H163-E166 IonicContact ND1-OE2 3.95Å; H163-A167 WeakPolarHBondContact O-CB 2.99Å; H163-A167 PolarHBondContact O-N 3.47Å
164	E	97.5	Very high	97.7	Very high	127 Å²	127	95.6 Å²	95.6	59%	0.593	49%	0.485	S	S	*	.	H	α-helix	trans	-62.2	-46	171.6	-71.5	176.9	173.6	0	0	111.4	A160 M161 A167 L168	A160-E164 PolarHBondContact O-N 3.38Å; M161-E164 PolarHBondContact O-N 3.18Å; E164-A167 WeakPolarHBondContact O-CB 3.15Å; E164-A167 PolarHBondContact O-N 2.9Å; E164-L168 WeakPolarHBondContact O-CG 3.21Å; E164-L168 PolarHBondContact O-N 3.19Å
165	N	97.9	Very high	97.8	Very high	83 Å²	83	95.6 Å²	95.6	44%	0.444	49%	0.487	S	S	.	.	H	α-helix	trans	-62	-45.7	177.4	-165.8	-18.1	0	0	0	111.1	M161 K162 A167 L168 W169	M161-N165 VanDerWaalsContact O-CB 3.23Å; M161-N165 WeakPolarHBondContact O-CB 3.35Å; M161-N165 PolarHBondContact O-N 3.1Å; K162-N165 PolarHBondContact O-N 2.87Å; N165-A167 VanDerWaalsContact C-N 3.29Å; N165-A167 PolarHBondContact O-N 2.84Å; N165-L168 PolarHBondContact O-N 3.17Å; N165-W169 PolarHBondContact O-N 3Å; N165-W169 PolarHBondContact OD1-NE1 2.63Å
166	E	97	Very high	97.8	Very high	90 Å²	90	100.1 Å²	100.1	42%	0.421	50%	0.498	S	S	.	.	H	α-helix	trans	-59.8	-37.4	174.2	-164.1	-140.5	115.7	0	0	112.6	K162 H163 W169 R170	K162-E166 WeakPolarHBondContact O-CB 3.4Å; K162-E166 PolarHBondContact O-N 3.33Å; H163-E166 IonicContact ND1-OE2 3.95Å; E166-W169 PolarHBondContact O-N 3.18Å; E166-R170 PolarHBondContact O-N 3.39Å; E166-R170 VanDerWaalsContact O-N 3.08Å; E166-R170 IonicContact OE1-CZ 3.98Å; E166-R170 IonicContact OE1-NE 3.12Å; E166-R170 PolarHBondContact OE1-NE 3.13Å; E166-R170 IonicContact OE1-NH2 3.66Å; E166-R170 PolarHBondContact OE1-NH2 3.32Å
167	A	97.9	Very high	97.8	Very high	30 Å²	30	103.1 Å²	103.1	25%	0.248	50%	0.503	C	S	.	.	H	α-helix	trans	-65.5	-45.1	173.5	0	0	0	0	0	112.3	H163 E164 N165 W169 R170 E171	H163-A167 WeakPolarHBondContact O-CB 2.99Å; H163-A167 PolarHBondContact O-N 3.47Å; E164-A167 WeakPolarHBondContact O-CB 3.15Å; E164-A167 PolarHBondContact O-N 2.9Å; N165-A167 VanDerWaalsContact C-N 3.29Å; N165-A167 PolarHBondContact O-N 2.84Å; A167-W169 VanDerWaalsContact C-N 3.33Å; A167-W169 PolarHBondContact O-N 3.04Å; A167-R170 WeakPolarHBondContact O-CB 3.01Å; A167-R170 PolarHBondContact O-N 2.82Å; A167-R170 VanDerWaalsContact O-N 3.15Å; A167-E171 PolarHBondContact O-N 3Å
168	L	98.4	Very high	97.9	Very high	104 Å²	104	101.9 Å²	101.9	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-60.5	-39.6	174.4	-69.3	170	0	0	0	111.9	E164 N165 R170 E171 V172	E164-L168 WeakPolarHBondContact O-CG 3.21Å; E164-L168 PolarHBondContact O-N 3.19Å; N165-L168 PolarHBondContact O-N 3.17Å; L168-R170 PolarHBondContact O-N 3.48Å; L168-E171 PolarHBondContact O-N 3.22Å; L168-V172 WeakPolarHBondContact O-CB 3.39Å; L168-V172 VanDerWaalsContact O-CG2 3.29Å; L168-V172 WeakPolarHBondContact O-CG2 3.42Å; L168-V172 PolarHBondContact O-N 3.42Å
169	W	98.3	Very high	97.9	Very high	161 Å²	161	102.2 Å²	102.2	61%	0.61	50%	0.496	S	S	*	.	H	α-helix	trans	-61.4	-42.4	173.1	-82.7	105.4	0	0	0	112.6	N165 E166 A167 V172 A173	N165-W169 PolarHBondContact O-N 3Å; N165-W169 PolarHBondContact OD1-NE1 2.63Å; E166-W169 PolarHBondContact O-N 3.18Å; A167-W169 VanDerWaalsContact C-N 3.33Å; A167-W169 PolarHBondContact O-N 3.04Å; W169-V172 PolarHBondContact O-N 3.43Å; W169-A173 WeakPolarHBondContact O-CB 3.5Å; W169-A173 PolarHBondContact O-N 2.84Å
170	R	98.1	Very high	97.9	Very high	141 Å²	141	100.1 Å²	100.1	53%	0.532	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-39.5	174.8	-75	-174.7	-93.2	100.1	-5.6	112	E166 A167 L168 S174	E166-R170 PolarHBondContact O-N 3.39Å; E166-R170 VanDerWaalsContact O-N 3.08Å; E166-R170 IonicContact OE1-CZ 3.98Å; E166-R170 IonicContact OE1-NE 3.12Å; E166-R170 PolarHBondContact OE1-NE 3.13Å; E166-R170 IonicContact OE1-NH2 3.66Å; E166-R170 PolarHBondContact OE1-NH2 3.32Å; A167-R170 WeakPolarHBondContact O-CB 3.01Å; A167-R170 PolarHBondContact O-N 2.82Å; A167-R170 VanDerWaalsContact O-N 3.15Å; L168-R170 PolarHBondContact O-N 3.48Å; R170-S174 PolarHBondContact O-N 3.2Å
171	E	98	Very high	97.9	Very high	123 Å²	123	103.2 Å²	103.2	58%	0.575	50%	0.498	S	S	*	.	H	α-helix	trans	-67.1	-47.4	174.4	-71.5	-168.6	-178.7	0	0	112.5	A167 L168 A173 S174 L175	A167-E171 PolarHBondContact O-N 3Å; L168-E171 PolarHBondContact O-N 3.22Å; E171-A173 VanDerWaalsContact C-N 3.3Å; E171-A173 PolarHBondContact O-N 3.33Å; E171-S174 CarbonylContact O-C 3.58Å; E171-S174 WeakPolarHBondContact O-CA 3.33Å; E171-S174 WeakPolarHBondContact O-CB 3.45Å; E171-S174 PolarHBondContact O-N 3.31Å; E171-S174 VanDerWaalsContact O-N 3.07Å; E171-L175 WeakPolarHBondContact O-CD1 3.33Å; E171-L175 PolarHBondContact O-N 3.48Å
172	V	98.2	Very high	97.8	Very high	60 Å²	60	104 Å²	104	36%	0.364	50%	0.501	S	S	.	.	H	α-helix	trans	-59.2	-40.8	177	168.2	0	0	0	0	111.2	L168 W169 L175 R176	L168-V172 WeakPolarHBondContact O-CB 3.39Å; L168-V172 VanDerWaalsContact O-CG2 3.29Å; L168-V172 WeakPolarHBondContact O-CG2 3.42Å; L168-V172 PolarHBondContact O-N 3.42Å; W169-V172 PolarHBondContact O-N 3.43Å; V172-L175 PolarHBondContact O-N 2.85Å; V172-R176 HydrophobicContact CG1-CG 4.48Å; V172-R176 WeakPolarHBondContact O-CB 3.43Å; V172-R176 VanDerWaalsContact O-CG 3.29Å; V172-R176 WeakPolarHBondContact O-CG 3.28Å; V172-R176 PolarHBondContact O-N 2.85Å
173	A	97.6	Very high	97.8	Very high	56 Å²	56	101.7 Å²	101.7	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-45.4	173.1	0	0	0	0	0	111.9	W169 E171 L175 R176 Q177	W169-A173 WeakPolarHBondContact O-CB 3.5Å; W169-A173 PolarHBondContact O-N 2.84Å; E171-A173 VanDerWaalsContact C-N 3.3Å; E171-A173 PolarHBondContact O-N 3.33Å; A173-L175 PolarHBondContact O-N 3.26Å; A173-R176 PolarHBondContact O-N 3.41Å; A173-Q177 PolarHBondContact O-N 3.36Å
174	S	98.2	Very high	97.7	Very high	38 Å²	38	103 Å²	103	27%	0.266	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-42.6	175.9	-168.5	0	0	0	0	112.4	R170 E171 Q177 K178	R170-S174 PolarHBondContact O-N 3.2Å; E171-S174 CarbonylContact O-C 3.58Å; E171-S174 WeakPolarHBondContact O-CA 3.33Å; E171-S174 WeakPolarHBondContact O-CB 3.45Å; E171-S174 PolarHBondContact O-N 3.31Å; E171-S174 VanDerWaalsContact O-N 3.07Å; S174-Q177 PolarHBondContact O-N 2.83Å; S174-K178 WeakPolarHBondContact O-CB 3.34Å; S174-K178 WeakPolarHBondContact O-CD 3.47Å; S174-K178 VanDerWaalsContact O-CG 3.25Å; S174-K178 WeakPolarHBondContact O-CG 3.39Å; S174-K178 PolarHBondContact O-N 3.36Å; S174-K178 WeakPolarHBondContact OG-CE 3.26Å; S174-K178 PolarHBondContact OG-NZ 3.49Å
175	L	98.1	Very high	97.7	Very high	106 Å²	106	100.5 Å²	100.5	56%	0.555	49%	0.489	S	S	*	.	H	α-helix	trans	-65.6	-44	177	-94.9	64.1	0	0	0	111.5	E171 V172 A173 Q177 K178 H179	E171-L175 WeakPolarHBondContact O-CD1 3.33Å; E171-L175 PolarHBondContact O-N 3.48Å; V172-L175 PolarHBondContact O-N 2.85Å; A173-L175 PolarHBondContact O-N 3.26Å; L175-Q177 VanDerWaalsContact C-N 3.33Å; L175-Q177 PolarHBondContact O-N 3.19Å; L175-K178 PolarHBondContact O-N 2.84Å; L175-H179 WeakPolarHBondContact O-CB 3.38Å; L175-H179 PolarHBondContact O-N 3.2Å
176	R	98.1	Very high	97.6	Very high	170 Å²	170	99.6 Å²	99.6	64%	0.642	49%	0.487	S	S	*	.	H	α-helix	trans	-59.3	-41.9	174	-75.1	174.3	177.1	-173.8	-0.1	111.7	V172 A173 A180	V172-R176 HydrophobicContact CG1-CG 4.48Å; V172-R176 WeakPolarHBondContact O-CB 3.43Å; V172-R176 VanDerWaalsContact O-CG 3.29Å; V172-R176 WeakPolarHBondContact O-CG 3.28Å; V172-R176 PolarHBondContact O-N 2.85Å; A173-R176 PolarHBondContact O-N 3.41Å; R176-A180 WeakPolarHBondContact O-CB 3.36Å; R176-A180 PolarHBondContact O-N 2.97Å
177	Q	97.9	Very high	97.5	Very high	143 Å²	143	99.2 Å²	99.2	67%	0.668	49%	0.487	S	S	*	.	H	α-helix	trans	-64.4	-45.8	175.4	-171.4	-173.3	12.4	0	0	112.2	A173 S174 L175 A180 Q181	A173-Q177 PolarHBondContact O-N 3.36Å; S174-Q177 PolarHBondContact O-N 2.83Å; L175-Q177 VanDerWaalsContact C-N 3.33Å; L175-Q177 PolarHBondContact O-N 3.19Å; Q177-A180 PolarHBondContact O-N 2.78Å; Q177-Q181 PolarHBondContact O-N 3.08Å
178	K	97.6	Very high	97.3	Very high	120 Å²	120	105.4 Å²	105.4	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-45.6	176.6	-73.3	159.7	-179.7	156.1	0	111.3	S174 L175 Q181 Q182	S174-K178 WeakPolarHBondContact O-CB 3.34Å; S174-K178 WeakPolarHBondContact O-CD 3.47Å; S174-K178 VanDerWaalsContact O-CG 3.25Å; S174-K178 WeakPolarHBondContact O-CG 3.39Å; S174-K178 PolarHBondContact O-N 3.36Å; S174-K178 WeakPolarHBondContact OG-CE 3.26Å; S174-K178 PolarHBondContact OG-NZ 3.49Å; L175-K178 PolarHBondContact O-N 2.84Å; K178-Q181 PolarHBondContact O-N 2.88Å; K178-Q182 WeakPolarHBondContact O-CG 3.49Å; K178-Q182 PolarHBondContact O-N 3.46Å
179	H	97.8	Very high	97.2	Very high	117 Å²	117	105 Å²	105	54%	0.542	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-46.5	176	-179.1	-105	0	0	0	112	L175 Q181 Q182 Q183	L175-H179 WeakPolarHBondContact O-CB 3.38Å; L175-H179 PolarHBondContact O-N 3.2Å; H179-Q181 VanDerWaalsContact C-N 3.26Å; H179-Q181 PolarHBondContact O-N 3.04Å; H179-Q182 WeakPolarHBondContact O-CB 3.46Å; H179-Q182 PolarHBondContact O-N 3.45Å; H179-Q183 PolarHBondContact O-N 2.87Å
180	A	97.3	Very high	97	Very high	45 Å²	45	101.6 Å²	101.6	37%	0.372	50%	0.499	S	S	.	.	H	α-helix	trans	-61.2	-34.5	175.9	0	0	0	0	0	112.6	R176 Q177 K184	R176-A180 WeakPolarHBondContact O-CB 3.36Å; R176-A180 PolarHBondContact O-N 2.97Å; Q177-A180 PolarHBondContact O-N 2.78Å; A180-K184 WeakPolarHBondContact O-CG 3.33Å; A180-K184 PolarHBondContact O-N 2.81Å
181	Q	97.5	Very high	96.8	Very high	113 Å²	113	100.9 Å²	100.9	53%	0.528	50%	0.502	S	S	.	.	H	α-helix	trans	-72.2	-39.9	174.4	-174.4	64.1	3.6	0	0	112.3	Q177 K178 H179 Q183 K184 V185	Q177-Q181 PolarHBondContact O-N 3.08Å; K178-Q181 PolarHBondContact O-N 2.88Å; H179-Q181 VanDerWaalsContact C-N 3.26Å; H179-Q181 PolarHBondContact O-N 3.04Å; Q181-Q183 VanDerWaalsContact C-N 3.35Å; Q181-K184 WeakPolarHBondContact O-CB 3.33Å; Q181-K184 PolarHBondContact O-N 3.03Å; Q181-V185 WeakPolarHBondContact O-CG2 3.31Å; Q181-V185 PolarHBondContact O-N 2.87Å
182	Q	96.9	Very high	96.6	Very high	124 Å²	124	101 Å²	101	58%	0.579	50%	0.501	S	S	*	.	H	α-helix	trans	-59.7	-45	171.2	-74	171	-32.6	0	0	111	K178 H179 K184 V185 V186	K178-Q182 WeakPolarHBondContact O-CG 3.49Å; K178-Q182 PolarHBondContact O-N 3.46Å; H179-Q182 WeakPolarHBondContact O-CB 3.46Å; H179-Q182 PolarHBondContact O-N 3.45Å; Q182-K184 VanDerWaalsContact C-N 3.32Å; Q182-K184 PolarHBondContact O-N 2.93Å; Q182-V185 WeakPolarHBondContact O-CB 3.43Å; Q182-V185 PolarHBondContact O-N 3.38Å; Q182-V186 WeakPolarHBondContact O-CG2 3.4Å; Q182-V186 PolarHBondContact O-N 2.97Å
183	Q	96.5	Very high	96.4	Very high	85 Å²	85	103.2 Å²	103.2	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-62	-37.7	176.2	-167.2	62.9	47	0	0	112.3	H179 Q181 V185 V186 N187	H179-Q183 PolarHBondContact O-N 2.87Å; Q181-Q183 VanDerWaalsContact C-N 3.35Å; Q183-V185 VanDerWaalsContact C-N 3.34Å; Q183-V185 PolarHBondContact O-N 2.91Å; Q183-V186 PolarHBondContact O-N 2.96Å; Q183-N187 PolarHBondContact NE2-OD1 3.21Å; Q183-N187 VanDerWaalsContact O-CB 3.3Å; Q183-N187 WeakPolarHBondContact O-CB 3.38Å; Q183-N187 PolarHBondContact O-N 2.76Å; Q183-N187 PolarHBondContact O-OD1 2.76Å
184	K	96.8	Very high	96.1	Very high	128 Å²	128	103.8 Å²	103.8	56%	0.557	51%	0.505	S	S	*	.	H	α-helix	trans	-62.4	-38.3	172.1	-74.2	168.4	-177	176.4	0	112.4	A180 Q181 Q182 K188	A180-K184 WeakPolarHBondContact O-CG 3.33Å; A180-K184 PolarHBondContact O-N 2.81Å; Q181-K184 WeakPolarHBondContact O-CB 3.33Å; Q181-K184 PolarHBondContact O-N 3.03Å; Q182-K184 VanDerWaalsContact C-N 3.32Å; Q182-K184 PolarHBondContact O-N 2.93Å; K184-K188 WeakPolarHBondContact O-CG 3.41Å; K184-K188 PolarHBondContact O-N 3.13Å
185	V	96.7	Very high	95.7	Very high	73 Å²	73	105.2 Å²	105.2	44%	0.442	52%	0.515	S	S	.	.	H	α-helix	trans	-68.7	-46.8	175.1	173.8	0	0	0	0	110.9	Q181 Q182 Q183 N187 K188 L189	Q181-V185 WeakPolarHBondContact O-CG2 3.31Å; Q181-V185 PolarHBondContact O-N 2.87Å; Q182-V185 WeakPolarHBondContact O-CB 3.43Å; Q182-V185 PolarHBondContact O-N 3.38Å; Q183-V185 VanDerWaalsContact C-N 3.34Å; Q183-V185 PolarHBondContact O-N 2.91Å; V185-N187 PolarHBondContact O-N 2.98Å; V185-K188 PolarHBondContact O-N 3.5Å; V185-K188 VanDerWaalsContact O-N 3.16Å; V185-L189 HydrophobicContact CG1-CD1 4.16Å; V185-L189 HydrophobicContact CG1-CG 4.48Å; V185-L189 WeakPolarHBondContact O-CG 3.11Å; V185-L189 PolarHBondContact O-N 2.8Å
186	V	95.9	Very high	95.2	Very high	65 Å²	65	103.8 Å²	103.8	39%	0.394	51%	0.507	S	S	.	.	H	α-helix	trans	-58.5	-46.2	175.9	170.7	0	0	0	0	111.1	Q182 Q183 K188 L189 I190	Q182-V186 WeakPolarHBondContact O-CG2 3.4Å; Q182-V186 PolarHBondContact O-N 2.97Å; Q183-V186 PolarHBondContact O-N 2.96Å; V186-K188 VanDerWaalsContact C-N 3.33Å; V186-K188 PolarHBondContact O-N 2.85Å; V186-L189 PolarHBondContact O-N 3.11Å; V186-L189 VanDerWaalsContact O-N 3.16Å; V186-I190 HydrophobicContact CG1-CD1 3.8Å; V186-I190 HydrophobicContact CG1-CG1 4.45Å; V186-I190 WeakPolarHBondContact O-CG1 3.35Å; V186-I190 PolarHBondContact O-N 2.72Å
187	N	95.2	Very high	94.6	Very high	81 Å²	81	99.6 Å²	99.6	43%	0.433	50%	0.5	S	S	.	.	H	α-helix	trans	-61.4	-40	176.3	-70.4	2.2	0	0	0	111.8	Q183 V185 I190 Q191	Q183-N187 PolarHBondContact NE2-OD1 3.21Å; Q183-N187 VanDerWaalsContact O-CB 3.3Å; Q183-N187 WeakPolarHBondContact O-CB 3.38Å; Q183-N187 PolarHBondContact O-N 2.76Å; Q183-N187 PolarHBondContact O-OD1 2.76Å; V185-N187 PolarHBondContact O-N 2.98Å; N187-I190 PolarHBondContact O-N 2.89Å; N187-Q191 VanDerWaalsContact O-CG 3.29Å; N187-Q191 WeakPolarHBondContact O-CG 3.4Å; N187-Q191 PolarHBondContact O-N 2.9Å
188	K	95.3	Very high	93.5	Very high	161 Å²	161	98.4 Å²	98.4	70%	0.7	50%	0.495	S	S	*	.	H	α-helix	trans	-64.9	-39.5	173.6	-79.7	-175.9	175.8	-171	0	112.6	K184 V185 V186 Q191 F192	K184-K188 WeakPolarHBondContact O-CG 3.41Å; K184-K188 PolarHBondContact O-N 3.13Å; V185-K188 PolarHBondContact O-N 3.5Å; V185-K188 VanDerWaalsContact O-N 3.16Å; V186-K188 VanDerWaalsContact C-N 3.33Å; V186-K188 PolarHBondContact O-N 2.85Å; K188-Q191 PolarHBondContact O-N 3.35Å; K188-F192 WeakPolarHBondContact O-CB 3.49Å; K188-F192 PolarHBondContact O-N 2.9Å
189	L	95.6	Very high	92.1	Very high	96 Å²	96	95 Å²	95	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-44.2	174.9	-69.8	171.5	0	0	0	111.2	V185 V186 Q191 F192 L193	V185-L189 HydrophobicContact CG1-CD1 4.16Å; V185-L189 HydrophobicContact CG1-CG 4.48Å; V185-L189 WeakPolarHBondContact O-CG 3.11Å; V185-L189 PolarHBondContact O-N 2.8Å; V186-L189 PolarHBondContact O-N 3.11Å; V186-L189 VanDerWaalsContact O-N 3.16Å; L189-Q191 PolarHBondContact O-N 3.13Å; L189-F192 WeakPolarHBondContact O-CB 3.45Å; L189-F192 PolarHBondContact O-N 2.91Å; L189-L193 WeakPolarHBondContact O-CD1 3.41Å; L189-L193 PolarHBondContact O-N 2.88Å
190	I	94.6	Very high	90.2	Very high	88 Å²	88	94.6 Å²	94.6	45%	0.451	49%	0.488	S	S	.	.	H	α-helix	trans	-58.8	-47.6	175	-69.4	166.3	0	0	0	110.6	V186 N187 F192 L193 I194	V186-I190 HydrophobicContact CG1-CD1 3.8Å; V186-I190 HydrophobicContact CG1-CG1 4.45Å; V186-I190 WeakPolarHBondContact O-CG1 3.35Å; V186-I190 PolarHBondContact O-N 2.72Å; N187-I190 PolarHBondContact O-N 2.89Å; I190-F192 VanDerWaalsContact C-N 3.33Å; I190-F192 PolarHBondContact O-N 3.34Å; I190-L193 PolarHBondContact O-N 3.45Å; I190-I194 HydrophobicContact CG2-CD1 3.76Å; I190-I194 HydrophobicContact CG2-CG1 4.46Å; I190-I194 VanDerWaalsContact O-CG1 3.28Å; I190-I194 WeakPolarHBondContact O-CG1 3.35Å; I190-I194 PolarHBondContact O-N 3.27Å
191	Q	92.3	Very high	88.4	Confident	127 Å²	127	102.2 Å²	102.2	59%	0.593	51%	0.507	S	S	*	.	H	α-helix	trans	-63	-36.8	176.5	-70.3	-67.3	-8.1	0	0	112.7	N187 K188 L189 I194 S195	N187-Q191 VanDerWaalsContact O-CG 3.29Å; N187-Q191 WeakPolarHBondContact O-CG 3.4Å; N187-Q191 PolarHBondContact O-N 2.9Å; K188-Q191 PolarHBondContact O-N 3.35Å; L189-Q191 PolarHBondContact O-N 3.13Å; Q191-I194 PolarHBondContact O-N 2.87Å; Q191-S195 WeakPolarHBondContact O-CB 3.29Å; Q191-S195 PolarHBondContact O-N 2.91Å
192	F	95.1	Very high	86.4	Confident	126 Å²	126	103.7 Å²	103.7	55%	0.553	52%	0.517	S	S	*	.	H	α-helix	trans	-65.6	-44.2	173.9	179.5	-111.2	0	0	0	112.1	K188 L189 I190 S195 L196	K188-F192 WeakPolarHBondContact O-CB 3.49Å; K188-F192 PolarHBondContact O-N 2.9Å; L189-F192 WeakPolarHBondContact O-CB 3.45Å; L189-F192 PolarHBondContact O-N 2.91Å; I190-F192 VanDerWaalsContact C-N 3.33Å; I190-F192 PolarHBondContact O-N 3.34Å; F192-S195 PolarHBondContact O-N 3.47Å; F192-L196 HydrophobicContact CD1-CD1 4Å; F192-L196 HydrophobicContact CE1-CD1 3.51Å; F192-L196 HydrophobicContact CE1-CG 4.29Å; F192-L196 HydrophobicContact CE2-CD1 4.36Å; F192-L196 HydrophobicContact CE2-CG 4.31Å; F192-L196 HydrophobicContact CZ-CD1 3.71Å; F192-L196 HydrophobicContact CZ-CD2 4.37Å; F192-L196 HydrophobicContact CZ-CG 4.14Å; F192-L196 WeakPolarHBondContact O-CG 3.43Å; F192-L196 PolarHBondContact O-N 3.45Å
193	L	93.5	Very high	84.3	Confident	106 Å²	106	103.8 Å²	103.8	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-62.8	-41.9	173.8	-89.5	81.4	0	0	0	111.9	L189 I190 L196 V197	L189-L193 WeakPolarHBondContact O-CD1 3.41Å; L189-L193 PolarHBondContact O-N 2.88Å; I190-L193 PolarHBondContact O-N 3.45Å; L193-L196 PolarHBondContact O-N 2.96Å; L193-V197 WeakPolarHBondContact O-CB 3.4Å; L193-V197 WeakPolarHBondContact O-CG2 3.23Å; L193-V197 PolarHBondContact O-N 2.87Å
194	I	91.8	Very high	82.4	Confident	67 Å²	67	103.1 Å²	103.1	34%	0.344	54%	0.537	S	S	.	.	H	α-helix	trans	-60.2	-47	175.3	-70.6	166.8	0	0	0	110.3	I190 Q191 L196 V197 Q198	I190-I194 HydrophobicContact CG2-CD1 3.76Å; I190-I194 HydrophobicContact CG2-CG1 4.46Å; I190-I194 VanDerWaalsContact O-CG1 3.28Å; I190-I194 WeakPolarHBondContact O-CG1 3.35Å; I190-I194 PolarHBondContact O-N 3.27Å; Q191-I194 PolarHBondContact O-N 2.87Å; I194-L196 PolarHBondContact O-N 3.42Å; I194-V197 PolarHBondContact O-N 3.2Å; I194-Q198 HydrophobicContact CG2-CG 4.31Å; I194-Q198 WeakPolarHBondContact O-CB 3.48Å; I194-Q198 WeakPolarHBondContact O-CG 3.49Å; I194-Q198 PolarHBondContact O-N 3.44Å
195	S	89.8	Confident	80.2	Confident	69 Å²	69	101.5 Å²	101.5	48%	0.483	54%	0.538	S	S	.	.	H	α-helix	trans	-61.7	-41.7	177.2	-177	0	0	0	0	112.6	Q191 F192 Q198 S199	Q191-S195 WeakPolarHBondContact O-CB 3.29Å; Q191-S195 PolarHBondContact O-N 2.91Å; F192-S195 PolarHBondContact O-N 3.47Å; S195-Q198 PolarHBondContact O-N 3.16Å; S195-S199 WeakPolarHBondContact O-CB 3.42Å; S195-S199 PolarHBondContact O-N 3.4Å; S195-S199 PolarHBondContact O-OG 3.45Å
196	L	87.5	Confident	78.2	Confident	76 Å²	76	106.8 Å²	106.8	40%	0.398	56%	0.555	S	S	.	*	H	α-helix	trans	-62.8	-41.6	172.8	-74.2	178.3	0	0	0	112.3	F192 L193 I194 S199 N200	F192-L196 HydrophobicContact CD1-CD1 4Å; F192-L196 HydrophobicContact CE1-CD1 3.51Å; F192-L196 HydrophobicContact CE1-CG 4.29Å; F192-L196 HydrophobicContact CE2-CD1 4.36Å; F192-L196 HydrophobicContact CE2-CG 4.31Å; F192-L196 HydrophobicContact CZ-CD1 3.71Å; F192-L196 HydrophobicContact CZ-CD2 4.37Å; F192-L196 HydrophobicContact CZ-CG 4.14Å; F192-L196 WeakPolarHBondContact O-CG 3.43Å; F192-L196 PolarHBondContact O-N 3.45Å; L193-L196 PolarHBondContact O-N 2.96Å; I194-L196 PolarHBondContact O-N 3.42Å; L196-S199 WeakPolarHBondContact CA-OG 3.33Å; L196-S199 PolarHBondContact O-OG 2.83Å; L196-S199 VanDerWaalsContact O-OG 3.13Å; L196-N200 WeakPolarHBondContact O-CB 3.39Å; L196-N200 PolarHBondContact O-N 3.41Å; L196-N200 VanDerWaalsContact O-N 3.11Å; L196-N200 PolarHBondContact O-ND2 2.84Å
197	V	84.4	Confident	76.3	Confident	82 Å²	82	113.3 Å²	113.3	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-70	-36.9	178.1	170	0	0	0	0	111.8	L193 I194 R201	L193-V197 WeakPolarHBondContact O-CB 3.4Å; L193-V197 WeakPolarHBondContact O-CG2 3.23Å; L193-V197 PolarHBondContact O-N 2.87Å; I194-V197 PolarHBondContact O-N 3.2Å; V197-R201 WeakPolarHBondContact O-CG 3.36Å; V197-R201 PolarHBondContact O-N 3.16Å
198	Q	75.9	Confident	74.1	Confident	117 Å²	117	117.9 Å²	117.9	55%	0.547	59%	0.588	S	S	.	*	H	α-helix	trans	-71.3	-46	177.3	-73.1	175.9	-7.1	0	0	111.9	I194 S195 N200 R201 I202	I194-Q198 HydrophobicContact CG2-CG 4.31Å; I194-Q198 WeakPolarHBondContact O-CB 3.48Å; I194-Q198 WeakPolarHBondContact O-CG 3.49Å; I194-Q198 PolarHBondContact O-N 3.44Å; S195-Q198 PolarHBondContact O-N 3.16Å; Q198-N200 VanDerWaalsContact C-N 3.35Å; Q198-N200 PolarHBondContact O-N 2.88Å; Q198-R201 WeakPolarHBondContact O-CB 3.45Å; Q198-R201 PolarHBondContact O-N 2.85Å; Q198-I202 PolarHBondContact O-N 3.06Å
199	S	66.8	Low	72.3	Confident	48 Å²	48	117.1 Å²	117.1	34%	0.336	59%	0.59	S	S	.	*	H	α-helix	trans	-62.2	-38.3	176.5	52.4	0	0	0	0	112.9	S195 L196 R201 I202 L203	S195-S199 WeakPolarHBondContact O-CB 3.42Å; S195-S199 PolarHBondContact O-N 3.4Å; S195-S199 PolarHBondContact O-OG 3.45Å; L196-S199 WeakPolarHBondContact CA-OG 3.33Å; L196-S199 PolarHBondContact O-OG 2.83Å; L196-S199 VanDerWaalsContact O-OG 3.13Å; S199-R201 PolarHBondContact O-N 3.38Å; S199-I202 PolarHBondContact O-N 3.18Å; S199-I202 VanDerWaalsContact O-N 3.13Å; S199-L203 PolarHBondContact O-N 3.31Å; S199-L203 VanDerWaalsContact O-N 3.13Å
200	N	59.2	Low	69.9	Low	110 Å²	110	117.6 Å²	117.6	59%	0.588	60%	0.599	S	S	*	*	H	α-helix	trans	-69.9	-12.7	172.6	-80.3	-83	0	0	0	114.3	L196 Q198	L196-N200 WeakPolarHBondContact O-CB 3.39Å; L196-N200 PolarHBondContact O-N 3.41Å; L196-N200 VanDerWaalsContact O-N 3.11Å; L196-N200 PolarHBondContact O-ND2 2.84Å; Q198-N200 VanDerWaalsContact C-N 3.35Å; Q198-N200 PolarHBondContact O-N 2.88Å
201	R	58.9	Low	67.9	Low	204 Å²	204	120.9 Å²	120.9	77%	0.77	62%	0.617	S	S	*	*	H	α-helix	trans	-84.5	-23.6	168.8	-73	173.1	-175.2	-119.3	3.5	112.9	V197 Q198 S199	V197-R201 WeakPolarHBondContact O-CG 3.36Å; V197-R201 PolarHBondContact O-N 3.16Å; Q198-R201 WeakPolarHBondContact O-CB 3.45Å; Q198-R201 PolarHBondContact O-N 2.85Å; S199-R201 PolarHBondContact O-N 3.38Å
202	I	55.1	Low	65.9	Low	145 Å²	145	122.1 Å²	122.1	74%	0.744	62%	0.624	S	S	*	*	H	α-helix	trans	-82.2	-42.2	178.4	-61.7	167.1	0	0	0	110.3	Q198 S199 G204	Q198-I202 PolarHBondContact O-N 3.06Å; S199-I202 PolarHBondContact O-N 3.18Å; S199-I202 VanDerWaalsContact O-N 3.13Å; I202-G204 PolarHBondContact O-N 2.86Å
203	L	53.6	Low	63.9	Low	126 Å²	126	124 Å²	124	66%	0.66	64%	0.639	S	S	*	*	S	Bend	trans	-86.6	84.2	173.9	-83.7	153.5	0	0	0	111	S199 V205	S199-L203 PolarHBondContact O-N 3.31Å; S199-L203 VanDerWaalsContact O-N 3.13Å; L203-V205 PolarHBondContact O-N 3.38Å
204	G	56.1	Low	61.3	Low	71 Å²	71	122.9 Å²	122.9	73%	0.732	64%	0.64	S	S	*	*			trans	-66.2	62.2	-178.8	0	0	0	0	0	115.8	I202 K206	I202-G204 PolarHBondContact O-N 2.86Å; G204-K206 PolarHBondContact O-N 2.9Å
205	V	52.1	Low	58.8	Low	94 Å²	94	127 Å²	127	57%	0.57	66%	0.663	S	S	*	*			trans	-77	88.3	175	-170.7	0	0	0	0	109.7	L203 R207	L203-V205 PolarHBondContact O-N 3.38Å; V205-R207 HydrophobicContact CG1-CG 3.84Å; V205-R207 PolarHBondContact O-N 3.43Å
206	K	53.6	Low	56.6	Low	184 Å²	184	129 Å²	129	80%	0.8	68%	0.677	S	S	*	*			trans	-66.3	67.2	177.4	-168	174.4	-174.3	169.6	0	112	G204 K208	G204-K206 PolarHBondContact O-N 2.9Å; K206-K208 VanDerWaalsContact C-N 3.31Å; K206-K208 PolarHBondContact O-N 3.28Å
207	R	56.7	Low	54.4	Low	201 Å²	201	133.2 Å²	133.2	76%	0.758	70%	0.7	S	S	*	*			trans	-66.1	87.7	173.8	-63.1	-164.9	-174.1	97	-0.6	109.6	V205 I209	V205-R207 HydrophobicContact CG1-CG 3.84Å; V205-R207 PolarHBondContact O-N 3.43Å; R207-I209 PolarHBondContact O-N 3.45Å
208	K	49.3	Very low	52.4	Low	178 Å²	178	135.3 Å²	135.3	77%	0.774	72%	0.718	S	S	*	*			trans	-60.4	99.7	164.4	-75.9	-174	174.1	-174.4	0	108.2	K206 P210	K206-K208 VanDerWaalsContact C-N 3.31Å; K206-K208 PolarHBondContact O-N 3.28Å; K208-P210 WeakPolarHBondContact O-CD 3.48Å
209	I	56.4	Low	50.7	Low	145 Å²	145	133 Å²	133	74%	0.744	72%	0.72	S	S	*	*			trans	-73.8	117.4	158.5	-61.9	170.5	0	0	0	105.8	R207 L211	R207-I209 PolarHBondContact O-N 3.45Å; I209-L211 PolarHBondContact O-N 2.83Å
210	P	44.4	Very low	49.4	Very low	105 Å²	105	139.4 Å²	139.4	68%	0.682	74%	0.744	S	S	*	*			trans	-73	109.1	173.6	-11.8	29.1	0	0	0	108.5	K208 M212	K208-P210 WeakPolarHBondContact O-CD 3.48Å; P210-M212 VanDerWaalsContact C-N 3.28Å; P210-M212 HydrophobicContact CB-CG 4.44Å; P210-M212 PolarHBondContact O-N 3.49Å
211	L	53.6	Low	48.3	Very low	158 Å²	158	139.6 Å²	139.6	83%	0.827	75%	0.753	S	S	*	*			trans	-71.6	88.1	165.7	-76.7	168.6	0	0	0	108.3	I209 L213	I209-L211 PolarHBondContact O-N 2.83Å; L211-L213 VanDerWaalsContact C-N 3.28Å; L211-L213 PolarHBondContact O-N 3.28Å
212	M	49.3	Very low	47.7	Very low	152 Å²	152	135.4 Å²	135.4	75%	0.749	75%	0.75	S	S	*	*			trans	-77	81.8	172.2	-73.1	-142.3	67.1	0	0	110.5	P210	P210-M212 VanDerWaalsContact C-N 3.28Å; P210-M212 HydrophobicContact CB-CG 4.44Å; P210-M212 PolarHBondContact O-N 3.49Å
213	L	54.2	Low	47.3	Very low	165 Å²	165	134.3 Å²	134.3	86%	0.864	75%	0.752	S	S	*	*			trans	-85	97.2	158.1	-67.7	172.8	0	0	0	107.8	L211	L211-L213 VanDerWaalsContact C-N 3.28Å; L211-L213 PolarHBondContact O-N 3.28Å
214	S	38.8	Very low	47	Very low	83 Å²	83	135.6 Å²	135.6	58%	0.58	75%	0.753	S	S	*	*			trans	-156.5	115.1	169.4	59.5	0	0	0	0	110.6
215	D	38.4	Very low	46.4	Very low	153 Å²	153	142.7 Å²	142.7	82%	0.818	76%	0.759	S	S	*	*			trans	-62.4	169.5	-168.1	-48.9	-75.5	0	0	0	117
216	S	45	Very low	45.6	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	77%	0.767	S	S	*	*			trans	72.4	101.1	147.5	-60.7	0	0	0	0	120.8
217	N	41.7	Very low	44.8	Very low	166 Å²	166	142.9 Å²	142.9	89%	0.888	77%	0.767	S	S	*	*				64.2	90.4	117.3	-166.1	94.7	0	0	0	119.1
218	S	42.1	Very low	43.7	Very low	126 Å²	126	138.8 Å²	138.8	88%	0.881	76%	0.756	S	S	*	*			trans	-148.3	164.7	146.8	-164.7	0	0	0	0	110.8
219	A	39.8	Very low	42.7	Very low	69 Å²	69	141.5 Å²	141.5	57%	0.57	76%	0.763	S	S	*	*			trans	-117	-178.4	-164.3	0	0	0	0	0	114.3
220	H	39.2	Very low	41.6	Very low	182 Å²	182	138.6 Å²	138.6	84%	0.843	76%	0.756	S	S	*	*			trans	75	142.4	175.7	-44	-78.7	0	0	0	115.3
221	S	36.7	Very low	41.4	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	76%	0.76	S	S	*	*			cis	-162.3	150	-12.9	43.8	0	0	0	0	111.4
222	V	45.2	Very low	40.2	Very low	116 Å²	116	141.7 Å²	141.7	70%	0.703	76%	0.761	S	S	*	*			trans	-84.4	161.5	175.6	-62.4	0	0	0	0	113.2	K224	V222-K224 HydrophobicContact CG2-CG 4.23Å
223	P	46.9	Very low	39.4	Very low	122 Å²	122	141.5 Å²	141.5	79%	0.792	76%	0.758	S	S	*	*				-119.7	141	102.2	-5.9	26.6	0	0	0	111.6
224	K	48.3	Very low	38.5	Very low	154 Å²	154	139.6 Å²	139.6	67%	0.67	75%	0.753	S	S	*	*				56.4	122.6	57.5	-70.5	-175.6	176.2	177	0	112.4	V222	V222-K224 HydrophobicContact CG2-CG 4.23Å
225	Y	42.5	Very low	38.2	Very low	219 Å²	219	143.3 Å²	143.3	86%	0.859	76%	0.761	S	S	*	*			cis	-133.7	166.8	20.6	-62.6	-94.9	0	0	0	111.5
226	G	35.6	Very low	37.9	Very low	71 Å²	71	139.1 Å²	139.1	73%	0.732	75%	0.754	S	S	*	*			cis	-156.5	-162.8	11.3	0	0	0	0	0	115.4
227	R	37	Very low	37.9	Very low	212 Å²	212	140.2 Å²	140.2	80%	0.8	76%	0.758	S	S	*	*			trans	-66.1	151.2	-168.6	-73.3	-176.3	-179.5	-97.4	15.5	114.1
228	Q	32.4	Very low	37.5	Very low	114 Å²	114	135.6 Å²	135.6	53%	0.533	75%	0.75	S	S	.	*			cis	92.8	112	21.5	-172.7	-152.9	0.6	0	0	116.1	S230	Q228-S230 PolarHBondContact NE2-OG 3.45Å
229	Y	29.9	Very low	37.7	Very low	235 Å²	235	134.5 Å²	134.5	92%	0.922	74%	0.739	S	S	*	*			trans	-144.4	82.2	139.1	-83.1	-71.7	0	0	0	106.4
230	S	33.7	Very low	37.6	Very low	85 Å²	85	141.7 Å²	141.7	59%	0.594	75%	0.754	S	S	*	*				80.1	106.5	73.7	-144	0	0	0	0	113.5	Q228	Q228-S230 PolarHBondContact NE2-OG 3.45Å
231	L	39.3	Very low	37.4	Very low	145 Å²	145	138.8 Å²	138.8	76%	0.759	75%	0.753	S	S	*	*			trans	-77.3	152.7	159.7	175.9	68.7	0	0	0	108.9
232	E	28.8	Very low	37.2	Very low	183 Å²	183	137.8 Å²	137.8	86%	0.855	75%	0.752	S	S	*	*			trans	-131.9	157.3	156.4	-162.6	160.9	-146.9	0	0	110.3
233	H	32.8	Very low	36.9	Very low	148 Å²	148	138.1 Å²	138.1	69%	0.685	76%	0.757	S	S	*	*			trans	-129.5	161.7	-177.2	-114.8	58	0	0	0	107.5
234	V	33.6	Very low	36.3	Very low	125 Å²	125	137.8 Å²	137.8	76%	0.758	76%	0.757	S	S	*	*				179.3	119.2	127.1	146.3	0	0	0	0	111.1
235	H	34.1	Very low	36.5	Very low	161 Å²	161	136.4 Å²	136.4	75%	0.745	76%	0.764	S	S	*	*			trans	29.5	129.6	148.3	-53.6	88.8	0	0	0	122.3
236	G	31.9	Very low	35.9	Very low	65 Å²	65	129.9 Å²	129.9	67%	0.67	76%	0.756	S	S	*	*				-95.2	159.1	124.4	0	0	0	0	0	110.6
237	P	44.5	Very low	35.8	Very low	133 Å²	133	137.3 Å²	137.3	86%	0.864	76%	0.763	S	S	*	*			trans	-85.3	153.9	172.4	34.4	-33.6	0	0	0	112.6
238	G	33.7	Very low	35.4	Very low	70 Å²	70	132.1 Å²	132.1	72%	0.722	76%	0.759	S	S	*	*			trans	-78.9	-167.7	166.5	0	0	0	0	0	112.7
239	P	45.3	Very low	35.1	Very low	102 Å²	102	132.1 Å²	132.1	66%	0.662	77%	0.772	S	S	*	*			cis	-117.8	-178.5	24.1	18.3	7.2	0	0	0	112.6
240	Y	39.2	Very low	35.2	Very low	221 Å²	221	125.9 Å²	125.9	87%	0.867	76%	0.762	S	S	*	*			cis	-140.5	163.7	26.1	-75.1	-93.7	0	0	0	113.8
241	S	33.6	Very low	34.9	Very low	120 Å²	120	127.7 Å²	127.7	84%	0.839	78%	0.775	S	S	*	*			trans	-69	170.2	168.6	-45.9	0	0	0	0	112.2
242	A	33.9	Very low	34.7	Very low	92 Å²	92	129 Å²	129	76%	0.76	78%	0.782	S	S	*	*			cis	-151.1	169.2	19.1	0	0	0	0	0	113
243	P	38.6	Very low	34.7	Very low	124 Å²	124	130.9 Å²	130.9	81%	0.805	78%	0.783	S	S	*	*			trans	-105.2	157.4	-171.7	39.5	-34	0	0	0	115.9
244	S	34.3	Very low	34.5	Very low	115 Å²	115	129 Å²	129	80%	0.804	79%	0.787	S	S	*	*			trans	-91.4	163.4	152	-73	0	0	0	0	109.1
245	P	52.5	Low	34.2	Very low	124 Å²	124	127.8 Å²	127.8	81%	0.805	78%	0.783	S	S	*	*			cis	-148.9	-169.2	30.1	42.9	-21.7	0	0	0	117.8
246	A	30.1	Very low	34	Very low	83 Å²	83	127.2 Å²	127.2	69%	0.686	79%	0.786	S	S	*	*			trans	102.2	120.3	145.2	0	0	0	0	0	121.1
247	Y	32.6	Very low	33.8	Very low	227 Å²	227	129 Å²	129	89%	0.89	79%	0.794	S	S	*	*			trans	45.7	126.3	143.2	-81.6	-96.6	0	0	0	121.7
248	S	28.9	Very low	33.5	Very low	102 Å²	102	129.2 Å²	129.2	71%	0.713	79%	0.793	S	S	*	*				175.7	145.9	103.4	-78.5	0	0	0	0	115
249	S	26.4	Very low	33.5	Very low	115 Å²	115	132 Å²	132	80%	0.804	80%	0.796	S	S	*	*			trans	67.3	155.6	157.7	78.4	0	0	0	0	117.5
250	S	31.1	Very low	32.9	Very low	103 Å²	103	131.8 Å²	131.8	72%	0.72	80%	0.797	S	S	*	*			cis	-136.1	149.3	8.9	-72	0	0	0	0	112.5
251	S	28.6	Very low	32.7	Very low	124 Å²	124	127.5 Å²	127.5	87%	0.867	80%	0.8	S	S	*	*			trans	-113.4	127.5	156.8	-59.3	0	0	0	0	108.8
252	L	33.6	Very low	32.7	Very low	173 Å²	173	125.3 Å²	125.3	91%	0.906	80%	0.796	S	S	*	*			trans	-122.6	155.4	165.7	-74.9	174.4	0	0	0	108.8
253	Y	30.1	Very low	33.3	Very low	221 Å²	221	126.3 Å²	126.3	87%	0.867	80%	0.795	S	S	*	*			trans	-86.1	145.9	-172.2	-84.9	-101.6	0	0	0	113.1
254	S	27.7	Very low	33.2	Very low	109 Å²	109	128.5 Å²	128.5	76%	0.762	80%	0.798	S	S	*	*			trans	63.7	159.1	149.2	-65.8	0	0	0	0	117.9
255	S	27.5	Very low	33.1	Very low	99 Å²	99	129 Å²	129	69%	0.692	79%	0.79	S	S	*	*			cis	-147.5	-172.5	-4.2	-131.5	0	0	0	0	111.1
256	D	29.3	Very low	32.1	Very low	149 Å²	149	128.3 Å²	128.3	80%	0.797	79%	0.788	S	S	*	*			trans	-46	148	176.3	-42.6	-101.4	0	0	0	116.5
257	A	29.2	Very low	32.3	Very low	103 Å²	103	129.8 Å²	129.8	85%	0.851	79%	0.785	S	S	*	*			trans	-161.2	147.6	137.1	0	0	0	0	0	111.8
258	V	37	Very low	32.2	Very low	137 Å²	137	125.9 Å²	125.9	83%	0.83	78%	0.778	S	S	*	*			trans	-102.7	139.6	174.7	168.2	0	0	0	0	110
259	T	35.1	Very low	32.4	Very low	129 Å²	129	127 Å²	127	79%	0.791	78%	0.78	S	S	*	*			trans	178.1	105.7	146.4	19.7	0	0	0	0	108.6
260	S	32.2	Very low	33	Very low	97 Å²	97	130.2 Å²	130.2	68%	0.678	78%	0.783	S	S	*	*				95.1	99.5	72.9	68.9	0	0	0	0	113.5
261	S	33.5	Very low	33	Very low	132 Å²	132	133.5 Å²	133.5	92%	0.923	79%	0.791	S	S	*	*			trans	-162.5	109.6	150.9	-79.8	0	0	0	0	109.3
262	G	35.4	Very low	33.1	Very low	74 Å²	74	131.7 Å²	131.7	76%	0.763	78%	0.784	S	S	*	*			trans	-112.5	-154.3	161.2	0	0	0	0	0	108.9
263	P	45.1	Very low	33.9	Very low	113 Å²	113	128.9 Å²	128.9	73%	0.734	78%	0.776	S	S	*	*			cis	-126.5	178.9	-8	41.2	-27.9	0	0	0	112.6
264	I	36.5	Very low	33.7	Very low	170 Å²	170	125 Å²	125	87%	0.872	78%	0.776	S	S	*	*			trans	-157	143.5	133.7	-103.4	154.5	0	0	0	107.8
265	I	32.2	Very low	33.9	Very low	125 Å²	125	125.1 Å²	125.1	64%	0.641	78%	0.776	S	S	*	*			trans	-117.9	136.2	-175.6	-56.3	166.4	0	0	0	104.8	D267	I265-D267 WeakPolarHBondContact CG2-OD2 3.33Å
266	S	33	Very low	34.6	Very low	110 Å²	110	126.7 Å²	126.7	77%	0.769	78%	0.784	S	S	*	*				-177.3	166.3	81.8	-75.8	0	0	0	0	108.4
267	D	33.7	Very low	34.7	Very low	113 Å²	113	127.4 Å²	127.4	60%	0.604	79%	0.787	S	S	*	*			cis	166.8	133.1	-29.6	-101	-35.6	0	0	0	105.1	I265	I265-D267 WeakPolarHBondContact CG2-OD2 3.33Å
268	I	30.4	Very low	34.7	Very low	146 Å²	146	127 Å²	127	75%	0.749	78%	0.784	S	S	*	*			trans	52.7	118.9	141.4	-49.7	167.8	0	0	0	116.4
269	T	33.8	Very low	34.4	Very low	125 Å²	125	125.6 Å²	125.6	77%	0.767	78%	0.78	S	S	*	*				-164.6	126.3	80.4	-54.9	0	0	0	0	112.2
270	E	38.3	Very low	34.9	Very low	183 Å²	183	125.5 Å²	125.5	86%	0.855	78%	0.782	S	S	*	*			trans	-88	145.2	149.9	-67.4	-172.6	142.7	0	0	109.2
271	L	29.8	Very low	34.6	Very low	172 Å²	172	124.2 Å²	124.2	90%	0.901	78%	0.784	S	S	*	*			trans	-172.7	150.7	138.1	-96	-162.7	0	0	0	110.9
272	A	30.9	Very low	34.3	Very low	86 Å²	86	129.5 Å²	129.5	71%	0.711	78%	0.783	S	S	*	*			trans	-138.6	178	165.9	0	0	0	0	0	107.7
273	P	51.2	Low	34	Very low	113 Å²	113	131 Å²	131	73%	0.734	78%	0.782	S	S	*	*			cis	-122.3	-177.6	-14.6	40.9	-27.7	0	0	0	111.9
274	T	26.9	Very low	33.4	Very low	141 Å²	141	133.8 Å²	133.8	87%	0.865	79%	0.789	S	S	*	*			trans	179.2	147.6	140.1	18.5	0	0	0	0	112.6
275	S	31.4	Very low	33.2	Very low	111 Å²	111	133 Å²	133	78%	0.776	79%	0.786	S	S	*	*			trans	-100.4	158.9	157.7	-54.6	0	0	0	0	109.1
276	P	42.4	Very low	33.1	Very low	132 Å²	132	135.3 Å²	135.3	86%	0.857	80%	0.795	S	S	*	*				-145.9	176.1	99.1	37.9	-21.7	0	0	0	116
277	L	31.6	Very low	33	Very low	164 Å²	164	140.9 Å²	140.9	86%	0.859	80%	0.799	S	S	*	*			trans	-77.3	138.1	-175.7	173.9	73.6	0	0	0	114.3
278	A	29.2	Very low	33.5	Very low	95 Å²	95	140.1 Å²	140.1	79%	0.785	80%	0.8	S	S	*	*			trans	-164	131.5	147.6	0	0	0	0	0	113.6
279	S	29.6	Very low	33.4	Very low	106 Å²	106	140.5 Å²	140.5	74%	0.741	80%	0.803	S	S	*	*			trans	-105.9	-173.4	161.4	-48.6	0	0	0	0	108.3
280	P	46.5	Very low	33.1	Very low	128 Å²	128	139.8 Å²	139.8	83%	0.831	80%	0.803	S	S	*	*			cis	-134.7	-174.9	-8.4	42.8	-26.7	0	0	0	114.2
281	G	24.9	Very low	32.6	Very low	70 Å²	70	136.5 Å²	136.5	72%	0.722	80%	0.8	S	S	*	*			trans	152.6	126.7	148.2	0	0	0	0	0	118.4
282	R	27.5	Very low	32.4	Very low	243 Å²	243	133.4 Å²	133.4	92%	0.917	79%	0.793	S	S	*	*			trans	41.1	118.9	158.9	-85.5	176.2	162.7	158.5	-5.8	119
283	S	29	Very low	32.2	Very low	106 Å²	106	136.2 Å²	136.2	74%	0.741	80%	0.802	S	S	*	*				59.7	107.7	56.3	-175.2	0	0	0	0	114.8
284	I	33.2	Very low	31.2	Very low	171 Å²	171	138.1 Å²	138.1	88%	0.877	81%	0.805	S	S	*	*			trans	-157.8	162.9	131.1	-102.1	159.8	0	0	0	107.9
285	D	31	Very low	31.4	Very low	152 Å²	152	137 Å²	137	81%	0.813	80%	0.797	S	S	*	*			trans	-100.8	-166	-160.7	-142.4	-39.5	0	0	0	113.6
286	E	30.6	Very low	31.3	Very low	175 Å²	175	143.2 Å²	143.2	82%	0.818	80%	0.804	S	S	*	*			trans	91.1	135.2	162.1	-72.2	-85.2	66.3	0	0	120.5
287	R	30.9	Very low	30.8	Very low	226 Å²	226	142.7 Å²	142.7	85%	0.853	80%	0.798	S	S	*	*			trans	-107.3	-168.5	170.2	-123.6	179.8	-174.6	165.8	2	106.7
288	P	44.4	Very low	30.8	Very low	97 Å²	97	144.7 Å²	144.7	63%	0.63	80%	0.8	S	S	*	*			cis	-134	-168.1	-16.2	24.7	0.9	0	0	0	113.7
289	L	28.2	Very low	30.9	Very low	155 Å²	155	148.6 Å²	148.6	81%	0.812	80%	0.802	S	S	*	*			trans	109.6	125.8	146.2	-64.5	172.4	0	0	0	121.3
290	S	27	Very low	31.1	Very low	109 Å²	109	151.8 Å²	151.8	76%	0.762	81%	0.805	S	S	*	*			trans	72.9	89.6	135.4	-61.9	0	0	0	0	122.6
291	S	28.1	Very low	31.1	Very low	114 Å²	114	151 Å²	151	80%	0.797	80%	0.799	S	S	*	*				-160.4	119.6	125.3	38.9	0	0	0	0	107.6
292	S	26	Very low	31.8	Very low	108 Å²	108	153.2 Å²	153.2	76%	0.755	80%	0.802	S	S	*	*				62.8	97.9	58.7	-163.6	0	0	0	0	113.2
293	T	25.7	Very low	32.3	Very low	145 Å²	145	147.5 Å²	147.5	89%	0.89	80%	0.799	S	S	*	*			trans	-148.9	132.5	156.9	-69.6	0	0	0	0	107.6
294	L	31.9	Very low	33	Very low	152 Å²	152	147.9 Å²	147.9	80%	0.796	80%	0.799	S	S	*	*			trans	-105.5	140.3	-170.3	-79.5	165.4	0	0	0	112.3
295	V	29.2	Very low	33.5	Very low	117 Å²	117	144.8 Å²	144.8	71%	0.709	79%	0.79	S	S	*	*			trans	54.9	115.6	143.5	179.9	0	0	0	0	118
296	R	30.6	Very low	33.3	Very low	242 Å²	242	146.9 Å²	146.9	91%	0.913	79%	0.794	S	S	*	*				-146.1	97.1	121.4	-155.7	166.2	-169.9	86.3	1.3	113.8
297	V	31.6	Very low	33.3	Very low	121 Å²	121	143.2 Å²	143.2	73%	0.733	79%	0.788	S	S	*	*			trans	-63.6	144.3	161.9	175	0	0	0	0	109.3
298	K	31.3	Very low	33.7	Very low	207 Å²	207	138.6 Å²	138.6	90%	0.9	79%	0.787	S	S	*	*			trans	-125.5	144.2	155.6	-167.3	174.6	178.5	-174	0	109.2
299	Q	31.7	Very low	33	Very low	176 Å²	176	144.9 Å²	144.9	82%	0.822	80%	0.798	S	S	*	*			trans	-114	148.4	-157.2	-173	176.8	12.7	0	0	112.1
300	E	34.4	Very low	32.9	Very low	173 Å²	173	144.6 Å²	144.6	81%	0.808	80%	0.803	S	S	*	*			trans	-82.7	143.3	173.8	-178.6	-174.6	166.1	0	0	112
301	P	45.7	Very low	33.1	Very low	111 Å²	111	146.3 Å²	146.3	72%	0.721	80%	0.802	S	S	*	*			trans	-100	149.6	169.1	36.5	-30.4	0	0	0	113.3
302	P	39.3	Very low	33	Very low	118 Å²	118	149.7 Å²	149.7	77%	0.766	81%	0.806	S	S	*	*			trans	-109.2	169.1	-157.3	41.5	-37.5	0	0	0	117.2
303	S	37.6	Very low	33	Very low	122 Å²	122	148.7 Å²	148.7	85%	0.853	80%	0.804	S	S	*	*			trans	-87.7	138.5	171	-54.6	0	0	0	0	114.2
304	P	45.5	Very low	33.1	Very low	115 Å²	115	147.2 Å²	147.2	75%	0.747	80%	0.8	S	S	*	*			trans	-147.4	179.4	146.5	39.2	-22.9	0	0	0	113.7
305	P	43	Very low	33.3	Very low	105 Å²	105	145.7 Å²	145.7	68%	0.682	80%	0.799	S	S	*	*			cis	-140.9	164.9	-47.7	40.5	-24.9	0	0	0	116
306	H	27.3	Very low	33.2	Very low	197 Å²	197	143.6 Å²	143.6	91%	0.912	80%	0.801	S	S	*	*			trans	64.6	169.2	148.2	-76.4	-53.8	0	0	0	123.4
307	S	29.3	Very low	33.1	Very low	98 Å²	98	143.1 Å²	143.1	69%	0.685	80%	0.799	S	S	*	*			trans	-128.2	170.8	-162.5	167.1	0	0	0	0	110.7
308	P	39	Very low	33.1	Very low	128 Å²	128	143 Å²	143	83%	0.831	80%	0.801	S	S	*	*				-135.2	167.9	117.9	37.7	-28.5	0	0	0	115.5
309	R	29.6	Very low	33	Very low	229 Å²	229	137.9 Å²	137.9	86%	0.864	79%	0.791	S	S	*	*			trans	-80.2	158.4	179.3	-64.3	166.7	164.4	159	-8.9	113.3
310	V	27.3	Very low	32.9	Very low	150 Å²	150	134.1 Å²	134.1	91%	0.909	78%	0.784	S	S	*	*			trans	-132.9	160.6	144.3	-177.9	0	0	0	0	108.6
311	L	30.4	Very low	32.8	Very low	144 Å²	144	134.6 Å²	134.6	75%	0.754	79%	0.789	S	S	*	*			trans	-115.2	169	-170.7	-94.7	155.5	0	0	0	112.1
312	E	26.6	Very low	32.3	Very low	185 Å²	185	136.6 Å²	136.6	86%	0.864	79%	0.794	S	S	*	*			trans	65.1	157.5	159.4	-73.4	175.8	130.8	0	0	117.8
313	A	26.3	Very low	32.2	Very low	87 Å²	87	136.9 Å²	136.9	72%	0.719	79%	0.793	S	S	*	*			cis	-156.5	166.6	-21.7	0	0	0	0	0	109.3
314	S	28.5	Very low	32.4	Very low	115 Å²	115	136 Å²	136	80%	0.804	79%	0.785	S	S	*	*			trans	-88.9	145.1	172.2	179.7	0	0	0	0	111.4
315	P	35.5	Very low	31.9	Very low	120 Å²	120	139 Å²	139	78%	0.779	79%	0.794	S	S	*	*				-146.2	156.8	129.3	38	-24.2	0	0	0	116.3
316	G	26.1	Very low	31.9	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	79%	0.785	S	S	*	*			trans	86	99.1	130.1	0	0	0	0	0	119.4
317	R	29.5	Very low	32.7	Very low	231 Å²	231	133.5 Å²	133.5	87%	0.872	78%	0.777	S	S	*	*			trans	-82.5	138.1	164.3	175.4	-175.3	-171.9	-150.8	8	111.6
318	P	31.8	Very low	33.5	Very low	119 Å²	119	134 Å²	134	77%	0.773	78%	0.776	S	S	*	*			trans	-112.1	-178.6	144.4	35.9	-29.9	0	0	0	112.3
319	S	28.8	Very low	34.2	Very low	100 Å²	100	131 Å²	131	70%	0.699	76%	0.762	S	S	*	*			trans	-109.7	152.4	-155.5	54.2	0	0	0	0	116.5
320	S	28.6	Very low	35.2	Very low	97 Å²	97	127.4 Å²	127.4	68%	0.678	75%	0.753	S	S	*	*			trans	59.2	102	139.2	-175	0	0	0	0	119.5
321	M	34.2	Very low	36.5	Very low	183 Å²	183	125.4 Å²	125.4	90%	0.901	74%	0.736	S	S	*	*			trans	-148.5	132.8	132.7	-85.1	-54.6	179	0	0	109.6
322	D	33.8	Very low	37.4	Very low	153 Å²	153	122.5 Å²	122.5	82%	0.818	72%	0.721	S	S	*	*			trans	-96.7	128	172.3	-73.9	-66.3	0	0	0	111.1
323	T	36.8	Very low	38.4	Very low	123 Å²	123	117.6 Å²	117.6	76%	0.755	71%	0.707	S	S	*	*			trans	-152.3	118.9	152.5	-47.6	0	0	0	0	110.2
324	P	42.2	Very low	39.8	Very low	105 Å²	105	118.7 Å²	118.7	68%	0.682	70%	0.7	S	S	*	*			trans	-84.5	143.8	174.2	33.4	-33.2	0	0	0	111.6
325	L	34.3	Very low	40.7	Very low	178 Å²	178	119.5 Å²	119.5	93%	0.932	69%	0.694	S	S	*	*			trans	-118.8	89.5	170	-69.2	179.4	0	0	0	110.9
326	S	44.2	Very low	41.1	Very low	72 Å²	72	122 Å²	122	50%	0.503	69%	0.688	S	S	.	*			trans	-130.8	134	160.4	-177	0	0	0	0	108.1	T328 A329	S326-T328 PolarHBondContact O-N 2.91Å; S326-A329 PolarHBondContact O-N 3.48Å
327	P	44.3	Very low	41.7	Very low	114 Å²	114	127.1 Å²	127.1	74%	0.74	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-24.2	-167.3	-29.2	36.3	0	0	0	116.2	A329	P327-A329 VanDerWaalsContact C-N 3.3Å; P327-A329 PolarHBondContact O-N 3.44Å
328	T	46.4	Very low	42	Very low	108 Å²	108	120.9 Å²	120.9	66%	0.663	68%	0.684	S	S	*	*	H	α-helix	trans	-66.9	-26	-176.9	-11	0	0	0	0	114	S326 F330	S326-T328 PolarHBondContact O-N 2.91Å; T328-F330 PolarHBondContact O-N 2.95Å
329	A	53.7	Low	42.1	Very low	64 Å²	64	124.1 Å²	124.1	53%	0.529	69%	0.689	S	S	.	*	H	α-helix	trans	-73.3	-23.8	-174.5	0	0	0	0	0	114	S326 P327	S326-A329 PolarHBondContact O-N 3.48Å; P327-A329 VanDerWaalsContact C-N 3.3Å; P327-A329 PolarHBondContact O-N 3.44Å
330	F	50.3	Low	42.4	Very low	155 Å²	155	124.5 Å²	124.5	68%	0.68	69%	0.689	S	S	*	*	H	α-helix	trans	-75.1	-36.4	-177.7	-176.1	-110	0	0	0	112.6	T328 S333 I334	T328-F330 PolarHBondContact O-N 2.95Å; F330-S333 PolarHBondContact O-N 3.28Å; F330-I334 HydrophobicContact CD1-CD1 4.12Å; F330-I334 HydrophobicContact CE1-CD1 3.71Å; F330-I334 HydrophobicContact CZ-CD1 4Å
331	I	54.3	Low	42.5	Very low	108 Å²	108	126.3 Å²	126.3	55%	0.554	70%	0.696	S	S	*	*	H	α-helix	trans	-69.4	-41.4	-175.5	-59.3	174.2	0	0	0	110.9	S333 I334	I331-S333 PolarHBondContact O-N 2.84Å; I331-I334 PolarHBondContact O-N 3.05Å; I331-I334 VanDerWaalsContact O-N 3.16Å
332	D	49.9	Very low	42.8	Very low	82 Å²	82	123.4 Å²	123.4	44%	0.439	69%	0.691	S	S	.	*	H	α-helix	trans	-73.4	-8.9	-177.2	-151.3	44.7	0	0	0	113.1	R336	D332-R336 PolarHBondContact O-NH1 3.49Å; D332-R336 IonicContact OD1-CZ 3.17Å; D332-R336 IonicContact OD1-NH1 3.39Å; D332-R336 IonicContact OD1-NH2 3.49Å; D332-R336 PolarHBondContact OD1-NH2 3.25Å; D332-R336 IonicContact OD2-CZ 3.75Å; D332-R336 IonicContact OD2-NH1 2.63Å; D332-R336 PolarHBondContact OD2-NH1 2.99Å; D332-R336 IonicContact OD2-NH2 2.77Å; D332-R336 PolarHBondContact OD2-NH2 3.06Å
333	S	46.8	Very low	42.6	Very low	82 Å²	82	120.3 Å²	120.3	57%	0.573	69%	0.687	S	S	*	*	H	α-helix	trans	-86.7	-22.3	171.7	-167.6	0	0	0	0	113.4	F330 I331	F330-S333 PolarHBondContact O-N 3.28Å; I331-S333 PolarHBondContact O-N 2.84Å
334	I	55.7	Low	42.3	Very low	110 Å²	110	118.5 Å²	118.5	56%	0.564	69%	0.685	S	S	*	*	H	α-helix	trans	-87.7	-23.7	-176	-64.6	171.1	0	0	0	111.3	F330 I331	F330-I334 HydrophobicContact CD1-CD1 4.12Å; F330-I334 HydrophobicContact CE1-CD1 3.71Å; F330-I334 HydrophobicContact CZ-CD1 4Å; I331-I334 PolarHBondContact O-N 3.05Å; I331-I334 VanDerWaalsContact O-N 3.16Å
335	L	46.7	Very low	41.7	Very low	132 Å²	132	118.3 Å²	118.3	69%	0.691	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	9.5	-178.4	-70.2	169.9	0	0	0	114.8
336	R	44.7	Very low	41.5	Very low	173 Å²	173	116.4 Å²	116.4	65%	0.653	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	0.1	-177.9	-68.2	-163.6	179.4	94.6	2.7	115.7	D332 S338	D332-R336 PolarHBondContact O-NH1 3.49Å; D332-R336 IonicContact OD1-CZ 3.17Å; D332-R336 IonicContact OD1-NH1 3.39Å; D332-R336 IonicContact OD1-NH2 3.49Å; D332-R336 PolarHBondContact OD1-NH2 3.25Å; D332-R336 IonicContact OD2-CZ 3.75Å; D332-R336 IonicContact OD2-NH1 2.63Å; D332-R336 PolarHBondContact OD2-NH1 2.99Å; D332-R336 IonicContact OD2-NH2 2.77Å; D332-R336 PolarHBondContact OD2-NH2 3.06Å; R336-S338 PolarHBondContact O-N 2.82Å
337	E	38.8	Very low	40.9	Very low	181 Å²	181	119.6 Å²	119.6	85%	0.846	69%	0.693	S	S	*	*			trans	-97.7	55	-175.8	-156.9	177.5	161	0	0	112.8
338	S	36.4	Very low	40.2	Very low	100 Å²	100	118.5 Å²	118.5	70%	0.699	69%	0.693	S	S	*	*			trans	-158.8	92.9	176.1	62.3	0	0	0	0	114.1	R336	R336-S338 PolarHBondContact O-N 2.82Å
339	E	33.2	Very low	40.2	Very low	187 Å²	187	118.8 Å²	118.8	87%	0.874	70%	0.697	S	S	*	*			trans	150.1	149.5	149.1	-83.3	-78.7	87.2	0	0	111.2
340	P	35.8	Very low	39.1	Very low	108 Å²	108	123.1 Å²	123.1	70%	0.701	71%	0.708	S	S	*	*			trans	-95.8	156.5	-165.4	36.4	-36.3	0	0	0	116.5
341	T	30.6	Very low	38.1	Very low	135 Å²	135	121.3 Å²	121.3	83%	0.828	71%	0.706	S	S	*	*			trans	-84.7	162.7	166.3	12.8	0	0	0	0	111.2
342	P	40.8	Very low	36.9	Very low	121 Å²	121	121.6 Å²	121.6	79%	0.786	71%	0.712	S	S	*	*			cis	-135.4	-159.2	42.7	38.4	-14.9	0	0	0	112.9
343	A	29	Very low	35.9	Very low	88 Å²	88	124.5 Å²	124.5	73%	0.727	73%	0.733	S	S	*	*			cis	-159	161.3	12.7	0	0	0	0	0	115.6
344	A	30	Very low	35	Very low	86 Å²	86	124.4 Å²	124.4	71%	0.711	75%	0.745	S	S	*	*			trans	52	107.9	139.3	0	0	0	0	0	123.2
345	S	29.2	Very low	33.8	Very low	101 Å²	101	123.9 Å²	123.9	71%	0.706	76%	0.757	S	S	*	*				98.4	135.5	114.6	77.4	0	0	0	0	123.1
346	N	30.3	Very low	32.9	Very low	138 Å²	138	126.7 Å²	126.7	74%	0.738	77%	0.767	S	S	*	*			trans	87.9	118.4	142.2	-66.2	-6.3	0	0	0	123.7
347	T	32.1	Very low	32.1	Very low	139 Å²	139	122.4 Å²	122.4	85%	0.853	77%	0.769	S	S	*	*			trans	66.5	130.2	139.8	49.6	0	0	0	0	122.2
348	A	29.1	Very low	32.6	Very low	90 Å²	90	119.8 Å²	119.8	74%	0.744	77%	0.767	S	S	*	*			trans	-103.6	-174.3	157.3	0	0	0	0	0	108.7
349	P	46.6	Very low	32.1	Very low	114 Å²	114	119.7 Å²	119.7	74%	0.74	77%	0.772	S	S	*	*			cis	-138.5	-156.9	2.3	43.2	-23.1	0	0	0	114.5
350	M	31.8	Very low	31.9	Very low	155 Å²	155	117.8 Å²	117.8	76%	0.764	77%	0.767	S	S	*	*			trans	103.2	116.7	145.8	-113.2	179.3	128.5	0	0	121.5
351	D	28	Very low	32.2	Very low	118 Å²	118	118.4 Å²	118.4	63%	0.631	77%	0.771	S	S	*	*				76	123.1	128.9	-80.8	23.5	0	0	0	127
352	T	29.4	Very low	32.1	Very low	113 Å²	113	117.5 Å²	117.5	69%	0.693	77%	0.766	S	S	*	*			trans	77	117.9	134.5	56	0	0	0	0	123.2
353	T	29.3	Very low	32.4	Very low	143 Å²	143	117.3 Å²	117.3	88%	0.877	77%	0.765	S	S	*	*				61.1	117	124.7	-44.1	0	0	0	0	120.3
354	G	27.7	Very low	32.3	Very low	80 Å²	80	118.7 Å²	118.7	83%	0.825	77%	0.769	S	S	*	*			trans	-174.1	142	162.2	0	0	0	0	0	110.7
355	A	29.6	Very low	32.3	Very low	99 Å²	99	121.1 Å²	121.1	82%	0.818	78%	0.775	S	S	*	*			trans	-125.3	178.4	-174.5	0	0	0	0	0	112.4
356	Q	28.3	Very low	33.1	Very low	192 Å²	192	121.8 Å²	121.8	90%	0.897	78%	0.777	S	S	*	*			trans	94.9	115.8	150.3	-157.6	156.7	3.5	0	0	118.6
357	A	29	Very low	33.2	Very low	83 Å²	83	121.9 Å²	121.9	69%	0.686	77%	0.773	S	S	*	*			trans	-91.3	-172	158.1	0	0	0	0	0	108.8
358	P	47.6	Very low	33	Very low	125 Å²	125	122.7 Å²	122.7	81%	0.812	77%	0.765	S	S	*	*			cis	-137.7	-176.4	1.8	44	-27.1	0	0	0	114.9
359	A	27.4	Very low	32.8	Very low	98 Å²	98	123.5 Å²	123.5	81%	0.81	76%	0.764	S	S	*	*			trans	-168.7	149.4	142.5	0	0	0	0	0	112.7
360	L	27.9	Very low	32.2	Very low	147 Å²	147	126.1 Å²	126.1	77%	0.77	77%	0.771	S	S	*	*			trans	-129.9	158.5	161.7	-143.9	82.3	0	0	0	107	T362	L360-T362 HydrophobicContact CD2-CG2 4.2Å
361	P	43.5	Very low	32	Very low	121 Å²	121	124 Å²	124	79%	0.786	77%	0.771	S	S	*	*				-151	177.4	89.2	38.2	-18.7	0	0	0	116.6
362	T	28	Very low	32.2	Very low	116 Å²	116	124.8 Å²	124.8	71%	0.712	78%	0.78	S	S	*	*			trans	-87.5	-169.7	175	53.2	0	0	0	0	111.1	L360	L360-T362 HydrophobicContact CD2-CG2 4.2Å
363	P	45.5	Very low	32.4	Very low	118 Å²	118	124 Å²	124	77%	0.766	79%	0.786	S	S	*	*			cis	-142.9	176	5.1	44.1	-25.5	0	0	0	118.3
364	S	26.9	Very low	32.5	Very low	117 Å²	117	123 Å²	123	82%	0.818	78%	0.783	S	S	*	*			trans	-175.4	150.1	138.6	31.6	0	0	0	0	112.8
365	T	30	Very low	32.7	Very low	136 Å²	136	127.4 Å²	127.4	83%	0.834	79%	0.786	S	S	*	*			trans	-155.7	174.9	179.6	54.3	0	0	0	0	108.3
366	P	46.6	Very low	32.8	Very low	116 Å²	116	128.9 Å²	128.9	75%	0.753	78%	0.781	S	S	*	*			cis	-116.4	-152.2	1.5	22	5.5	0	0	0	111.1
367	E	32.3	Very low	32.9	Very low	140 Å²	140	125.9 Å²	125.9	65%	0.654	77%	0.771	S	S	*	*			cis	-152.2	-177.2	14.7	-54.9	-178.6	80.2	0	0	113.5
368	K	28	Very low	32.8	Very low	155 Å²	155	129.6 Å²	129.6	67%	0.674	78%	0.778	S	S	*	*			trans	76.9	76.8	142.3	-80.8	160	-175.6	146.8	0	121.5
369	C	26.2	Very low	31.9	Very low	108 Å²	108	127.2 Å²	127.2	73%	0.73	77%	0.769	S	S	*	*				73.5	117.3	112.5	-67.1	0	0	0	0	122.8
370	L	32.7	Very low	31.9	Very low	168 Å²	168	132.8 Å²	132.8	88%	0.88	77%	0.769	S	S	*	*			trans	70.3	153	144.9	-55.4	170.1	0	0	0	118.3
371	S	28.1	Very low	32	Very low	110 Å²	110	129.9 Å²	129.9	77%	0.769	77%	0.766	S	S	*	*			cis	-164.4	152.6	-33.8	-167.5	0	0	0	0	107.6
372	V	32.8	Very low	31.6	Very low	135 Å²	135	130.3 Å²	130.3	82%	0.818	77%	0.769	S	S	*	*			trans	-116.5	133.4	-169	179.7	0	0	0	0	113.2
373	A	33.2	Very low	31.6	Very low	98 Å²	98	133.3 Å²	133.3	81%	0.81	78%	0.775	S	S	*	*			trans	-151.3	149.4	160.1	0	0	0	0	0	110.1
374	C	31.9	Very low	30.7	Very low	122 Å²	122	135.6 Å²	135.6	82%	0.824	78%	0.778	S	S	*	*			trans	-97.1	159.1	-172.2	-60.2	0	0	0	0	113.5
375	L	31.9	Very low	30.7	Very low	171 Å²	171	135.3 Å²	135.3	90%	0.895	78%	0.775	S	S	*	*			trans	-123.9	98.4	176	-78.8	171.9	0	0	0	113
376	D	31	Very low	30.7	Very low	131 Å²	131	132 Å²	132	70%	0.701	77%	0.769	S	S	*	*				49.3	135.5	118.6	-145.2	40.9	0	0	0	124.3
377	N	29.5	Very low	29.8	Very low	128 Å²	128	133.2 Å²	133.2	68%	0.684	77%	0.773	S	S	*	*			trans	41	127.9	147.7	-83	-48.4	0	0	0	123.7
378	L	28.1	Very low	29.6	Very low	162 Å²	162	130.2 Å²	130.2	85%	0.848	77%	0.773	S	S	*	*				-152.1	144.5	119.3	-153.9	60	0	0	0	114.1
379	A	28.8	Very low	29.7	Very low	74 Å²	74	134 Å²	134	61%	0.612	78%	0.783	S	S	*	*			trans	-81.6	168.2	-174.7	0	0	0	0	0	115.2
380	R	28	Very low	29.7	Very low	215 Å²	215	136.7 Å²	136.7	81%	0.811	79%	0.789	S	S	*	*				169.9	142.5	109.1	-173.4	157.5	-70.8	112.4	0.8	113.6
381	A	29.2	Very low	29.7	Very low	86 Å²	86	137.9 Å²	137.9	71%	0.711	79%	0.788	S	S	*	*			trans	-104.2	165.5	172.6	0	0	0	0	0	112.4
382	P	34.8	Very low	29.9	Very low	131 Å²	131	138.3 Å²	138.3	85%	0.851	79%	0.788	S	S	*	*			trans	-132.8	172.9	134.8	37.4	-26.4	0	0	0	114
383	Q	29.2	Very low	29.6	Very low	179 Å²	179	136.8 Å²	136.8	84%	0.836	78%	0.782	S	S	*	*			trans	-108	177.9	-174.9	-73.5	-154.8	55.6	0	0	113.9
384	M	25.2	Very low	29.9	Very low	166 Å²	166	137.6 Å²	137.6	82%	0.818	78%	0.779	S	S	*	*			trans	133.7	150.1	157	-74.9	-62.1	110.5	0	0	110.5
385	S	28	Very low	29.8	Very low	110 Å²	110	136.8 Å²	136.8	77%	0.769	78%	0.775	S	S	*	*			cis	-170.6	161.4	-23.2	-170.4	0	0	0	0	109.3
386	G	28.9	Very low	29.8	Very low	67 Å²	67	133.5 Å²	133.5	69%	0.691	77%	0.766	S	S	*	*			trans	121.4	120.9	175.1	0	0	0	0	0	113.3
387	V	27.7	Very low	29.7	Very low	141 Å²	141	135.8 Å²	135.8	86%	0.855	77%	0.77	S	S	*	*			cis	96.6	115.7	14.5	-172.6	0	0	0	0	116.3
388	A	29.5	Very low	29.9	Very low	78 Å²	78	136.5 Å²	136.5	65%	0.645	77%	0.773	S	S	*	*			trans	87.3	111.5	153.9	0	0	0	0	0	122.8
389	R	28.8	Very low	30.1	Very low	233 Å²	233	137.9 Å²	137.9	88%	0.879	78%	0.775	S	S	*	*			trans	61.6	133.1	134.9	-52.8	174.8	179.9	-178.3	-0.4	118.5
390	L	26.7	Very low	30.1	Very low	166 Å²	166	138 Å²	138	87%	0.869	78%	0.783	S	S	*	*				-167.7	164.1	67.6	-86.5	169.9	0	0	0	112.9
391	F	32	Very low	30.3	Very low	192 Å²	192	138.3 Å²	138.3	84%	0.842	78%	0.784	S	S	*	*			trans	-78.6	165.2	162	-87.9	-84.5	0	0	0	110.5
392	P	32.4	Very low	30.7	Very low	119 Å²	119	139.8 Å²	139.8	77%	0.773	78%	0.784	S	S	*	*			cis	-148.5	178.6	39.9	43.7	-23.2	0	0	0	119
393	C	27.2	Very low	30.9	Very low	104 Å²	104	139.3 Å²	139.3	70%	0.703	77%	0.77	S	S	*	*			trans	-82.6	168.3	161.6	-43.9	0	0	0	0	110.4
394	P	39	Very low	31.7	Very low	114 Å²	114	136.2 Å²	136.2	74%	0.74	77%	0.766	S	S	*	*				-153.5	151	72.1	39.1	-19.1	0	0	0	118.7
395	S	31	Very low	32.7	Very low	105 Å²	105	130.9 Å²	130.9	73%	0.734	75%	0.754	S	S	*	*			trans	57.2	157.3	148.7	-43.5	0	0	0	0	119.8
396	S	30.4	Very low	34.1	Very low	102 Å²	102	130 Å²	130	71%	0.713	74%	0.74	S	S	*	*			cis	-153.1	137	22.3	-69.3	0	0	0	0	114.3
397	F	30.4	Very low	36.3	Very low	179 Å²	179	133.2 Å²	133.2	79%	0.785	74%	0.737	S	S	*	*			trans	38.3	126.3	136.1	-62.6	-76.7	0	0	0	124.9
398	L	33.1	Very low	38.4	Very low	144 Å²	144	131.9 Å²	131.9	75%	0.754	73%	0.725	S	S	*	*			trans	68.9	108.4	134.8	-62.3	170.7	0	0	0	121.9
399	H	32.2	Very low	40.8	Very low	191 Å²	191	131 Å²	131	88%	0.884	71%	0.714	S	S	*	*				-154.1	122.7	109	-112	69.7	0	0	0	111.6	R401	H399-R401 PolarHBondContact O-N 2.93Å
400	G	29.1	Very low	43.2	Very low	75 Å²	75	124.6 Å²	124.6	77%	0.773	70%	0.697	S	S	*	*			trans	-86.9	105.3	178.6	0	0	0	0	0	111.7
401	R	32.1	Very low	46.2	Very low	223 Å²	223	121.7 Å²	121.7	84%	0.842	68%	0.679	S	S	*	*			trans	-92.1	109.2	170.1	-177.9	176.4	-177.2	155.6	1.6	108.8	H399 Q403	H399-R401 PolarHBondContact O-N 2.93Å; R401-Q403 PolarHBondContact O-N 3.25Å
402	V	36.5	Very low	48.8	Very low	116 Å²	116	116.9 Å²	116.9	70%	0.703	66%	0.661	S	S	*	*			trans	-59.1	129.5	174.3	-179.6	0	0	0	0	109.2
403	Q	39.1	Very low	51.2	Low	121 Å²	121	115.4 Å²	115.4	57%	0.565	65%	0.647	S	S	*	*			trans	-104.1	130.1	173.8	-78.3	-86.7	78.6	0	0	108.3	R401 G405 N406	R401-Q403 PolarHBondContact O-N 3.25Å; Q403-G405 PolarHBondContact O-N 3.46Å; Q403-N406 PolarHBondContact O-N 3.16Å
404	P	47.3	Very low	54	Low	114 Å²	114	112.4 Å²	112.4	74%	0.74	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	15.2	-177.3	32.3	-37.6	0	0	0	114
405	G	46.4	Very low	56.3	Low	55 Å²	55	110.7 Å²	110.7	57%	0.567	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-17.1	172.7	0	0	0	0	0	113.8	Q403	Q403-G405 PolarHBondContact O-N 3.46Å
406	N	56.8	Low	58.8	Low	92 Å²	92	110.9 Å²	110.9	49%	0.492	61%	0.606	S	S	.	*	H	α-helix	trans	-74.9	-44.6	-176.8	-77.6	56.5	0	0	0	112.1	Q403 L408 S409 D410	Q403-N406 PolarHBondContact O-N 3.16Å; N406-L408 PolarHBondContact O-N 3.14Å; N406-S409 CarbonylContact O-C 3.59Å; N406-S409 WeakPolarHBondContact O-CA 3.36Å; N406-S409 WeakPolarHBondContact O-CB 3.4Å; N406-S409 PolarHBondContact O-N 2.91Å; N406-D410 VanDerWaalsContact O-CG 3.3Å; N406-D410 PolarHBondContact O-N 3.08Å
407	E	74.4	Confident	61.3	Low	133 Å²	133	109.2 Å²	109.2	62%	0.621	59%	0.594	S	S	*	*	H	α-helix	trans	-55.3	-32.2	-172.6	-63.5	172.2	-170.3	0	0	113.6	H411	E407-H411 WeakPolarHBondContact O-CB 3.39Å; E407-H411 PolarHBondContact O-N 3.35Å; E407-H411 VanDerWaalsContact O-N 3.12Å
408	L	71.8	Confident	64	Low	113 Å²	113	105.8 Å²	105.8	59%	0.592	58%	0.584	S	S	*	*	H	α-helix	trans	-77	-36.5	174.5	-177.2	60.4	0	0	0	112.7	N406 L412	N406-L408 PolarHBondContact O-N 3.14Å; L408-L412 HydrophobicContact CD1-CD1 4.41Å; L408-L412 HydrophobicContact CD1-CG 4.49Å; L408-L412 HydrophobicContact CG-CD1 4.12Å; L408-L412 WeakPolarHBondContact O-CB 3.38Å; L408-L412 WeakPolarHBondContact O-CD1 3.29Å; L408-L412 WeakPolarHBondContact O-CG 3.35Å; L408-L412 PolarHBondContact O-N 2.83Å
409	S	80.6	Confident	66.6	Low	60 Å²	60	103.9 Å²	103.9	42%	0.42	57%	0.574	S	S	.	*	H	α-helix	trans	-66.4	-51.6	173.2	-163.1	0	0	0	0	110.1	N406 H411 L412 D413	N406-S409 CarbonylContact O-C 3.59Å; N406-S409 WeakPolarHBondContact O-CA 3.36Å; N406-S409 WeakPolarHBondContact O-CB 3.4Å; N406-S409 PolarHBondContact O-N 2.91Å; S409-H411 PolarHBondContact O-N 2.83Å; S409-H411 VanDerWaalsContact O-N 3.14Å; S409-L412 WeakPolarHBondContact O-CA 3.3Å; S409-L412 PolarHBondContact O-N 3.37Å; S409-D413 WeakPolarHBondContact O-CB 3.29Å; S409-D413 PolarHBondContact O-N 3.22Å; S409-D413 PolarHBondContact OG-OD2 3.36Å
410	D	79.1	Confident	69	Low	98 Å²	98	99.7 Å²	99.7	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-57	-33.4	178.8	-58.3	-38.3	0	0	0	111.2	N406 A414	N406-D410 VanDerWaalsContact O-CG 3.3Å; N406-D410 PolarHBondContact O-N 3.08Å; D410-A414 WeakPolarHBondContact O-CB 3.4Å; D410-A414 PolarHBondContact O-N 3.09Å; D410-A414 VanDerWaalsContact O-N 3.11Å
411	H	89.9	Confident	71.3	Confident	105 Å²	105	100.7 Å²	100.7	49%	0.486	55%	0.546	S	S	.	.	H	α-helix	trans	-74.4	-40.1	173.4	-176.3	38.2	0	0	0	113.7	E407 S409 A414 M415	E407-H411 WeakPolarHBondContact O-CB 3.39Å; E407-H411 PolarHBondContact O-N 3.35Å; E407-H411 VanDerWaalsContact O-N 3.12Å; S409-H411 PolarHBondContact O-N 2.83Å; S409-H411 VanDerWaalsContact O-N 3.14Å; H411-A414 PolarHBondContact O-N 2.93Å; H411-M415 WeakPolarHBondContact O-CG 3.49Å; H411-M415 PolarHBondContact O-N 3.06Å
412	L	85.4	Confident	73.5	Confident	91 Å²	91	94.4 Å²	94.4	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-64.7	-48.3	174.5	-74.4	162.5	0	0	0	111.1	L408 S409 A414 M415 D416	L408-L412 HydrophobicContact CD1-CD1 4.41Å; L408-L412 HydrophobicContact CD1-CG 4.49Å; L408-L412 HydrophobicContact CG-CD1 4.12Å; L408-L412 WeakPolarHBondContact O-CB 3.38Å; L408-L412 WeakPolarHBondContact O-CD1 3.29Å; L408-L412 WeakPolarHBondContact O-CG 3.35Å; L408-L412 PolarHBondContact O-N 2.83Å; S409-L412 WeakPolarHBondContact O-CA 3.3Å; S409-L412 PolarHBondContact O-N 3.37Å; L412-A414 VanDerWaalsContact C-N 3.25Å; L412-A414 PolarHBondContact O-N 3.07Å; L412-M415 HydrophobicContact CD2-CE 3.9Å; L412-M415 HydrophobicContact CG-CE 4.43Å; L412-M415 WeakPolarHBondContact O-CA 3.33Å; L412-M415 WeakPolarHBondContact O-CB 3.37Å; L412-M415 PolarHBondContact O-N 3.26Å; L412-D416 PolarHBondContact O-N 3.46Å
413	D	82.9	Confident	75.4	Confident	88 Å²	88	94.9 Å²	94.9	47%	0.471	52%	0.523	S	S	.	.	H	α-helix	trans	-60.1	-35.7	176.4	-68.8	-52.2	0	0	0	111.3	S409 S417	S409-D413 WeakPolarHBondContact O-CB 3.29Å; S409-D413 PolarHBondContact O-N 3.22Å; S409-D413 PolarHBondContact OG-OD2 3.36Å; D413-S417 VanDerWaalsContact O-CB 3.26Å; D413-S417 WeakPolarHBondContact O-CB 3.4Å; D413-S417 PolarHBondContact O-N 2.93Å; D413-S417 PolarHBondContact O-OG 2.93Å
414	A	87.4	Confident	77.1	Confident	42 Å²	42	92.8 Å²	92.8	35%	0.347	52%	0.518	S	S	.	.	H	α-helix	trans	-71.6	-31.1	172.4	0	0	0	0	0	113.5	D410 H411 L412 N418	D410-A414 WeakPolarHBondContact O-CB 3.4Å; D410-A414 PolarHBondContact O-N 3.09Å; D410-A414 VanDerWaalsContact O-N 3.11Å; H411-A414 PolarHBondContact O-N 2.93Å; L412-A414 VanDerWaalsContact C-N 3.25Å; L412-A414 PolarHBondContact O-N 3.07Å; A414-N418 WeakPolarHBondContact O-CB 3.4Å; A414-N418 VanDerWaalsContact O-CG 3.28Å; A414-N418 PolarHBondContact O-N 3.48Å; A414-N418 VanDerWaalsContact O-N 3.12Å; A414-N418 PolarHBondContact O-ND2 3.05Å
415	M	87	Confident	78.2	Confident	77 Å²	77	92.6 Å²	92.6	38%	0.379	51%	0.509	S	S	.	.	H	α-helix	trans	-72.1	-46.6	173.6	-76.1	-172.5	-67.6	0	0	111.5	H411 L412 S417 N418 L419	H411-M415 WeakPolarHBondContact O-CG 3.49Å; H411-M415 PolarHBondContact O-N 3.06Å; L412-M415 HydrophobicContact CD2-CE 3.9Å; L412-M415 HydrophobicContact CG-CE 4.43Å; L412-M415 WeakPolarHBondContact O-CA 3.33Å; L412-M415 WeakPolarHBondContact O-CB 3.37Å; L412-M415 PolarHBondContact O-N 3.26Å; M415-S417 VanDerWaalsContact C-N 3.33Å; M415-S417 PolarHBondContact O-N 2.98Å; M415-N418 PolarHBondContact O-N 3.37Å; M415-L419 WeakPolarHBondContact O-CG 3.35Å; M415-L419 PolarHBondContact O-N 2.92Å
416	D	82.6	Confident	79.3	Confident	110 Å²	110	95 Å²	95	59%	0.588	51%	0.508	S	S	*	.	H	α-helix	trans	-60	-43.6	174.5	-87	3.2	0	0	0	111.1	L412 N418 L419 D420	L412-D416 PolarHBondContact O-N 3.46Å; D416-N418 VanDerWaalsContact C-N 3.27Å; D416-N418 PolarHBondContact O-N 2.96Å; D416-L419 PolarHBondContact O-N 3.44Å; D416-L419 VanDerWaalsContact O-N 3.1Å; D416-D420 PolarHBondContact O-N 2.89Å
417	S	84.2	Confident	79.7	Confident	67 Å²	67	95.8 Å²	95.8	47%	0.469	52%	0.517	S	S	.	.	H	α-helix	trans	-57.9	-37.4	173.4	-62.4	0	0	0	0	112.8	D413 M415 N421	D413-S417 VanDerWaalsContact O-CB 3.26Å; D413-S417 WeakPolarHBondContact O-CB 3.4Å; D413-S417 PolarHBondContact O-N 2.93Å; D413-S417 PolarHBondContact O-OG 2.93Å; M415-S417 VanDerWaalsContact C-N 3.33Å; M415-S417 PolarHBondContact O-N 2.98Å; S417-N421 WeakPolarHBondContact O-CB 3.42Å; S417-N421 VanDerWaalsContact O-CG 3.27Å; S417-N421 PolarHBondContact O-N 3.28Å; S417-N421 VanDerWaalsContact O-N 3.08Å; S417-N421 PolarHBondContact O-ND2 2.87Å
418	N	86.6	Confident	79.1	Confident	107 Å²	107	94.2 Å²	94.2	57%	0.572	52%	0.52	S	S	*	.	H	α-helix	trans	-74.7	-32.2	176.5	-77.8	-40.4	0	0	0	112.7	A414 M415 D416 L422	A414-N418 WeakPolarHBondContact O-CB 3.4Å; A414-N418 VanDerWaalsContact O-CG 3.28Å; A414-N418 PolarHBondContact O-N 3.48Å; A414-N418 VanDerWaalsContact O-N 3.12Å; A414-N418 PolarHBondContact O-ND2 3.05Å; M415-N418 PolarHBondContact O-N 3.37Å; D416-N418 VanDerWaalsContact C-N 3.27Å; D416-N418 PolarHBondContact O-N 2.96Å; N418-L422 WeakPolarHBondContact O-CB 3.45Å; N418-L422 PolarHBondContact O-N 3.39Å
419	L	87.9	Confident	78.5	Confident	103 Å²	103	94.5 Å²	94.5	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-69.9	-42	173.7	-69.3	173.9	0	0	0	111.7	M415 D416 N421 L422 Q423	M415-L419 WeakPolarHBondContact O-CG 3.35Å; M415-L419 PolarHBondContact O-N 2.92Å; D416-L419 PolarHBondContact O-N 3.44Å; D416-L419 VanDerWaalsContact O-N 3.1Å; L419-N421 VanDerWaalsContact C-N 3.34Å; L419-N421 PolarHBondContact O-N 2.87Å; L419-L422 PolarHBondContact O-N 3.24Å; L419-Q423 WeakPolarHBondContact O-CB 3.48Å; L419-Q423 PolarHBondContact O-N 3.36Å
420	D	81	Confident	77.3	Confident	103 Å²	103	95.2 Å²	95.2	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-64.1	-38.8	173.6	-111.4	-17.8	0	0	0	111.6	D416 Q423 T424	D416-D420 PolarHBondContact O-N 2.89Å; D420-Q423 PolarHBondContact O-N 2.93Å; D420-T424 WeakPolarHBondContact O-CB 3.35Å; D420-T424 WeakPolarHBondContact O-CG2 3.47Å; D420-T424 PolarHBondContact O-N 3.35Å; D420-T424 PolarHBondContact O-OG1 2.81Å
421	N	78.9	Confident	76	Confident	97 Å²	97	97.5 Å²	97.5	52%	0.519	54%	0.541	S	S	.	.	H	α-helix	trans	-63.6	-40.1	171.5	-79.6	-44.5	0	0	0	112.2	S417 L419 T424 M425	S417-N421 WeakPolarHBondContact O-CB 3.42Å; S417-N421 VanDerWaalsContact O-CG 3.27Å; S417-N421 PolarHBondContact O-N 3.28Å; S417-N421 VanDerWaalsContact O-N 3.08Å; S417-N421 PolarHBondContact O-ND2 2.87Å; L419-N421 VanDerWaalsContact C-N 3.34Å; L419-N421 PolarHBondContact O-N 2.87Å; N421-T424 WeakPolarHBondContact CA-OG1 3.38Å; N421-T424 PolarHBondContact O-OG1 3.37Å; N421-T424 VanDerWaalsContact O-OG1 3.12Å; N421-M425 WeakPolarHBondContact O-CB 3.36Å; N421-M425 PolarHBondContact O-N 3.07Å
422	L	78.1	Confident	74.1	Confident	90 Å²	90	97.9 Å²	97.9	47%	0.471	56%	0.555	S	S	.	*	H	α-helix	trans	-66.7	-43.9	175.3	-165.3	80.6	0	0	0	111.3	N418 L419 M425 L426	N418-L422 WeakPolarHBondContact O-CB 3.45Å; N418-L422 PolarHBondContact O-N 3.39Å; L419-L422 PolarHBondContact O-N 3.24Å; L422-M425 WeakPolarHBondContact O-CB 3.38Å; L422-M425 PolarHBondContact O-N 2.94Å; L422-L426 HydrophobicContact CD2-CD1 4.27Å; L422-L426 HydrophobicContact CG-CD1 4.05Å; L422-L426 WeakPolarHBondContact O-CB 3.4Å; L422-L426 VanDerWaalsContact O-CG 3.29Å; L422-L426 WeakPolarHBondContact O-CG 3.38Å; L422-L426 PolarHBondContact O-N 2.98Å
423	Q	75.9	Confident	72.6	Confident	126 Å²	126	98.5 Å²	98.5	59%	0.589	56%	0.562	S	S	*	*	H	α-helix	trans	-66.7	-38.6	179.9	-175.7	169.9	-52.5	0	0	112	L419 D420 T427	L419-Q423 WeakPolarHBondContact O-CB 3.48Å; L419-Q423 PolarHBondContact O-N 3.36Å; D420-Q423 PolarHBondContact O-N 2.93Å; Q423-T427 WeakPolarHBondContact O-CB 3.42Å; Q423-T427 WeakPolarHBondContact O-CG2 3.25Å; Q423-T427 PolarHBondContact O-N 2.89Å; Q423-T427 VanDerWaalsContact O-N 3.07Å; Q423-T427 PolarHBondContact O-OG1 2.92Å
424	T	74.4	Confident	71	Confident	77 Å²	77	99 Å²	99	47%	0.472	57%	0.565	S	S	.	*	H	α-helix	trans	-69.5	-34.6	171.3	47.4	0	0	0	0	112.2	D420 N421 T427 S428	D420-T424 WeakPolarHBondContact O-CB 3.35Å; D420-T424 WeakPolarHBondContact O-CG2 3.47Å; D420-T424 PolarHBondContact O-N 3.35Å; D420-T424 PolarHBondContact O-OG1 2.81Å; N421-T424 WeakPolarHBondContact CA-OG1 3.38Å; N421-T424 PolarHBondContact O-OG1 3.37Å; N421-T424 VanDerWaalsContact O-OG1 3.12Å; T424-T427 WeakPolarHBondContact CA-OG1 3.49Å; T424-T427 PolarHBondContact O-N 3.24Å; T424-T427 PolarHBondContact O-OG1 3.49Å; T424-S428 WeakPolarHBondContact O-CB 3.49Å; T424-S428 PolarHBondContact O-N 3.41Å
425	M	70.1	Confident	69.7	Low	110 Å²	110	101.8 Å²	101.8	54%	0.542	58%	0.578	S	S	.	*	H	α-helix	trans	-63.9	-45.5	172.5	-157.8	-169.8	-45.7	0	0	111.8	N421 L422 T427 H429	N421-M425 WeakPolarHBondContact O-CB 3.36Å; N421-M425 PolarHBondContact O-N 3.07Å; L422-M425 WeakPolarHBondContact O-CB 3.38Å; L422-M425 PolarHBondContact O-N 2.94Å; M425-T427 VanDerWaalsContact C-N 3.28Å; M425-T427 PolarHBondContact O-N 3.18Å; M425-H429 PolarHBondContact O-N 3.43Å
426	L	69.5	Low	68.2	Low	105 Å²	105	101.4 Å²	101.4	55%	0.55	58%	0.583	S	S	.	*	H	α-helix	trans	-69.8	-17.8	178.9	-71.8	168.1	0	0	0	114.4	L422	L422-L426 HydrophobicContact CD2-CD1 4.27Å; L422-L426 HydrophobicContact CG-CD1 4.05Å; L422-L426 WeakPolarHBondContact O-CB 3.4Å; L422-L426 VanDerWaalsContact O-CG 3.29Å; L422-L426 WeakPolarHBondContact O-CG 3.38Å; L422-L426 PolarHBondContact O-N 2.98Å
427	T	65.3	Low	66.8	Low	109 Å²	109	99.1 Å²	99.1	67%	0.669	58%	0.579	S	S	*	*	H	α-helix	trans	-104.6	-22.9	175.8	50.6	0	0	0	0	113.5	Q423 T424 M425	Q423-T427 WeakPolarHBondContact O-CB 3.42Å; Q423-T427 WeakPolarHBondContact O-CG2 3.25Å; Q423-T427 PolarHBondContact O-N 2.89Å; Q423-T427 VanDerWaalsContact O-N 3.07Å; Q423-T427 PolarHBondContact O-OG1 2.92Å; T424-T427 WeakPolarHBondContact CA-OG1 3.49Å; T424-T427 PolarHBondContact O-N 3.24Å; T424-T427 PolarHBondContact O-OG1 3.49Å; M425-T427 VanDerWaalsContact C-N 3.28Å; M425-T427 PolarHBondContact O-N 3.18Å
428	S	63.4	Low	65.3	Low	100 Å²	100	100.9 Å²	100.9	70%	0.699	58%	0.583	S	S	*	*	H	α-helix	trans	-81.7	-42.4	174.2	-174.4	0	0	0	0	112	T424 G430	T424-S428 WeakPolarHBondContact O-CB 3.49Å; T424-S428 PolarHBondContact O-N 3.41Å; S428-G430 PolarHBondContact O-N 3.15Å
429	H	58	Low	64	Low	119 Å²	119	101.3 Å²	101.3	55%	0.551	58%	0.584	S	S	*	*	S	Bend	trans	-85.7	109.2	163.9	-79.7	-90.2	0	0	0	109	M425 F431	M425-H429 PolarHBondContact O-N 3.43Å; H429-F431 HydrophobicContact CB-CD2 3.81Å; H429-F431 HydrophobicContact CB-CE2 3.55Å; H429-F431 HydrophobicContact CB-CZ 4.4Å; H429-F431 WeakPolarHBondContact O-CD2 3.45Å; H429-F431 PolarHBondContact O-N 3.19Å
430	G	56.4	Low	62.3	Low	75 Å²	75	101.5 Å²	101.5	77%	0.773	59%	0.586	S	S	*	*			trans	-68	75	175.9	0	0	0	0	0	112.5	S428 S432	S428-G430 PolarHBondContact O-N 3.15Å; G430-S432 PolarHBondContact O-N 2.95Å
431	F	50.3	Low	61	Low	147 Å²	147	101.2 Å²	101.2	65%	0.645	58%	0.584	S	S	*	*			trans	-70.2	81.2	171	-76.2	-77.2	0	0	0	110.1	H429 V433	H429-F431 HydrophobicContact CB-CD2 3.81Å; H429-F431 HydrophobicContact CB-CE2 3.55Å; H429-F431 HydrophobicContact CB-CZ 4.4Å; H429-F431 WeakPolarHBondContact O-CD2 3.45Å; H429-F431 PolarHBondContact O-N 3.19Å; F431-V433 VanDerWaalsContact C-N 3.26Å; F431-V433 PolarHBondContact O-N 3.1Å
432	S	51.5	Low	59.6	Low	112 Å²	112	103.4 Å²	103.4	78%	0.783	59%	0.591	S	S	*	*			trans	-65.2	90.9	160.5	-176.8	0	0	0	0	108.2	G430 D434	G430-S432 PolarHBondContact O-N 2.95Å; S432-D434 PolarHBondContact O-N 3.33Å
433	V	52.4	Low	58.3	Low	104 Å²	104	106.2 Å²	106.2	63%	0.63	60%	0.601	S	S	*	*			trans	-64.8	103.1	166.8	177.2	0	0	0	0	106.9	F431 T435	F431-V433 VanDerWaalsContact C-N 3.26Å; F431-V433 PolarHBondContact O-N 3.1Å; V433-T435 PolarHBondContact O-N 2.98Å
434	D	50.9	Low	56.8	Low	98 Å²	98	107.3 Å²	107.3	52%	0.524	61%	0.611	S	S	.	*			trans	-68.6	105.2	176.9	-164.7	-33.5	0	0	0	108.8	S432 S436 A437	S432-D434 PolarHBondContact O-N 3.33Å; D434-S436 PolarHBondContact O-N 3.38Å; D434-S436 WeakPolarHBondContact OD1-CB 3.44Å; D434-S436 PolarHBondContact OD1-N 3.06Å; D434-S436 VanDerWaalsContact OD1-N 3.1Å; D434-S436 PolarHBondContact OD1-OG 2.77Å; D434-A437 PolarHBondContact O-N 2.93Å; D434-A437 VanDerWaalsContact O-N 3.08Å
435	T	59.2	Low	55.3	Low	102 Å²	102	110.2 Å²	110.2	63%	0.626	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	-19	-176.3	47.8	0	0	0	0	112.9	V433 A437 L438	V433-T435 PolarHBondContact O-N 2.98Å; T435-A437 VanDerWaalsContact C-N 3.29Å; T435-A437 PolarHBondContact O-N 3.08Å; T435-L438 PolarHBondContact O-N 2.7Å
436	S	55.2	Low	54.1	Low	68 Å²	68	108.9 Å²	108.9	48%	0.476	62%	0.624	S	S	.	*	H	α-helix	trans	-57.7	-41.5	174.2	-42.7	0	0	0	0	111.7	D434 L438 L439	D434-S436 PolarHBondContact O-N 3.38Å; D434-S436 WeakPolarHBondContact OD1-CB 3.44Å; D434-S436 PolarHBondContact OD1-N 3.06Å; D434-S436 VanDerWaalsContact OD1-N 3.1Å; D434-S436 PolarHBondContact OD1-OG 2.77Å; S436-L438 PolarHBondContact O-N 2.97Å; S436-L439 PolarHBondContact O-N 3.13Å; S436-L439 VanDerWaalsContact O-N 3.1Å
437	A	54.3	Low	52.6	Low	62 Å²	62	110.2 Å²	110.2	51%	0.512	64%	0.639	S	S	.	*	H	α-helix	trans	-70.2	-17.7	-177.5	0	0	0	0	0	114	D434 T435 I441	D434-A437 PolarHBondContact O-N 2.93Å; D434-A437 VanDerWaalsContact O-N 3.08Å; T435-A437 VanDerWaalsContact C-N 3.29Å; T435-A437 PolarHBondContact O-N 3.08Å; A437-I441 WeakPolarHBondContact O-CG1 3.29Å
438	L	52.7	Low	51.2	Low	105 Å²	105	114 Å²	114	55%	0.55	65%	0.649	S	S	.	*	H	α-helix	trans	-83.9	-22.2	173	-87.5	164.8	0	0	0	112.7	T435 S436 Q442	T435-L438 PolarHBondContact O-N 2.7Å; S436-L438 PolarHBondContact O-N 2.97Å; L438-Q442 PolarHBondContact O-N 3.42Å
439	L	59.1	Low	50.1	Low	115 Å²	115	117.7 Å²	117.7	60%	0.602	66%	0.655	S	S	*	*	H	α-helix	trans	-74.7	-42.6	177.4	-63.9	173.2	0	0	0	111.2	S436 I441 Q442 E443	S436-L439 PolarHBondContact O-N 3.13Å; S436-L439 VanDerWaalsContact O-N 3.1Å; L439-I441 VanDerWaalsContact C-N 3.27Å; L439-I441 PolarHBondContact O-N 2.63Å; L439-Q442 PolarHBondContact O-N 3.45Å; L439-E443 PolarHBondContact O-N 3.04Å
440	D	50.9	Low	49.1	Very low	107 Å²	107	117.1 Å²	117.1	57%	0.572	66%	0.662	S	S	*	*	H	α-helix	trans	-54.3	-41.7	173.3	-76.5	14.6	0	0	0	112.2	Q442 E443 L444	D440-Q442 VanDerWaalsContact C-N 3.29Å; D440-Q442 PolarHBondContact O-N 2.89Å; D440-E443 PolarHBondContact O-N 3.07Å; D440-L444 WeakPolarHBondContact O-CG 3.35Å; D440-L444 PolarHBondContact O-N 2.79Å
441	I	54.3	Low	48.2	Very low	98 Å²	98	119.4 Å²	119.4	50%	0.503	66%	0.663	S	S	.	*	H	α-helix	trans	-66.2	-32.9	178.7	-65	171.9	0	0	0	111.3	A437 L439	A437-I441 WeakPolarHBondContact O-CG1 3.29Å; L439-I441 VanDerWaalsContact C-N 3.27Å; L439-I441 PolarHBondContact O-N 2.63Å
442	Q	50.4	Low	47.3	Very low	142 Å²	142	123.7 Å²	123.7	66%	0.664	68%	0.675	S	S	*	*	H	α-helix	trans	-79.9	-27.7	177.5	-168.8	162.6	-20.7	0	0	112.5	L438 L439 D440 L445	L438-Q442 PolarHBondContact O-N 3.42Å; L439-Q442 PolarHBondContact O-N 3.45Å; D440-Q442 VanDerWaalsContact C-N 3.29Å; D440-Q442 PolarHBondContact O-N 2.89Å; Q442-L445 PolarHBondContact O-N 2.69Å
443	E	49.6	Very low	46.4	Very low	149 Å²	149	124.3 Å²	124.3	70%	0.696	68%	0.677	S	S	*	*	H	α-helix	trans	-68.3	-41.2	170.4	-168.3	164.8	-164.5	0	0	111.3	L439 D440 L445 S446	L439-E443 PolarHBondContact O-N 3.04Å; D440-E443 PolarHBondContact O-N 3.07Å; E443-L445 PolarHBondContact O-N 3.16Å; E443-L445 VanDerWaalsContact O-N 3.1Å; E443-S446 PolarHBondContact O-N 3.23Å; E443-S446 VanDerWaalsContact O-N 3.15Å
444	L	43.8	Very low	45.7	Very low	150 Å²	150	127 Å²	127	79%	0.785	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-10.9	174.7	-73	172.7	0	0	0	115.2	D440	D440-L444 WeakPolarHBondContact O-CG 3.35Å; D440-L444 PolarHBondContact O-N 2.79Å
445	L	44	Very low	44.7	Very low	137 Å²	137	131.6 Å²	131.6	72%	0.717	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	3.4	177.6	-74.6	167.8	0	0	0	113.7	Q442 E443	Q442-L445 PolarHBondContact O-N 2.69Å; E443-L445 PolarHBondContact O-N 3.16Å; E443-L445 VanDerWaalsContact O-N 3.1Å
446	S	43.7	Very low	43.4	Very low	82 Å²	82	131 Å²	131	57%	0.573	71%	0.709	S	S	*	*	S	Bend	trans	-80.4	130.9	173.8	-67.2	0	0	0	0	111.6	E443 Q448	E443-S446 PolarHBondContact O-N 3.23Å; E443-S446 VanDerWaalsContact O-N 3.15Å; S446-Q448 PolarHBondContact O-N 2.77Å
447	P	39.4	Very low	42.3	Very low	134 Å²	134	135.7 Å²	135.7	87%	0.87	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-63.8	119.2	178.8	-23.5	34.3	0	0	0	112.7
448	Q	36.3	Very low	41.2	Very low	187 Å²	187	139 Å²	139	87%	0.874	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-83.1	118.4	176.2	-175.6	175.4	95.5	0	0	110.7	S446	S446-Q448 PolarHBondContact O-N 2.77Å
449	E	40.1	Very low	40.2	Very low	179 Å²	179	139.9 Å²	139.9	84%	0.836	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-67.5	135.5	168.9	-96.3	-167	112.2	0	0	110.9
450	P	37.1	Very low	38.9	Very low	107 Å²	107	141.7 Å²	141.7	70%	0.695	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-79.1	147.3	178.1	32.1	-34.7	0	0	0	112.2
451	P	37.4	Very low	38.8	Very low	123 Å²	123	141.7 Å²	141.7	80%	0.799	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-72	141	177.4	30.2	-34.9	0	0	0	111.8
452	R	30.1	Very low	37.6	Very low	236 Å²	236	144.1 Å²	144.1	89%	0.891	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-81.8	136.5	171.4	-61.1	-173.8	-140	159.5	5.7	111.3
453	P	34	Very low	36.9	Very low	125 Å²	125	142.3 Å²	142.3	81%	0.812	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.9	163	158.5	-16.5	31.5	0	0	0	111.8
454	I	36.6	Very low	36.2	Very low	161 Å²	161	138.7 Å²	138.7	83%	0.826	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-94.2	132.9	169.8	-61.4	162.8	0	0	0	107.8
455	E	30.8	Very low	36.1	Very low	194 Å²	194	141.9 Å²	141.9	91%	0.907	79%	0.792	S	S	*	*			trans	-172.1	-176.4	136.4	-107	168.9	-147.6	0	0	112.6
456	A	31.6	Very low	36	Very low	89 Å²	89	144.4 Å²	144.4	74%	0.736	80%	0.8	S	S	*	*			trans	-90.5	150.3	-141.1	0	0	0	0	0	118.3
457	E	32.1	Very low	35.6	Very low	167 Å²	167	148.7 Å²	148.7	78%	0.78	82%	0.815	S	S	*	*			trans	57.4	128.1	141.4	-69.3	-127.2	128.8	0	0	123.6
458	N	31.6	Very low	35.5	Very low	132 Å²	132	147.5 Å²	147.5	71%	0.706	81%	0.805	S	S	*	*			trans	85.5	147.6	138.1	-83.5	-49.9	0	0	0	122.6
459	S	30.2	Very low	35.3	Very low	123 Å²	123	146.8 Å²	146.8	86%	0.86	80%	0.802	S	S	*	*			trans	72.7	117.4	176.8	68.1	0	0	0	0	119.3
460	N	31.8	Very low	34.9	Very low	153 Å²	153	148.3 Å²	148.3	82%	0.818	80%	0.801	S	S	*	*			trans	-98.2	172	158.9	-138.8	13.5	0	0	0	106.8
461	P	49.2	Very low	34.8	Very low	108 Å²	108	148.9 Å²	148.9	70%	0.701	80%	0.803	S	S	*	*			cis	-146.1	-178.7	12.1	45.2	-25.9	0	0	0	118.4
462	D	30.9	Very low	34.7	Very low	148 Å²	148	148 Å²	148	79%	0.791	81%	0.806	S	S	*	*			trans	88	158.4	138.5	-155.1	31	0	0	0	122.7
463	S	35.4	Very low	34.9	Very low	104 Å²	104	145 Å²	145	73%	0.727	80%	0.802	S	S	*	*			trans	79.7	82.9	170.3	71.9	0	0	0	0	117.8
464	G	34	Very low	35.2	Very low	74 Å²	74	144.7 Å²	144.7	76%	0.763	80%	0.8	S	S	*	*			trans	-86.2	-176.1	177.8	0	0	0	0	0	116
465	K	42.3	Very low	35.2	Very low	217 Å²	217	145.3 Å²	145.3	94%	0.943	80%	0.804	S	S	*	*			trans	-154.6	133.5	160	-100.5	145.1	-173.5	171.8	0	108.6
466	Q	40.9	Very low	35.4	Very low	189 Å²	189	145.4 Å²	145.4	88%	0.883	80%	0.802	S	S	*	*			trans	-109.4	127.2	-175.5	-174	176.2	3.3	0	0	109.7
467	L	36.2	Very low	35.6	Very low	172 Å²	172	149.3 Å²	149.3	90%	0.901	81%	0.809	S	S	*	*			trans	-92.1	131	178.4	-171.4	62.3	0	0	0	110.1
468	V	38.1	Very low	35.8	Very low	109 Å²	109	148.8 Å²	148.8	66%	0.661	81%	0.811	S	S	*	*			trans	-87.9	126	-175.9	177.6	0	0	0	0	110.6
469	H	32	Very low	36	Very low	173 Å²	173	149.9 Å²	149.9	80%	0.801	82%	0.817	S	S	*	*			trans	-84.1	115.5	176.8	-145.5	-66.3	0	0	0	109.7
470	Y	30.1	Very low	36.9	Very low	210 Å²	210	149.8 Å²	149.8	82%	0.824	81%	0.813	S	S	*	*			trans	-82.8	143.1	167.8	-85.6	-91.2	0	0	0	110.2
471	T	35.2	Very low	36.8	Very low	119 Å²	119	150.6 Å²	150.6	73%	0.73	82%	0.818	S	S	*	*			trans	-124.3	134.7	172.1	52.7	0	0	0	0	109
472	A	36.2	Very low	36.1	Very low	104 Å²	104	150 Å²	150	86%	0.86	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-96.5	126.4	176.3	0	0	0	0	0	109.6
473	Q	34.8	Very low	36.5	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.813	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-98.7	137.7	170.9	-69	-178.2	-16.4	0	0	109.7	L475	Q473-L475 PolarHBondContact O-N 3.49Å
474	P	39.6	Very low	36.3	Very low	119 Å²	119	151.9 Å²	151.9	77%	0.773	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-74.4	125.2	172.5	30.4	-32.5	0	0	0	110.1
475	L	36.7	Very low	36.3	Very low	174 Å²	174	154.5 Å²	154.5	91%	0.911	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-80.7	130.9	173.6	-78.8	169.6	0	0	0	110.9	Q473	Q473-L475 PolarHBondContact O-N 3.49Å
476	F	35.5	Very low	35.7	Very low	196 Å²	196	147.5 Å²	147.5	86%	0.86	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-75.2	137.5	163.5	-77.8	-100.1	0	0	0	109.5
477	L	35.6	Very low	35.3	Very low	170 Å²	170	143.7 Å²	143.7	89%	0.89	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-95	135.4	169.1	-168.5	69.4	0	0	0	109.4
478	L	35.9	Very low	35.3	Very low	156 Å²	156	140.7 Å²	140.7	82%	0.817	81%	0.807	S	S	*	*			trans	-130.1	139.7	172.4	-79.2	165.8	0	0	0	108.4
479	D	35.6	Very low	35	Very low	155 Å²	155	144.4 Å²	144.4	83%	0.829	82%	0.817	S	S	*	*			trans	-63.8	158.3	166.5	-65.2	-55.1	0	0	0	110.7
480	P	48	Very low	35.4	Very low	121 Å²	121	143.8 Å²	143.8	79%	0.786	82%	0.819	S	S	*	*				-145.2	145.4	104.8	36.5	-22.4	0	0	0	116
481	D	30.2	Very low	35.9	Very low	171 Å²	171	139.7 Å²	139.7	91%	0.914	82%	0.818	S	S	*	*			trans	-68.8	126.2	150.5	-94.4	-48	0	0	0	110.2
482	A	34.4	Very low	35.9	Very low	95 Å²	95	140 Å²	140	79%	0.785	82%	0.82	S	S	*	*			trans	-161.7	143.8	157.3	0	0	0	0	0	111.9
483	V	39.5	Very low	35.6	Very low	144 Å²	144	141.8 Å²	141.8	87%	0.873	81%	0.814	S	S	*	*			trans	-113.6	132.6	179.7	167.3	0	0	0	0	110.1
484	D	30.6	Very low	35.4	Very low	147 Å²	147	141.5 Å²	141.5	79%	0.786	81%	0.81	S	S	*	*				-163.7	-179.5	124.7	-148.5	-13.3	0	0	0	112.1
485	T	35.1	Very low	35.2	Very low	130 Å²	130	143.8 Å²	143.8	80%	0.798	81%	0.811	S	S	*	*			trans	-105.8	156.9	-162.6	51.7	0	0	0	0	113.4
486	G	30.1	Very low	35	Very low	70 Å²	70	143.4 Å²	143.4	72%	0.722	81%	0.809	S	S	*	*			trans	169.1	73.6	174.5	0	0	0	0	0	118.3
487	S	31.6	Very low	34.8	Very low	109 Å²	109	137.3 Å²	137.3	76%	0.762	80%	0.801	S	S	*	*			trans	30.2	128.3	148.9	58.6	0	0	0	0	123.2
488	S	36	Very low	34.8	Very low	108 Å²	108	139.1 Å²	139.1	76%	0.755	81%	0.805	S	S	*	*			trans	53.5	121.9	143.9	58.9	0	0	0	0	119.3
489	E	32.2	Very low	34.4	Very low	188 Å²	188	136.9 Å²	136.9	88%	0.879	80%	0.802	S	S	*	*				-154.8	175.6	52.1	-77.5	-172.4	108.2	0	0	112.9
490	L	40.8	Very low	34.5	Very low	159 Å²	159	135 Å²	135	83%	0.832	80%	0.802	S	S	*	*			trans	-95.2	151.1	164.7	-74	173.1	0	0	0	110.9
491	P	39.7	Very low	33.7	Very low	124 Å²	124	138.4 Å²	138.4	81%	0.805	80%	0.8	S	S	*	*			trans	-125.7	143.6	131.4	35.5	-29.7	0	0	0	113.4
492	V	36.5	Very low	33.7	Very low	127 Å²	127	139.1 Å²	139.1	77%	0.77	80%	0.795	S	S	*	*			trans	-82.8	144.2	166.1	171.9	0	0	0	0	109.1
493	L	29.7	Very low	33.8	Very low	140 Å²	140	140 Å²	140	73%	0.733	80%	0.796	S	S	*	*			trans	-167.9	140.2	148.2	-127.8	67.4	0	0	0	113
494	F	30.7	Very low	33.6	Very low	169 Å²	169	142.1 Å²	142.1	74%	0.741	80%	0.796	S	S	*	*			trans	36.8	128.9	160.4	-59.8	-52.7	0	0	0	120.7
495	E	34.3	Very low	33.6	Very low	167 Å²	167	137.9 Å²	137.9	78%	0.78	79%	0.787	S	S	*	*			cis	71.6	133.9	16.3	-147.7	-178.1	-148.9	0	0	117.8
496	L	33.5	Very low	33.4	Very low	166 Å²	166	139.6 Å²	139.6	87%	0.869	79%	0.792	S	S	*	*			trans	74.1	137.3	179.3	-55.4	174.9	0	0	0	116.9
497	G	30	Very low	33.5	Very low	68 Å²	68	142.8 Å²	142.8	70%	0.701	79%	0.792	S	S	*	*			trans	166.3	-3.9	173.2	0	0	0	0	0	120.8	S499	G497-S499 PolarHBondContact O-N 3.35Å
498	E	35.6	Very low	33.6	Very low	207 Å²	207	147 Å²	147	97%	0.967	79%	0.792	S	S	*	*			trans	-72.4	110.2	175.1	-74.4	-169	151.7	0	0	111.4
499	S	29.3	Very low	33.5	Very low	109 Å²	109	148.9 Å²	148.9	76%	0.762	80%	0.8	S	S	*	*			trans	-116.2	108.8	175.1	49.9	0	0	0	0	111.8	G497	G497-S499 PolarHBondContact O-N 3.35Å
500	S	36.1	Very low	33.6	Very low	116 Å²	116	147.1 Å²	147.1	81%	0.811	80%	0.797	S	S	*	*			trans	-79.1	139.5	164	-175.3	0	0	0	0	109.6
501	Y	32.2	Very low	33.3	Very low	192 Å²	192	146.2 Å²	146.2	75%	0.753	79%	0.793	S	S	*	*			trans	-149.8	160.9	174	-127	-91	0	0	0	113
502	F	30.7	Very low	33.7	Very low	187 Å²	187	144.7 Å²	144.7	82%	0.82	78%	0.782	S	S	*	*			trans	73.3	137	-168.9	-64.2	-82.2	0	0	0	115.2
503	S	35.2	Very low	33.4	Very low	113 Å²	113	145.2 Å²	145.2	79%	0.79	79%	0.786	S	S	*	*			cis	-140.5	162.1	3.2	-157.8	0	0	0	0	113.4
504	E	35.2	Very low	33.8	Very low	189 Å²	189	146.1 Å²	146.1	88%	0.883	79%	0.79	S	S	*	*			trans	-91.2	163.4	-172.4	-142.8	162.5	116.7	0	0	113.4
505	G	31.3	Very low	34.1	Very low	58 Å²	58	142.8 Å²	142.8	60%	0.598	79%	0.788	S	S	*	*			trans	148.9	109.5	163.8	0	0	0	0	0	116.9
506	D	30.6	Very low	34.1	Very low	166 Å²	166	142.4 Å²	142.4	89%	0.888	79%	0.79	S	S	*	*			trans	59.5	141.8	138.4	-54	-5.5	0	0	0	120.6
507	D	32	Very low	34.1	Very low	137 Å²	137	142.7 Å²	142.7	73%	0.733	79%	0.792	S	S	*	*			cis	-158.9	176.7	-9.5	-171.2	45.1	0	0	0	110.9
508	Y	34.1	Very low	34.1	Very low	196 Å²	196	145.4 Å²	145.4	77%	0.769	80%	0.795	S	S	*	*			trans	-39	143.5	-174.1	-76.3	-88.9	0	0	0	120.6
509	T	34.5	Very low	33.8	Very low	149 Å²	149	139.3 Å²	139.3	91%	0.914	79%	0.788	S	S	*	*				-170.5	163.1	109.2	17.9	0	0	0	0	112.4
510	D	34.3	Very low	34.1	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	79%	0.785	S	S	*	*			trans	-128.4	136.9	-159.9	-156.3	6.6	0	0	0	114.9
511	D	33.3	Very low	34	Very low	140 Å²	140	142.5 Å²	142.5	75%	0.749	79%	0.786	S	S	*	*			trans	53.8	-167.5	159.4	-144.6	32.6	0	0	0	120.1
512	P	48.3	Very low	34.6	Very low	91 Å²	91	137.6 Å²	137.6	59%	0.591	78%	0.778	S	S	*	*				-109.7	155.5	-79.9	28.8	-19.6	0	0	0	115.4
513	T	31	Very low	34.9	Very low	139 Å²	139	137.9 Å²	137.9	85%	0.853	78%	0.781	S	S	*	*			trans	-154.8	114.3	134.7	-48.4	0	0	0	0	112.9
514	I	38.1	Very low	34.8	Very low	158 Å²	158	141.6 Å²	141.6	81%	0.81	78%	0.783	S	S	*	*			trans	-125.6	141.1	159.6	-85.5	-178.9	0	0	0	108.6
515	S	35.8	Very low	35.2	Very low	99 Å²	99	137.5 Å²	137.5	69%	0.692	78%	0.781	S	S	*	*			trans	65.8	108.8	176.4	-58.4	0	0	0	0	116.8
516	L	34.9	Very low	35.7	Very low	159 Å²	159	143 Å²	143	83%	0.832	79%	0.789	S	S	*	*				174.3	127.9	96.9	-89.3	174	0	0	0	111.2
517	L	32.7	Very low	36.2	Very low	172 Å²	172	141.4 Å²	141.4	90%	0.901	78%	0.78	S	S	*	*				-176	150.3	124.8	-99.4	169.6	0	0	0	111.2
518	T	31.3	Very low	37.4	Very low	126 Å²	126	139.7 Å²	139.7	77%	0.773	78%	0.777	S	S	*	*			trans	-98.4	158.3	-165.8	44.4	0	0	0	0	114
519	G	28.6	Very low	38.4	Very low	79 Å²	79	136.7 Å²	136.7	81%	0.814	78%	0.779	S	S	*	*			trans	-154.4	36.8	-174.7	0	0	0	0	0	116.7
520	T	35.3	Very low	39.1	Very low	116 Å²	116	135.9 Å²	135.9	71%	0.712	77%	0.774	S	S	*	*			trans	19.9	123.7	150.3	-36.4	0	0	0	0	121.9
521	E	33.8	Very low	39.7	Very low	176 Å²	176	137.3 Å²	137.3	82%	0.822	80%	0.795	S	S	*	*				-171.6	155.3	120.2	-99	-73.6	96.6	0	0	110.6
522	P	46.7	Very low	40	Very low	89 Å²	89	137.2 Å²	137.2	58%	0.578	80%	0.798	S	S	*	*			trans	-119.8	168	-159.9	43.1	-35.5	0	0	0	116.6
523	H	35	Very low	39.6	Very low	193 Å²	193	139.6 Å²	139.6	89%	0.894	81%	0.809	S	S	*	*			trans	-140.2	89.5	159.2	-99.1	-82.3	0	0	0	114.2
524	K	34	Very low	40.1	Very low	191 Å²	191	139.7 Å²	139.7	83%	0.83	81%	0.806	S	S	*	*			trans	35.4	112.4	136.1	-166.8	173.7	-174.2	172.8	0	119.8
525	A	44.2	Very low	40.2	Very low	103 Å²	103	138.6 Å²	138.6	85%	0.851	81%	0.806	S	S	*	*			trans	-92.4	153.3	166	0	0	0	0	0	113.5
526	K	41.5	Very low	40.4	Very low	174 Å²	174	141.1 Å²	141.1	76%	0.757	81%	0.813	S	S	*	*			trans	-172	136.6	170.4	-166.3	168.6	179.3	172	0	108.1
527	D	41.3	Very low	40.8	Very low	131 Å²	131	139.9 Å²	139.9	70%	0.701	81%	0.812	S	S	*	*			cis	-139.9	169.4	0.7	-109.1	-20.3	0	0	0	109.8
528	P	56.3	Low	41.4	Very low	102 Å²	102	137.6 Å²	137.6	66%	0.662	81%	0.805	S	S	*	*			trans	-113	139.2	-179.4	38	-28	0	0	0	116.7
529	T	55.1	Low	42.2	Very low	132 Å²	132	138.5 Å²	138.5	81%	0.81	81%	0.808	S	S	*	*			trans	69.3	165.9	143.1	-46.6	0	0	0	0	119.6
530	V	48.9	Very low	43.3	Very low	133 Å²	133	143.4 Å²	143.4	81%	0.806	81%	0.807	S	S	*	*			trans	86	125.4	173.3	-172	0	0	0	0	114.1
531	S	47.6	Very low	44	Very low	181 Å²	181	145.9 Å²	145.9	100%	1.266	82%	0.816	S	S	*	*			cis	-137.8	0	1.3	-164.9	0	0	0	0	113.1

Retrieved 531 of 531 residues in 423.9 ms (Link to these results)

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