A0A3Q0KDB2_SCHMA Loading...

CRC domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KDB2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 538 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	79.2	Confident	93.3	Very high	141 Å²	141	99.4 Å²	99.4	70%	0.695	49%	0.494	S	S	*	.				0	-35.9	0	-55.3	-36.3	-169.9	0	0	113.9	N3 H6	M1-N3 VanDerWaalsContact C-N 3.27Å; M1-N3 PolarHBondContact O-N 3.45Å; M1-N3 VanDerWaalsContact O-N 3.11Å; M1-H6 HydrophobicContact SD-CB 4.05Å; M1-H6 PolarHBondContact SD-CD2 3.38Å
2	N	91.6	Very high	93.6	Very high	141 Å²	141	100.8 Å²	100.8	75%	0.754	50%	0.495	S	S	*	.			trans	-86.1	64.1	173.5	-169.7	29.1	0	0	0	112.1	R10	N2-R10 VanDerWaalsContact OD1-CD 3.31Å; N2-R10 WeakPolarHBondContact OD1-CD 3.17Å
3	N	94	Very high	93.8	Very high	74 Å²	74	98.2 Å²	98.2	40%	0.396	49%	0.492	S	S	.	.	S	Bend	trans	-155.3	165.5	-178.6	57.5	-15.1	0	0	0	110.2	M1 S5 H6	M1-N3 VanDerWaalsContact C-N 3.27Å; M1-N3 PolarHBondContact O-N 3.45Å; M1-N3 VanDerWaalsContact O-N 3.11Å; N3-S5 VanDerWaalsContact C-N 3.27Å; N3-S5 PolarHBondContact ND2-OG 3.01Å; N3-S5 PolarHBondContact O-N 3.04Å; N3-S5 PolarHBondContact OD1-OG 3.33Å; N3-H6 PolarHBondContact O-N 3.46Å; N3-H6 VanDerWaalsContact O-N 3.14Å; N3-H6 PolarHBondContact OD1-CD2 3.42Å
4	Q	93.2	Very high	94	Very high	131 Å²	131	95.5 Å²	95.5	61%	0.612	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-63.5	-29.3	-171.7	-169.2	56.2	23.5	0	0	113.7	H6 E7	Q4-H6 PolarHBondContact O-N 3.19Å; Q4-E7 PolarHBondContact NE2-OE2 3.25Å
5	S	95.8	Very high	94.2	Very high	87 Å²	87	98.2 Å²	98.2	61%	0.608	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-67.5	-13.4	177.2	61.2	0	0	0	0	114.7	N3	N3-S5 VanDerWaalsContact C-N 3.27Å; N3-S5 PolarHBondContact ND2-OG 3.01Å; N3-S5 PolarHBondContact O-N 3.04Å; N3-S5 PolarHBondContact OD1-OG 3.33Å
6	H	93.4	Very high	94.4	Very high	70 Å²	70	101.3 Å²	101.3	32%	0.324	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-125.4	37.7	-176.5	-59	-42.4	0	0	0	111.3	M1 N3 Q4 E8 D9 R10	M1-H6 HydrophobicContact SD-CB 4.05Å; M1-H6 PolarHBondContact SD-CD2 3.38Å; N3-H6 PolarHBondContact O-N 3.46Å; N3-H6 VanDerWaalsContact O-N 3.14Å; N3-H6 PolarHBondContact OD1-CD2 3.42Å; Q4-H6 PolarHBondContact O-N 3.19Å; H6-E8 PolarHBondContact O-N 2.91Å; H6-D9 PolarHBondContact O-N 3.13Å; H6-R10 WeakPolarHBondContact O-CB 3.06Å; H6-R10 PolarHBondContact O-N 3Å
7	E	94.9	Very high	94.5	Very high	63 Å²	63	98.8 Å²	98.8	29%	0.294	48%	0.484	S	S	.	.	H	α-helix	trans	-57.4	-41.8	-172	-166	-178.1	142.5	0	0	113.7	Q4 R10 K11	Q4-E7 PolarHBondContact NE2-OE2 3.25Å; E7-R10 WeakPolarHBondContact O-CB 3.28Å; E7-R10 PolarHBondContact O-N 3.15Å; E7-K11 HydrophobicContact CG-CD 4.39Å; E7-K11 WeakPolarHBondContact O-CG 3.34Å; E7-K11 PolarHBondContact O-N 3.13Å; E7-K11 WeakPolarHBondContact OE1-CE 3.31Å; E7-K11 IonicContact OE1-NZ 3.66Å; E7-K11 PolarHBondContact OE1-NZ 3.04Å
8	E	95.4	Very high	94.6	Very high	126 Å²	126	97.2 Å²	97.2	59%	0.589	48%	0.477	S	S	*	.	H	α-helix	trans	-69.6	-41.7	-179.4	-67.1	-52.9	121	0	0	112.8	H6 R10 K11 K12	H6-E8 PolarHBondContact O-N 2.91Å; E8-R10 VanDerWaalsContact C-N 3.29Å; E8-R10 PolarHBondContact O-N 3.43Å; E8-K11 PolarHBondContact O-N 3.06Å; E8-K11 WeakPolarHBondContact OE1-CD 3.31Å; E8-K11 IonicContact OE1-NZ 2.67Å; E8-K11 PolarHBondContact OE1-NZ 3.28Å; E8-K12 VanDerWaalsContact O-CB 3.29Å; E8-K12 WeakPolarHBondContact O-CB 3.45Å; E8-K12 PolarHBondContact O-N 3.22Å
9	D	96.3	Very high	94.7	Very high	79 Å²	79	98.7 Å²	98.7	42%	0.422	48%	0.483	S	S	.	.	H	α-helix	trans	-65.7	-34.7	172.5	-74.7	-44	0	0	0	111.6	H6 S13	H6-D9 PolarHBondContact O-N 3.13Å; D9-S13 VanDerWaalsContact O-CB 3.3Å; D9-S13 WeakPolarHBondContact O-CB 3.5Å; D9-S13 PolarHBondContact O-N 3.11Å; D9-S13 PolarHBondContact O-OG 2.99Å
10	R	96.7	Very high	94.7	Very high	89 Å²	89	105 Å²	105	34%	0.336	50%	0.501	S	S	.	.	H	α-helix	trans	-64.1	-50.6	173.2	-168.6	-179.9	74.7	136.4	-3	111	N2 H6 E7 E8 K12 S13 I14	N2-R10 VanDerWaalsContact OD1-CD 3.31Å; N2-R10 WeakPolarHBondContact OD1-CD 3.17Å; H6-R10 WeakPolarHBondContact O-CB 3.06Å; H6-R10 PolarHBondContact O-N 3Å; E7-R10 WeakPolarHBondContact O-CB 3.28Å; E7-R10 PolarHBondContact O-N 3.15Å; E8-R10 VanDerWaalsContact C-N 3.29Å; E8-R10 PolarHBondContact O-N 3.43Å; R10-K12 PolarHBondContact O-N 2.62Å; R10-S13 PolarHBondContact O-N 3.33Å; R10-S13 VanDerWaalsContact O-N 3.16Å; R10-I14 HydrophobicContact CG-CD1 4.01Å; R10-I14 VanDerWaalsContact O-CG1 3.32Å; R10-I14 WeakPolarHBondContact O-CG1 3.37Å; R10-I14 PolarHBondContact O-N 3.49Å
11	K	96.3	Very high	94.5	Very high	92 Å²	92	103.3 Å²	103.3	40%	0.4	50%	0.495	S	S	.	.	H	α-helix	trans	-56.3	-47.3	175.4	-76.2	169	-177.3	159	0	111.7	E7 E8 S13 I14 K15	E7-K11 HydrophobicContact CG-CD 4.39Å; E7-K11 WeakPolarHBondContact O-CG 3.34Å; E7-K11 PolarHBondContact O-N 3.13Å; E7-K11 WeakPolarHBondContact OE1-CE 3.31Å; E7-K11 IonicContact OE1-NZ 3.66Å; E7-K11 PolarHBondContact OE1-NZ 3.04Å; E8-K11 PolarHBondContact O-N 3.06Å; E8-K11 WeakPolarHBondContact OE1-CD 3.31Å; E8-K11 IonicContact OE1-NZ 2.67Å; E8-K11 PolarHBondContact OE1-NZ 3.28Å; K11-S13 VanDerWaalsContact C-N 3.3Å; K11-S13 PolarHBondContact O-N 2.78Å; K11-I14 PolarHBondContact O-N 2.77Å; K11-K15 PolarHBondContact O-N 2.78Å
12	K	96.7	Very high	95.2	Very high	117 Å²	117	101.4 Å²	101.4	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-61.2	-37.5	177.5	-172.6	176.6	-177.5	178.3	0	112.4	E8 R10 R16	E8-K12 VanDerWaalsContact O-CB 3.29Å; E8-K12 WeakPolarHBondContact O-CB 3.45Å; E8-K12 PolarHBondContact O-N 3.22Å; R10-K12 PolarHBondContact O-N 2.62Å; K12-R16 WeakPolarHBondContact O-CG 3.42Å; K12-R16 PolarHBondContact O-N 2.83Å
13	S	96.5	Very high	95	Very high	66 Å²	66	97.5 Å²	97.5	46%	0.462	48%	0.477	S	S	.	.	H	α-helix	trans	-72.6	-40.6	176.3	-58.5	0	0	0	0	112.6	D9 R10 K11 R16 T17	D9-S13 VanDerWaalsContact O-CB 3.3Å; D9-S13 WeakPolarHBondContact O-CB 3.5Å; D9-S13 PolarHBondContact O-N 3.11Å; D9-S13 PolarHBondContact O-OG 2.99Å; R10-S13 PolarHBondContact O-N 3.33Å; R10-S13 VanDerWaalsContact O-N 3.16Å; K11-S13 VanDerWaalsContact C-N 3.3Å; K11-S13 PolarHBondContact O-N 2.78Å; S13-R16 PolarHBondContact O-N 3.14Å; S13-T17 WeakPolarHBondContact O-CB 2.77Å; S13-T17 PolarHBondContact O-N 2.84Å; S13-T17 VanDerWaalsContact O-N 3.09Å; S13-T17 PolarHBondContact O-OG1 3.25Å
14	I	96.1	Very high	94.9	Very high	61 Å²	61	95.8 Å²	95.8	31%	0.313	47%	0.474	S	S	.	.	H	α-helix	trans	-60.1	-49	173.1	-70.8	165.4	0	0	0	110	R10 K11 R16 T17 L18 F25	R10-I14 HydrophobicContact CG-CD1 4.01Å; R10-I14 VanDerWaalsContact O-CG1 3.32Å; R10-I14 WeakPolarHBondContact O-CG1 3.37Å; R10-I14 PolarHBondContact O-N 3.49Å; K11-I14 PolarHBondContact O-N 2.77Å; I14-R16 PolarHBondContact O-N 3.17Å; I14-T17 WeakPolarHBondContact O-CB 3.5Å; I14-T17 PolarHBondContact O-N 2.86Å; I14-L18 HydrophobicContact CG2-CD1 4.04Å; I14-L18 PolarHBondContact O-N 3.04Å; I14-F25 HydrophobicContact CB-CE2 4.46Å; I14-F25 HydrophobicContact CG1-CZ 4.27Å; I14-F25 HydrophobicContact CG2-CD2 4.48Å; I14-F25 HydrophobicContact CG2-CE2 3.87Å; I14-F25 HydrophobicContact CG2-CZ 4.39Å
15	K	96.7	Very high	94.8	Very high	136 Å²	136	95.2 Å²	95.2	59%	0.591	47%	0.469	S	S	*	.	H	α-helix	trans	-56.6	-50.7	178.5	-168.2	-172.7	180	-170.8	0	111.9	K11 T17 L18 E19	K11-K15 PolarHBondContact O-N 2.78Å; K15-T17 PolarHBondContact O-N 2.91Å; K15-L18 PolarHBondContact O-N 3.29Å; K15-E19 WeakPolarHBondContact CE-OE1 3.47Å; K15-E19 WeakPolarHBondContact CG-OE1 3.46Å; K15-E19 IonicContact NZ-OE1 2.71Å; K15-E19 VanDerWaalsContact O-CG 3.32Å; K15-E19 WeakPolarHBondContact O-CG 3.33Å; K15-E19 PolarHBondContact O-N 2.86Å
16	R	97.4	Very high	94.4	Very high	147 Å²	147	97.5 Å²	97.5	56%	0.555	47%	0.47	S	S	*	.	H	α-helix	trans	-61.4	-23.5	176.6	-75.2	175.9	171.4	-167	-4.2	114.2	K12 S13 I14 R20	K12-R16 WeakPolarHBondContact O-CG 3.42Å; K12-R16 PolarHBondContact O-N 2.83Å; S13-R16 PolarHBondContact O-N 3.14Å; I14-R16 PolarHBondContact O-N 3.17Å; R16-R20 WeakPolarHBondContact O-CG 3.43Å
17	T	96.5	Very high	94	Very high	60 Å²	60	99.2 Å²	99.2	37%	0.368	49%	0.487	S	S	.	.	H	α-helix	trans	-79.7	-46	176.3	-56.2	0	0	0	0	110.3	S13 I14 K15 E19 R20 N21 A24 F25	S13-T17 WeakPolarHBondContact O-CB 2.77Å; S13-T17 PolarHBondContact O-N 2.84Å; S13-T17 VanDerWaalsContact O-N 3.09Å; S13-T17 PolarHBondContact O-OG1 3.25Å; I14-T17 WeakPolarHBondContact O-CB 3.5Å; I14-T17 PolarHBondContact O-N 2.86Å; K15-T17 PolarHBondContact O-N 2.91Å; T17-E19 PolarHBondContact O-N 3.23Å; T17-R20 PolarHBondContact O-N 3.26Å; T17-R20 VanDerWaalsContact O-N 3.14Å; T17-N21 PolarHBondContact O-N 3.08Å; T17-A24 HydrophobicContact CG2-CB 3.73Å; T17-F25 HydrophobicContact CG2-CE2 3.98Å; T17-F25 HydrophobicContact CG2-CZ 3.91Å
18	L	95.5	Very high	93	Very high	70 Å²	70	106 Å²	106	37%	0.366	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-38	174.9	-74.2	170	0	0	0	112.9	I14 K15 R20 N21 P22 F25	I14-L18 HydrophobicContact CG2-CD1 4.04Å; I14-L18 PolarHBondContact O-N 3.04Å; K15-L18 PolarHBondContact O-N 3.29Å; L18-R20 PolarHBondContact O-N 2.83Å; L18-N21 CarbonylContact O-C 3.23Å; L18-N21 VanDerWaalsContact O-C 3.23Å; L18-N21 PolarHBondContact O-N 3.43Å; L18-P22 WeakPolarHBondContact CD2-O 3.47Å; L18-F25 HydrophobicContact CD1-CD2 4.44Å; L18-F25 HydrophobicContact CD2-CD2 3.8Å; L18-F25 HydrophobicContact CD2-CE2 4.33Å; L18-F25 HydrophobicContact CG-CD2 3.94Å; L18-F25 HydrophobicContact CG-CE2 4.02Å
19	E	96.8	Very high	91.7	Very high	126 Å²	126	106.2 Å²	106.2	59%	0.589	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-26.8	173.3	-76.2	167.1	-178.5	0	0	113	K15 T17	K15-E19 WeakPolarHBondContact CE-OE1 3.47Å; K15-E19 WeakPolarHBondContact CG-OE1 3.46Å; K15-E19 IonicContact NZ-OE1 2.71Å; K15-E19 VanDerWaalsContact O-CG 3.32Å; K15-E19 WeakPolarHBondContact O-CG 3.33Å; K15-E19 PolarHBondContact O-N 2.86Å; T17-E19 PolarHBondContact O-N 3.23Å
20	R	95.3	Very high	90.1	Very high	223 Å²	223	109.1 Å²	109.1	84%	0.842	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-32.3	179	-67.7	172.9	176.8	-177.9	-2	113.5	R16 T17 L18	R16-R20 WeakPolarHBondContact O-CG 3.43Å; T17-R20 PolarHBondContact O-N 3.26Å; T17-R20 VanDerWaalsContact O-N 3.14Å; L18-R20 PolarHBondContact O-N 2.83Å
21	N	90	Very high	88.5	Confident	71 Å²	71	113.9 Å²	113.9	38%	0.38	56%	0.555	S	S	.	*			trans	-149.6	104.7	175.2	177.2	21.9	0	0	0	109.3	T17 L18 S23 A24	T17-N21 PolarHBondContact O-N 3.08Å; L18-N21 CarbonylContact O-C 3.23Å; L18-N21 VanDerWaalsContact O-C 3.23Å; L18-N21 PolarHBondContact O-N 3.43Å; N21-S23 VanDerWaalsContact CG-OG 3.3Å; N21-S23 PolarHBondContact ND2-OG 3.14Å; N21-S23 VanDerWaalsContact ND2-OG 3.12Å; N21-S23 PolarHBondContact O-N 2.9Å; N21-S23 VanDerWaalsContact O-N 3.15Å; N21-S23 PolarHBondContact OD1-N 3Å; N21-S23 VanDerWaalsContact OD1-N 3.07Å; N21-S23 PolarHBondContact OD1-OG 3.06Å; N21-A24 HydrophobicContact CB-CB 4.23Å; N21-A24 PolarHBondContact ND2-N 3.26Å; N21-A24 WeakPolarHBondContact O-CB 3.47Å; N21-A24 PolarHBondContact O-N 2.87Å
22	P	93.7	Very high	86.9	Confident	100 Å²	100	112.8 Å²	112.8	65%	0.649	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-56.6	-30.4	176.3	-27.1	35.5	0	0	0	113.2	L18 A24	L18-P22 WeakPolarHBondContact CD2-O 3.47Å; P22-A24 VanDerWaalsContact C-N 3.28Å; P22-A24 PolarHBondContact O-N 3.13Å
23	S	88.8	Confident	85.7	Confident	59 Å²	59	108.3 Å²	108.3	41%	0.413	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-80.7	2	179.8	70	0	0	0	0	114.8	N21 F25 H26	N21-S23 VanDerWaalsContact CG-OG 3.3Å; N21-S23 PolarHBondContact ND2-OG 3.14Å; N21-S23 VanDerWaalsContact ND2-OG 3.12Å; N21-S23 PolarHBondContact O-N 2.9Å; N21-S23 VanDerWaalsContact O-N 3.15Å; N21-S23 PolarHBondContact OD1-N 3Å; N21-S23 VanDerWaalsContact OD1-N 3.07Å; N21-S23 PolarHBondContact OD1-OG 3.06Å; S23-F25 PolarHBondContact O-N 3.05Å; S23-H26 PolarHBondContact O-N 3.46Å; S23-H26 VanDerWaalsContact O-N 3.08Å
24	A	90.5	Very high	84.7	Confident	39 Å²	39	110.3 Å²	110.3	32%	0.322	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-58.7	-25.7	-168.8	0	0	0	0	0	115.7	T17 N21 P22	T17-A24 HydrophobicContact CG2-CB 3.73Å; N21-A24 HydrophobicContact CB-CB 4.23Å; N21-A24 PolarHBondContact ND2-N 3.26Å; N21-A24 WeakPolarHBondContact O-CB 3.47Å; N21-A24 PolarHBondContact O-N 2.87Å; P22-A24 VanDerWaalsContact C-N 3.28Å; P22-A24 PolarHBondContact O-N 3.13Å
25	F	92	Very high	84.2	Confident	119 Å²	119	114.5 Å²	114.5	52%	0.522	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-117	13	180	-57.4	-71.6	0	0	0	113.1	I14 T17 L18 S23	I14-F25 HydrophobicContact CB-CE2 4.46Å; I14-F25 HydrophobicContact CG1-CZ 4.27Å; I14-F25 HydrophobicContact CG2-CD2 4.48Å; I14-F25 HydrophobicContact CG2-CE2 3.87Å; I14-F25 HydrophobicContact CG2-CZ 4.39Å; T17-F25 HydrophobicContact CG2-CE2 3.98Å; T17-F25 HydrophobicContact CG2-CZ 3.91Å; L18-F25 HydrophobicContact CD1-CD2 4.44Å; L18-F25 HydrophobicContact CD2-CD2 3.8Å; L18-F25 HydrophobicContact CD2-CE2 4.33Å; L18-F25 HydrophobicContact CG-CD2 3.94Å; L18-F25 HydrophobicContact CG-CE2 4.02Å; S23-F25 PolarHBondContact O-N 3.05Å
26	H	86.7	Confident	84	Confident	135 Å²	135	108.2 Å²	108.2	63%	0.625	54%	0.543	S	S	*	.	S	Bend	trans	-67.5	142.2	170.7	-80.5	-118.3	0	0	0	110.1	S23 K28	S23-H26 PolarHBondContact O-N 3.46Å; S23-H26 VanDerWaalsContact O-N 3.08Å; H26-K28 PolarHBondContact O-N 3.19Å
27	P	84.9	Confident	83.8	Confident	106 Å²	106	101.4 Å²	101.4	69%	0.688	52%	0.518	S	S	*	.			trans	-56.4	138	173.9	-24.3	34.2	0	0	0	111.6	T29	P27-T29 HydrophobicContact CB-CG2 4.34Å; P27-T29 PolarHBondContact O-N 3.39Å
28	K	74.8	Confident	83.8	Confident	205 Å²	205	103 Å²	103	89%	0.891	53%	0.527	S	S	*	.			trans	-76.8	73.8	175	-63.5	-179.2	-178	178.8	0	109.9	H26 E30	H26-K28 PolarHBondContact O-N 3.19Å; K28-E30 VanDerWaalsContact C-N 3.34Å
29	T	66.8	Low	83.9	Confident	131 Å²	131	100.3 Å²	100.3	80%	0.804	52%	0.515	S	S	*	.			trans	-69.4	-31.7	-179.6	49.2	0	0	0	0	112.7	P27	P27-T29 HydrophobicContact CB-CG2 4.34Å; P27-T29 PolarHBondContact O-N 3.39Å
30	E	62.7	Low	83.9	Confident	140 Å²	140	101.5 Å²	101.5	65%	0.654	52%	0.518	S	S	*	.	S	Bend	trans	-99.1	138.9	174.5	-65.8	-174	-167.8	0	0	111.6	K28 S32	K28-E30 VanDerWaalsContact C-N 3.34Å; E30-S32 PolarHBondContact O-N 3.36Å
31	R	63.4	Low	83.9	Confident	189 Å²	189	100.6 Å²	100.6	71%	0.713	52%	0.52	S	S	*	.	S	Bend	trans	-69.4	-5.9	169.2	-62.9	-177.1	-179.9	172.3	0.3	112.5	V56	R31-V56 HydrophobicContact CB-CG1 3.92Å; R31-V56 VanDerWaalsContact O-CG1 3.29Å; R31-V56 WeakPolarHBondContact O-CG1 3.11Å
32	S	63.6	Low	84.2	Confident	68 Å²	68	97.9 Å²	97.9	48%	0.476	51%	0.507	S	S	.	.	S	Bend	trans	-87.1	135.8	177.6	-171	0	0	0	0	111.6	E30	E30-S32 PolarHBondContact O-N 3.36Å
33	H	71.8	Confident	84.2	Confident	24 Å²	24	99.4 Å²	99.4	11%	0.111	50%	0.5	C	S	.	.			trans	-83.1	121.6	173	47.5	56.4	0	0	0	110.7	K35 G36 C51 C62	H33-K35 PolarHBondContact O-N 2.99Å; H33-G36 WeakPolarHBondContact ND1-CA 3.45Å; H33-C51 PolarHBondContact CD2-SG 3.17Å; H33-C51 PolarHBondContact NE2-SG 3.18Å; H33-C62 PolarHBondContact CE1-SG 2.87Å
34	S	75.1	Confident	84.5	Confident	107 Å²	107	96.6 Å²	96.6	75%	0.748	48%	0.48	S	S	*	.	S	Bend	trans	-63.2	-28.2	177.8	55.7	0	0	0	0	113.9
35	K	85.2	Confident	84.6	Confident	150 Å²	150	95.8 Å²	95.8	65%	0.652	47%	0.47	S	S	*	.	S	Bend	trans	-93.8	-25.3	-171.6	-171	175.7	178.1	-176.7	0	115.5	H33	H33-K35 PolarHBondContact O-N 2.99Å
36	G	91.5	Very high	84.7	Confident	4 Å²	4	95.9 Å²	95.9	4%	0.041	47%	0.47	C	S	.	.			trans	73.4	147.9	-168.8	0	0	0	0	0	114.1	H33	H33-G36 WeakPolarHBondContact ND1-CA 3.45Å
37	C	95.2	Very high	85	Confident	3 Å²	3	94.2 Å²	94.2	2%	0.02	47%	0.466	C	S	.	.			trans	-76.9	164.2	175.2	75.4	0	0	0	0	112.6	C51 C62 R63	C37-C51 VanDerWaalsContact CB-SG 3.55Å; C37-C51 PolarHBondContact SG-SG 3.36Å; C37-C62 PolarHBondContact N-SG 2.98Å; C37-R63 CarbonylContact O-C 3.53Å; C37-R63 PolarHBondContact O-N 3.39Å
38	T	96.2	Very high	85.5	Confident	93 Å²	93	98.7 Å²	98.7	57%	0.571	47%	0.47	S	S	*	.			trans	-125.6	26.3	-179.6	54.9	0	0	0	0	112.9	R63	T38-R63 HydrophobicContact CG2-CB 4.41Å
39	C	97.1	Very high	86.5	Confident	14 Å²	14	88.9 Å²	88.9	10%	0.095	43%	0.428	C	S	.	.			trans	-56.4	133.1	-173.4	-65.7	0	0	0	0	113.6	S42 C49 C64 Q65	C39-S42 WeakPolarHBondContact CB-OG 3.38Å; C39-C49 VanDerWaalsContact SG-CA 3.59Å; C39-C49 WeakPolarHBondContact SG-CB 3.29Å; C39-C49 VanDerWaalsContact SG-SG 3.6Å; C39-C64 HydrophobicContact CB-CB 3.99Å; C39-C64 CarbonylContact O-C 3.59Å; C39-C64 VanDerWaalsContact O-CA 3.3Å; C39-C64 WeakPolarHBondContact O-CA 3.44Å; C39-C64 WeakPolarHBondContact O-CB 3.28Å; C39-Q65 PolarHBondContact O-N 2.92Å
40	K	96.4	Very high	87.7	Confident	151 Å²	151	88 Å²	88	66%	0.657	41%	0.414	S	S	*	.	S	Bend	trans	-112.7	-38.4	176.6	-56.8	-173.4	-179.5	179.6	0	114.5
41	K	96	Very high	89.1	Confident	205 Å²	205	81.3 Å²	81.3	89%	0.891	38%	0.383	S	S	*	.	S	Bend	trans	-105.4	-29.2	-173.2	-64.6	-174.7	178.9	-177	0	114.3	R43	K41-R43 VanDerWaalsContact C-N 3.27Å; K41-R43 PolarHBondContact O-N 2.91Å
42	S	95	Very high	90.6	Very high	14 Å²	14	72.7 Å²	72.7	10%	0.098	35%	0.351	C	S	.	.	S	Bend	trans	-75.4	-11.9	-175.3	56.1	0	0	0	0	114.3	C39 C44 L45	C39-S42 WeakPolarHBondContact CB-OG 3.38Å; S42-C44 PolarHBondContact O-N 3.48Å; S42-C44 PolarHBondContact OG-N 3.46Å; S42-L45 PolarHBondContact O-N 3.3Å
43	R	94.5	Very high	92	Very high	132 Å²	132	75.3 Å²	75.3	50%	0.498	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	22.4	-166.8	-54.1	-178.6	-166.7	155.3	2.6	112.9	K41 L45 G66 R68	K41-R43 VanDerWaalsContact C-N 3.27Å; K41-R43 PolarHBondContact O-N 2.91Å; R43-L45 PolarHBondContact O-N 3.25Å; R43-G66 WeakPolarHBondContact CA-O 3.2Å; R43-G66 WeakPolarHBondContact CB-O 3.45Å; R43-R68 HydrophobicContact CB-CB 4.36Å; R43-R68 HydrophobicContact CB-CG 4.2Å; R43-R68 PolarHBondContact O-N 2.99Å
44	C	95.5	Very high	92.8	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	16.8	-171.2	-54.2	0	0	0	0	115.9	S42 C49 Y52 C58 C64 N69	S42-C44 PolarHBondContact O-N 3.48Å; S42-C44 PolarHBondContact OG-N 3.46Å; C44-C49 HydrophobicContact CB-CB 4.32Å; C44-C49 VanDerWaalsContact CB-SG 3.6Å; C44-Y52 VanDerWaalsContact O-CB 3.29Å; C44-Y52 WeakPolarHBondContact O-CB 3.47Å; C44-Y52 VanDerWaalsContact O-CD2 3.23Å; C44-Y52 WeakPolarHBondContact O-CD2 3.34Å; C44-C58 VanDerWaalsContact SG-SG 3.68Å; C44-C64 VanDerWaalsContact SG-CB 3.54Å; C44-C64 VanDerWaalsContact SG-SG 3.64Å; C44-N69 HydrophobicContact CB-CB 3.41Å; C44-N69 VanDerWaalsContact CB-CB 3.41Å; C44-N69 WeakPolarHBondContact O-CB 3.37Å
45	L	92.5	Very high	93.5	Very high	21 Å²	21	76.4 Å²	76.4	11%	0.11	36%	0.355	C	S	.	.			trans	-106.2	23.7	-179.9	-65.2	175	0	0	0	113.7	S42 R43 Y52 R68	S42-L45 PolarHBondContact O-N 3.3Å; R43-L45 PolarHBondContact O-N 3.25Å; L45-Y52 HydrophobicContact CB-CE2 4.46Å; L45-Y52 HydrophobicContact CD2-CD2 4.47Å; L45-Y52 HydrophobicContact CD2-CE2 4.22Å; L45-R68 HydrophobicContact CD1-CB 3.54Å; L45-R68 HydrophobicContact CD1-CG 4.43Å; L45-R68 HydrophobicContact CD2-CB 4.38Å; L45-R68 HydrophobicContact CG-CB 3.89Å
46	K	93.6	Very high	93.7	Very high	121 Å²	121	70.8 Å²	70.8	53%	0.526	33%	0.333	S	S	.	.	S	Bend	trans	-144.3	155.1	179.8	-59.2	-168.5	177.5	-162.8	0	109.6	Y48 C49	K46-Y48 HydrophobicContact CB-CD2 3.8Å; K46-Y48 HydrophobicContact CB-CE2 4.36Å; K46-Y48 HydrophobicContact CD-CD2 4.28Å; K46-Y48 HydrophobicContact CD-CE2 4.18Å; K46-Y48 PolarHBondContact O-N 3.01Å; K46-C49 WeakPolarHBondContact O-CB 3.46Å; K46-C49 PolarHBondContact O-N 3.43Å
47	N	94.2	Very high	93.7	Very high	101 Å²	101	78.6 Å²	78.6	54%	0.54	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-10.7	-177.6	-61.9	-9.7	0	0	0	114.6	C49 Y52	N47-C49 PolarHBondContact O-N 3.3Å; N47-C49 VanDerWaalsContact O-N 3.11Å; N47-Y52 WeakPolarHBondContact OD1-CD1 3.48Å; N47-Y52 WeakPolarHBondContact OD1-CE1 3.43Å
48	Y	94.4	Very high	93.7	Very high	199 Å²	199	79 Å²	79	78%	0.78	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-8.8	164.3	-50.7	-64.2	0	0	0	114.2	K46	K46-Y48 HydrophobicContact CB-CD2 3.8Å; K46-Y48 HydrophobicContact CB-CE2 4.36Å; K46-Y48 HydrophobicContact CD-CD2 4.28Å; K46-Y48 HydrophobicContact CD-CE2 4.18Å; K46-Y48 PolarHBondContact O-N 3.01Å
49	C	95.3	Very high	93.4	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	35%	0.348	C	S	.	.	S	Bend	trans	-106.5	114.8	176.5	-180	0	0	0	0	109.6	C39 C44 K46 N47 C51 Y52 E53	C39-C49 VanDerWaalsContact SG-CA 3.59Å; C39-C49 WeakPolarHBondContact SG-CB 3.29Å; C39-C49 VanDerWaalsContact SG-SG 3.6Å; C44-C49 HydrophobicContact CB-CB 4.32Å; C44-C49 VanDerWaalsContact CB-SG 3.6Å; K46-C49 WeakPolarHBondContact O-CB 3.46Å; K46-C49 PolarHBondContact O-N 3.43Å; N47-C49 PolarHBondContact O-N 3.3Å; N47-C49 VanDerWaalsContact O-N 3.11Å; C49-C51 PolarHBondContact O-N 2.94Å; C49-C51 VanDerWaalsContact O-N 3.08Å; C49-Y52 PolarHBondContact O-N 3.34Å; C49-E53 PolarHBondContact O-N 2.79Å
50	E	92.3	Very high	93.1	Very high	111 Å²	111	82.9 Å²	82.9	52%	0.519	38%	0.383	S	S	.	.	H	α-helix	trans	-50	-36.1	177.2	-62.2	171.7	-172.5	0	0	112.5	A54	E50-A54 VanDerWaalsContact O-CB 3.23Å; E50-A54 WeakPolarHBondContact O-CB 3.43Å; E50-A54 PolarHBondContact O-N 3.07Å
51	C	93.3	Very high	92.9	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-65.2	-47.3	176.6	-33	0	0	0	0	111.8	H33 C37 C49 A54 K55 V56 C58 C62 N69	H33-C51 PolarHBondContact CD2-SG 3.17Å; H33-C51 PolarHBondContact NE2-SG 3.18Å; C37-C51 VanDerWaalsContact CB-SG 3.55Å; C37-C51 PolarHBondContact SG-SG 3.36Å; C49-C51 PolarHBondContact O-N 2.94Å; C49-C51 VanDerWaalsContact O-N 3.08Å; C51-A54 CarbonylContact O-C 3.5Å; C51-A54 PolarHBondContact O-N 3.22Å; C51-K55 PolarHBondContact O-N 3.4Å; C51-K55 VanDerWaalsContact O-N 3.13Å; C51-V56 CarbonylContact C-O 3.54Å; C51-V56 HydrophobicContact CB-CG2 4.23Å; C51-V56 WeakPolarHBondContact O-CG2 3.39Å; C51-V56 PolarHBondContact O-N 2.91Å; C51-C58 PolarHBondContact SG-SG 2.76Å; C51-C62 VanDerWaalsContact SG-SG 3.65Å; C51-N69 WeakPolarHBondContact CB-ND2 3.43Å
52	Y	93.8	Very high	92.8	Very high	8 Å²	8	71.7 Å²	71.7	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-71.6	-37.8	-176.2	-173.6	-93.5	0	0	0	112.2	C44 L45 N47 C49 K55 R76	C44-Y52 VanDerWaalsContact O-CB 3.29Å; C44-Y52 WeakPolarHBondContact O-CB 3.47Å; C44-Y52 VanDerWaalsContact O-CD2 3.23Å; C44-Y52 WeakPolarHBondContact O-CD2 3.34Å; L45-Y52 HydrophobicContact CB-CE2 4.46Å; L45-Y52 HydrophobicContact CD2-CD2 4.47Å; L45-Y52 HydrophobicContact CD2-CE2 4.22Å; N47-Y52 WeakPolarHBondContact OD1-CD1 3.48Å; N47-Y52 WeakPolarHBondContact OD1-CE1 3.43Å; C49-Y52 PolarHBondContact O-N 3.34Å; Y52-K55 WeakPolarHBondContact O-CD 3.39Å; Y52-K55 PolarHBondContact O-N 3.05Å; Y52-K55 PolarHBondContact O-NZ 3Å; Y52-R76 HydrophobicContact CE2-CB 4.21Å; Y52-R76 HydrophobicContact CE2-CG 3.91Å
53	E	93.1	Very high	92.9	Very high	123 Å²	123	79.4 Å²	79.4	58%	0.575	37%	0.367	S	S	*	.	H	α-helix	trans	-59.5	-52.1	171.7	-175.3	178.1	-147.8	0	0	110.2	C49 K55	C49-E53 PolarHBondContact O-N 2.79Å; E53-K55 PolarHBondContact O-N 3.17Å; E53-K55 VanDerWaalsContact O-N 3.09Å
54	A	89.5	Confident	92.9	Very high	47 Å²	47	74.5 Å²	74.5	39%	0.388	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	5.8	176.6	0	0	0	0	0	115.1	E50 C51 V56	E50-A54 VanDerWaalsContact O-CB 3.23Å; E50-A54 WeakPolarHBondContact O-CB 3.43Å; E50-A54 PolarHBondContact O-N 3.07Å; C51-A54 CarbonylContact O-C 3.5Å; C51-A54 PolarHBondContact O-N 3.22Å; A54-V56 HydrophobicContact CB-CG2 4.24Å; A54-V56 PolarHBondContact O-N 3.39Å
55	K	89.4	Confident	93	Very high	108 Å²	108	80.1 Å²	80.1	47%	0.47	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	28.6	-178.7	-48.5	-60.1	166	-160.3	0	114.6	C51 Y52 E53 R76	C51-K55 PolarHBondContact O-N 3.4Å; C51-K55 VanDerWaalsContact O-N 3.13Å; Y52-K55 WeakPolarHBondContact O-CD 3.39Å; Y52-K55 PolarHBondContact O-N 3.05Å; Y52-K55 PolarHBondContact O-NZ 3Å; E53-K55 PolarHBondContact O-N 3.17Å; E53-K55 VanDerWaalsContact O-N 3.09Å; K55-R76 VanDerWaalsContact C-NH1 3.29Å; K55-R76 PolarHBondContact O-NH1 2.9Å
56	V	89.3	Confident	93	Very high	31 Å²	31	82 Å²	82	19%	0.188	40%	0.402	C	S	.	.			trans	-108.4	149.1	173.7	-63.7	0	0	0	0	111.9	R31 C51 A54 N69 R76	R31-V56 HydrophobicContact CB-CG1 3.92Å; R31-V56 VanDerWaalsContact O-CG1 3.29Å; R31-V56 WeakPolarHBondContact O-CG1 3.11Å; C51-V56 CarbonylContact C-O 3.54Å; C51-V56 HydrophobicContact CB-CG2 4.23Å; C51-V56 WeakPolarHBondContact O-CG2 3.39Å; C51-V56 PolarHBondContact O-N 2.91Å; A54-V56 HydrophobicContact CB-CG2 4.24Å; A54-V56 PolarHBondContact O-N 3.39Å; V56-N69 PolarHBondContact O-ND2 2.96Å; V56-R76 VanDerWaalsContact C-NH2 3.28Å; V56-R76 PolarHBondContact O-NH2 2.99Å
57	R	92	Very high	93.1	Very high	169 Å²	169	78 Å²	78	64%	0.638	39%	0.389	S	S	*	.			trans	-67.3	150	172.2	58.9	-179.8	171.4	79.7	-0.7	110	S59 R76	R57-S59 PolarHBondContact O-N 3.03Å; R57-R76 VanDerWaalsContact CA-NH2 3.33Å; R57-R76 VanDerWaalsContact N-NH2 3.14Å
58	C	93.5	Very high	93.1	Very high	12 Å²	12	79.6 Å²	79.6	8%	0.081	39%	0.388	C	S	.	.			trans	-63.8	134.7	169.8	-69.8	0	0	0	0	109.2	C44 C51 C62 C67 N69	C44-C58 VanDerWaalsContact SG-SG 3.68Å; C51-C58 PolarHBondContact SG-SG 2.76Å; C58-C62 HydrophobicContact CB-CB 4.07Å; C58-C67 VanDerWaalsContact SG-SG 3.64Å; C58-N69 PolarHBondContact N-ND2 2.96Å; C58-N69 PolarHBondContact N-O 3.09Å; C58-N69 PolarHBondContact SG-ND2 2.58Å
59	S	90.7	Very high	93	Very high	31 Å²	31	70.1 Å²	70.1	22%	0.217	35%	0.351	C	S	.	.			trans	-96	175.4	174.1	63.8	0	0	0	0	111.3	R57 M61 C62	R57-S59 PolarHBondContact O-N 3.03Å; S59-M61 PolarHBondContact O-N 3.34Å; S59-M61 VanDerWaalsContact O-N 3.12Å; S59-M61 PolarHBondContact OG-N 2.71Å; S59-C62 VanDerWaalsContact O-CB 3.32Å; S59-C62 WeakPolarHBondContact O-CB 3.42Å; S59-C62 PolarHBondContact O-N 2.99Å
60	N	91.5	Very high	92.5	Very high	156 Å²	156	74.7 Å²	74.7	83%	0.834	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-19.2	168.4	59.8	-19.3	0	0	0	114.1	C62	N60-C62 VanDerWaalsContact C-N 3.29Å; N60-C62 PolarHBondContact O-N 2.87Å
61	M	91.3	Very high	91.4	Very high	102 Å²	102	74.3 Å²	74.3	50%	0.502	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-18.2	174	-59.1	-60.2	-72.8	0	0	113.1	S59	S59-M61 PolarHBondContact O-N 3.34Å; S59-M61 VanDerWaalsContact O-N 3.12Å; S59-M61 PolarHBondContact OG-N 2.71Å
62	C	94.9	Very high	89.8	Confident	20 Å²	20	77.5 Å²	77.5	14%	0.135	39%	0.394	C	S	.	.			trans	-75.8	131.1	-179	-67.2	0	0	0	0	112.3	H33 C37 C51 C58 S59 N60	H33-C62 PolarHBondContact CE1-SG 2.87Å; C37-C62 PolarHBondContact N-SG 2.98Å; C51-C62 VanDerWaalsContact SG-SG 3.65Å; C58-C62 HydrophobicContact CB-CB 4.07Å; S59-C62 VanDerWaalsContact O-CB 3.32Å; S59-C62 WeakPolarHBondContact O-CB 3.42Å; S59-C62 PolarHBondContact O-N 2.99Å; N60-C62 VanDerWaalsContact C-N 3.29Å; N60-C62 PolarHBondContact O-N 2.87Å
63	R	95.4	Very high	88	Confident	176 Å²	176	80.6 Å²	80.6	66%	0.664	41%	0.41	S	S	*	.			trans	-105.6	47.3	175.4	-71.9	172.6	-77.7	-157	-10	111	C37 T38	C37-R63 CarbonylContact O-C 3.53Å; C37-R63 PolarHBondContact O-N 3.39Å; T38-R63 HydrophobicContact CG2-CB 4.41Å
64	C	96.2	Very high	86.3	Confident	28 Å²	28	80 Å²	80	19%	0.189	41%	0.41	C	S	.	.			trans	-91.6	153.1	-178.8	54.2	0	0	0	0	111.9	C39 C44 C67	C39-C64 HydrophobicContact CB-CB 3.99Å; C39-C64 CarbonylContact O-C 3.59Å; C39-C64 VanDerWaalsContact O-CA 3.3Å; C39-C64 WeakPolarHBondContact O-CA 3.44Å; C39-C64 WeakPolarHBondContact O-CB 3.28Å; C44-C64 VanDerWaalsContact SG-CB 3.54Å; C44-C64 VanDerWaalsContact SG-SG 3.64Å; C64-C67 VanDerWaalsContact SG-CB 3.54Å; C64-C67 VanDerWaalsContact SG-SG 3.65Å
65	Q	96.1	Very high	84.6	Confident	118 Å²	118	82.1 Å²	82.1	55%	0.551	41%	0.412	S	S	*	.	S	Bend	trans	-107	130.6	-178.6	-63.3	179.2	-30.8	0	0	109.7	C39 C67	C39-Q65 PolarHBondContact O-N 2.92Å; Q65-C67 VanDerWaalsContact C-N 3.34Å; Q65-C67 PolarHBondContact O-N 3.5Å
66	G	94.2	Very high	83.1	Confident	60 Å²	60	77.8 Å²	77.8	62%	0.619	39%	0.392	S	S	*	.	S	Bend	trans	59.5	42.4	-178.4	0	0	0	0	0	113.2	R43 R68	R43-G66 WeakPolarHBondContact CA-O 3.2Å; R43-G66 WeakPolarHBondContact CB-O 3.45Å; G66-R68 PolarHBondContact O-N 3.42Å
67	C	95.4	Very high	81.6	Confident	37 Å²	37	83.9 Å²	83.9	25%	0.25	41%	0.413	C	S	.	.			trans	-60	131.7	-179	-167.1	0	0	0	0	111.6	C58 C64 Q65 N69 V70	C58-C67 VanDerWaalsContact SG-SG 3.64Å; C64-C67 VanDerWaalsContact SG-CB 3.54Å; C64-C67 VanDerWaalsContact SG-SG 3.65Å; Q65-C67 VanDerWaalsContact C-N 3.34Å; Q65-C67 PolarHBondContact O-N 3.5Å; C67-N69 PolarHBondContact SG-N 3.35Å; C67-V70 HydrophobicContact CB-CG1 4.43Å
68	R	94.2	Very high	80.1	Confident	135 Å²	135	80.6 Å²	80.6	51%	0.509	42%	0.416	S	S	.	.			trans	-119.5	1.2	169	-65.3	-174.3	177.6	-158.4	-5.1	112.8	R43 L45 G66 V70	R43-R68 HydrophobicContact CB-CB 4.36Å; R43-R68 HydrophobicContact CB-CG 4.2Å; R43-R68 PolarHBondContact O-N 2.99Å; L45-R68 HydrophobicContact CD1-CB 3.54Å; L45-R68 HydrophobicContact CD1-CG 4.43Å; L45-R68 HydrophobicContact CD2-CB 4.38Å; L45-R68 HydrophobicContact CG-CB 3.89Å; G66-R68 PolarHBondContact O-N 3.42Å; R68-V70 PolarHBondContact O-N 3Å; R68-V70 VanDerWaalsContact O-N 3.1Å
69	N	92.6	Very high	78.3	Confident	1 Å²	1	84.6 Å²	84.6	1%	0.005	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	49.5	170.9	-172.3	39.6	0	0	0	111.3	C44 C51 V56 C58 C67 R76	C44-N69 HydrophobicContact CB-CB 3.41Å; C44-N69 VanDerWaalsContact CB-CB 3.41Å; C44-N69 WeakPolarHBondContact O-CB 3.37Å; C51-N69 WeakPolarHBondContact CB-ND2 3.43Å; V56-N69 PolarHBondContact O-ND2 2.96Å; C58-N69 PolarHBondContact N-ND2 2.96Å; C58-N69 PolarHBondContact N-O 3.09Å; C58-N69 PolarHBondContact SG-ND2 2.58Å; C67-N69 PolarHBondContact SG-N 3.35Å; N69-R76 PolarHBondContact OD1-NE 3.47Å; N69-R76 PolarHBondContact OD1-NH2 2.98Å
70	V	84.7	Confident	76.6	Confident	96 Å²	96	87.5 Å²	87.5	58%	0.582	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	-22.1	175.6	-64.4	0	0	0	0	111.5	C67 R68	C67-V70 HydrophobicContact CB-CG1 4.43Å; R68-V70 PolarHBondContact O-N 3Å; R68-V70 VanDerWaalsContact O-N 3.1Å
71	E	68.7	Low	74.6	Confident	102 Å²	102	88.3 Å²	88.3	48%	0.477	45%	0.445	S	S	.	.	S	Bend	trans	-91.7	160.3	-176.6	-164.3	50.8	-99.9	0	0	111.8
72	D	58.4	Low	72.3	Confident	68 Å²	68	88.1 Å²	88.1	36%	0.364	45%	0.451	S	S	.	.			trans	-62	158.7	-171.1	-85.4	-37.6	0	0	0	115.3	I74 Q75	D72-I74 PolarHBondContact O-N 3.42Å; D72-Q75 PolarHBondContact O-N 3.03Å; D72-Q75 VanDerWaalsContact O-N 3.14Å
73	L	57.8	Low	70	Confident	72 Å²	72	93 Å²	93	38%	0.377	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.5	-32.6	-173.4	-78.6	159.9	0	0	0	114.8	Q75 R76 Y77	L73-Q75 VanDerWaalsContact C-N 3.29Å; L73-Q75 PolarHBondContact O-N 3.39Å; L73-R76 VanDerWaalsContact CD2-NH1 3.27Å; L73-R76 WeakPolarHBondContact O-CB 3.35Å; L73-R76 PolarHBondContact O-N 3.21Å; L73-Y77 HydrophobicContact CB-CE2 4.16Å; L73-Y77 HydrophobicContact CD2-CE2 4.48Å; L73-Y77 VanDerWaalsContact O-CD2 3.26Å; L73-Y77 WeakPolarHBondContact O-CD2 3.38Å; L73-Y77 PolarHBondContact O-N 3.31Å
74	I	57.1	Low	67.4	Low	112 Å²	112	92.7 Å²	92.7	57%	0.574	49%	0.486	S	S	*	.	H	α-helix	trans	-46.5	-48.4	179	-53.3	175.3	0	0	0	111.6	D72 R76 Y77 S78	D72-I74 PolarHBondContact O-N 3.42Å; I74-R76 PolarHBondContact O-N 3.42Å; I74-Y77 PolarHBondContact O-N 3.42Å; I74-S78 PolarHBondContact O-N 3.49Å; I74-S78 PolarHBondContact O-OG 3.13Å
75	Q	54	Low	64.6	Low	90 Å²	90	96.1 Å²	96.1	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-68	-19.1	-179.1	-75.7	-173.4	6.6	0	0	114.1	D72 L73 Q79	D72-Q75 PolarHBondContact O-N 3.03Å; D72-Q75 VanDerWaalsContact O-N 3.14Å; L73-Q75 VanDerWaalsContact C-N 3.29Å; L73-Q75 PolarHBondContact O-N 3.39Å; Q75-Q79 PolarHBondContact O-NE2 2.91Å
76	R	56.8	Low	62	Low	17 Å²	17	97.2 Å²	97.2	6%	0.064	52%	0.519	C	S	.	.	H	α-helix	trans	-77	-40.8	175.6	-53.6	-167.8	-173.4	135.1	5.6	111	Y52 K55 V56 R57 N69 L73 I74 Q79 L80	Y52-R76 HydrophobicContact CE2-CB 4.21Å; Y52-R76 HydrophobicContact CE2-CG 3.91Å; K55-R76 VanDerWaalsContact C-NH1 3.29Å; K55-R76 PolarHBondContact O-NH1 2.9Å; V56-R76 VanDerWaalsContact C-NH2 3.28Å; V56-R76 PolarHBondContact O-NH2 2.99Å; R57-R76 VanDerWaalsContact CA-NH2 3.33Å; R57-R76 VanDerWaalsContact N-NH2 3.14Å; N69-R76 PolarHBondContact OD1-NE 3.47Å; N69-R76 PolarHBondContact OD1-NH2 2.98Å; L73-R76 VanDerWaalsContact CD2-NH1 3.27Å; L73-R76 WeakPolarHBondContact O-CB 3.35Å; L73-R76 PolarHBondContact O-N 3.21Å; I74-R76 PolarHBondContact O-N 3.42Å; R76-Q79 PolarHBondContact O-N 3.36Å; R76-L80 PolarHBondContact O-N 3.47Å
77	Y	57.5	Low	59.6	Low	159 Å²	159	102.4 Å²	102.4	62%	0.624	52%	0.524	S	S	*	.	H	α-helix	trans	-67	-38.8	178.4	-68.4	-77.2	0	0	0	111.8	L73 I74 Q79 L80	L73-Y77 HydrophobicContact CB-CE2 4.16Å; L73-Y77 HydrophobicContact CD2-CE2 4.48Å; L73-Y77 VanDerWaalsContact O-CD2 3.26Å; L73-Y77 WeakPolarHBondContact O-CD2 3.38Å; L73-Y77 PolarHBondContact O-N 3.31Å; I74-Y77 PolarHBondContact O-N 3.42Å; Y77-Q79 PolarHBondContact O-N 3.43Å; Y77-Q79 VanDerWaalsContact O-N 3.07Å; Y77-L80 HydrophobicContact CD1-CD1 3.95Å; Y77-L80 HydrophobicContact CE1-CD1 4.46Å; Y77-L80 PolarHBondContact O-N 2.89Å; Y77-L80 VanDerWaalsContact O-N 3.08Å
78	S	60	Low	57	Low	100 Å²	100	109.2 Å²	109.2	70%	0.699	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-7.2	173.8	-47.7	0	0	0	0	115.1	I74	I74-S78 PolarHBondContact O-N 3.49Å; I74-S78 PolarHBondContact O-OG 3.13Å
79	Q	56.1	Low	54.4	Low	97 Å²	97	111.2 Å²	111.2	45%	0.453	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.3	7.3	176.1	-75.3	172.3	89.8	0	0	112.7	Q75 R76 Y77	Q75-Q79 PolarHBondContact O-NE2 2.91Å; R76-Q79 PolarHBondContact O-N 3.36Å; Y77-Q79 PolarHBondContact O-N 3.43Å; Y77-Q79 VanDerWaalsContact O-N 3.07Å
80	L	56.3	Low	51.8	Low	92 Å²	92	116.4 Å²	116.4	48%	0.482	60%	0.599	S	S	.	*	S	Bend	trans	-87.7	127.3	166.1	-63.6	175.4	0	0	0	108.3	R76 Y77	R76-L80 PolarHBondContact O-N 3.47Å; Y77-L80 HydrophobicContact CD1-CD1 3.95Å; Y77-L80 HydrophobicContact CE1-CD1 4.46Å; Y77-L80 PolarHBondContact O-N 2.89Å; Y77-L80 VanDerWaalsContact O-N 3.08Å
81	E	49.7	Very low	49.5	Very low	172 Å²	172	120.1 Å²	120.1	80%	0.804	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-54.5	134.8	165.4	-66.5	-74.3	135.6	0	0	108.8	V83	E81-V83 PolarHBondContact O-N 3.25Å
82	P	41.8	Very low	48.3	Very low	98 Å²	98	122.9 Å²	122.9	64%	0.636	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-55.4	134.6	179	-26.1	34.2	0	0	0	111.9	H84	P82-H84 PolarHBondContact O-N 2.82Å
83	V	47	Very low	47.3	Very low	122 Å²	122	124.8 Å²	124.8	74%	0.739	65%	0.645	S	S	*	*	S	Bend	trans	-77.8	54.8	174.8	-167.2	0	0	0	0	110.1	E81	E81-V83 PolarHBondContact O-N 3.25Å
84	H	41.1	Very low	46.5	Very low	170 Å²	170	126.5 Å²	126.5	79%	0.787	66%	0.663	S	S	*	*			trans	-131.2	49.6	179.9	-71.5	-49	0	0	0	111.2	P82	P82-H84 PolarHBondContact O-N 2.82Å
85	S	36.6	Very low	45.5	Very low	101 Å²	101	132.4 Å²	132.4	71%	0.706	68%	0.678	S	S	*	*			trans	-162.7	40.5	158.4	-88	0	0	0	0	113.4	K87	S85-K87 PolarHBondContact O-N 2.92Å
86	I	41.2	Very low	44.7	Very low	140 Å²	140	134 Å²	134	72%	0.718	70%	0.697	S	S	*	*			trans	-71.7	76.8	146.8	-53.1	179.8	0	0	0	106.1	E88	I86-E88 VanDerWaalsContact C-N 3.3Å; I86-E88 HydrophobicContact CG2-CG 4.31Å; I86-E88 PolarHBondContact O-N 3.3Å; I86-E88 VanDerWaalsContact O-N 3.1Å
87	K	43.5	Very low	43.7	Very low	170 Å²	170	138.9 Å²	138.9	74%	0.739	73%	0.728	S	S	*	*			trans	-67.1	103.6	153.8	-74.2	-172.8	178.3	-176.4	0	104.7	S85 K89	S85-K87 PolarHBondContact O-N 2.92Å; K87-K89 VanDerWaalsContact C-N 3.26Å; K87-K89 PolarHBondContact O-N 2.88Å
88	E	41.3	Very low	42.4	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	74%	0.741	S	S	*	*			trans	-54.1	98.4	162.3	-65	-171.5	158.1	0	0	107.4	I86 P90	I86-E88 VanDerWaalsContact C-N 3.3Å; I86-E88 HydrophobicContact CG2-CG 4.31Å; I86-E88 PolarHBondContact O-N 3.3Å; I86-E88 VanDerWaalsContact O-N 3.1Å; E88-P90 VanDerWaalsContact O-CD 3.29Å; E88-P90 WeakPolarHBondContact O-CD 3.29Å
89	K	40.4	Very low	41.3	Very low	178 Å²	178	143.5 Å²	143.5	77%	0.774	75%	0.746	S	S	*	*			trans	-81.8	112.5	168.8	-81	-172.7	174.2	-178.2	0	105.7	K87 H91	K87-K89 VanDerWaalsContact C-N 3.26Å; K87-K89 PolarHBondContact O-N 2.88Å; K89-H91 PolarHBondContact O-N 2.98Å; K89-H91 VanDerWaalsContact O-N 3.12Å
90	P	38.2	Very low	40.1	Very low	110 Å²	110	142 Å²	142	71%	0.714	76%	0.756	S	S	*	*			trans	-57.9	123.8	172.8	24.7	-32.9	0	0	0	107.5	E88 L92	E88-P90 VanDerWaalsContact O-CD 3.29Å; E88-P90 WeakPolarHBondContact O-CD 3.29Å; P90-L92 PolarHBondContact O-N 2.98Å
91	H	36.2	Very low	39.3	Very low	173 Å²	173	145.1 Å²	145.1	80%	0.801	77%	0.771	S	S	*	*			trans	-80.6	54	-169.2	-158.3	-86.2	0	0	0	111.8	K89 S93	K89-H91 PolarHBondContact O-N 2.98Å; K89-H91 VanDerWaalsContact O-N 3.12Å; H91-S93 PolarHBondContact O-N 3.36Å
92	L	43.1	Very low	38.8	Very low	160 Å²	160	145.4 Å²	145.4	84%	0.838	77%	0.773	S	S	*	*			trans	-79.2	98.3	172.3	-92.9	157.3	0	0	0	109.6	P90 S94	P90-L92 PolarHBondContact O-N 2.98Å; L92-S94 PolarHBondContact O-N 2.78Å; L92-S94 VanDerWaalsContact O-N 3.15Å
93	S	37	Very low	38.3	Very low	108 Å²	108	148 Å²	148	76%	0.755	78%	0.781	S	S	*	*			trans	-57.4	110.6	171.9	179.6	0	0	0	0	111.2	H91	H91-S93 PolarHBondContact O-N 3.36Å
94	S	41	Very low	38	Very low	109 Å²	109	147.5 Å²	147.5	76%	0.762	78%	0.781	S	S	*	*			trans	-166.1	117.3	153.8	-85.9	0	0	0	0	111.2	L92 P96	L92-S94 PolarHBondContact O-N 2.78Å; L92-S94 VanDerWaalsContact O-N 3.15Å; S94-P96 VanDerWaalsContact O-CD 3.28Å; S94-P96 WeakPolarHBondContact O-CD 3.44Å
95	R	36.1	Very low	37.5	Very low	235 Å²	235	144.5 Å²	144.5	89%	0.887	77%	0.774	S	S	*	*			trans	-72.1	113.3	176.2	177.7	-170.8	-169.9	-164.7	4.9	110	T97	R95-T97 PolarHBondContact O-N 3.12Å
96	P	38.3	Very low	37.5	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	78%	0.781	S	S	*	*			trans	-78.2	118.2	174.9	-9.3	27.5	0	0	0	109.7	S94	S94-P96 VanDerWaalsContact O-CD 3.28Å; S94-P96 WeakPolarHBondContact O-CD 3.44Å
97	T	35	Very low	37.1	Very low	119 Å²	119	146.2 Å²	146.2	73%	0.73	78%	0.78	S	S	*	*			trans	-72.7	149.4	167.8	-65.5	0	0	0	0	110.1	R95 T99	R95-T97 PolarHBondContact O-N 3.12Å; T97-T99 PolarHBondContact O-N 3.06Å; T97-T99 VanDerWaalsContact O-N 3.14Å
98	Y	30.1	Very low	36.9	Very low	227 Å²	227	147.6 Å²	147.6	89%	0.89	79%	0.786	S	S	*	*			trans	-73.1	97.9	-172.9	-167.7	-88.7	0	0	0	113.4
99	T	38.1	Very low	36.5	Very low	129 Å²	129	145.6 Å²	145.6	79%	0.791	78%	0.781	S	S	*	*			trans	-152.1	115.1	158	49.5	0	0	0	0	105.2	T97	T97-T99 PolarHBondContact O-N 3.06Å; T97-T99 VanDerWaalsContact O-N 3.14Å
100	G	31	Very low	36.2	Very low	66 Å²	66	144.9 Å²	144.9	68%	0.68	79%	0.786	S	S	*	*				91	120	58.9	0	0	0	0	0	108.7
101	I	37.7	Very low	35.9	Very low	156 Å²	156	147.3 Å²	147.3	80%	0.8	79%	0.788	S	S	*	*			trans	119.4	94.8	175.2	-61.3	155.8	0	0	0	114.5
102	Q	39.7	Very low	35.7	Very low	179 Å²	179	148.4 Å²	148.4	84%	0.836	80%	0.796	S	S	*	*			trans	57.3	121.3	130.9	-59.8	169.1	11.2	0	0	122.7
103	D	31.4	Very low	34.8	Very low	152 Å²	152	148.6 Å²	148.6	81%	0.813	79%	0.792	S	S	*	*			trans	-50.9	172	151.7	-68.8	-61.5	0	0	0	113.8
104	P	40.7	Very low	34.4	Very low	111 Å²	111	150.9 Å²	150.9	72%	0.721	80%	0.795	S	S	*	*			cis	-149.4	163.2	27.1	42.4	-21	0	0	0	121.2
105	V	31.4	Very low	33.9	Very low	108 Å²	108	150.6 Å²	150.6	66%	0.655	79%	0.791	S	S	*	*			trans	34.9	126.4	134.7	-174.5	0	0	0	0	120.5	H107	V105-H107 VanDerWaalsContact CG1-CD2 3.49Å; V105-H107 WeakPolarHBondContact CG1-CD2 3.31Å
106	C	36.2	Very low	33.5	Very low	127 Å²	127	148 Å²	148	86%	0.858	79%	0.788	S	S	*	*			trans	-139.1	112.5	142.3	-170.6	0	0	0	0	111.1
107	H	33.5	Very low	33.2	Very low	150 Å²	150	149.7 Å²	149.7	69%	0.694	79%	0.789	S	S	*	*			trans	-87.9	151.5	166.2	-67.1	-85.2	0	0	0	110.4	V105	V105-H107 VanDerWaalsContact CG1-CD2 3.49Å; V105-H107 WeakPolarHBondContact CG1-CD2 3.31Å
108	K	38.2	Very low	33.1	Very low	198 Å²	198	150.2 Å²	150.2	86%	0.861	79%	0.788	S	S	*	*			trans	-165.8	111	136	-106.7	152.4	-171.2	179.3	0	112.2
109	N	32.3	Very low	33	Very low	137 Å²	137	147.9 Å²	147.9	73%	0.733	79%	0.785	S	S	*	*			trans	-77.5	145.3	161.2	-63	-15.6	0	0	0	108.7
110	N	35.4	Very low	32.7	Very low	163 Å²	163	148.5 Å²	148.5	87%	0.872	79%	0.788	S	S	*	*			trans	-126	105.1	156.6	-83.8	-14.5	0	0	0	107.8
111	Q	32.1	Very low	32.5	Very low	162 Å²	162	150.9 Å²	150.9	76%	0.757	79%	0.794	S	S	*	*			trans	-92.2	143.9	165.3	-69.2	175.3	-6.4	0	0	108.5
112	M	31.2	Very low	32.2	Very low	195 Å²	195	151.1 Å²	151.1	96%	0.961	80%	0.797	S	S	*	*			trans	-119.6	112.8	159.1	-75.8	-178.7	69.5	0	0	107.6
113	E	25.4	Very low	31.9	Very low	165 Å²	165	153.9 Å²	153.9	77%	0.771	80%	0.799	S	S	*	*			trans	-88.2	147.2	169.1	-68	-178.5	100.4	0	0	110.8
114	L	27.6	Very low	32	Very low	156 Å²	156	151.1 Å²	151.1	82%	0.817	80%	0.798	S	S	*	*				164.3	159.4	124.4	-109.5	76.4	0	0	0	109.5
115	P	29.9	Very low	31.7	Very low	103 Å²	103	151.5 Å²	151.5	67%	0.669	80%	0.801	S	S	*	*			cis	-127.1	168.6	-20.2	31.8	-13.6	0	0	0	113.3
116	Q	28	Very low	31.7	Very low	179 Å²	179	152 Å²	152	84%	0.836	80%	0.795	S	S	*	*			trans	-69.5	138.1	173.9	-61	174.2	-0.1	0	0	111.9
117	I	32	Very low	31.6	Very low	162 Å²	162	151.5 Å²	151.5	83%	0.831	79%	0.791	S	S	*	*			trans	-129	124.6	163.7	-61.1	-179.5	0	0	0	108.2
118	N	33.4	Very low	31.9	Very low	130 Å²	130	147.6 Å²	147.6	70%	0.695	78%	0.78	S	S	*	*			trans	-80.1	143.7	-175.7	-70	-40.2	0	0	0	112.9
119	H	28.2	Very low	31.6	Very low	178 Å²	178	144.1 Å²	144.1	82%	0.824	78%	0.776	S	S	*	*			trans	25.3	103.7	151.8	-76.5	-87	0	0	0	119
120	V	31.3	Very low	31.7	Very low	141 Å²	141	145.4 Å²	145.4	86%	0.855	78%	0.781	S	S	*	*			trans	-132.5	131.1	136.4	-178.6	0	0	0	0	107.5
121	S	27.5	Very low	31.5	Very low	116 Å²	116	145 Å²	145	81%	0.811	78%	0.779	S	S	*	*			trans	-70.6	127.5	174.5	-62.5	0	0	0	0	110.7
122	D	31.6	Very low	31.7	Very low	162 Å²	162	143 Å²	143	87%	0.866	77%	0.773	S	S	*	*			trans	-142.6	141.8	154.1	-148.5	-16.6	0	0	0	110.6	A124	D122-A124 PolarHBondContact O-N 3.34Å
123	R	32.1	Very low	31.8	Very low	236 Å²	236	137.9 Å²	137.9	89%	0.891	75%	0.754	S	S	*	*			trans	-91.8	99.2	-170.2	-73.3	179.5	175.2	174.6	-1.5	110.3
124	A	34.2	Very low	32.2	Very low	95 Å²	95	138.5 Å²	138.5	79%	0.785	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-64.4	129.6	168.9	0	0	0	0	0	110.9	D122	D122-A124 PolarHBondContact O-N 3.34Å
125	P	33.1	Very low	32.5	Very low	119 Å²	119	136.6 Å²	136.6	77%	0.773	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-67.2	133.1	179.6	-21.2	33.4	0	0	0	112.8
126	H	32	Very low	32.8	Very low	117 Å²	117	137.8 Å²	137.8	54%	0.542	74%	0.742	S	S	.	*	P	Polyproline II helix	trans	-65.3	146.2	173.5	-172.8	-95.7	0	0	0	111	S128	H126-S128 PolarHBondContact ND1-OG 3.47Å; H126-S128 PolarHBondContact O-N 3.29Å
127	P	35.1	Very low	33.3	Very low	118 Å²	118	136.5 Å²	136.5	77%	0.766	73%	0.734	S	S	*	*	S	Bend	trans	-71.4	28.7	-172.8	29.4	-37.6	0	0	0	115.7	V129	P127-V129 PolarHBondContact O-N 3.02Å
128	S	38.7	Very low	33.6	Very low	68 Å²	68	135.4 Å²	135.4	48%	0.476	72%	0.72	S	S	.	*			trans	-96.9	32.2	-178	43.4	0	0	0	0	113.4	H126 L130	H126-S128 PolarHBondContact ND1-OG 3.47Å; H126-S128 PolarHBondContact O-N 3.29Å; S128-L130 VanDerWaalsContact C-N 3.33Å
129	V	33.1	Very low	34.1	Very low	125 Å²	125	136.1 Å²	136.1	76%	0.758	72%	0.717	S	S	*	*			trans	-77.9	-20.6	-179.6	-164.5	0	0	0	0	112	P127 N131	P127-V129 PolarHBondContact O-N 3.02Å; V129-N131 PolarHBondContact O-N 2.8Å; V129-N131 VanDerWaalsContact O-N 3.14Å
130	L	34.8	Very low	34.4	Very low	163 Å²	163	133 Å²	133	85%	0.853	71%	0.706	S	S	*	*			trans	-83.3	80.6	168.4	-62.6	179.6	0	0	0	110.2	S128 L132	S128-L130 VanDerWaalsContact C-N 3.33Å; L130-L132 PolarHBondContact O-N 3.37Å
131	N	31	Very low	34.9	Very low	154 Å²	154	131 Å²	131	82%	0.824	70%	0.696	S	S	*	*			trans	-71.3	53.1	170.5	-87.4	-47.8	0	0	0	112.1	V129	V129-N131 PolarHBondContact O-N 2.8Å; V129-N131 VanDerWaalsContact O-N 3.14Å
132	L	36.4	Very low	35.6	Very low	122 Å²	122	129.3 Å²	129.3	64%	0.639	68%	0.677	S	S	*	*			trans	-79.8	142.5	167	-140.7	74.9	0	0	0	108.8	L130 Y134 F137	L130-L132 PolarHBondContact O-N 3.37Å; L132-Y134 PolarHBondContact O-N 2.76Å; L132-F137 HydrophobicContact CD2-CD2 4.46Å; L132-F137 HydrophobicContact CD2-CE2 4.04Å
133	P	32.2	Very low	36.5	Very low	86 Å²	86	125.1 Å²	125.1	56%	0.558	66%	0.655	S	S	*	*			trans	-61.8	94.4	-177.7	-26.2	36.3	0	0	0	113.5	V135 H136	P133-V135 PolarHBondContact O-N 2.96Å; P133-H136 PolarHBondContact O-N 2.95Å
134	Y	33.3	Very low	37.3	Very low	179 Å²	179	116.1 Å²	116.1	70%	0.702	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	-13.9	-173.5	-172.9	-104.9	0	0	0	115.2	L132 Y138	L132-Y134 PolarHBondContact O-N 2.76Å; Y134-Y138 WeakPolarHBondContact O-CD2 3.46Å; Y134-Y138 WeakPolarHBondContact O-CE2 3.4Å
135	V	35.1	Very low	38.3	Very low	116 Å²	116	115.4 Å²	115.4	70%	0.703	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	6.7	-170.5	-73.6	0	0	0	0	115.3	P133	P133-V135 PolarHBondContact O-N 2.96Å
136	H	36.7	Very low	39.5	Very low	127 Å²	127	117.7 Å²	117.7	59%	0.588	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	-12.2	-179.6	-118.9	-104.6	0	0	0	117.4	P133 K139	P133-H136 PolarHBondContact O-N 2.95Å; H136-K139 PolarHBondContact NE2-NZ 3.38Å
137	F	37	Very low	40.9	Very low	153 Å²	153	115.3 Å²	115.3	67%	0.671	60%	0.603	S	S	*	*	S	Bend	trans	-84.2	-18.3	178.2	-86	-89.3	0	0	0	115	L132 K139	L132-F137 HydrophobicContact CD2-CD2 4.46Å; L132-F137 HydrophobicContact CD2-CE2 4.04Å; F137-K139 PolarHBondContact O-N 2.98Å
138	Y	38.5	Very low	42.7	Very low	139 Å²	139	114 Å²	114	55%	0.545	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	-5.3	-173.9	-65.8	-71.5	0	0	0	115.6	Y134 N140	Y134-Y138 WeakPolarHBondContact O-CD2 3.46Å; Y134-Y138 WeakPolarHBondContact O-CE2 3.4Å; Y138-N140 PolarHBondContact O-N 2.89Å
139	K	43.3	Very low	44.7	Very low	145 Å²	145	113.1 Å²	113.1	63%	0.63	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	0.5	-173.7	-76.4	178.2	179.6	167.7	0	115.6	H136 F137	H136-K139 PolarHBondContact NE2-NZ 3.38Å; F137-K139 PolarHBondContact O-N 2.98Å
140	N	35.4	Very low	46.9	Very low	112 Å²	112	111.9 Å²	111.9	60%	0.599	57%	0.566	S	S	*	*			trans	-149.9	99.6	-173.5	-92.1	-32.2	0	0	0	112.6	Y138 I142	Y138-N140 PolarHBondContact O-N 2.89Å; N140-I142 HydrophobicContact CB-CD1 3.71Å; N140-I142 HydrophobicContact CB-CG1 3.78Å; N140-I142 PolarHBondContact O-N 3.17Å; N140-I142 WeakPolarHBondContact OD1-CD1 3.23Å
141	P	41.6	Very low	49.1	Very low	98 Å²	98	110.9 Å²	110.9	64%	0.636	56%	0.557	S	S	*	*			trans	-76.9	56.4	165.1	34.3	-35.1	0	0	0	110.3	L143	P141-L143 VanDerWaalsContact C-N 3.33Å
142	I	42.7	Very low	51.7	Low	81 Å²	81	105.1 Å²	105.1	42%	0.415	53%	0.527	S	S	.	.			trans	-86.2	-8.7	179.9	-59.4	174.1	0	0	0	111.5	N140 S144 Q200	N140-I142 HydrophobicContact CB-CD1 3.71Å; N140-I142 HydrophobicContact CB-CG1 3.78Å; N140-I142 PolarHBondContact O-N 3.17Å; N140-I142 WeakPolarHBondContact OD1-CD1 3.23Å; I142-S144 PolarHBondContact O-N 3.39Å; I142-Q200 VanDerWaalsContact CG2-NE2 3.26Å
143	L	49.4	Very low	54.1	Low	75 Å²	75	100.3 Å²	100.3	39%	0.393	50%	0.503	S	S	.	.			trans	-67.7	75.8	160.5	-93.8	166.5	0	0	0	110.3	P141 F147 F148 L193 L196	P141-L143 VanDerWaalsContact C-N 3.33Å; L143-F147 HydrophobicContact CD2-CB 4.33Å; L143-F148 HydrophobicContact CB-CE2 4.36Å; L143-F148 HydrophobicContact CD1-CE2 3.93Å; L143-F148 HydrophobicContact CD1-CZ 4.15Å; L143-F148 HydrophobicContact CD2-CD2 4.13Å; L143-F148 HydrophobicContact CD2-CE2 3.45Å; L143-F148 VanDerWaalsContact CD2-CE2 3.45Å; L143-F148 HydrophobicContact CD2-CZ 3.93Å; L143-F148 HydrophobicContact CG-CE2 4.11Å; L143-L193 HydrophobicContact CD1-CD2 4.25Å; L143-L196 HydrophobicContact CD1-CD1 4.41Å; L143-L196 HydrophobicContact CD2-CD1 3.39Å; L143-L196 HydrophobicContact CD2-CD2 4.04Å; L143-L196 HydrophobicContact CD2-CG 4.26Å; L143-L196 HydrophobicContact CG-CD1 3.67Å
144	S	50.9	Low	56.6	Low	46 Å²	46	99.8 Å²	99.8	32%	0.322	49%	0.493	S	S	.	.			trans	-54.2	139.3	168.6	179.9	0	0	0	0	109.3	I142 K146 F147	I142-S144 PolarHBondContact O-N 3.39Å; S144-K146 PolarHBondContact O-N 3.43Å; S144-F147 WeakPolarHBondContact O-CD2 3.49Å; S144-F147 PolarHBondContact O-N 2.83Å
145	S	55	Low	59.2	Low	81 Å²	81	93.8 Å²	93.8	57%	0.566	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	10.8	174.3	73.1	0	0	0	0	114.2
146	K	56.6	Low	61.8	Low	166 Å²	166	89.2 Å²	89.2	72%	0.722	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-15.4	170	-65	-174	176	-171.3	0	113.1	S144 T149	S144-K146 PolarHBondContact O-N 3.43Å; K146-T149 WeakPolarHBondContact O-CG2 3.44Å
147	F	61.5	Low	64.5	Low	68 Å²	68	83.2 Å²	83.2	30%	0.298	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-29.2	-175.1	-63	-65.2	0	0	0	113.7	L143 S144 T149 L196 L199	L143-F147 HydrophobicContact CD2-CB 4.33Å; S144-F147 WeakPolarHBondContact O-CD2 3.49Å; S144-F147 PolarHBondContact O-N 2.83Å; F147-T149 PolarHBondContact O-N 3.18Å; F147-L196 HydrophobicContact CB-CD2 3.66Å; F147-L196 HydrophobicContact CD1-CD2 3.56Å; F147-L196 HydrophobicContact CD2-CD2 3.37Å; F147-L196 HydrophobicContact CE1-CD2 3.97Å; F147-L196 HydrophobicContact CE2-CD2 3.8Å; F147-L196 HydrophobicContact CG-CD2 3.23Å; F147-L196 HydrophobicContact CZ-CD2 4.08Å; F147-L199 HydrophobicContact CD1-CD1 4.45Å; F147-L199 HydrophobicContact CE1-CD1 3.94Å
148	F	74	Confident	67	Low	89 Å²	89	78.1 Å²	78.1	39%	0.39	41%	0.411	S	S	.	.	S	Bend	trans	-86.5	69.2	161.9	-62.8	-72.7	0	0	0	108.4	L143 V153 I192	L143-F148 HydrophobicContact CB-CE2 4.36Å; L143-F148 HydrophobicContact CD1-CE2 3.93Å; L143-F148 HydrophobicContact CD1-CZ 4.15Å; L143-F148 HydrophobicContact CD2-CD2 4.13Å; L143-F148 HydrophobicContact CD2-CE2 3.45Å; L143-F148 VanDerWaalsContact CD2-CE2 3.45Å; L143-F148 HydrophobicContact CD2-CZ 3.93Å; L143-F148 HydrophobicContact CG-CE2 4.11Å; F148-V153 HydrophobicContact CB-CG2 4.24Å; F148-V153 HydrophobicContact CD1-CG2 4.45Å; F148-I192 HydrophobicContact CE1-CD1 4.08Å; F148-I192 HydrophobicContact CE1-CG2 4.14Å; F148-I192 HydrophobicContact CZ-CG2 4.39Å
149	T	79.6	Confident	69.4	Low	51 Å²	51	73.9 Å²	73.9	31%	0.313	40%	0.4	S	S	.	.			trans	-66.4	158.6	163.8	61	0	0	0	0	108.8	K146 F147 E151 V152 V153	K146-T149 WeakPolarHBondContact O-CG2 3.44Å; F147-T149 PolarHBondContact O-N 3.18Å; T149-E151 PolarHBondContact O-N 2.88Å; T149-V152 PolarHBondContact O-N 3.09Å; T149-V152 VanDerWaalsContact O-N 3.15Å; T149-V152 WeakPolarHBondContact OG1-CG2 3.48Å; T149-V152 PolarHBondContact OG1-N 2.9Å; T149-V153 WeakPolarHBondContact O-CG2 3.44Å; T149-V153 PolarHBondContact O-N 3.49Å; T149-V153 VanDerWaalsContact O-N 3.1Å
150	L	80.5	Confident	71.8	Confident	98 Å²	98	67.9 Å²	67.9	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-54.3	-45.6	175.2	179.6	59.8	0	0	0	110.4	V152 V153 E154 T450 L454	L150-V152 PolarHBondContact O-N 3.46Å; L150-V153 CarbonylContact O-C 3.59Å; L150-V153 PolarHBondContact O-N 3.45Å; L150-E154 HydrophobicContact CD1-CG 4.05Å; L150-E154 HydrophobicContact CG-CG 4.2Å; L150-E154 VanDerWaalsContact CG-OE1 3.31Å; L150-E154 WeakPolarHBondContact CG-OE1 3.18Å; L150-E154 WeakPolarHBondContact O-CB 3.43Å; L150-E154 WeakPolarHBondContact O-CG 3.23Å; L150-E154 PolarHBondContact O-N 3.32Å; L150-T450 HydrophobicContact CD1-CG2 4.11Å; L150-L454 HydrophobicContact CD1-CD1 4.37Å
151	E	80.8	Confident	74.5	Confident	143 Å²	143	63.6 Å²	63.6	67%	0.668	35%	0.352	S	S	*	.	H	α-helix	trans	-53.1	-44.3	175.3	-57.1	163.3	166.8	0	0	113.5	T149 A155	T149-E151 PolarHBondContact O-N 2.88Å; E151-A155 VanDerWaalsContact O-CB 3.27Å; E151-A155 WeakPolarHBondContact O-CB 3.31Å; E151-A155 PolarHBondContact O-N 2.82Å
152	V	84.8	Confident	76.9	Confident	33 Å²	33	63.3 Å²	63.3	20%	0.2	35%	0.348	C	S	.	.	H	α-helix	trans	-69	-36.2	178.3	168	0	0	0	0	111.4	T149 L150 A156 I192	T149-V152 PolarHBondContact O-N 3.09Å; T149-V152 VanDerWaalsContact O-N 3.15Å; T149-V152 WeakPolarHBondContact OG1-CG2 3.48Å; T149-V152 PolarHBondContact OG1-N 2.9Å; L150-V152 PolarHBondContact O-N 3.46Å; V152-A156 WeakPolarHBondContact O-CB 3.29Å; V152-A156 PolarHBondContact O-N 3.07Å; V152-A156 VanDerWaalsContact O-N 3.12Å; V152-I192 HydrophobicContact CG1-CD1 3.8Å; V152-I192 HydrophobicContact CG1-CG1 3.91Å
153	V	88.1	Confident	79.1	Confident	20 Å²	20	62.3 Å²	62.3	12%	0.121	34%	0.342	C	S	.	.	H	α-helix	trans	-70.4	-46	176.1	-178.4	0	0	0	0	110.3	F148 T149 L150 A155 A156 C157 T450 L454	F148-V153 HydrophobicContact CB-CG2 4.24Å; F148-V153 HydrophobicContact CD1-CG2 4.45Å; T149-V153 WeakPolarHBondContact O-CG2 3.44Å; T149-V153 PolarHBondContact O-N 3.49Å; T149-V153 VanDerWaalsContact O-N 3.1Å; L150-V153 CarbonylContact O-C 3.59Å; L150-V153 PolarHBondContact O-N 3.45Å; V153-A155 PolarHBondContact O-N 2.82Å; V153-A156 PolarHBondContact O-N 3.27Å; V153-C157 WeakPolarHBondContact O-CB 3.39Å; V153-C157 PolarHBondContact O-N 3.49Å; V153-C157 PolarHBondContact O-SG 3.41Å; V153-T450 HydrophobicContact CG1-CG2 4.09Å; V153-L454 HydrophobicContact CG1-CD2 4.32Å; V153-L454 HydrophobicContact CG1-CG 4.37Å; V153-L454 HydrophobicContact CG2-CD2 4.48Å
154	E	84.7	Confident	81.1	Confident	75 Å²	75	60.5 Å²	60.5	35%	0.35	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-42.4	176.8	-73.5	169.5	162.8	0	0	111.8	L150 C157 S158 T450	L150-E154 HydrophobicContact CD1-CG 4.05Å; L150-E154 HydrophobicContact CG-CG 4.2Å; L150-E154 VanDerWaalsContact CG-OE1 3.31Å; L150-E154 WeakPolarHBondContact CG-OE1 3.18Å; L150-E154 WeakPolarHBondContact O-CB 3.43Å; L150-E154 WeakPolarHBondContact O-CG 3.23Å; L150-E154 PolarHBondContact O-N 3.32Å; E154-C157 PolarHBondContact O-N 3.1Å; E154-S158 WeakPolarHBondContact O-CB 3.4Å; E154-S158 PolarHBondContact O-N 3.21Å; E154-S158 PolarHBondContact O-OG 3.25Å; E154-T450 HydrophobicContact CG-CG2 3.93Å
155	A	87.2	Confident	82.9	Confident	54 Å²	54	61.4 Å²	61.4	45%	0.446	33%	0.33	S	S	.	.	H	α-helix	trans	-60.8	-48.7	173.9	0	0	0	0	0	111.9	E151 V153 C157 S158 C159	E151-A155 VanDerWaalsContact O-CB 3.27Å; E151-A155 WeakPolarHBondContact O-CB 3.31Å; E151-A155 PolarHBondContact O-N 2.82Å; V153-A155 PolarHBondContact O-N 2.82Å; A155-C157 VanDerWaalsContact C-N 3.34Å; A155-C157 PolarHBondContact O-N 3.26Å; A155-S158 WeakPolarHBondContact O-CB 3.31Å; A155-S158 PolarHBondContact O-N 2.9Å; A155-C159 PolarHBondContact O-N 3.14Å; A155-C159 PolarHBondContact O-SG 3.22Å; A155-C159 VanDerWaalsContact O-SG 3.37Å
156	A	90.8	Very high	84.5	Confident	19 Å²	19	61.4 Å²	61.4	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-62.3	-39	176.7	0	0	0	0	0	112.4	V152 V153 S158 C159 I160 C188	V152-A156 WeakPolarHBondContact O-CB 3.29Å; V152-A156 PolarHBondContact O-N 3.07Å; V152-A156 VanDerWaalsContact O-N 3.12Å; V153-A156 PolarHBondContact O-N 3.27Å; A156-S158 VanDerWaalsContact C-N 3.35Å; A156-C159 PolarHBondContact O-N 2.98Å; A156-I160 WeakPolarHBondContact O-CD1 3.49Å; A156-I160 VanDerWaalsContact O-CG1 3.29Å; A156-I160 WeakPolarHBondContact O-CG1 3.45Å; A156-I160 PolarHBondContact O-N 2.8Å; A156-C188 HydrophobicContact CB-CB 3.96Å
157	C	92.2	Very high	86.1	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.014	29%	0.288	C	S	.	.	H	α-helix	trans	-63.4	-41.8	174.3	-65.3	0	0	0	0	111.5	V153 E154 A155 I160 L161 A449 T450 L453	V153-C157 WeakPolarHBondContact O-CB 3.39Å; V153-C157 PolarHBondContact O-N 3.49Å; V153-C157 PolarHBondContact O-SG 3.41Å; E154-C157 PolarHBondContact O-N 3.1Å; A155-C157 VanDerWaalsContact C-N 3.34Å; A155-C157 PolarHBondContact O-N 3.26Å; C157-I160 PolarHBondContact O-N 2.87Å; C157-L161 WeakPolarHBondContact O-CB 3.49Å; C157-L161 WeakPolarHBondContact O-CG 3.32Å; C157-L161 PolarHBondContact O-N 3.24Å; C157-A449 HydrophobicContact CB-CB 4.44Å; C157-T450 VanDerWaalsContact SG-CA 3.58Å; C157-L453 WeakPolarHBondContact SG-CD1 3.49Å
158	S	90.5	Very high	87.5	Confident	46 Å²	46	55.1 Å²	55.1	32%	0.322	29%	0.294	S	S	.	.	H	α-helix	trans	-61.9	-46	178.3	-58.4	0	0	0	0	111.6	E154 A155 A156 I160 L161 V162	E154-S158 WeakPolarHBondContact O-CB 3.4Å; E154-S158 PolarHBondContact O-N 3.21Å; E154-S158 PolarHBondContact O-OG 3.25Å; A155-S158 WeakPolarHBondContact O-CB 3.31Å; A155-S158 PolarHBondContact O-N 2.9Å; A156-S158 VanDerWaalsContact C-N 3.35Å; S158-I160 PolarHBondContact O-N 3.27Å; S158-L161 PolarHBondContact O-N 3.37Å; S158-V162 VanDerWaalsContact O-CG2 3.31Å; S158-V162 WeakPolarHBondContact O-CG2 3.43Å; S158-V162 PolarHBondContact O-N 3.12Å
159	C	87.9	Confident	88.3	Confident	49 Å²	49	60.2 Å²	60.2	33%	0.331	31%	0.313	S	S	.	.	H	α-helix	trans	-55.3	-50.5	174	-67.2	0	0	0	0	112	A155 A156 L161 V162 Q163 E184	A155-C159 PolarHBondContact O-N 3.14Å; A155-C159 PolarHBondContact O-SG 3.22Å; A155-C159 VanDerWaalsContact O-SG 3.37Å; A156-C159 PolarHBondContact O-N 2.98Å; C159-L161 PolarHBondContact O-N 3.12Å; C159-V162 PolarHBondContact O-N 3.05Å; C159-Q163 WeakPolarHBondContact O-CG 3.26Å; C159-Q163 PolarHBondContact O-N 2.84Å; C159-Q163 VanDerWaalsContact O-N 3.13Å; C159-E184 HydrophobicContact CB-CG 4.17Å
160	I	93.7	Very high	88.9	Confident	19 Å²	19	63 Å²	63	10%	0.097	32%	0.32	C	S	.	.	H	α-helix	trans	-61.9	-42	179.9	-65.5	162.9	0	0	0	111.6	A156 C157 S158 Q163 L164 V181 E184 F185	A156-I160 WeakPolarHBondContact O-CD1 3.49Å; A156-I160 VanDerWaalsContact O-CG1 3.29Å; A156-I160 WeakPolarHBondContact O-CG1 3.45Å; A156-I160 PolarHBondContact O-N 2.8Å; C157-I160 PolarHBondContact O-N 2.87Å; S158-I160 PolarHBondContact O-N 3.27Å; I160-Q163 PolarHBondContact O-N 2.82Å; I160-L164 WeakPolarHBondContact O-CB 3.15Å; I160-L164 PolarHBondContact O-N 3.33Å; I160-V181 HydrophobicContact CG2-CB 4.42Å; I160-V181 HydrophobicContact CG2-CG1 3.86Å; I160-V181 HydrophobicContact CG2-CG2 4.23Å; I160-E184 HydrophobicContact CG1-CB 4.26Å; I160-E184 HydrophobicContact CG1-CG 4.12Å; I160-F185 HydrophobicContact CD1-CB 3.97Å; I160-F185 HydrophobicContact CD1-CD2 3.91Å; I160-F185 HydrophobicContact CD1-CG 4.45Å; I160-F185 HydrophobicContact CG1-CB 4.45Å
161	L	92.2	Very high	89.5	Confident	23 Å²	23	65 Å²	65	12%	0.12	33%	0.332	C	S	.	.	H	α-helix	trans	-68.9	-38.9	179.3	-75.1	174.5	0	0	0	112.8	C157 S158 C159 L164 K165 T446 A449	C157-L161 WeakPolarHBondContact O-CB 3.49Å; C157-L161 WeakPolarHBondContact O-CG 3.32Å; C157-L161 PolarHBondContact O-N 3.24Å; S158-L161 PolarHBondContact O-N 3.37Å; C159-L161 PolarHBondContact O-N 3.12Å; L161-L164 PolarHBondContact O-N 3.4Å; L161-K165 WeakPolarHBondContact O-CB 3.35Å; L161-K165 WeakPolarHBondContact O-CG 3.33Å; L161-K165 PolarHBondContact O-N 3.4Å; L161-T446 VanDerWaalsContact CD1-CA 3.5Å; L161-T446 HydrophobicContact CD1-CG2 4.3Å; L161-A449 HydrophobicContact CD1-CB 3.81Å; L161-A449 HydrophobicContact CD2-CB 4.24Å; L161-A449 HydrophobicContact CG-CB 4.17Å
162	V	91.3	Very high	89.9	Confident	91 Å²	91	61.9 Å²	61.9	55%	0.552	32%	0.316	S	S	*	.	H	α-helix	trans	-59.8	-48.2	174.1	168.8	0	0	0	0	110.4	S158 C159 L164 K165 E166	S158-V162 VanDerWaalsContact O-CG2 3.31Å; S158-V162 WeakPolarHBondContact O-CG2 3.43Å; S158-V162 PolarHBondContact O-N 3.12Å; C159-V162 PolarHBondContact O-N 3.05Å; V162-L164 VanDerWaalsContact C-N 3.35Å; V162-L164 PolarHBondContact O-N 3.44Å; V162-K165 PolarHBondContact O-N 2.75Å; V162-E166 PolarHBondContact O-N 3.26Å
163	Q	90	Very high	90	Very high	60 Å²	60	63.4 Å²	63.4	28%	0.28	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-40.2	177.1	-67.3	-63.6	-14.7	0	0	112.4	C159 I160 E166 A167 I180 E184	C159-Q163 WeakPolarHBondContact O-CG 3.26Å; C159-Q163 PolarHBondContact O-N 2.84Å; C159-Q163 VanDerWaalsContact O-N 3.13Å; I160-Q163 PolarHBondContact O-N 2.82Å; Q163-E166 PolarHBondContact O-N 3.12Å; Q163-A167 VanDerWaalsContact O-CB 3.29Å; Q163-A167 WeakPolarHBondContact O-CB 3.48Å; Q163-A167 PolarHBondContact O-N 3.34Å; Q163-I180 HydrophobicContact CB-CG2 3.69Å; Q163-E184 HydrophobicContact CB-CB 4.38Å; Q163-E184 HydrophobicContact CB-CG 4.36Å; Q163-E184 HydrophobicContact CG-CB 3.99Å; Q163-E184 HydrophobicContact CG-CG 3.61Å
164	L	90.5	Very high	90	Very high	37 Å²	37	68.8 Å²	68.8	19%	0.194	35%	0.354	C	S	.	.	H	α-helix	trans	-66.9	-40.5	175.6	-179.1	58.1	0	0	0	112.3	I160 L161 V162 A167 K168 Q177 V181	I160-L164 WeakPolarHBondContact O-CB 3.15Å; I160-L164 PolarHBondContact O-N 3.33Å; L161-L164 PolarHBondContact O-N 3.4Å; V162-L164 VanDerWaalsContact C-N 3.35Å; V162-L164 PolarHBondContact O-N 3.44Å; L164-A167 PolarHBondContact O-N 2.87Å; L164-K168 HydrophobicContact CD1-CG 4.45Å; L164-K168 HydrophobicContact CG-CD 4.4Å; L164-K168 WeakPolarHBondContact O-CB 3.41Å; L164-K168 VanDerWaalsContact O-CG 3.31Å; L164-K168 WeakPolarHBondContact O-CG 3.41Å; L164-K168 PolarHBondContact O-N 3.2Å; L164-Q177 HydrophobicContact CD1-CB 3.97Å; L164-V181 HydrophobicContact CB-CG2 3.91Å; L164-V181 HydrophobicContact CD1-CG2 3.96Å; L164-V181 HydrophobicContact CD2-CG2 4.28Å; L164-V181 HydrophobicContact CG-CG2 4.26Å
165	K	89.3	Confident	90	Very high	65 Å²	65	71.6 Å²	71.6	28%	0.283	37%	0.365	S	S	.	.	H	α-helix	trans	-62.8	-44.3	174.8	-78	179.7	174.4	-175.7	0	110.8	L161 V162 K168 Y169 E442 E445	L161-K165 WeakPolarHBondContact O-CB 3.35Å; L161-K165 WeakPolarHBondContact O-CG 3.33Å; L161-K165 PolarHBondContact O-N 3.4Å; V162-K165 PolarHBondContact O-N 2.75Å; K165-K168 PolarHBondContact O-N 3.19Å; K165-Y169 WeakPolarHBondContact O-CB 3.45Å; K165-Y169 PolarHBondContact O-N 3.01Å; K165-E442 IonicContact NZ-OE1 3.82Å; K165-E442 PolarHBondContact NZ-OE1 3.5Å; K165-E442 VanDerWaalsContact NZ-OE1 3.14Å; K165-E445 WeakPolarHBondContact CE-OE2 3.38Å; K165-E445 IonicContact NZ-OE2 3.14Å; K165-E445 PolarHBondContact NZ-OE2 2.9Å
166	E	88.8	Confident	89.8	Confident	82 Å²	82	70.7 Å²	70.7	38%	0.383	35%	0.354	S	S	.	.	H	α-helix	trans	-64.6	-40.7	175.6	-169.2	178.1	-179.8	0	0	112	V162 Q163 K168 Y169 K170	V162-E166 PolarHBondContact O-N 3.26Å; Q163-E166 PolarHBondContact O-N 3.12Å; E166-K168 PolarHBondContact O-N 3.45Å; E166-Y169 PolarHBondContact O-N 3.18Å; E166-K170 HydrophobicContact CG-CD 4.23Å; E166-K170 WeakPolarHBondContact O-CB 3.44Å; E166-K170 WeakPolarHBondContact O-CG 3.42Å; E166-K170 PolarHBondContact O-N 2.87Å; E166-K170 WeakPolarHBondContact OE1-CE 3.35Å; E166-K170 IonicContact OE1-NZ 2.62Å; E166-K170 PolarHBondContact OE1-NZ 2.92Å
167	A	89.7	Confident	89.6	Confident	2 Å²	2	71.2 Å²	71.2	2%	0.017	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-38.4	176	0	0	0	0	0	112.9	Q163 L164 N171 F172 Q177 I180	Q163-A167 VanDerWaalsContact O-CB 3.29Å; Q163-A167 WeakPolarHBondContact O-CB 3.48Å; Q163-A167 PolarHBondContact O-N 3.34Å; L164-A167 PolarHBondContact O-N 2.87Å; A167-N171 PolarHBondContact O-N 3.43Å; A167-F172 HydrophobicContact CB-CD2 3.98Å; A167-F172 PolarHBondContact O-N 2.93Å; A167-F172 VanDerWaalsContact O-N 3.07Å; A167-Q177 HydrophobicContact CB-CB 4.45Å; A167-Q177 HydrophobicContact CB-CG 4.08Å; A167-I180 HydrophobicContact CB-CD1 3.69Å; A167-I180 HydrophobicContact CB-CG2 4.43Å
168	K	90.6	Very high	89.3	Confident	99 Å²	99	77 Å²	77	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-65.7	-45.5	171.5	-74.6	171.8	178.8	176.4	0	111.4	L164 K165 E166 K170 N171	L164-K168 HydrophobicContact CD1-CG 4.45Å; L164-K168 HydrophobicContact CG-CD 4.4Å; L164-K168 WeakPolarHBondContact O-CB 3.41Å; L164-K168 VanDerWaalsContact O-CG 3.31Å; L164-K168 WeakPolarHBondContact O-CG 3.41Å; L164-K168 PolarHBondContact O-N 3.2Å; K165-K168 PolarHBondContact O-N 3.19Å; E166-K168 PolarHBondContact O-N 3.45Å; K168-K170 VanDerWaalsContact C-N 3.33Å; K168-K170 PolarHBondContact O-N 3.5Å; K168-N171 WeakPolarHBondContact O-CA 3.34Å; K168-N171 PolarHBondContact O-N 3.36Å
169	Y	92	Very high	89	Confident	197 Å²	197	80.4 Å²	80.4	77%	0.773	39%	0.389	S	S	*	.	H	α-helix	trans	-60.7	-40.5	178	-178.7	-97.6	0	0	0	112.3	K165 E166 N171	K165-Y169 WeakPolarHBondContact O-CB 3.45Å; K165-Y169 PolarHBondContact O-N 3.01Å; E166-Y169 PolarHBondContact O-N 3.18Å; Y169-N171 PolarHBondContact O-N 2.86Å; Y169-N171 PolarHBondContact O-ND2 3.37Å
170	K	92	Very high	88.8	Confident	108 Å²	108	79.6 Å²	79.6	47%	0.47	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	1.9	172.3	-68.6	175.2	-175.5	170.5	0	114	E166 K168 F172	E166-K170 HydrophobicContact CG-CD 4.23Å; E166-K170 WeakPolarHBondContact O-CB 3.44Å; E166-K170 WeakPolarHBondContact O-CG 3.42Å; E166-K170 PolarHBondContact O-N 2.87Å; E166-K170 WeakPolarHBondContact OE1-CE 3.35Å; E166-K170 IonicContact OE1-NZ 2.62Å; E166-K170 PolarHBondContact OE1-NZ 2.92Å; K168-K170 VanDerWaalsContact C-N 3.33Å; K168-K170 PolarHBondContact O-N 3.5Å; K170-F172 HydrophobicContact CB-CD1 4.44Å; K170-F172 HydrophobicContact CB-CD2 4.03Å; K170-F172 HydrophobicContact CB-CE1 4.28Å; K170-F172 HydrophobicContact CB-CE2 3.85Å; K170-F172 HydrophobicContact CB-CG 4.31Å; K170-F172 HydrophobicContact CB-CZ 3.98Å; K170-F172 HydrophobicContact CD-CE2 3.68Å; K170-F172 HydrophobicContact CD-CZ 3.81Å; K170-F172 HydrophobicContact CG-CE2 4.41Å; K170-F172 PolarHBondContact O-N 3.3Å
171	N	91.8	Very high	88.5	Confident	141 Å²	141	80.5 Å²	80.5	75%	0.754	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	35.1	-179.4	-71	-92.2	0	0	0	113.4	A167 K168 Y169	A167-N171 PolarHBondContact O-N 3.43Å; K168-N171 WeakPolarHBondContact O-CA 3.34Å; K168-N171 PolarHBondContact O-N 3.36Å; Y169-N171 PolarHBondContact O-N 2.86Å; Y169-N171 PolarHBondContact O-ND2 3.37Å
172	F	89.3	Confident	88.3	Confident	77 Å²	77	84.3 Å²	84.3	34%	0.338	41%	0.407	S	S	.	.			trans	-65.7	144.9	176.6	-71.2	-39.4	0	0	0	111.4	A167 K170 V176 Q177 I180	A167-F172 HydrophobicContact CB-CD2 3.98Å; A167-F172 PolarHBondContact O-N 2.93Å; A167-F172 VanDerWaalsContact O-N 3.07Å; K170-F172 HydrophobicContact CB-CD1 4.44Å; K170-F172 HydrophobicContact CB-CD2 4.03Å; K170-F172 HydrophobicContact CB-CE1 4.28Å; K170-F172 HydrophobicContact CB-CE2 3.85Å; K170-F172 HydrophobicContact CB-CG 4.31Å; K170-F172 HydrophobicContact CB-CZ 3.98Å; K170-F172 HydrophobicContact CD-CE2 3.68Å; K170-F172 HydrophobicContact CD-CZ 3.81Å; K170-F172 HydrophobicContact CG-CE2 4.41Å; K170-F172 PolarHBondContact O-N 3.3Å; F172-V176 HydrophobicContact CB-CB 4.03Å; F172-V176 HydrophobicContact CB-CG1 3.81Å; F172-V176 HydrophobicContact CD1-CG1 4.31Å; F172-V176 HydrophobicContact CD2-CG1 3.93Å; F172-V176 HydrophobicContact CG-CG1 3.79Å; F172-Q177 HydrophobicContact CB-CG 4.33Å; F172-Q177 PolarHBondContact O-NE2 3.36Å; F172-I180 HydrophobicContact CD2-CD1 3.75Å; F172-I180 HydrophobicContact CE2-CD1 3.96Å
173	P	87	Confident	88	Confident	65 Å²	65	84.7 Å²	84.7	42%	0.422	40%	0.403	S	S	.	.			trans	-65	152.8	175.8	28.9	-35.5	0	0	0	110.9	F175 V176 Q177	P173-F175 VanDerWaalsContact C-N 3.27Å; P173-F175 HydrophobicContact CB-CD1 3.88Å; P173-F175 HydrophobicContact CB-CE1 3.65Å; P173-F175 HydrophobicContact CG-CD1 3.92Å; P173-F175 HydrophobicContact CG-CE1 3.34Å; P173-F175 HydrophobicContact CG-CZ 3.81Å; P173-F175 PolarHBondContact O-N 3.25Å; P173-F175 VanDerWaalsContact O-N 3.08Å; P173-V176 HydrophobicContact CG-CB 4.28Å; P173-V176 HydrophobicContact CG-CG2 3.85Å; P173-V176 WeakPolarHBondContact O-CA 3.37Å; P173-V176 WeakPolarHBondContact O-CB 3.31Å; P173-V176 PolarHBondContact O-N 3.08Å; P173-Q177 PolarHBondContact O-N 3.01Å
174	L	89.2	Confident	88.1	Confident	133 Å²	133	83.3 Å²	83.3	70%	0.696	40%	0.396	S	S	*	.	H	α-helix	trans	-50.8	-40.4	-171	-66.6	175.8	0	0	0	114.3	V176 Q177 E178	L174-V176 PolarHBondContact O-N 3.27Å; L174-Q177 WeakPolarHBondContact O-CB 3.39Å; L174-Q177 PolarHBondContact O-N 2.76Å; L174-Q177 VanDerWaalsContact O-N 3.13Å; L174-E178 WeakPolarHBondContact O-CB 3.47Å; L174-E178 PolarHBondContact O-N 2.83Å
175	F	84.2	Confident	88.2	Confident	134 Å²	134	85.8 Å²	85.8	59%	0.588	41%	0.405	S	S	*	.	H	α-helix	trans	-65.1	-23.8	178.7	75.8	-91.1	0	0	0	113.8	P173 K179	P173-F175 VanDerWaalsContact C-N 3.27Å; P173-F175 HydrophobicContact CB-CD1 3.88Å; P173-F175 HydrophobicContact CB-CE1 3.65Å; P173-F175 HydrophobicContact CG-CD1 3.92Å; P173-F175 HydrophobicContact CG-CE1 3.34Å; P173-F175 HydrophobicContact CG-CZ 3.81Å; P173-F175 PolarHBondContact O-N 3.25Å; P173-F175 VanDerWaalsContact O-N 3.08Å; F175-K179 WeakPolarHBondContact O-CB 3.29Å; F175-K179 PolarHBondContact O-N 2.98Å
176	V	83	Confident	88.1	Confident	35 Å²	35	84 Å²	84	21%	0.212	41%	0.406	C	S	.	.	H	α-helix	trans	-83	-37.9	172.9	174.8	0	0	0	0	110.4	F172 P173 L174 K179 I180	F172-V176 HydrophobicContact CB-CB 4.03Å; F172-V176 HydrophobicContact CB-CG1 3.81Å; F172-V176 HydrophobicContact CD1-CG1 4.31Å; F172-V176 HydrophobicContact CD2-CG1 3.93Å; F172-V176 HydrophobicContact CG-CG1 3.79Å; P173-V176 HydrophobicContact CG-CB 4.28Å; P173-V176 HydrophobicContact CG-CG2 3.85Å; P173-V176 WeakPolarHBondContact O-CA 3.37Å; P173-V176 WeakPolarHBondContact O-CB 3.31Å; P173-V176 PolarHBondContact O-N 3.08Å; L174-V176 PolarHBondContact O-N 3.27Å; V176-K179 PolarHBondContact O-N 3.36Å; V176-I180 HydrophobicContact CG1-CD1 3.87Å; V176-I180 HydrophobicContact CG1-CG1 4.48Å; V176-I180 WeakPolarHBondContact O-CB 3.23Å; V176-I180 VanDerWaalsContact O-CG1 3.28Å; V176-I180 WeakPolarHBondContact O-CG1 3.34Å; V176-I180 PolarHBondContact O-N 3Å
177	Q	85.8	Confident	88	Confident	30 Å²	30	88.2 Å²	88.2	14%	0.14	42%	0.418	C	S	.	.	H	α-helix	trans	-60.6	-46	173	-58.5	-177.5	21	0	0	111.1	L164 A167 F172 P173 L174 I180 V181	L164-Q177 HydrophobicContact CD1-CB 3.97Å; A167-Q177 HydrophobicContact CB-CB 4.45Å; A167-Q177 HydrophobicContact CB-CG 4.08Å; F172-Q177 HydrophobicContact CB-CG 4.33Å; F172-Q177 PolarHBondContact O-NE2 3.36Å; P173-Q177 PolarHBondContact O-N 3.01Å; L174-Q177 WeakPolarHBondContact O-CB 3.39Å; L174-Q177 PolarHBondContact O-N 2.76Å; L174-Q177 VanDerWaalsContact O-N 3.13Å; Q177-I180 PolarHBondContact O-N 3.44Å; Q177-V181 WeakPolarHBondContact O-CG2 3.36Å; Q177-V181 PolarHBondContact O-N 3.41Å
178	E	86.9	Confident	88	Confident	124 Å²	124	88.5 Å²	88.5	58%	0.579	42%	0.42	S	S	*	.	H	α-helix	trans	-60.4	-45.7	175	-177.9	179.4	-167.9	0	0	111.6	L174 I180 V181 I182	L174-E178 WeakPolarHBondContact O-CB 3.47Å; L174-E178 PolarHBondContact O-N 2.83Å; E178-I180 VanDerWaalsContact C-N 3.35Å; E178-I180 PolarHBondContact O-N 3.08Å; E178-V181 PolarHBondContact O-N 2.81Å; E178-I182 HydrophobicContact CG-CD1 3.94Å; E178-I182 WeakPolarHBondContact O-CG1 3.47Å; E178-I182 PolarHBondContact O-N 3.46Å
179	K	83.4	Confident	87.9	Confident	117 Å²	117	86.9 Å²	86.9	51%	0.509	42%	0.416	S	S	.	.	H	α-helix	trans	-56.8	-47.9	175	-177.8	-174	167.8	-169.4	0	111.6	F175 V176 V181 I182 E183	F175-K179 WeakPolarHBondContact O-CB 3.29Å; F175-K179 PolarHBondContact O-N 2.98Å; V176-K179 PolarHBondContact O-N 3.36Å; K179-V181 PolarHBondContact O-N 3.5Å; K179-I182 PolarHBondContact O-N 3.45Å; K179-E183 WeakPolarHBondContact CE-OE1 3.4Å; K179-E183 WeakPolarHBondContact CE-OE2 3.29Å; K179-E183 HydrophobicContact CG-CG 4.46Å; K179-E183 IonicContact NZ-OE1 3.91Å; K179-E183 PolarHBondContact NZ-OE1 2.92Å; K179-E183 VanDerWaalsContact NZ-OE1 3.17Å; K179-E183 IonicContact NZ-OE2 3.18Å; K179-E183 WeakPolarHBondContact O-CG 3.3Å; K179-E183 PolarHBondContact O-N 3.49Å
180	I	83.5	Confident	87.3	Confident	32 Å²	32	81.9 Å²	81.9	16%	0.164	40%	0.401	C	S	.	.	H	α-helix	trans	-60.7	-44	179.7	-73.8	166.5	0	0	0	111	Q163 A167 F172 V176 Q177 E178 I182 E183 E184	Q163-I180 HydrophobicContact CB-CG2 3.69Å; A167-I180 HydrophobicContact CB-CD1 3.69Å; A167-I180 HydrophobicContact CB-CG2 4.43Å; F172-I180 HydrophobicContact CD2-CD1 3.75Å; F172-I180 HydrophobicContact CE2-CD1 3.96Å; V176-I180 HydrophobicContact CG1-CD1 3.87Å; V176-I180 HydrophobicContact CG1-CG1 4.48Å; V176-I180 WeakPolarHBondContact O-CB 3.23Å; V176-I180 VanDerWaalsContact O-CG1 3.28Å; V176-I180 WeakPolarHBondContact O-CG1 3.34Å; V176-I180 PolarHBondContact O-N 3Å; Q177-I180 PolarHBondContact O-N 3.44Å; E178-I180 VanDerWaalsContact C-N 3.35Å; E178-I180 PolarHBondContact O-N 3.08Å; I180-I182 PolarHBondContact O-N 3.47Å; I180-E183 PolarHBondContact O-N 3.08Å; I180-E184 PolarHBondContact O-N 2.83Å
181	V	88.8	Confident	86.7	Confident	39 Å²	39	82.7 Å²	82.7	24%	0.236	41%	0.407	C	S	.	.	H	α-helix	trans	-60.5	-42.8	175.7	163.9	0	0	0	0	112	I160 L164 Q177 E178 K179 F185	I160-V181 HydrophobicContact CG2-CB 4.42Å; I160-V181 HydrophobicContact CG2-CG1 3.86Å; I160-V181 HydrophobicContact CG2-CG2 4.23Å; L164-V181 HydrophobicContact CB-CG2 3.91Å; L164-V181 HydrophobicContact CD1-CG2 3.96Å; L164-V181 HydrophobicContact CD2-CG2 4.28Å; L164-V181 HydrophobicContact CG-CG2 4.26Å; Q177-V181 WeakPolarHBondContact O-CG2 3.36Å; Q177-V181 PolarHBondContact O-N 3.41Å; E178-V181 PolarHBondContact O-N 2.81Å; K179-V181 PolarHBondContact O-N 3.5Å; V181-F185 WeakPolarHBondContact O-CB 3.48Å; V181-F185 PolarHBondContact O-N 3.35Å
182	I	88	Confident	86.4	Confident	103 Å²	103	77.2 Å²	77.2	53%	0.528	38%	0.377	S	S	.	.	H	α-helix	trans	-68.6	-40.8	178.7	-67.2	167	0	0	0	111.3	E178 K179 I180 G186	E178-I182 HydrophobicContact CG-CD1 3.94Å; E178-I182 WeakPolarHBondContact O-CG1 3.47Å; E178-I182 PolarHBondContact O-N 3.46Å; K179-I182 PolarHBondContact O-N 3.45Å; I180-I182 PolarHBondContact O-N 3.47Å; I182-G186 PolarHBondContact O-N 3.13Å
183	E	83.3	Confident	85.9	Confident	98 Å²	98	77.6 Å²	77.6	46%	0.458	38%	0.382	S	S	.	.	H	α-helix	trans	-63.9	-41.7	176.5	-75.2	179.5	155.4	0	0	111.6	K179 I180 G186 R187	K179-E183 WeakPolarHBondContact CE-OE1 3.4Å; K179-E183 WeakPolarHBondContact CE-OE2 3.29Å; K179-E183 HydrophobicContact CG-CG 4.46Å; K179-E183 IonicContact NZ-OE1 3.91Å; K179-E183 PolarHBondContact NZ-OE1 2.92Å; K179-E183 VanDerWaalsContact NZ-OE1 3.17Å; K179-E183 IonicContact NZ-OE2 3.18Å; K179-E183 WeakPolarHBondContact O-CG 3.3Å; K179-E183 PolarHBondContact O-N 3.49Å; I180-E183 PolarHBondContact O-N 3.08Å; E183-G186 PolarHBondContact O-N 3.44Å; E183-R187 WeakPolarHBondContact O-CG 3.38Å; E183-R187 PolarHBondContact O-N 3.19Å
184	E	93.1	Very high	85.3	Confident	31 Å²	31	79.1 Å²	79.1	15%	0.145	38%	0.384	C	S	.	.	H	α-helix	trans	-70.6	-40.3	177.8	-165.4	67.3	179.7	0	0	112.7	C159 I160 Q163 I180 G186 R187 C188	C159-E184 HydrophobicContact CB-CG 4.17Å; I160-E184 HydrophobicContact CG1-CB 4.26Å; I160-E184 HydrophobicContact CG1-CG 4.12Å; Q163-E184 HydrophobicContact CB-CB 4.38Å; Q163-E184 HydrophobicContact CB-CG 4.36Å; Q163-E184 HydrophobicContact CG-CB 3.99Å; Q163-E184 HydrophobicContact CG-CG 3.61Å; I180-E184 PolarHBondContact O-N 2.83Å; E184-G186 VanDerWaalsContact C-N 3.28Å; E184-G186 PolarHBondContact O-N 2.88Å; E184-R187 WeakPolarHBondContact O-CB 3.5Å; E184-R187 PolarHBondContact O-N 3.45Å; E184-R187 VanDerWaalsContact OE2-CD 3.31Å; E184-R187 WeakPolarHBondContact OE2-CD 3.33Å; E184-C188 PolarHBondContact O-N 3Å; E184-C188 PolarHBondContact O-SG 3.5Å
185	F	92.7	Very high	84.4	Confident	89 Å²	89	75 Å²	75	39%	0.39	37%	0.366	S	S	.	.	H	α-helix	trans	-59.1	-41.2	171.9	177.1	-107.2	0	0	0	111.5	I160 V181 C188 L189 L453	I160-F185 HydrophobicContact CD1-CB 3.97Å; I160-F185 HydrophobicContact CD1-CD2 3.91Å; I160-F185 HydrophobicContact CD1-CG 4.45Å; I160-F185 HydrophobicContact CG1-CB 4.45Å; V181-F185 WeakPolarHBondContact O-CB 3.48Å; V181-F185 PolarHBondContact O-N 3.35Å; F185-C188 PolarHBondContact O-N 2.93Å; F185-L189 HydrophobicContact CD1-CD1 4.07Å; F185-L189 HydrophobicContact CE1-CD1 3.5Å; F185-L189 VanDerWaalsContact CE1-CD1 3.5Å; F185-L189 HydrophobicContact CE1-CG 4.27Å; F185-L189 HydrophobicContact CE2-CD1 4.38Å; F185-L189 HydrophobicContact CE2-CG 4.35Å; F185-L189 HydrophobicContact CZ-CD1 3.68Å; F185-L189 HydrophobicContact CZ-CD2 4.38Å; F185-L189 HydrophobicContact CZ-CG 4.13Å; F185-L189 WeakPolarHBondContact O-CG 3.28Å; F185-L189 PolarHBondContact O-N 3.24Å; F185-L453 HydrophobicContact CE2-CD2 4.31Å
186	G	87.2	Confident	83.6	Confident	28 Å²	28	69 Å²	69	29%	0.289	34%	0.34	S	S	.	.	H	α-helix	trans	-60	-44.8	172.9	0	0	0	0	0	113.1	I182 E183 E184 L189 I190	I182-G186 PolarHBondContact O-N 3.13Å; E183-G186 PolarHBondContact O-N 3.44Å; E184-G186 VanDerWaalsContact C-N 3.28Å; E184-G186 PolarHBondContact O-N 2.88Å; G186-L189 PolarHBondContact O-N 2.79Å; G186-I190 WeakPolarHBondContact O-CG1 3.42Å; G186-I190 PolarHBondContact O-N 3.48Å
187	R	86.9	Confident	82.7	Confident	171 Å²	171	70.3 Å²	70.3	65%	0.645	35%	0.348	S	S	*	.	H	α-helix	trans	-60.4	-48.1	175	-73.5	170.6	176.4	-86.7	-1	112.1	E183 E184 L189 I190 Q191	E183-R187 WeakPolarHBondContact O-CG 3.38Å; E183-R187 PolarHBondContact O-N 3.19Å; E184-R187 WeakPolarHBondContact O-CB 3.5Å; E184-R187 PolarHBondContact O-N 3.45Å; E184-R187 VanDerWaalsContact OE2-CD 3.31Å; E184-R187 WeakPolarHBondContact OE2-CD 3.33Å; R187-L189 VanDerWaalsContact C-N 3.32Å; R187-L189 PolarHBondContact O-N 2.84Å; R187-I190 PolarHBondContact O-N 2.85Å; R187-Q191 PolarHBondContact O-N 3.5Å
188	C	89.8	Confident	81.4	Confident	8 Å²	8	70.8 Å²	70.8	5%	0.054	36%	0.361	C	S	.	.	H	α-helix	trans	-58.2	-44.3	177.9	-65.3	0	0	0	0	111.5	A156 E184 F185 Q191 I192	A156-C188 HydrophobicContact CB-CB 3.96Å; E184-C188 PolarHBondContact O-N 3Å; E184-C188 PolarHBondContact O-SG 3.5Å; F185-C188 PolarHBondContact O-N 2.93Å; C188-Q191 PolarHBondContact O-N 3.35Å; C188-I192 WeakPolarHBondContact O-CB 3.24Å; C188-I192 WeakPolarHBondContact O-CD1 3.29Å; C188-I192 VanDerWaalsContact O-CG1 3.23Å; C188-I192 WeakPolarHBondContact O-CG1 3.25Å; C188-I192 PolarHBondContact O-N 2.9Å
189	L	88.1	Confident	79.7	Confident	65 Å²	65	69 Å²	69	34%	0.34	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-41.5	176.6	-73.4	-179.2	0	0	0	112.7	F185 G186 R187 I192 L193	F185-L189 HydrophobicContact CD1-CD1 4.07Å; F185-L189 HydrophobicContact CE1-CD1 3.5Å; F185-L189 VanDerWaalsContact CE1-CD1 3.5Å; F185-L189 HydrophobicContact CE1-CG 4.27Å; F185-L189 HydrophobicContact CE2-CD1 4.38Å; F185-L189 HydrophobicContact CE2-CG 4.35Å; F185-L189 HydrophobicContact CZ-CD1 3.68Å; F185-L189 HydrophobicContact CZ-CD2 4.38Å; F185-L189 HydrophobicContact CZ-CG 4.13Å; F185-L189 WeakPolarHBondContact O-CG 3.28Å; F185-L189 PolarHBondContact O-N 3.24Å; G186-L189 PolarHBondContact O-N 2.79Å; R187-L189 VanDerWaalsContact C-N 3.32Å; R187-L189 PolarHBondContact O-N 2.84Å; L189-I192 PolarHBondContact O-N 3.48Å; L189-L193 WeakPolarHBondContact O-CB 3.32Å; L189-L193 VanDerWaalsContact O-CG 3.23Å; L189-L193 WeakPolarHBondContact O-CG 3.42Å; L189-L193 PolarHBondContact O-N 2.99Å
190	I	79.5	Confident	77.7	Confident	91 Å²	91	65.9 Å²	65.9	47%	0.467	34%	0.342	S	S	.	.	H	α-helix	trans	-62.3	-48.6	176.8	-69.7	164.9	0	0	0	110.1	G186 R187 I192 L193 E194	G186-I190 WeakPolarHBondContact O-CG1 3.42Å; G186-I190 PolarHBondContact O-N 3.48Å; R187-I190 PolarHBondContact O-N 2.85Å; I190-I192 VanDerWaalsContact C-N 3.33Å; I190-I192 PolarHBondContact O-N 2.73Å; I190-L193 CarbonylContact O-C 3.36Å; I190-L193 PolarHBondContact O-N 3.08Å; I190-L193 VanDerWaalsContact O-N 3.09Å; I190-E194 HydrophobicContact CG2-CG 4.22Å; I190-E194 WeakPolarHBondContact CG2-OE1 3.4Å; I190-E194 WeakPolarHBondContact O-CB 3.48Å; I190-E194 WeakPolarHBondContact O-CG 2.81Å; I190-E194 PolarHBondContact O-N 3.43Å
191	Q	80.2	Confident	75.7	Confident	125 Å²	125	70.3 Å²	70.3	58%	0.584	37%	0.365	S	S	*	.	H	α-helix	trans	-62.2	-38.4	179.8	-170.7	178	9.2	0	0	112.8	R187 C188 S195	R187-Q191 PolarHBondContact O-N 3.5Å; C188-Q191 PolarHBondContact O-N 3.35Å; Q191-S195 WeakPolarHBondContact O-CB 3.27Å; Q191-S195 PolarHBondContact O-N 3.27Å; Q191-S195 PolarHBondContact O-OG 2.94Å
192	I	84.6	Confident	73.4	Confident	26 Å²	26	72.2 Å²	72.2	13%	0.133	39%	0.385	C	S	.	.	H	α-helix	trans	-62.7	-48.5	172.3	-69.3	165.5	0	0	0	109.8	F148 V152 C188 L189 I190 S195 L196	F148-I192 HydrophobicContact CE1-CD1 4.08Å; F148-I192 HydrophobicContact CE1-CG2 4.14Å; F148-I192 HydrophobicContact CZ-CG2 4.39Å; V152-I192 HydrophobicContact CG1-CD1 3.8Å; V152-I192 HydrophobicContact CG1-CG1 3.91Å; C188-I192 WeakPolarHBondContact O-CB 3.24Å; C188-I192 WeakPolarHBondContact O-CD1 3.29Å; C188-I192 VanDerWaalsContact O-CG1 3.23Å; C188-I192 WeakPolarHBondContact O-CG1 3.25Å; C188-I192 PolarHBondContact O-N 2.9Å; L189-I192 PolarHBondContact O-N 3.48Å; I190-I192 VanDerWaalsContact C-N 3.33Å; I190-I192 PolarHBondContact O-N 2.73Å; I192-S195 WeakPolarHBondContact O-CB 3.47Å; I192-S195 PolarHBondContact O-N 3.19Å; I192-L196 WeakPolarHBondContact O-CG 3.37Å; I192-L196 PolarHBondContact O-N 3.21Å
193	L	79.4	Confident	71.3	Confident	85 Å²	85	73 Å²	73	45%	0.445	39%	0.39	S	S	.	.	H	α-helix	trans	-62.8	-42.2	179	-71.2	170.5	0	0	0	112.6	L143 L189 I190 S195 L196 T197	L143-L193 HydrophobicContact CD1-CD2 4.25Å; L189-L193 WeakPolarHBondContact O-CB 3.32Å; L189-L193 VanDerWaalsContact O-CG 3.23Å; L189-L193 WeakPolarHBondContact O-CG 3.42Å; L189-L193 PolarHBondContact O-N 2.99Å; I190-L193 CarbonylContact O-C 3.36Å; I190-L193 PolarHBondContact O-N 3.08Å; I190-L193 VanDerWaalsContact O-N 3.09Å; L193-S195 VanDerWaalsContact C-N 3.32Å; L193-S195 PolarHBondContact O-N 2.78Å; L193-L196 HydrophobicContact CD2-CD1 3.87Å; L193-L196 VanDerWaalsContact O-CB 3.29Å; L193-L196 WeakPolarHBondContact O-CB 3.27Å; L193-L196 PolarHBondContact O-N 3.24Å; L193-L196 VanDerWaalsContact O-N 3.12Å; L193-T197 PolarHBondContact O-N 3.1Å
194	E	72.7	Confident	69	Low	97 Å²	97	73.9 Å²	73.9	45%	0.453	40%	0.398	S	S	.	.	H	α-helix	trans	-60.4	-44.1	175.6	-75.5	174.6	170.8	0	0	110.7	I190 L196 T197 G198	I190-E194 HydrophobicContact CG2-CG 4.22Å; I190-E194 WeakPolarHBondContact CG2-OE1 3.4Å; I190-E194 WeakPolarHBondContact O-CB 3.48Å; I190-E194 WeakPolarHBondContact O-CG 2.81Å; I190-E194 PolarHBondContact O-N 3.43Å; E194-L196 VanDerWaalsContact C-N 3.29Å; E194-L196 PolarHBondContact O-N 3.15Å; E194-T197 WeakPolarHBondContact CA-OG1 3.37Å; E194-T197 PolarHBondContact O-N 3.47Å; E194-T197 PolarHBondContact O-OG1 2.8Å; E194-G198 PolarHBondContact O-N 3.05Å
195	S	72	Confident	66.2	Low	46 Å²	46	80.7 Å²	80.7	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-58.2	-39.3	173.6	-57.6	0	0	0	0	112	Q191 I192 L193 L199	Q191-S195 WeakPolarHBondContact O-CB 3.27Å; Q191-S195 PolarHBondContact O-N 3.27Å; Q191-S195 PolarHBondContact O-OG 2.94Å; I192-S195 WeakPolarHBondContact O-CB 3.47Å; I192-S195 PolarHBondContact O-N 3.19Å; L193-S195 VanDerWaalsContact C-N 3.32Å; L193-S195 PolarHBondContact O-N 2.78Å; S195-L199 WeakPolarHBondContact O-CB 3.35Å; S195-L199 WeakPolarHBondContact O-CD1 3.33Å; S195-L199 VanDerWaalsContact O-CG 3.29Å; S195-L199 WeakPolarHBondContact O-CG 3.47Å; S195-L199 PolarHBondContact O-N 3.01Å
196	L	67	Low	63.3	Low	10 Å²	10	80.4 Å²	80.4	5%	0.052	44%	0.443	C	S	.	.	H	α-helix	trans	-62.7	-43.4	171.2	-54.9	172.6	0	0	0	112.1	L143 F147 I192 L193 E194 L199 Q200	L143-L196 HydrophobicContact CD1-CD1 4.41Å; L143-L196 HydrophobicContact CD2-CD1 3.39Å; L143-L196 HydrophobicContact CD2-CD2 4.04Å; L143-L196 HydrophobicContact CD2-CG 4.26Å; L143-L196 HydrophobicContact CG-CD1 3.67Å; F147-L196 HydrophobicContact CB-CD2 3.66Å; F147-L196 HydrophobicContact CD1-CD2 3.56Å; F147-L196 HydrophobicContact CD2-CD2 3.37Å; F147-L196 HydrophobicContact CE1-CD2 3.97Å; F147-L196 HydrophobicContact CE2-CD2 3.8Å; F147-L196 HydrophobicContact CG-CD2 3.23Å; F147-L196 HydrophobicContact CZ-CD2 4.08Å; I192-L196 WeakPolarHBondContact O-CG 3.37Å; I192-L196 PolarHBondContact O-N 3.21Å; L193-L196 HydrophobicContact CD2-CD1 3.87Å; L193-L196 VanDerWaalsContact O-CB 3.29Å; L193-L196 WeakPolarHBondContact O-CB 3.27Å; L193-L196 PolarHBondContact O-N 3.24Å; L193-L196 VanDerWaalsContact O-N 3.12Å; E194-L196 VanDerWaalsContact C-N 3.29Å; E194-L196 PolarHBondContact O-N 3.15Å; L196-L199 CarbonylContact O-C 3.58Å; L196-L199 PolarHBondContact O-N 3.32Å; L196-Q200 VanDerWaalsContact O-CB 3.31Å; L196-Q200 WeakPolarHBondContact O-CB 3.43Å; L196-Q200 WeakPolarHBondContact O-CG 3.23Å; L196-Q200 PolarHBondContact O-N 3.34Å
197	T	63.5	Low	60.7	Low	62 Å²	62	86.7 Å²	86.7	38%	0.38	47%	0.47	S	S	.	.	H	α-helix	trans	-67.5	-40.8	-178.2	61.8	0	0	0	0	111.4	L193 E194 L199 Q200 I201	L193-T197 PolarHBondContact O-N 3.1Å; E194-T197 WeakPolarHBondContact CA-OG1 3.37Å; E194-T197 PolarHBondContact O-N 3.47Å; E194-T197 PolarHBondContact O-OG1 2.8Å; T197-L199 PolarHBondContact O-N 2.91Å; T197-Q200 PolarHBondContact O-N 2.73Å; T197-I201 WeakPolarHBondContact O-CB 3.5Å; T197-I201 WeakPolarHBondContact O-CD1 3.18Å; T197-I201 WeakPolarHBondContact O-CG1 3.29Å; T197-I201 PolarHBondContact O-N 3.29Å
198	G	59	Low	58.3	Low	39 Å²	39	82.7 Å²	82.7	40%	0.402	46%	0.462	S	S	.	.	H	α-helix	trans	-59.5	-45.8	171.5	0	0	0	0	0	112.2	E194 Q200 I201 A202	E194-G198 PolarHBondContact O-N 3.05Å; G198-Q200 VanDerWaalsContact C-N 3.33Å; G198-Q200 PolarHBondContact O-N 2.78Å; G198-I201 PolarHBondContact O-N 2.94Å; G198-A202 WeakPolarHBondContact O-CB 3.46Å; G198-A202 PolarHBondContact O-N 2.8Å
199	L	51.8	Low	55.8	Low	86 Å²	86	87.9 Å²	87.9	45%	0.45	50%	0.496	S	S	.	.	H	α-helix	trans	-66.3	-30.5	175	-74	163.6	0	0	0	112.9	F147 S195 L196 T197 N203	F147-L199 HydrophobicContact CD1-CD1 4.45Å; F147-L199 HydrophobicContact CE1-CD1 3.94Å; S195-L199 WeakPolarHBondContact O-CB 3.35Å; S195-L199 WeakPolarHBondContact O-CD1 3.33Å; S195-L199 VanDerWaalsContact O-CG 3.29Å; S195-L199 WeakPolarHBondContact O-CG 3.47Å; S195-L199 PolarHBondContact O-N 3.01Å; L196-L199 CarbonylContact O-C 3.58Å; L196-L199 PolarHBondContact O-N 3.32Å; T197-L199 PolarHBondContact O-N 2.91Å; L199-N203 WeakPolarHBondContact O-CB 3.4Å; L199-N203 PolarHBondContact O-N 2.93Å; L199-N203 PolarHBondContact O-ND2 3.08Å
200	Q	41.2	Very low	53.4	Low	53 Å²	53	89.3 Å²	89.3	25%	0.248	50%	0.503	C	S	.	.	H	α-helix	trans	-75.8	-38.5	175.3	-76.6	169.7	11.6	0	0	112.3	I142 L196 T197 G198 A202 N203 N204	I142-Q200 VanDerWaalsContact CG2-NE2 3.26Å; L196-Q200 VanDerWaalsContact O-CB 3.31Å; L196-Q200 WeakPolarHBondContact O-CB 3.43Å; L196-Q200 WeakPolarHBondContact O-CG 3.23Å; L196-Q200 PolarHBondContact O-N 3.34Å; T197-Q200 PolarHBondContact O-N 2.73Å; G198-Q200 VanDerWaalsContact C-N 3.33Å; G198-Q200 PolarHBondContact O-N 2.78Å; Q200-A202 VanDerWaalsContact C-N 3.32Å; Q200-N203 PolarHBondContact O-N 3.14Å; Q200-N203 VanDerWaalsContact O-N 3.17Å; Q200-N204 PolarHBondContact O-N 2.93Å
201	I	41.2	Very low	51.3	Low	124 Å²	124	89.5 Å²	89.5	64%	0.636	51%	0.513	S	S	*	.	H	α-helix	trans	-63.5	-40.5	173.9	-69.4	161.8	0	0	0	110.1	T197 G198 N203	T197-I201 WeakPolarHBondContact O-CB 3.5Å; T197-I201 WeakPolarHBondContact O-CD1 3.18Å; T197-I201 WeakPolarHBondContact O-CG1 3.29Å; T197-I201 PolarHBondContact O-N 3.29Å; G198-I201 PolarHBondContact O-N 2.94Å; I201-N203 VanDerWaalsContact C-N 3.28Å; I201-N203 PolarHBondContact O-N 3.39Å
202	A	40.9	Very low	49.2	Very low	80 Å²	80	90.2 Å²	90.2	66%	0.661	52%	0.516	S	S	*	.	H	α-helix	trans	-66.2	-25.4	173.8	0	0	0	0	0	114	G198 Q200	G198-A202 WeakPolarHBondContact O-CB 3.46Å; G198-A202 PolarHBondContact O-N 2.8Å; Q200-A202 VanDerWaalsContact C-N 3.32Å
203	N	43.9	Very low	47	Very low	120 Å²	120	94.8 Å²	94.8	64%	0.642	54%	0.539	S	S	*	.	H	α-helix	trans	-107.8	-10.4	-173.8	-77.8	-69.4	0	0	0	115.5	L199 Q200 I201	L199-N203 WeakPolarHBondContact O-CB 3.4Å; L199-N203 PolarHBondContact O-N 2.93Å; L199-N203 PolarHBondContact O-ND2 3.08Å; Q200-N203 PolarHBondContact O-N 3.14Å; Q200-N203 VanDerWaalsContact O-N 3.17Å; I201-N203 VanDerWaalsContact C-N 3.28Å; I201-N203 PolarHBondContact O-N 3.39Å
204	N	34.9	Very low	44.9	Very low	115 Å²	115	99.1 Å²	99.1	62%	0.615	55%	0.551	S	S	*	*			trans	-141.2	86.8	-177.5	-71.5	-82.1	0	0	0	113.9	Q200 S206	Q200-N204 PolarHBondContact O-N 2.93Å; N204-S206 PolarHBondContact O-N 3.11Å
205	L	33.9	Very low	43.2	Very low	175 Å²	175	103.1 Å²	103.1	92%	0.916	57%	0.567	S	S	*	*			trans	-72.7	72.7	154.2	-92.5	79.5	0	0	0	110.5
206	S	32	Very low	41.3	Very low	82 Å²	82	108.6 Å²	108.6	57%	0.573	59%	0.587	S	S	*	*	S	Bend	trans	-175	131.7	136.3	64.5	0	0	0	0	111.2	N204	N204-S206 PolarHBondContact O-N 3.11Å
207	N	33.2	Very low	39.5	Very low	160 Å²	160	116 Å²	116	86%	0.856	62%	0.621	S	S	*	*			trans	64.1	83.2	161.6	-44.8	-44.8	0	0	0	117.5
208	N	35.9	Very low	38	Very low	87 Å²	87	121.9 Å²	121.9	47%	0.465	64%	0.638	S	S	.	*			trans	-130.1	118.4	159.6	-165.4	-10	0	0	0	110.8	L210	N208-L210 PolarHBondContact O-N 2.88Å; N208-L210 VanDerWaalsContact O-N 3.14Å
209	P	36.8	Very low	36.6	Very low	118 Å²	118	125.2 Å²	125.2	77%	0.766	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-71.6	2.8	-177	-19.4	33	0	0	0	116.6	S211	P209-S211 VanDerWaalsContact C-N 3.33Å; P209-S211 PolarHBondContact O-N 3.06Å
210	L	37.4	Very low	35.9	Very low	94 Å²	94	125.3 Å²	125.3	49%	0.492	65%	0.652	S	S	.	*	G	3₁₀ helix	trans	-82.4	-1.8	-172.8	-72.7	169.2	0	0	0	115	N208 E212 I213	N208-L210 PolarHBondContact O-N 2.88Å; N208-L210 VanDerWaalsContact O-N 3.14Å; L210-E212 VanDerWaalsContact C-N 3.26Å; L210-E212 PolarHBondContact O-N 3.4Å; L210-I213 HydrophobicContact CD2-CD1 4.07Å
211	S	36.5	Very low	35.4	Very low	96 Å²	96	129.4 Å²	129.4	67%	0.671	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-70.9	-10.7	-177	53	0	0	0	0	115.6	P209	P209-S211 VanDerWaalsContact C-N 3.33Å; P209-S211 PolarHBondContact O-N 3.06Å
212	E	36.7	Very low	35	Very low	139 Å²	139	131.5 Å²	131.5	65%	0.65	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-90.5	-10.8	-177.9	-66.9	-172.9	147.6	0	0	114.1	L210	L210-E212 VanDerWaalsContact C-N 3.26Å; L210-E212 PolarHBondContact O-N 3.4Å
213	I	37.1	Very low	34.4	Very low	122 Å²	122	134.7 Å²	134.7	63%	0.626	69%	0.692	S	S	*	*	S	Bend	trans	-88.3	-25.8	-173.7	-61.2	176.8	0	0	0	112.6	L210	L210-I213 HydrophobicContact CD2-CD1 4.07Å
214	Y	36.2	Very low	33.6	Very low	177 Å²	177	134.9 Å²	134.9	69%	0.694	70%	0.697	S	S	*	*			trans	-105.8	35.9	-167.9	-76.9	-89.2	0	0	0	114.7
215	K	35.4	Very low	33.3	Very low	181 Å²	181	136.6 Å²	136.6	79%	0.787	71%	0.706	S	S	*	*			trans	-86.8	-3.7	179.1	-91.6	-174.8	176.7	176.9	0	115.7
216	H	33.4	Very low	32.9	Very low	160 Å²	160	135.1 Å²	135.1	74%	0.741	70%	0.698	S	S	*	*	S	Bend	trans	-109.6	109.6	176.2	-86.6	-86.4	0	0	0	111.8
217	E	29.7	Very low	32.8	Very low	165 Å²	165	136.9 Å²	136.9	77%	0.771	71%	0.71	S	S	*	*			trans	45	101.4	143.6	-62.9	164.1	123.5	0	0	117.9
218	Y	30.3	Very low	32.5	Very low	187 Å²	187	134.4 Å²	134.4	73%	0.733	70%	0.704	S	S	*	*			trans	-158.1	162	133.8	-131.3	-103.5	0	0	0	113.3	Y260	Y218-Y260 VanDerWaalsContact OH-CE2 3.28Å; Y218-Y260 WeakPolarHBondContact OH-CE2 3.2Å; Y218-Y260 VanDerWaalsContact OH-CZ 3.3Å; Y218-Y260 PolarHBondContact OH-OH 3.34Å
219	N	30.9	Very low	32	Very low	108 Å²	108	137.1 Å²	137.1	58%	0.578	72%	0.724	S	S	*	*			trans	-81	129.1	-159.5	-172.7	-0.8	0	0	0	114.4	D221	N219-D221 PolarHBondContact O-N 3.27Å
220	P	35.5	Very low	31.7	Very low	88 Å²	88	139.5 Å²	139.5	57%	0.571	73%	0.725	S	S	*	*			trans	-75.5	-2.4	-174.9	30.2	-39	0	0	0	117.7	L222 I223	P220-L222 PolarHBondContact O-N 3.09Å; P220-I223 WeakPolarHBondContact O-CG1 3.31Å
221	D	32.6	Very low	31.2	Very low	139 Å²	139	140.9 Å²	140.9	74%	0.743	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	13.5	-168.2	-69.3	-23.6	0	0	0	116.6	N219	N219-D221 PolarHBondContact O-N 3.27Å
222	L	32	Very low	30.8	Very low	168 Å²	168	145 Å²	145	88%	0.88	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	20.8	177.6	-89.5	164.3	0	0	0	114.2	P220 T224	P220-L222 PolarHBondContact O-N 3.09Å; L222-T224 PolarHBondContact O-N 2.88Å; L222-T224 VanDerWaalsContact O-N 3.09Å
223	I	27.5	Very low	30.2	Very low	148 Å²	148	142 Å²	142	76%	0.759	76%	0.757	S	S	*	*			trans	-79.5	87.2	174.8	-57.9	167.8	0	0	0	110.1	P220	P220-I223 WeakPolarHBondContact O-CG1 3.31Å
224	T	28.6	Very low	29.7	Very low	123 Å²	123	145.1 Å²	145.1	76%	0.755	77%	0.767	S	S	*	*			trans	-150.5	143.8	158.5	-45.2	0	0	0	0	110.6	L222	L222-T224 PolarHBondContact O-N 2.88Å; L222-T224 VanDerWaalsContact O-N 3.09Å
225	L	26.9	Very low	29.1	Very low	152 Å²	152	144.2 Å²	144.2	80%	0.796	77%	0.769	S	S	*	*			trans	74.2	83.8	176.9	-49.8	-178.1	0	0	0	117.1
226	L	27.1	Very low	28.5	Very low	144 Å²	144	141.3 Å²	141.3	75%	0.754	77%	0.766	S	S	*	*			trans	-162.7	59.5	136	-106	168.6	0	0	0	109.8
227	S	29	Very low	28.1	Very low	119 Å²	119	141.7 Å²	141.7	83%	0.832	77%	0.771	S	S	*	*			trans	-87	110.4	-178	-60.7	0	0	0	0	111.8
228	C	26.3	Very low	28	Very low	108 Å²	108	140.3 Å²	140.3	73%	0.73	77%	0.768	S	S	*	*			trans	1	117.3	165.1	-76	0	0	0	0	119.4	Q230	C228-Q230 HydrophobicContact CB-CG 4.41Å; C228-Q230 PolarHBondContact O-N 2.78Å
229	T	26.8	Very low	27.8	Very low	144 Å²	144	136.8 Å²	136.8	88%	0.883	77%	0.767	S	S	*	*			trans	-85.3	86.2	149.7	42.8	0	0	0	0	110.4	S231	T229-S231 PolarHBondContact O-N 3.24Å
230	Q	30.1	Very low	27.7	Very low	168 Å²	168	138.3 Å²	138.3	79%	0.785	78%	0.775	S	S	*	*			trans	-77.8	106.3	165.2	-77.3	-176.7	-0.9	0	0	109.7	C228 E232	C228-Q230 HydrophobicContact CB-CG 4.41Å; C228-Q230 PolarHBondContact O-N 2.78Å; Q230-E232 PolarHBondContact O-N 3.49Å
231	S	26.1	Very low	27.3	Very low	122 Å²	122	142.5 Å²	142.5	85%	0.853	79%	0.786	S	S	*	*			trans	-87.2	79.8	172.8	65.2	0	0	0	0	111.2	T229	T229-S231 PolarHBondContact O-N 3.24Å
232	E	29.1	Very low	27	Very low	183 Å²	183	140.5 Å²	140.5	86%	0.855	78%	0.783	S	S	*	*			trans	-112	108.8	161.8	-68.6	-159.4	166.3	0	0	109.5	Q230	Q230-E232 PolarHBondContact O-N 3.49Å
233	G	23	Very low	26.7	Very low	75 Å²	75	140.8 Å²	140.8	77%	0.773	78%	0.78	S	S	*	*			trans	-85.3	113.4	-179.8	0	0	0	0	0	111.7
234	F	26.8	Very low	26.6	Very low	188 Å²	188	143.1 Å²	143.1	83%	0.825	79%	0.785	S	S	*	*			trans	-142.1	108.5	160.9	-106.7	-80.1	0	0	0	112.8
235	Q	25.1	Very low	26.4	Very low	159 Å²	159	145.7 Å²	145.7	74%	0.743	79%	0.788	S	S	*	*			trans	22.8	108	146	-64.9	172.9	-4	0	0	120.3
236	T	22.6	Very low	26.5	Very low	120 Å²	120	145.6 Å²	145.6	74%	0.736	79%	0.787	S	S	*	*				44.4	115	127.9	64	0	0	0	0	120.4
237	M	24.6	Very low	26.4	Very low	168 Å²	168	143 Å²	143	83%	0.828	78%	0.781	S	S	*	*				172.7	148.3	101	-91.2	-175.3	175.2	0	0	113.6
238	D	27	Very low	26.1	Very low	135 Å²	135	145.6 Å²	145.6	72%	0.722	79%	0.785	S	S	*	*			trans	56	98.4	153.2	-58.9	-8.6	0	0	0	122.4
239	T	26.2	Very low	26.1	Very low	114 Å²	114	146.9 Å²	146.9	70%	0.699	79%	0.785	S	S	*	*			trans	14.1	125.9	130.3	55.8	0	0	0	0	119.7
240	N	28.6	Very low	26	Very low	140 Å²	140	145.9 Å²	145.9	75%	0.749	78%	0.782	S	S	*	*				-176.9	145.3	108.1	-89.4	-43.3	0	0	0	111.8
241	H	27.2	Very low	25.8	Very low	176 Å²	176	144.5 Å²	144.5	82%	0.815	78%	0.78	S	S	*	*			trans	5.6	140	161.3	-55.2	-84.4	0	0	0	119.4
242	S	26.1	Very low	25.9	Very low	96 Å²	96	143.3 Å²	143.3	67%	0.671	77%	0.772	S	S	*	*			cis	-166.9	159.4	43	51.5	0	0	0	0	113.9
243	E	25.7	Very low	25.8	Very low	175 Å²	175	142.7 Å²	142.7	82%	0.818	77%	0.769	S	S	*	*			trans	48.3	104.8	151	-66	176.2	137.4	0	0	119.8
244	F	25.5	Very low	26	Very low	196 Å²	196	146.2 Å²	146.2	86%	0.86	77%	0.769	S	S	*	*				-154.6	96.8	126.2	-112.6	-73.6	0	0	0	110.3	L246	F244-L246 HydrophobicContact CD1-CD1 3.9Å; F244-L246 HydrophobicContact CD1-CG 4.19Å; F244-L246 HydrophobicContact CE1-CD1 3.78Å; F244-L246 HydrophobicContact CE1-CG 4.42Å
245	H	24	Very low	26	Very low	177 Å²	177	145.6 Å²	145.6	82%	0.819	77%	0.768	S	S	*	*			trans	-103.5	89.7	175.6	-149	-75.5	0	0	0	107.4
246	L	29.2	Very low	26	Very low	150 Å²	150	146.4 Å²	146.4	79%	0.785	77%	0.772	S	S	*	*			trans	-116.9	99.6	173.1	-82.8	175.6	0	0	0	110.5	F244	F244-L246 HydrophobicContact CD1-CD1 3.9Å; F244-L246 HydrophobicContact CD1-CG 4.19Å; F244-L246 HydrophobicContact CE1-CD1 3.78Å; F244-L246 HydrophobicContact CE1-CG 4.42Å
247	S	25	Very low	26.1	Very low	90 Å²	90	146.2 Å²	146.2	63%	0.629	77%	0.773	S	S	*	*			trans	-46.9	134.9	-176.8	-47.7	0	0	0	0	114.7	N249	S247-N249 PolarHBondContact O-N 2.88Å
248	L	23.3	Very low	26	Very low	173 Å²	173	143.8 Å²	143.8	91%	0.906	77%	0.768	S	S	*	*			trans	-49.8	121.5	150.2	-66.3	153.9	0	0	0	109.2
249	N	26.2	Very low	25.9	Very low	135 Å²	135	144 Å²	144	72%	0.722	76%	0.764	S	S	*	*			trans	-146.6	113.7	162.2	-107	-3	0	0	0	108.5	S247 D251	S247-N249 PolarHBondContact O-N 2.88Å; N249-D251 VanDerWaalsContact C-N 3.34Å; N249-D251 PolarHBondContact O-N 3.2Å; N249-D251 VanDerWaalsContact O-N 3.08Å
250	C	24.9	Very low	25.8	Very low	123 Å²	123	146 Å²	146	83%	0.831	76%	0.76	S	S	*	*			trans	-76.3	88.6	168.3	-64.7	0	0	0	0	107.9	S252	C250-S252 PolarHBondContact O-N 3.49Å; C250-S252 PolarHBondContact O-OG 3.44Å
251	D	24.9	Very low	25.7	Very low	139 Å²	139	146.2 Å²	146.2	74%	0.743	76%	0.755	S	S	*	*			trans	-75.6	89.6	177.3	-110.7	-40.2	0	0	0	110.4	N249 H253	N249-D251 VanDerWaalsContact C-N 3.34Å; N249-D251 PolarHBondContact O-N 3.2Å; N249-D251 VanDerWaalsContact O-N 3.08Å; D251-H253 PolarHBondContact O-N 2.87Å
252	S	28.2	Very low	25.7	Very low	98 Å²	98	148.6 Å²	148.6	69%	0.685	76%	0.758	S	S	*	*			trans	-69.8	18.3	-174.1	-50.4	0	0	0	0	115.3	C250	C250-S252 PolarHBondContact O-N 3.49Å; C250-S252 PolarHBondContact O-OG 3.44Å
253	H	27.2	Very low	25.7	Very low	169 Å²	169	150.6 Å²	150.6	78%	0.782	76%	0.761	S	S	*	*			trans	-147	50.1	-167.8	-74.9	-55.9	0	0	0	115	D251	D251-H253 PolarHBondContact O-N 2.87Å
254	L	27.3	Very low	25.7	Very low	150 Å²	150	150.6 Å²	150.6	79%	0.785	76%	0.761	S	S	*	*			trans	-151.7	148.1	155.7	-140.7	68.1	0	0	0	112.2
255	H	28.2	Very low	25.9	Very low	174 Å²	174	152 Å²	152	81%	0.806	76%	0.762	S	S	*	*			trans	83.1	99.7	-172.8	-54.5	86	0	0	0	115.1
256	Q	24	Very low	25.9	Very low	176 Å²	176	147.4 Å²	147.4	82%	0.822	76%	0.763	S	S	*	*			trans	-54.1	150.2	163.7	-64.6	167.7	-39.8	0	0	110.2	T258	Q256-T258 PolarHBondContact O-N 3.09Å
257	P	24.1	Very low	25.9	Very low	117 Å²	117	145.7 Å²	145.7	76%	0.76	76%	0.763	S	S	*	*			trans	-59.5	113.9	170.4	26	-33.2	0	0	0	108.8	H259	P257-H259 PolarHBondContact O-N 2.96Å
258	T	24.4	Very low	26	Very low	117 Å²	117	150.1 Å²	150.1	72%	0.718	77%	0.774	S	S	*	*			trans	-64	103.4	173.8	27.9	0	0	0	0	108.3	Q256 Y260	Q256-T258 PolarHBondContact O-N 3.09Å; T258-Y260 VanDerWaalsContact C-N 3.32Å; T258-Y260 PolarHBondContact O-N 3.36Å
259	H	24.6	Very low	26	Very low	138 Å²	138	147 Å²	147	64%	0.639	77%	0.773	S	S	*	*			trans	-69.6	88.1	-174.8	-140.8	-68.9	0	0	0	108.8	P257 F261	P257-H259 PolarHBondContact O-N 2.96Å; H259-F261 HydrophobicContact CB-CD2 4.13Å; H259-F261 HydrophobicContact CB-CE2 4.31Å; H259-F261 AromaticContact CE1-CD2 3.87Å; H259-F261 AromaticContact CE1-CE1 3.93Å; H259-F261 AromaticContact CE1-CE2 3.31Å; H259-F261 WeakPolarHBondContact CE1-CE2 3.49Å; H259-F261 AromaticContact CE1-CZ 3.34Å; H259-F261 WeakPolarHBondContact CE1-CZ 3.29Å; H259-F261 AromaticContact CG-CD2 3.84Å; H259-F261 AromaticContact CG-CE2 3.68Å; H259-F261 AromaticContact ND1-CD2 3.17Å; H259-F261 WeakPolarHBondContact ND1-CD2 3.37Å; H259-F261 AromaticContact ND1-CE2 3.06Å; H259-F261 WeakPolarHBondContact ND1-CE2 3.43Å; H259-F261 AromaticContact ND1-CG 3.78Å; H259-F261 AromaticContact ND1-CZ 3.57Å; H259-F261 PolarHBondContact O-N 2.89Å
260	Y	24.2	Very low	26.1	Very low	157 Å²	157	146.9 Å²	146.9	62%	0.616	78%	0.777	S	S	*	*			trans	-70.4	76	167.8	-81.9	-74.7	0	0	0	109.6	Y218 T258 Y262	Y218-Y260 VanDerWaalsContact OH-CE2 3.28Å; Y218-Y260 WeakPolarHBondContact OH-CE2 3.2Å; Y218-Y260 VanDerWaalsContact OH-CZ 3.3Å; Y218-Y260 PolarHBondContact OH-OH 3.34Å; T258-Y260 VanDerWaalsContact C-N 3.32Å; T258-Y260 PolarHBondContact O-N 3.36Å; Y260-Y262 PolarHBondContact O-N 3.1Å
261	F	25.7	Very low	26.1	Very low	144 Å²	144	149.6 Å²	149.6	63%	0.632	78%	0.777	S	S	*	*			trans	-61.7	117.9	161.8	-88.5	-74.3	0	0	0	108.5	H259 N263	H259-F261 HydrophobicContact CB-CD2 4.13Å; H259-F261 HydrophobicContact CB-CE2 4.31Å; H259-F261 AromaticContact CE1-CD2 3.87Å; H259-F261 AromaticContact CE1-CE1 3.93Å; H259-F261 AromaticContact CE1-CE2 3.31Å; H259-F261 WeakPolarHBondContact CE1-CE2 3.49Å; H259-F261 AromaticContact CE1-CZ 3.34Å; H259-F261 WeakPolarHBondContact CE1-CZ 3.29Å; H259-F261 AromaticContact CG-CD2 3.84Å; H259-F261 AromaticContact CG-CE2 3.68Å; H259-F261 AromaticContact ND1-CD2 3.17Å; H259-F261 WeakPolarHBondContact ND1-CD2 3.37Å; H259-F261 AromaticContact ND1-CE2 3.06Å; H259-F261 WeakPolarHBondContact ND1-CE2 3.43Å; H259-F261 AromaticContact ND1-CG 3.78Å; H259-F261 AromaticContact ND1-CZ 3.57Å; H259-F261 PolarHBondContact O-N 2.89Å; F261-N263 PolarHBondContact O-N 2.68Å
262	Y	27.1	Very low	26.2	Very low	226 Å²	226	148.5 Å²	148.5	89%	0.886	78%	0.78	S	S	*	*			trans	-66.7	96.5	167.9	-88.6	-97.5	0	0	0	109.6	Y260	Y260-Y262 PolarHBondContact O-N 3.1Å
263	N	25.2	Very low	26	Very low	139 Å²	139	150.1 Å²	150.1	74%	0.743	78%	0.78	S	S	*	*			trans	-108.7	48.2	175.8	-72.4	3.9	0	0	0	111.6	F261	F261-N263 PolarHBondContact O-N 2.68Å
264	E	27.2	Very low	26.2	Very low	175 Å²	175	151.1 Å²	151.1	82%	0.818	79%	0.785	S	S	*	*			trans	-131.4	51.4	173.3	-73.1	-157.1	141.2	0	0	112.8
265	Y	28.4	Very low	26.3	Very low	225 Å²	225	151.3 Å²	151.3	88%	0.882	78%	0.78	S	S	*	*			trans	-138.9	102.2	154.7	-85.3	-77.1	0	0	0	109.7	S267	Y265-S267 PolarHBondContact O-N 2.91Å
266	G	24.5	Very low	26.3	Very low	80 Å²	80	152.9 Å²	152.9	83%	0.825	78%	0.78	S	S	*	*			trans	-64.1	129.9	166.9	0	0	0	0	0	110
267	S	28.9	Very low	26.5	Very low	114 Å²	114	149.7 Å²	149.7	80%	0.797	78%	0.777	S	S	*	*			trans	-143.6	136.3	164.5	-74.9	0	0	0	0	107.9	Y265	Y265-S267 PolarHBondContact O-N 2.91Å
268	E	27.6	Very low	26.6	Very low	184 Å²	184	151.7 Å²	151.7	86%	0.86	78%	0.781	S	S	*	*			trans	-59.4	144.8	-168.5	-64.8	167	122.1	0	0	111.8	V270	E268-V270 PolarHBondContact O-N 3.26Å
269	A	23.5	Very low	26.8	Very low	106 Å²	106	152.1 Å²	152.1	88%	0.876	79%	0.787	S	S	*	*			trans	-63.4	107.7	178.1	0	0	0	0	0	110.6
270	V	27.6	Very low	27	Very low	133 Å²	133	152.7 Å²	152.7	81%	0.806	80%	0.795	S	S	*	*			trans	-111.7	97.4	160	-177.2	0	0	0	0	107.6	E268 C272	E268-V270 PolarHBondContact O-N 3.26Å; V270-C272 PolarHBondContact O-N 3.47Å
271	E	24.7	Very low	27.2	Very low	180 Å²	180	153.1 Å²	153.1	84%	0.841	80%	0.803	S	S	*	*			trans	-60	122.5	177.3	-173.1	173	-136.3	0	0	110.7
272	C	26.8	Very low	27.5	Very low	117 Å²	117	152.7 Å²	152.7	79%	0.791	81%	0.807	S	S	*	*			trans	-142.9	87.2	166.5	-166.1	0	0	0	0	109.8	V270 Q274	V270-C272 PolarHBondContact O-N 3.47Å; C272-Q274 PolarHBondContact O-N 2.81Å
273	D	24.9	Very low	27.9	Very low	131 Å²	131	150.8 Å²	150.8	70%	0.701	81%	0.806	S	S	*	*			trans	-56.9	120.9	168.6	-101	-33.8	0	0	0	111.2
274	Q	31.9	Very low	28	Very low	190 Å²	190	148.4 Å²	148.4	89%	0.888	81%	0.814	S	S	*	*			trans	-157.4	129.4	135.2	-113.5	141.9	84.4	0	0	113.7	C272	C272-Q274 PolarHBondContact O-N 2.81Å
275	K	28.3	Very low	28.1	Very low	154 Å²	154	146.5 Å²	146.5	67%	0.67	82%	0.819	S	S	*	*			trans	-78.9	179.3	-176.3	-80.8	173.5	173.6	167.5	0	113.4
276	Y	28.2	Very low	28.1	Very low	207 Å²	207	138.3 Å²	138.3	81%	0.812	80%	0.803	S	S	*	*			trans	86.3	144.1	155.6	-47.4	-72	0	0	0	115.7
277	S	28.7	Very low	28.2	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	81%	0.807	S	S	*	*			cis	-166.5	154.9	-23.8	-179.1	0	0	0	0	107.4
278	L	25.1	Very low	28.2	Very low	159 Å²	159	143.3 Å²	143.3	83%	0.832	80%	0.8	S	S	*	*			trans	-55.4	140.3	166.5	-72.6	143.8	0	0	0	111.7
279	C	30.4	Very low	28.2	Very low	127 Å²	127	144.2 Å²	144.2	86%	0.858	80%	0.801	S	S	*	*			trans	-157.4	145.9	151.8	-92.3	0	0	0	0	109.6
280	D	27.8	Very low	28.3	Very low	149 Å²	149	148.4 Å²	148.4	80%	0.797	80%	0.796	S	S	*	*			trans	-88.6	165	-166.1	-56.8	-80.1	0	0	0	115.8
281	E	29.5	Very low	28.2	Very low	167 Å²	167	153.1 Å²	153.1	78%	0.78	80%	0.799	S	S	*	*			trans	43.7	148.3	145.8	-65.9	-66.3	104.4	0	0	122.3
282	D	31.4	Very low	28.4	Very low	135 Å²	135	153.1 Å²	153.1	72%	0.722	80%	0.796	S	S	*	*			trans	57.6	106.2	169.1	-67.9	-35.9	0	0	0	117.7
283	H	35.3	Very low	28.3	Very low	185 Å²	185	153 Å²	153	86%	0.856	80%	0.796	S	S	*	*				170	123.9	116.9	-91.1	61.5	0	0	0	109.2
284	G	26.8	Very low	28.3	Very low	89 Å²	89	154.2 Å²	154.2	92%	0.918	80%	0.801	S	S	*	*			trans	-70.8	133.7	-176.9	0	0	0	0	0	113.7
285	C	29.1	Very low	28	Very low	136 Å²	136	150.4 Å²	150.4	92%	0.919	79%	0.793	S	S	*	*			trans	-144.6	143.2	166.1	-157.2	0	0	0	0	112.3
286	G	29	Very low	27.7	Very low	53 Å²	53	148.7 Å²	148.7	55%	0.546	80%	0.796	S	S	.	*			trans	-73	152.6	-160.7	0	0	0	0	0	118.4	I288	G286-I288 PolarHBondContact O-N 2.98Å
287	N	26.2	Very low	27.6	Very low	170 Å²	170	146.4 Å²	146.4	91%	0.909	80%	0.796	S	S	*	*			trans	33	69.7	142.4	-68	-40.1	0	0	0	117.7
288	I	28.8	Very low	27.3	Very low	129 Å²	129	146 Å²	146	66%	0.662	79%	0.789	S	S	*	*			trans	-87.3	108	163	-61.5	178.9	0	0	0	109	G286 Y290	G286-I288 PolarHBondContact O-N 2.98Å; I288-Y290 HydrophobicContact CB-CD2 4.5Å; I288-Y290 HydrophobicContact CB-CE2 4.23Å; I288-Y290 HydrophobicContact CG2-CD2 4Å; I288-Y290 HydrophobicContact CG2-CE2 3.81Å; I288-Y290 PolarHBondContact O-N 3.34Å
289	K	28	Very low	27.4	Very low	203 Å²	203	148 Å²	148	88%	0.883	79%	0.791	S	S	*	*			trans	-69.4	96	170.2	-76.3	-176.6	175.8	-179.8	0	109.9	R291	K289-R291 PolarHBondContact O-N 3.42Å
290	Y	26.3	Very low	27.1	Very low	194 Å²	194	145.2 Å²	145.2	76%	0.761	78%	0.783	S	S	*	*			trans	-68.4	103.2	172	-84.5	-86.6	0	0	0	111.5	I288 K292	I288-Y290 HydrophobicContact CB-CD2 4.5Å; I288-Y290 HydrophobicContact CB-CE2 4.23Å; I288-Y290 HydrophobicContact CG2-CD2 4Å; I288-Y290 HydrophobicContact CG2-CE2 3.81Å; I288-Y290 PolarHBondContact O-N 3.34Å; Y290-K292 PolarHBondContact O-N 3.12Å; Y290-K292 VanDerWaalsContact O-N 3.13Å
291	R	24.8	Very low	27.1	Very low	232 Å²	232	146 Å²	146	88%	0.875	79%	0.787	S	S	*	*			trans	-62.1	105.5	155.4	-82.6	-175.8	172.3	-175.5	-2.2	107.9	K289 C293	K289-R291 PolarHBondContact O-N 3.42Å; R291-C293 PolarHBondContact O-N 3.07Å; R291-C293 VanDerWaalsContact O-N 3.13Å
292	K	29.7	Very low	26.8	Very low	179 Å²	179	145.5 Å²	145.5	78%	0.778	78%	0.784	S	S	*	*			trans	-75.2	99.3	166.7	-86	-172.5	173.4	-178.7	0	109.4	Y290 L294	Y290-K292 PolarHBondContact O-N 3.12Å; Y290-K292 VanDerWaalsContact O-N 3.13Å; K292-L294 PolarHBondContact O-N 3.35Å
293	C	23.9	Very low	26.5	Very low	116 Å²	116	148.5 Å²	148.5	78%	0.784	79%	0.791	S	S	*	*			trans	-67.8	111.1	158.3	-58	0	0	0	0	107.2	R291	R291-C293 PolarHBondContact O-N 3.07Å; R291-C293 VanDerWaalsContact O-N 3.13Å
294	L	25.5	Very low	26.2	Very low	155 Å²	155	147.4 Å²	147.4	81%	0.812	79%	0.786	S	S	*	*			trans	-80.5	129.9	166.6	-90.3	157.5	0	0	0	108.1	K292 T296	K292-L294 PolarHBondContact O-N 3.35Å; L294-T296 PolarHBondContact O-N 3.05Å
295	P	25	Very low	26	Very low	110 Å²	110	148.7 Å²	148.7	71%	0.714	78%	0.781	S	S	*	*			trans	-69	128.6	177.3	27.6	-32.8	0	0	0	110.5	I297	P295-I297 PolarHBondContact O-N 3.08Å; P295-I297 VanDerWaalsContact O-N 3.11Å
296	T	22.2	Very low	26	Very low	119 Å²	119	147 Å²	147	73%	0.73	78%	0.777	S	S	*	*			trans	-71.5	99	174.8	-56	0	0	0	0	110.4	L294 T298	L294-T296 PolarHBondContact O-N 3.05Å; T296-T298 HydrophobicContact CG2-CG2 4.03Å; T296-T298 PolarHBondContact O-N 3.05Å
297	I	25.5	Very low	25.9	Very low	159 Å²	159	150.4 Å²	150.4	82%	0.815	79%	0.788	S	S	*	*			trans	-76.3	104.9	167.5	-57.4	179.3	0	0	0	108.2	P295	P295-I297 PolarHBondContact O-N 3.08Å; P295-I297 VanDerWaalsContact O-N 3.11Å
298	T	22.9	Very low	25.9	Very low	100 Å²	100	149.1 Å²	149.1	61%	0.613	78%	0.78	S	S	*	*			trans	-108.2	163.1	165.6	36.2	0	0	0	0	109.4	T296	T296-T298 HydrophobicContact CG2-CG2 4.03Å; T296-T298 PolarHBondContact O-N 3.05Å
299	K	27	Very low	25.9	Very low	201 Å²	201	151.2 Å²	151.2	87%	0.874	79%	0.792	S	S	*	*			trans	76.3	146	-173.7	-45.6	160.1	-174	177.1	0	111.9
300	G	25.3	Very low	25.7	Very low	68 Å²	68	152.4 Å²	152.4	70%	0.701	79%	0.791	S	S	*	*			cis	152.5	100.7	-2.1	0	0	0	0	0	109.1	H302	G300-H302 VanDerWaalsContact C-N 3.32Å; G300-H302 PolarHBondContact O-N 3.15Å
301	L	26.2	Very low	25.7	Very low	165 Å²	165	153.1 Å²	153.1	86%	0.864	80%	0.798	S	S	*	*			trans	-73.8	88	178.8	-75.3	170.8	0	0	0	110	F303	L301-F303 PolarHBondContact O-N 3.48Å
302	H	25.1	Very low	25.8	Very low	158 Å²	158	147.2 Å²	147.2	73%	0.731	79%	0.793	S	S	*	*			trans	-72.2	105.4	167.2	-137.6	-112.4	0	0	0	107.9	G300 E304	G300-H302 VanDerWaalsContact C-N 3.32Å; G300-H302 PolarHBondContact O-N 3.15Å; H302-E304 VanDerWaalsContact C-N 3.33Å; H302-E304 IonicContact CE1-OE1 3.83Å; H302-E304 IonicContact ND1-OE1 3.52Å; H302-E304 PolarHBondContact O-N 3.12Å
303	F	23.2	Very low	25.5	Very low	198 Å²	198	147.8 Å²	147.8	87%	0.868	79%	0.792	S	S	*	*			trans	-73.8	90.2	168.1	-79.7	-90.3	0	0	0	108.3	L301	L301-F303 PolarHBondContact O-N 3.48Å
304	E	29	Very low	25.6	Very low	162 Å²	162	147.8 Å²	147.8	76%	0.757	79%	0.793	S	S	*	*			trans	-89.9	130.8	172.4	-118.1	165.8	-151.9	0	0	111.3	H302	H302-E304 VanDerWaalsContact C-N 3.33Å; H302-E304 IonicContact CE1-OE1 3.83Å; H302-E304 IonicContact ND1-OE1 3.52Å; H302-E304 PolarHBondContact O-N 3.12Å
305	S	23.4	Very low	25.5	Very low	116 Å²	116	148.5 Å²	148.5	81%	0.811	79%	0.792	S	S	*	*			trans	-78.7	121.5	-172.1	54	0	0	0	0	111.9
306	A	29.1	Very low	25.7	Very low	101 Å²	101	149.3 Å²	149.3	84%	0.835	80%	0.797	S	S	*	*			trans	-116.1	106.2	160	0	0	0	0	0	109.4
307	T	27	Very low	25.8	Very low	124 Å²	124	150.9 Å²	150.9	76%	0.761	80%	0.801	S	S	*	*			trans	-68.3	164.4	170.1	39	0	0	0	0	111.9
308	D	26.9	Very low	25.9	Very low	142 Å²	142	154.4 Å²	154.4	76%	0.759	81%	0.806	S	S	*	*			trans	70.7	88.7	170.8	-62	-31.7	0	0	0	117.9
309	L	28.7	Very low	25.9	Very low	174 Å²	174	159.4 Å²	159.4	91%	0.911	81%	0.813	S	S	*	*				-159.6	117.8	108.1	-101.4	158.6	0	0	0	110.8
310	R	23.2	Very low	25.9	Very low	228 Å²	228	155.4 Å²	155.4	86%	0.86	81%	0.81	S	S	*	*			trans	-83.6	132.3	176.9	-61.9	176.5	-178.9	179.5	-0.2	110.3
311	F	26.7	Very low	26.1	Very low	208 Å²	208	159.2 Å²	159.2	91%	0.912	81%	0.81	S	S	*	*			trans	-149	152.6	135.4	-97.7	-70.9	0	0	0	110.5
312	S	25.5	Very low	26.3	Very low	108 Å²	108	157 Å²	157	76%	0.755	81%	0.809	S	S	*	*			trans	-95.2	129.4	-150.3	50	0	0	0	0	115.5
313	Y	23.7	Very low	26.2	Very low	192 Å²	192	155.5 Å²	155.5	75%	0.753	82%	0.815	S	S	*	*			trans	-81.4	137.9	158.6	-98.5	-95.6	0	0	0	111.2
314	S	26.7	Very low	26.6	Very low	116 Å²	116	150.9 Å²	150.9	81%	0.811	80%	0.804	S	S	*	*			trans	-110.9	111	167.1	43.8	0	0	0	0	110.4
315	Q	23.8	Very low	26.5	Very low	169 Å²	169	150.6 Å²	150.6	79%	0.79	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-84.8	146.2	175.1	-71.8	-171.5	-20.9	0	0	112.2
316	P	28.6	Very low	26.7	Very low	127 Å²	127	149.1 Å²	149.1	83%	0.825	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-90	131.4	155.9	0.6	19.1	0	0	0	111.1
317	N	25.1	Very low	26.6	Very low	152 Å²	152	153.4 Å²	153.4	81%	0.813	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69.4	149.5	-174	-64.1	-74.5	0	0	0	114.8
318	Y	25.9	Very low	26.6	Very low	234 Å²	234	151.8 Å²	151.8	92%	0.918	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-103	131.5	151.3	-129	-93.4	0	0	0	109.1
319	R	23.3	Very low	26.8	Very low	205 Å²	205	153.3 Å²	153.3	77%	0.774	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-68.7	137.9	180	-83.1	-176	171.5	-167.2	0.7	111.7	E321	R319-E321 IonicContact CZ-OE1 3.98Å; R319-E321 IonicContact NE-OE1 3.19Å; R319-E321 IonicContact NH1-OE1 2.58Å; R319-E321 PolarHBondContact NH1-OE1 2.81Å; R319-E321 IonicContact NH2-OE1 3.17Å
320	S	27.5	Very low	26.8	Very low	116 Å²	116	150.7 Å²	150.7	81%	0.811	78%	0.777	S	S	*	*			trans	-133.8	124	140.4	58.4	0	0	0	0	107.9
321	E	28.8	Very low	27.1	Very low	148 Å²	148	150.7 Å²	150.7	69%	0.692	78%	0.779	S	S	*	*			trans	-92.3	123.3	-175.7	-71.1	175	173.8	0	0	111.1	R319	R319-E321 IonicContact CZ-OE1 3.98Å; R319-E321 IonicContact NE-OE1 3.19Å; R319-E321 IonicContact NH1-OE1 2.58Å; R319-E321 PolarHBondContact NH1-OE1 2.81Å; R319-E321 IonicContact NH2-OE1 3.17Å
322	S	31.2	Very low	27	Very low	120 Å²	120	147.8 Å²	147.8	84%	0.839	77%	0.773	S	S	*	*			trans	-148.9	100.6	155.6	29	0	0	0	0	109.6
323	C	23.6	Very low	27.2	Very low	126 Å²	126	150.3 Å²	150.3	85%	0.851	78%	0.777	S	S	*	*			trans	-72.5	-179.9	172.9	-108.1	0	0	0	0	112
324	P	31.2	Very low	27.3	Very low	100 Å²	100	146.8 Å²	146.8	65%	0.649	78%	0.776	S	S	*	*			cis	-137.8	-161.8	-11.5	26.6	-1.5	0	0	0	113.7
325	L	26.8	Very low	27.5	Very low	157 Å²	157	148.5 Å²	148.5	82%	0.822	78%	0.776	S	S	*	*			trans	91.8	133.4	159	-48.8	178.9	0	0	0	116.7
326	S	26.9	Very low	27.7	Very low	84 Å²	84	145.7 Å²	145.7	59%	0.587	77%	0.77	S	S	*	*			cis	-171.3	157.4	-11.4	49.6	0	0	0	0	112.1
327	F	26.9	Very low	27.6	Very low	191 Å²	191	144.2 Å²	144.2	84%	0.838	76%	0.763	S	S	*	*			trans	73.6	114.8	170	-64.5	-80.5	0	0	0	117.6
328	S	28.1	Very low	28	Very low	90 Å²	90	145.4 Å²	145.4	63%	0.629	76%	0.761	S	S	*	*				89.2	125.6	66.9	-163.3	0	0	0	0	110.3
329	K	30.9	Very low	28.2	Very low	175 Å²	175	140.4 Å²	140.4	76%	0.761	75%	0.75	S	S	*	*			cis	-149	145.4	35.4	-74.5	177.6	-179.5	176.8	0	114.9
330	D	28.7	Very low	28.6	Very low	119 Å²	119	138.6 Å²	138.6	64%	0.636	75%	0.75	S	S	*	*				38.9	121.1	127.2	-34.6	-32.6	0	0	0	120.5
331	Y	29.3	Very low	28.6	Very low	228 Å²	228	137.7 Å²	137.7	89%	0.894	74%	0.744	S	S	*	*				-178.7	124.3	96.3	-101.7	-76.4	0	0	0	112.2
332	D	24.9	Very low	28.6	Very low	147 Å²	147	139 Å²	139	79%	0.786	75%	0.75	S	S	*	*			trans	-76.4	155.2	169.3	-86.3	-52.6	0	0	0	112.2
333	L	29.7	Very low	28.4	Very low	161 Å²	161	138.5 Å²	138.5	84%	0.843	75%	0.746	S	S	*	*				-177.7	134.9	114.2	-95.7	160.8	0	0	0	113.8
334	T	26.6	Very low	28.7	Very low	117 Å²	117	142 Å²	142	72%	0.718	75%	0.748	S	S	*	*			trans	-42.6	147.1	161.6	51.3	0	0	0	0	115.2
335	D	29.8	Very low	28.6	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	76%	0.758	S	S	*	*				-167.1	173.1	101.5	-138.6	-21.4	0	0	0	115.1
336	T	27.2	Very low	28.7	Very low	110 Å²	110	146.3 Å²	146.3	68%	0.675	76%	0.759	S	S	*	*			trans	-94.6	149.6	-153.7	-48.7	0	0	0	0	114.2
337	S	27.4	Very low	28.9	Very low	95 Å²	95	148.7 Å²	148.7	66%	0.664	77%	0.765	S	S	*	*			trans	64.1	130.8	155.9	68.2	0	0	0	0	120.7
338	K	33.8	Very low	29.2	Very low	177 Å²	177	146.3 Å²	146.3	77%	0.77	76%	0.76	S	S	*	*				171.1	135.9	108.9	-94.2	160.6	-174.5	168.9	0	111.6
339	N	30.7	Very low	29.4	Very low	130 Å²	130	148.8 Å²	148.8	70%	0.695	76%	0.762	S	S	*	*			trans	59.9	163.7	145	-56.5	0.1	0	0	0	117
340	Q	30.8	Very low	29.5	Very low	166 Å²	166	147.4 Å²	147.4	78%	0.776	76%	0.762	S	S	*	*			cis	-149.8	172.4	-28.9	-114.5	164.9	-28.9	0	0	106
341	S	27	Very low	29.6	Very low	97 Å²	97	146.7 Å²	146.7	68%	0.678	76%	0.762	S	S	*	*			trans	-48.7	141	164	47.8	0	0	0	0	113.1
342	E	30.1	Very low	29.9	Very low	177 Å²	177	143.8 Å²	143.8	83%	0.827	76%	0.756	S	S	*	*				-172.8	152.4	118.3	-102.8	164.3	-156.1	0	0	113.1
343	S	26.2	Very low	30.3	Very low	108 Å²	108	145.3 Å²	145.3	76%	0.755	76%	0.759	S	S	*	*			trans	-89.2	145.7	-176.2	52.5	0	0	0	0	112.7
344	F	30.1	Very low	30.3	Very low	201 Å²	201	140.8 Å²	140.8	88%	0.882	75%	0.751	S	S	*	*			trans	-126.2	118.7	161.7	-84.7	-85.4	0	0	0	111.9
345	Q	28	Very low	30.6	Very low	185 Å²	185	144.4 Å²	144.4	86%	0.864	76%	0.757	S	S	*	*			trans	-87.5	157.8	161.4	-93	-175.9	-29.4	0	0	110.5
346	L	30.2	Very low	30.8	Very low	161 Å²	161	141.4 Å²	141.4	84%	0.843	75%	0.748	S	S	*	*			trans	172.1	106.8	150.3	-93.4	159.1	0	0	0	105.4
347	N	29.6	Very low	31.2	Very low	135 Å²	135	144.1 Å²	144.1	72%	0.722	75%	0.751	S	S	*	*			cis	94.6	155.5	41.9	-164	29	0	0	0	113.7
348	I	33.2	Very low	31.4	Very low	140 Å²	140	145.4 Å²	145.4	72%	0.718	75%	0.75	S	S	*	*			trans	94.6	131.5	176.9	-54.5	166.9	0	0	0	114.7
349	Q	32.6	Very low	31.3	Very low	143 Å²	143	143.6 Å²	143.6	67%	0.668	75%	0.745	S	S	*	*			cis	-171	-175.1	-33.5	-123.1	163.2	-40.5	0	0	111.2
350	D	33.1	Very low	31.2	Very low	145 Å²	145	144.1 Å²	144.1	78%	0.775	75%	0.747	S	S	*	*			trans	84.5	101.6	169.1	-54.4	-22.8	0	0	0	117.6
351	V	31	Very low	30.9	Very low	104 Å²	104	141.3 Å²	141.3	63%	0.63	75%	0.746	S	S	*	*				83.1	114.5	53.1	-178.3	0	0	0	0	111.2
352	H	35.4	Very low	31	Very low	167 Å²	167	143.1 Å²	143.1	77%	0.773	75%	0.753	S	S	*	*				-147.7	133.8	59.3	-80.2	-95.3	0	0	0	111.5
353	Q	32.9	Very low	30.7	Very low	179 Å²	179	139.6 Å²	139.6	84%	0.836	74%	0.744	S	S	*	*				74.3	119.3	72.6	-94.3	-175.1	3.8	0	0	118
354	G	31.6	Very low	30.8	Very low	66 Å²	66	144.2 Å²	144.2	68%	0.68	75%	0.75	S	S	*	*			trans	-177.9	54.6	178.5	0	0	0	0	0	118.7
355	F	31.5	Very low	30.5	Very low	193 Å²	193	141.9 Å²	141.9	85%	0.846	75%	0.746	S	S	*	*			trans	50.1	115.4	151.2	-71.6	-86.2	0	0	0	121.3
356	S	33.9	Very low	30.5	Very low	91 Å²	91	138.3 Å²	138.3	64%	0.636	74%	0.742	S	S	*	*				90.8	133.2	88	175.7	0	0	0	0	113.9
357	K	35.4	Very low	30.6	Very low	167 Å²	167	139 Å²	139	73%	0.726	74%	0.741	S	S	*	*			cis	-170.5	154.8	4.6	-109.4	175	-168.7	175.1	0	109.9
358	N	32.1	Very low	30.6	Very low	122 Å²	122	136.1 Å²	136.1	65%	0.652	73%	0.731	S	S	*	*			trans	63.6	148.9	143.8	-61.5	23.1	0	0	0	118.5
359	E	31.5	Very low	30.3	Very low	139 Å²	139	135.4 Å²	135.4	65%	0.65	74%	0.737	S	S	*	*			cis	-164.9	164.4	1.3	-125.9	170.7	-119.3	0	0	113.2
360	N	29.8	Very low	30.2	Very low	140 Å²	140	133.2 Å²	133.2	75%	0.749	74%	0.744	S	S	*	*			trans	78.1	117	151.6	-59.9	-30.5	0	0	0	122.4
361	S	24.7	Very low	29.8	Very low	108 Å²	108	136 Å²	136	76%	0.755	75%	0.749	S	S	*	*			trans	-82.7	161.2	172.4	-38.5	0	0	0	0	112.8
362	T	28.6	Very low	29.7	Very low	134 Å²	134	136 Å²	136	82%	0.822	75%	0.754	S	S	*	*			trans	-144.6	132.3	142.5	-58	0	0	0	0	109.4
363	V	23.1	Very low	29.4	Very low	104 Å²	104	133.3 Å²	133.3	63%	0.63	75%	0.75	S	S	*	*			trans	-103.6	142.5	179.7	172	0	0	0	0	109.1	L365	V363-L365 HydrophobicContact CG1-CB 4.46Å; V363-L365 HydrophobicContact CG1-CD1 4.21Å; V363-L365 HydrophobicContact CG1-CG 4.17Å
364	F	27.8	Very low	29	Very low	204 Å²	204	132.3 Å²	132.3	90%	0.895	75%	0.75	S	S	*	*			trans	-128.7	135.9	151.9	-96.9	-84.3	0	0	0	110.4
365	L	24.8	Very low	29.2	Very low	152 Å²	152	133.8 Å²	133.8	80%	0.796	75%	0.747	S	S	*	*			trans	-133.7	126.7	-171.9	-108	169.6	0	0	0	109.2	V363	V363-L365 HydrophobicContact CG1-CB 4.46Å; V363-L365 HydrophobicContact CG1-CD1 4.21Å; V363-L365 HydrophobicContact CG1-CG 4.17Å
366	S	27.7	Very low	28.9	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	75%	0.745	S	S	*	*			trans	170.9	154.2	156.2	49.9	0	0	0	0	109
367	E	32.7	Very low	28.6	Very low	174 Å²	174	139.6 Å²	139.6	81%	0.813	76%	0.757	S	S	*	*			cis	-167.5	158.9	-22.7	-102.1	-140.2	-103.2	0	0	107.8
368	S	29.9	Very low	28.4	Very low	76 Å²	76	136.9 Å²	136.9	53%	0.531	76%	0.756	S	S	.	*			cis	-166.4	163.7	-33.4	66.1	0	0	0	0	109.1
369	C	25.9	Very low	28.3	Very low	125 Å²	125	142.8 Å²	142.8	85%	0.845	77%	0.769	S	S	*	*			trans	68.4	147.5	161.8	-58.8	0	0	0	0	118.6
370	A	30.1	Very low	28.1	Very low	97 Å²	97	143.4 Å²	143.4	80%	0.802	78%	0.778	S	S	*	*			cis	-151.1	159.2	-0.9	0	0	0	0	0	113.1
371	F	25.3	Very low	28.2	Very low	202 Å²	202	144.1 Å²	144.1	89%	0.886	78%	0.78	S	S	*	*			trans	-88.1	153.1	173.5	-84.3	-110.4	0	0	0	113.5
372	S	28.9	Very low	28.6	Very low	105 Å²	105	145.4 Å²	145.4	73%	0.734	78%	0.778	S	S	*	*			trans	178.1	110.8	140.2	-176.7	0	0	0	0	109
373	T	29.6	Very low	28.5	Very low	111 Å²	111	143.7 Å²	143.7	68%	0.681	77%	0.771	S	S	*	*				68.8	87.8	62.7	67.2	0	0	0	0	117.3
374	N	24.9	Very low	28.9	Very low	158 Å²	158	150 Å²	150	85%	0.845	78%	0.784	S	S	*	*			trans	40.6	175.4	132.7	-117.6	-8.4	0	0	0	121.3
375	P	34.7	Very low	28.9	Very low	96 Å²	96	145 Å²	145	62%	0.623	77%	0.774	S	S	*	*			cis	-132	174.6	-23.9	20.9	4.3	0	0	0	115.8
376	Y	25.3	Very low	29.2	Very low	205 Å²	205	143.4 Å²	143.4	80%	0.804	77%	0.771	S	S	*	*			trans	46.3	127.3	149.1	-83.6	-110	0	0	0	123.5
377	F	27.8	Very low	29.2	Very low	202 Å²	202	144.6 Å²	144.6	89%	0.886	77%	0.767	S	S	*	*				166.3	138.6	118.6	-99.1	-75.1	0	0	0	112.3
378	P	30.7	Very low	29.2	Very low	109 Å²	109	143.9 Å²	143.9	71%	0.708	77%	0.769	S	S	*	*			trans	-105.3	160.8	-179.2	39	-33.6	0	0	0	114.9
379	R	30.7	Very low	29.3	Very low	246 Å²	246	146.7 Å²	146.7	93%	0.928	78%	0.778	S	S	*	*			trans	-150.3	145.2	158.8	-68.6	-164.2	-169.1	-141.4	1.4	112.9
380	D	26.8	Very low	29.4	Very low	153 Å²	153	149.6 Å²	149.6	82%	0.818	78%	0.776	S	S	*	*			trans	-85.7	-161.9	-177.8	-56.9	-82.4	0	0	0	114.9
381	I	32.3	Very low	29.6	Very low	155 Å²	155	150.3 Å²	150.3	80%	0.795	77%	0.772	S	S	*	*			trans	91.6	127.5	165.5	-53.1	161	0	0	0	113.1
382	D	32.5	Very low	29.6	Very low	135 Å²	135	148.4 Å²	148.4	72%	0.722	77%	0.766	S	S	*	*			cis	-154	139.5	-0.4	-119.4	-20.7	0	0	0	108.6
383	S	28	Very low	29.6	Very low	97 Å²	97	151.4 Å²	151.4	68%	0.678	77%	0.772	S	S	*	*				77.8	139.2	87.2	-65.5	0	0	0	0	119.2
384	R	31	Very low	29.5	Very low	236 Å²	236	153.7 Å²	153.7	89%	0.891	78%	0.775	S	S	*	*			trans	83.2	121.7	171.3	-60.2	178	175.4	176.2	-1.2	117.1
385	S	26.9	Very low	29.7	Very low	100 Å²	100	151.7 Å²	151.7	70%	0.699	77%	0.774	S	S	*	*			cis	103.7	155.3	26.6	72.9	0	0	0	0	114
386	V	31.9	Very low	29.3	Very low	119 Å²	119	156.8 Å²	156.8	72%	0.721	79%	0.786	S	S	*	*			trans	86.1	95.1	179.7	-169.4	0	0	0	0	113.1
387	I	27.5	Very low	29.2	Very low	136 Å²	136	153.3 Å²	153.3	70%	0.697	79%	0.787	S	S	*	*				69.7	114.5	75.1	-59.2	161	0	0	0	113.1
388	N	32.5	Very low	29.1	Very low	159 Å²	159	152.4 Å²	152.4	85%	0.85	79%	0.787	S	S	*	*			trans	-171.6	160.6	133.7	-95.7	-20.4	0	0	0	112.2
389	D	32.6	Very low	28.8	Very low	134 Å²	134	155.1 Å²	155.1	72%	0.717	79%	0.79	S	S	*	*			trans	-95.8	156.7	-153.8	-84.5	-76.3	0	0	0	117.9
390	K	28.2	Very low	28.7	Very low	186 Å²	186	149 Å²	149	81%	0.809	78%	0.782	S	S	*	*			trans	13.4	171	135.3	-88.7	172.6	-179.7	169.5	0	122.2
391	P	33	Very low	28.6	Very low	112 Å²	112	148.5 Å²	148.5	73%	0.727	78%	0.779	S	S	*	*			cis	-138	179.5	-6.8	28.4	-4.1	0	0	0	116.9
392	H	27.2	Very low	28.4	Very low	162 Å²	162	148.9 Å²	148.9	75%	0.75	78%	0.78	S	S	*	*			trans	-1	135.7	154.6	-92	-80.3	0	0	0	121.9
393	I	28.6	Very low	28.1	Very low	168 Å²	168	150.8 Å²	150.8	86%	0.862	78%	0.784	S	S	*	*			trans	-127.9	142.6	135.8	-65.3	-178	0	0	0	108.5
394	Q	26.5	Very low	28.2	Very low	159 Å²	159	150.5 Å²	150.5	74%	0.743	78%	0.781	S	S	*	*			trans	-99.1	146.6	178.4	-64.2	165.8	-45.1	0	0	110.8
395	S	28.8	Very low	28	Very low	117 Å²	117	144.1 Å²	144.1	82%	0.818	77%	0.772	S	S	*	*			trans	-149.6	128.4	158.1	61.3	0	0	0	0	111.7
396	F	26.9	Very low	28.1	Very low	203 Å²	203	146.8 Å²	146.8	89%	0.89	78%	0.777	S	S	*	*			trans	-48.8	155.2	-168.1	-66.5	-96	0	0	0	119.2
397	T	23.1	Very low	27.8	Very low	132 Å²	132	150.1 Å²	150.1	81%	0.81	78%	0.784	S	S	*	*			trans	-78.9	142.4	171.5	45.8	0	0	0	0	113.4
398	M	26	Very low	27.9	Very low	182 Å²	182	154.3 Å²	154.3	90%	0.897	79%	0.793	S	S	*	*			trans	-145	120.2	142.9	-84	-157.5	74	0	0	109.8
399	E	24.7	Very low	27.8	Very low	166 Å²	166	151.9 Å²	151.9	78%	0.776	79%	0.789	S	S	*	*			trans	-94.6	148.9	159.9	-67.1	-176.7	142.8	0	0	109
400	P	27.3	Very low	27.5	Very low	117 Å²	117	153 Å²	153	76%	0.76	79%	0.794	S	S	*	*			trans	-120.4	119.7	140.6	32.7	-24.8	0	0	0	110.8
401	I	24.8	Very low	27.5	Very low	144 Å²	144	150.5 Å²	150.5	74%	0.738	80%	0.795	S	S	*	*			trans	-67.5	131.6	166.7	-61.6	160	0	0	0	108.8
402	I	28.9	Very low	27.2	Very low	162 Å²	162	153.1 Å²	153.1	83%	0.831	80%	0.801	S	S	*	*			trans	-151.7	140.8	150.6	-89.9	126.4	0	0	0	108.9
403	H	25.5	Very low	27.4	Very low	175 Å²	175	154 Å²	154	81%	0.81	81%	0.806	S	S	*	*			trans	-96.4	-166.1	-168.1	-150.1	-139.9	0	0	0	110.4
404	P	31	Very low	27.3	Very low	92 Å²	92	154.3 Å²	154.3	60%	0.597	80%	0.803	S	S	*	*			trans	-112.5	-174.8	-141	21.2	6.9	0	0	0	111.6
405	S	25.8	Very low	27.5	Very low	102 Å²	102	156.1 Å²	156.1	71%	0.713	81%	0.809	S	S	*	*			trans	163.6	111.4	144.2	-77.6	0	0	0	0	110.7
406	I	28.7	Very low	27.6	Very low	156 Å²	156	159.4 Å²	159.4	80%	0.8	81%	0.812	S	S	*	*			trans	-140.2	116.2	152.4	-59.7	-176.9	0	0	0	106.4	Y408	I406-Y408 HydrophobicContact CG2-CD2 4Å; I406-Y408 HydrophobicContact CG2-CE2 3.98Å
407	Q	26.8	Very low	27.5	Very low	188 Å²	188	157.6 Å²	157.6	88%	0.879	81%	0.811	S	S	*	*			trans	-96.4	149.7	166.4	-67.9	175.8	-76	0	0	108.6
408	Y	28.8	Very low	27.8	Very low	225 Å²	225	159 Å²	159	88%	0.882	81%	0.811	S	S	*	*			trans	-130	142.8	155.2	-93.2	-86.6	0	0	0	108	I406	I406-Y408 HydrophobicContact CG2-CD2 4Å; I406-Y408 HydrophobicContact CG2-CE2 3.98Å
409	S	29.6	Very low	28.1	Very low	108 Å²	108	155.5 Å²	155.5	76%	0.755	81%	0.805	S	S	*	*			trans	-113	147.8	-170.9	51.5	0	0	0	0	111.4
410	D	26.3	Very low	28.4	Very low	156 Å²	156	153.4 Å²	153.4	83%	0.834	81%	0.805	S	S	*	*			trans	-70.4	150.7	178.1	-54	-67.5	0	0	0	113.3
411	T	28.9	Very low	28.6	Very low	135 Å²	135	153.1 Å²	153.1	83%	0.828	81%	0.813	S	S	*	*			trans	-138	115.5	163.1	47.2	0	0	0	0	108.4
412	I	26	Very low	29	Very low	166 Å²	166	149.6 Å²	149.6	85%	0.851	81%	0.812	S	S	*	*			trans	-94.7	130.8	169.7	-62.7	171.6	0	0	0	107
413	E	32.7	Very low	29.2	Very low	180 Å²	180	148.1 Å²	148.1	84%	0.841	81%	0.811	S	S	*	*			trans	-108	140.4	165.9	-81.3	-171	157.8	0	0	110.3
414	E	26.4	Very low	29.5	Very low	175 Å²	175	146.1 Å²	146.1	82%	0.818	81%	0.811	S	S	*	*			trans	-103.6	140.7	-171.9	176.4	179	-145.2	0	0	109
415	F	30.1	Very low	29.4	Very low	198 Å²	198	146.9 Å²	146.9	87%	0.868	82%	0.818	S	S	*	*			trans	-143	131.1	172.5	-101.7	-78.6	0	0	0	113.4
416	E	30.3	Very low	29.9	Very low	185 Å²	185	147.1 Å²	147.1	86%	0.864	82%	0.817	S	S	*	*			trans	-82.3	163.8	-169.6	-65.3	178.1	110.4	0	0	115.4
417	L	26	Very low	30.1	Very low	166 Å²	166	147.9 Å²	147.9	87%	0.869	82%	0.823	S	S	*	*			trans	-71.2	148.2	176.2	-77	148	0	0	0	114.1
418	I	29.3	Very low	30.1	Very low	161 Å²	161	144.6 Å²	144.6	83%	0.826	82%	0.82	S	S	*	*			trans	-132.8	136.2	155.5	-58.9	179.6	0	0	0	109.6
419	S	31.8	Very low	30.3	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	81%	0.813	S	S	*	*			trans	-152.1	146.5	168.4	-75.3	0	0	0	0	110.1
420	P	31.9	Very low	30.2	Very low	122 Å²	122	139.8 Å²	139.8	79%	0.792	82%	0.816	S	S	*	*			trans	-142.8	131.8	154.8	32.6	-14.5	0	0	0	117.1
421	A	32	Very low	30.2	Very low	111 Å²	111	144.3 Å²	144.3	92%	0.917	82%	0.821	S	S	*	*			trans	72.6	132.7	135.4	0	0	0	0	0	122.8
422	G	33.1	Very low	30	Very low	70 Å²	70	149.2 Å²	149.2	72%	0.722	83%	0.825	S	S	*	*			trans	-174.6	32.3	176.4	0	0	0	0	0	119.6
423	T	32.9	Very low	30.1	Very low	131 Å²	131	149.5 Å²	149.5	80%	0.804	82%	0.822	S	S	*	*			trans	42.8	119.1	154.6	41.3	0	0	0	0	124.9
424	V	30.3	Very low	29.9	Very low	133 Å²	133	148.8 Å²	148.8	81%	0.806	82%	0.819	S	S	*	*				64.8	132.6	123.8	179.4	0	0	0	0	118.8
425	S	29.2	Very low	29.9	Very low	109 Å²	109	147.5 Å²	147.5	76%	0.762	82%	0.817	S	S	*	*			cis	-160.6	170.4	41.1	-137.8	0	0	0	0	113.5
426	P	36.2	Very low	29.6	Very low	106 Å²	106	144.3 Å²	144.3	69%	0.688	81%	0.814	S	S	*	*			trans	-114.1	170	-162.9	42.3	-34.8	0	0	0	117.2
427	N	34.5	Very low	29.4	Very low	173 Å²	173	141.6 Å²	141.6	93%	0.925	81%	0.81	S	S	*	*			trans	-163	151.7	137.7	-99.5	-39	0	0	0	113
428	C	26.9	Very low	29.7	Very low	119 Å²	119	137.1 Å²	137.1	80%	0.804	79%	0.789	S	S	*	*			trans	-106.1	-174.6	-164.6	-127.5	0	0	0	0	112.3
429	P	32.1	Very low	29.9	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	79%	0.786	S	S	*	*			cis	-139.5	-178.5	-9.6	38	-18.3	0	0	0	116.8
430	S	27	Very low	30.1	Very low	118 Å²	118	142.1 Å²	142.1	83%	0.825	79%	0.79	S	S	*	*			trans	92.8	87.2	144.6	-148.7	0	0	0	0	120.9
431	R	27.1	Very low	30.4	Very low	251 Å²	251	142.9 Å²	142.9	95%	0.947	78%	0.783	S	S	*	*				174.5	100.8	115.6	-169.8	175.6	-167.4	-159.8	2.9	108.5
432	R	25.4	Very low	30.9	Very low	239 Å²	239	142 Å²	142	90%	0.902	76%	0.761	S	S	*	*			trans	-139.3	104.4	-175.1	-170.9	-178.1	-163.4	158.4	5.7	110.4
433	E	26.9	Very low	31.5	Very low	171 Å²	171	146.4 Å²	146.4	80%	0.799	76%	0.762	S	S	*	*			trans	-168.7	139.1	159.8	-111.3	156.3	-147.7	0	0	108.8
434	H	27.8	Very low	32.3	Very low	166 Å²	166	145.9 Å²	145.9	77%	0.769	76%	0.755	S	S	*	*	S	Bend	trans	66.9	93.4	176.9	-48.6	-66.7	0	0	0	119
435	L	28.1	Very low	33.6	Very low	148 Å²	148	143.5 Å²	143.5	78%	0.775	74%	0.735	S	S	*	*			trans	164.6	71.4	130.5	-90.1	155.5	0	0	0	110.5
436	T	23.7	Very low	34.8	Very low	131 Å²	131	140 Å²	140	80%	0.804	71%	0.708	S	S	*	*			trans	-139.9	69.2	169.5	50.6	0	0	0	0	109.2
437	T	26.4	Very low	36	Very low	127 Å²	127	141.7 Å²	141.7	78%	0.779	71%	0.705	S	S	*	*	S	Bend	trans	-175	97.3	171.9	35.8	0	0	0	0	106.5
438	T	31.9	Very low	37.4	Very low	72 Å²	72	136.1 Å²	136.1	44%	0.442	68%	0.683	S	S	.	*			trans	-176.9	-25.6	168.8	18	0	0	0	0	113.7	E440 E441	T438-E440 PolarHBondContact O-N 3.14Å; T438-E441 PolarHBondContact O-N 3.19Å; T438-E441 VanDerWaalsContact O-N 3.09Å
439	Y	33.2	Very low	38.9	Very low	191 Å²	191	131.6 Å²	131.6	75%	0.749	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-0.9	-170.4	-68	-73.1	0	0	0	116.9
440	E	35.9	Very low	39.7	Very low	183 Å²	183	126.5 Å²	126.5	86%	0.855	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-14.2	174.1	-66.2	179.5	174.1	0	0	112.6	T438	T438-E440 PolarHBondContact O-N 3.14Å
441	E	39	Very low	41.3	Very low	138 Å²	138	123.2 Å²	123.2	65%	0.645	60%	0.597	S	S	*	*	H	α-helix	trans	-86.6	-13.1	-177.5	-62.6	-178.1	169.4	0	0	113.4	T438	T438-E441 PolarHBondContact O-N 3.19Å; T438-E441 VanDerWaalsContact O-N 3.09Å
442	E	42.6	Very low	42.8	Very low	94 Å²	94	114.1 Å²	114.1	44%	0.439	58%	0.575	S	S	.	*	H	α-helix	trans	-82.9	-29	-170.4	-54.9	-153.2	109.4	0	0	114.3	K165 T446	K165-E442 IonicContact NZ-OE1 3.82Å; K165-E442 PolarHBondContact NZ-OE1 3.5Å; K165-E442 VanDerWaalsContact NZ-OE1 3.14Å; E442-T446 PolarHBondContact O-OG1 3.18Å
443	E	45.1	Very low	44.2	Very low	162 Å²	162	105.9 Å²	105.9	76%	0.757	55%	0.549	S	S	*	.	H	α-helix	trans	-72.5	-39.5	177.7	-62.9	-171.1	162.8	0	0	111.1	T446 F447	E443-T446 PolarHBondContact O-N 3.19Å; E443-F447 WeakPolarHBondContact O-CB 3.5Å; E443-F447 PolarHBondContact O-N 3.04Å
444	D	50.1	Low	45.3	Very low	120 Å²	120	102.9 Å²	102.9	64%	0.642	54%	0.537	S	S	*	.	H	α-helix	trans	-63.9	-44.5	-179.7	-87.1	-11.5	0	0	0	113.2	T446 F447 A448	D444-T446 VanDerWaalsContact C-N 3.29Å; D444-T446 PolarHBondContact O-N 2.97Å; D444-F447 PolarHBondContact O-N 3.09Å; D444-A448 VanDerWaalsContact O-CB 3.24Å; D444-A448 WeakPolarHBondContact O-CB 3.28Å; D444-A448 PolarHBondContact O-N 3.14Å
445	E	57.5	Low	46.3	Very low	82 Å²	82	100.7 Å²	100.7	38%	0.383	53%	0.531	S	S	.	.	H	α-helix	trans	-62.8	-38.5	176	-73.4	-166.5	132	0	0	111.6	K165 A448 A449	K165-E445 WeakPolarHBondContact CE-OE2 3.38Å; K165-E445 IonicContact NZ-OE2 3.14Å; K165-E445 PolarHBondContact NZ-OE2 2.9Å; E445-A448 PolarHBondContact O-N 3.38Å; E445-A449 WeakPolarHBondContact O-CB 3.38Å; E445-A449 PolarHBondContact O-N 3.15Å
446	T	53	Low	46.9	Very low	35 Å²	35	96.6 Å²	96.6	22%	0.215	52%	0.515	C	S	.	.	H	α-helix	trans	-70.8	-42.7	-178.9	-48.7	0	0	0	0	111.2	L161 E442 E443 D444 A449 T450	L161-T446 VanDerWaalsContact CD1-CA 3.5Å; L161-T446 HydrophobicContact CD1-CG2 4.3Å; E442-T446 PolarHBondContact O-OG1 3.18Å; E443-T446 PolarHBondContact O-N 3.19Å; D444-T446 VanDerWaalsContact C-N 3.29Å; D444-T446 PolarHBondContact O-N 2.97Å; T446-A449 PolarHBondContact O-N 3.22Å; T446-T450 WeakPolarHBondContact O-CB 3.3Å; T446-T450 PolarHBondContact O-N 2.71Å; T446-T450 PolarHBondContact O-OG1 3.44Å
447	F	61.9	Low	47.6	Very low	142 Å²	142	95.3 Å²	95.3	62%	0.623	51%	0.511	S	S	*	.	H	α-helix	trans	-63.2	-42	172.2	-177.2	-100.1	0	0	0	112	E443 D444 T450 T451	E443-F447 WeakPolarHBondContact O-CB 3.5Å; E443-F447 PolarHBondContact O-N 3.04Å; D444-F447 PolarHBondContact O-N 3.09Å; F447-T450 PolarHBondContact O-N 2.76Å; F447-T451 WeakPolarHBondContact O-CB 3.31Å; F447-T451 PolarHBondContact O-N 3.5Å; F447-T451 PolarHBondContact O-OG1 2.86Å
448	A	63.6	Low	47.9	Very low	56 Å²	56	96 Å²	96	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-42.9	177.8	0	0	0	0	0	112.5	D444 E445 T451 A452	D444-A448 VanDerWaalsContact O-CB 3.24Å; D444-A448 WeakPolarHBondContact O-CB 3.28Å; D444-A448 PolarHBondContact O-N 3.14Å; E445-A448 PolarHBondContact O-N 3.38Å; A448-T451 PolarHBondContact O-N 2.9Å; A448-A452 VanDerWaalsContact O-CB 3.27Å; A448-A452 WeakPolarHBondContact O-CB 3.15Å; A448-A452 PolarHBondContact O-N 3.35Å
449	A	58	Low	47.8	Very low	25 Å²	25	100.7 Å²	100.7	21%	0.207	53%	0.532	C	S	.	.	H	α-helix	trans	-65	-45.1	175.7	0	0	0	0	0	112.1	C157 L161 E445 T446 T451 A452 L453	C157-A449 HydrophobicContact CB-CB 4.44Å; L161-A449 HydrophobicContact CD1-CB 3.81Å; L161-A449 HydrophobicContact CD2-CB 4.24Å; L161-A449 HydrophobicContact CG-CB 4.17Å; E445-A449 WeakPolarHBondContact O-CB 3.38Å; E445-A449 PolarHBondContact O-N 3.15Å; T446-A449 PolarHBondContact O-N 3.22Å; A449-T451 PolarHBondContact O-N 3.3Å; A449-A452 PolarHBondContact O-N 3.46Å; A449-L453 PolarHBondContact O-N 3.3Å
450	T	49.9	Very low	47.6	Very low	6 Å²	6	95.7 Å²	95.7	4%	0.037	52%	0.524	C	S	.	.	H	α-helix	trans	-59.5	-46.5	175.6	-56.1	0	0	0	0	110.9	L150 V153 E154 C157 T446 F447 A452 L453 L454	L150-T450 HydrophobicContact CD1-CG2 4.11Å; V153-T450 HydrophobicContact CG1-CG2 4.09Å; E154-T450 HydrophobicContact CG-CG2 3.93Å; C157-T450 VanDerWaalsContact SG-CA 3.58Å; T446-T450 WeakPolarHBondContact O-CB 3.3Å; T446-T450 PolarHBondContact O-N 2.71Å; T446-T450 PolarHBondContact O-OG1 3.44Å; F447-T450 PolarHBondContact O-N 2.76Å; T450-A452 PolarHBondContact O-N 3.18Å; T450-L453 PolarHBondContact O-N 2.89Å; T450-L454 HydrophobicContact CG2-CD1 3.99Å; T450-L454 WeakPolarHBondContact O-CB 3.32Å; T450-L454 VanDerWaalsContact O-CG 3.28Å; T450-L454 WeakPolarHBondContact O-CG 3.32Å; T450-L454 PolarHBondContact O-N 3.11Å
451	T	59.9	Low	47.3	Very low	49 Å²	49	92 Å²	92	30%	0.301	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-40.2	176.2	-62.8	0	0	0	0	112	F447 A448 A449 N455	F447-T451 WeakPolarHBondContact O-CB 3.31Å; F447-T451 PolarHBondContact O-N 3.5Å; F447-T451 PolarHBondContact O-OG1 2.86Å; A448-T451 PolarHBondContact O-N 2.9Å; A449-T451 PolarHBondContact O-N 3.3Å; T451-N455 VanDerWaalsContact CG2-ND2 3.29Å; T451-N455 WeakPolarHBondContact CG2-ND2 3.41Å; T451-N455 VanDerWaalsContact O-CB 3.25Å; T451-N455 WeakPolarHBondContact O-CB 3.29Å; T451-N455 PolarHBondContact O-N 3.4Å; T451-N455 PolarHBondContact O-ND2 3.43Å
452	A	59.4	Low	47	Very low	59 Å²	59	94.2 Å²	94.2	49%	0.488	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-41.6	176.5	0	0	0	0	0	111.7	A448 A449 T450 N455 S456	A448-A452 VanDerWaalsContact O-CB 3.27Å; A448-A452 WeakPolarHBondContact O-CB 3.15Å; A448-A452 PolarHBondContact O-N 3.35Å; A449-A452 PolarHBondContact O-N 3.46Å; T450-A452 PolarHBondContact O-N 3.18Å; A452-N455 PolarHBondContact O-N 3.16Å; A452-S456 WeakPolarHBondContact O-CB 3.34Å; A452-S456 PolarHBondContact O-N 2.93Å; A452-S456 PolarHBondContact O-OG 2.81Å
453	L	54	Low	46.3	Very low	67 Å²	67	95.2 Å²	95.2	35%	0.351	54%	0.535	S	S	.	.	H	α-helix	trans	-68.1	-44.1	177.4	-82.9	162.1	0	0	0	112.2	C157 F185 A449 T450 N455 S456	C157-L453 WeakPolarHBondContact SG-CD1 3.49Å; F185-L453 HydrophobicContact CE2-CD2 4.31Å; A449-L453 PolarHBondContact O-N 3.3Å; T450-L453 PolarHBondContact O-N 2.89Å; L453-N455 VanDerWaalsContact C-N 3.31Å; L453-N455 PolarHBondContact O-N 2.96Å; L453-S456 WeakPolarHBondContact CA-OG 3.4Å; L453-S456 PolarHBondContact O-N 3.38Å; L453-S456 PolarHBondContact O-OG 3.01Å
454	L	50.5	Low	45.4	Very low	107 Å²	107	93.3 Å²	93.3	56%	0.56	54%	0.536	S	S	*	.	H	α-helix	trans	-64.3	-32.1	175.5	-69.9	172.2	0	0	0	113.2	L150 V153 T450	L150-L454 HydrophobicContact CD1-CD1 4.37Å; V153-L454 HydrophobicContact CG1-CD2 4.32Å; V153-L454 HydrophobicContact CG1-CG 4.37Å; V153-L454 HydrophobicContact CG2-CD2 4.48Å; T450-L454 HydrophobicContact CG2-CD1 3.99Å; T450-L454 WeakPolarHBondContact O-CB 3.32Å; T450-L454 VanDerWaalsContact O-CG 3.28Å; T450-L454 WeakPolarHBondContact O-CG 3.32Å; T450-L454 PolarHBondContact O-N 3.11Å
455	N	49	Very low	44.4	Very low	120 Å²	120	91.8 Å²	91.8	64%	0.642	54%	0.535	S	S	*	.	H	α-helix	trans	-91.6	-13.7	177.8	-70	-49.7	0	0	0	114.1	T451 A452 L453 S457	T451-N455 VanDerWaalsContact CG2-ND2 3.29Å; T451-N455 WeakPolarHBondContact CG2-ND2 3.41Å; T451-N455 VanDerWaalsContact O-CB 3.25Å; T451-N455 WeakPolarHBondContact O-CB 3.29Å; T451-N455 PolarHBondContact O-N 3.4Å; T451-N455 PolarHBondContact O-ND2 3.43Å; A452-N455 PolarHBondContact O-N 3.16Å; L453-N455 VanDerWaalsContact C-N 3.31Å; L453-N455 PolarHBondContact O-N 2.96Å; N455-S457 VanDerWaalsContact C-N 3.28Å; N455-S457 PolarHBondContact O-N 3.32Å
456	S	41.4	Very low	42.9	Very low	63 Å²	63	95.4 Å²	95.4	44%	0.441	56%	0.555	S	S	.	*			trans	-72.8	82.1	176.9	62.7	0	0	0	0	111.2	A452 L453 V458	A452-S456 WeakPolarHBondContact O-CB 3.34Å; A452-S456 PolarHBondContact O-N 2.93Å; A452-S456 PolarHBondContact O-OG 2.81Å; L453-S456 WeakPolarHBondContact CA-OG 3.4Å; L453-S456 PolarHBondContact O-N 3.38Å; L453-S456 PolarHBondContact O-OG 3.01Å; S456-V458 PolarHBondContact O-N 3.32Å; S456-V458 VanDerWaalsContact O-N 3.12Å
457	S	37.2	Very low	41.8	Very low	103 Å²	103	101.7 Å²	101.7	72%	0.72	59%	0.587	S	S	*	*			trans	-53.4	119.4	157.5	-69.3	0	0	0	0	108	N455 H459	N455-S457 VanDerWaalsContact C-N 3.28Å; N455-S457 PolarHBondContact O-N 3.32Å; S457-H459 PolarHBondContact O-N 3.2Å
458	V	33	Very low	40.1	Very low	143 Å²	143	100.6 Å²	100.6	87%	0.867	60%	0.597	S	S	*	*			trans	-66.7	80.9	175.8	-178.8	0	0	0	0	108.6	S456 C460	S456-V458 PolarHBondContact O-N 3.32Å; S456-V458 VanDerWaalsContact O-N 3.12Å; V458-C460 VanDerWaalsContact C-N 3.31Å; V458-C460 PolarHBondContact O-N 3.14Å
459	H	30.4	Very low	38.6	Very low	169 Å²	169	102.6 Å²	102.6	78%	0.782	61%	0.607	S	S	*	*			trans	-81.9	82.4	-176.3	-156.3	-44.3	0	0	0	108.4	S457 P461	S457-H459 PolarHBondContact O-N 3.2Å; H459-P461 WeakPolarHBondContact O-CD 3.35Å
460	C	27.9	Very low	37.2	Very low	87 Å²	87	110.2 Å²	110.2	59%	0.588	64%	0.638	S	S	*	*			trans	-57.3	127.5	171.1	-169.5	0	0	0	0	108.9	V458 Q462	V458-C460 VanDerWaalsContact C-N 3.31Å; V458-C460 PolarHBondContact O-N 3.14Å; C460-Q462 PolarHBondContact O-N 3.49Å
461	P	30.5	Very low	36.2	Very low	106 Å²	106	120 Å²	120	69%	0.688	68%	0.681	S	S	*	*			trans	-70.7	103.5	174.2	27.6	-32.1	0	0	0	108.9	H459 N463	H459-P461 WeakPolarHBondContact O-CD 3.35Å; P461-N463 VanDerWaalsContact C-N 3.32Å; P461-N463 PolarHBondContact O-N 3.18Å
462	Q	32.9	Very low	34.5	Very low	184 Å²	184	124.7 Å²	124.7	86%	0.86	70%	0.704	S	S	*	*			trans	-67.7	93.5	168	-75.1	-170.1	-10.9	0	0	109.1	C460 P464	C460-Q462 PolarHBondContact O-N 3.49Å; Q462-P464 VanDerWaalsContact O-CD 3.31Å; Q462-P464 WeakPolarHBondContact O-CD 2.95Å
463	N	27	Very low	33.2	Very low	115 Å²	115	132 Å²	132	62%	0.615	73%	0.725	S	S	*	*			trans	-73.4	112.6	177.3	-157	-2.5	0	0	0	109.2	P461 S465	P461-N463 VanDerWaalsContact C-N 3.32Å; P461-N463 PolarHBondContact O-N 3.18Å; N463-S465 PolarHBondContact O-N 3.25Å
464	P	27	Very low	32	Very low	121 Å²	121	132 Å²	132	79%	0.786	74%	0.741	S	S	*	*			trans	-97.2	69.8	-163.4	37.3	-33.5	0	0	0	112.2	Q462	Q462-P464 VanDerWaalsContact O-CD 3.31Å; Q462-P464 WeakPolarHBondContact O-CD 2.95Å
465	S	28	Very low	30.9	Very low	88 Å²	88	136.2 Å²	136.2	62%	0.615	76%	0.759	S	S	*	*			trans	-162.1	57.6	-175.2	50.9	0	0	0	0	117.7	N463	N463-S465 PolarHBondContact O-N 3.25Å
466	I	27.5	Very low	30	Very low	158 Å²	158	135.4 Å²	135.4	81%	0.81	77%	0.768	S	S	*	*			trans	-143.6	86.6	145.8	-49	-179.7	0	0	0	111
467	L	29.2	Very low	29.4	Very low	167 Å²	167	136.9 Å²	136.9	87%	0.874	78%	0.784	S	S	*	*			trans	-139.3	72.3	148.2	-94.9	179.8	0	0	0	108.2	S469	L467-S469 PolarHBondContact O-N 2.71Å; L467-S469 VanDerWaalsContact O-N 3.15Å
468	S	26.5	Very low	29.2	Very low	120 Å²	120	141.1 Å²	141.1	84%	0.839	79%	0.793	S	S	*	*			trans	-78	89.7	172.6	-60.1	0	0	0	0	110.1
469	S	31.8	Very low	29	Very low	97 Å²	97	139.9 Å²	139.9	68%	0.678	79%	0.786	S	S	*	*			trans	-150.8	84.3	155.2	65.6	0	0	0	0	110.1	L467	L467-S469 PolarHBondContact O-N 2.71Å; L467-S469 VanDerWaalsContact O-N 3.15Å
470	E	29.1	Very low	29.2	Very low	185 Å²	185	140.5 Å²	140.5	86%	0.864	79%	0.786	S	S	*	*			trans	40.9	105	141.7	-57.3	179.7	162.3	0	0	118.5
471	F	28	Very low	29.6	Very low	211 Å²	211	145.1 Å²	145.1	93%	0.925	80%	0.799	S	S	*	*			trans	-151.3	113.3	130.5	-123.6	-83.3	0	0	0	110.1
472	N	24.6	Very low	29.5	Very low	149 Å²	149	147.4 Å²	147.4	80%	0.797	81%	0.806	S	S	*	*			trans	-89.8	143.2	179.4	-99.3	-44.3	0	0	0	111.4
473	F	30.9	Very low	29.5	Very low	211 Å²	211	146.5 Å²	146.5	93%	0.925	81%	0.805	S	S	*	*			trans	179.4	103.6	139.8	-98.1	-68.7	0	0	0	105.6
474	G	29.4	Very low	29.4	Very low	67 Å²	67	149.3 Å²	149.3	69%	0.691	81%	0.812	S	S	*	*				84.6	74.3	84.3	0	0	0	0	0	109.1
475	E	27.2	Very low	29.7	Very low	197 Å²	197	151.3 Å²	151.3	92%	0.921	82%	0.815	S	S	*	*				61.1	101.6	87.9	-169	173.3	-154.7	0	0	113.8
476	A	30.7	Very low	29.9	Very low	102 Å²	102	154.1 Å²	154.1	84%	0.843	82%	0.818	S	S	*	*			trans	-163.6	104.5	151.4	0	0	0	0	0	108.7
477	A	27.8	Very low	30	Very low	94 Å²	94	151 Å²	151	78%	0.777	81%	0.81	S	S	*	*			trans	-84.4	145.5	164.2	0	0	0	0	0	109.1
478	E	33.9	Very low	30.2	Very low	193 Å²	193	150.3 Å²	150.3	90%	0.902	81%	0.813	S	S	*	*			trans	-171.9	150.9	131.1	-107.2	175.6	-166.6	0	0	113.7
479	T	28.8	Very low	30.4	Very low	117 Å²	117	151 Å²	151	72%	0.718	81%	0.807	S	S	*	*			trans	-71.2	148.2	-171.1	45.5	0	0	0	0	115.6
480	K	34.7	Very low	30.4	Very low	182 Å²	182	152.4 Å²	152.4	79%	0.791	81%	0.811	S	S	*	*			trans	167.8	113.7	136.5	-91	149.8	-169.8	163.9	0	109.1
481	E	35.5	Very low	30.7	Very low	184 Å²	184	148.7 Å²	148.7	86%	0.86	80%	0.803	S	S	*	*				72.3	130.3	86.1	-76.5	-163.4	136	0	0	115.1
482	N	29.2	Very low	30.8	Very low	154 Å²	154	142.9 Å²	142.9	82%	0.824	79%	0.789	S	S	*	*			trans	-53.9	150.7	-174.9	-54.1	-58.6	0	0	0	114.8
483	I	31.7	Very low	31.2	Very low	164 Å²	164	142.4 Å²	142.4	84%	0.841	79%	0.786	S	S	*	*			trans	-151.8	136.5	131	-94.3	135.8	0	0	0	108.7
484	F	26.7	Very low	31.3	Very low	175 Å²	175	138.6 Å²	138.6	77%	0.768	78%	0.78	S	S	*	*			trans	-111.4	123.2	-179.6	-177.6	-81.5	0	0	0	108.3
485	L	32.5	Very low	31.4	Very low	162 Å²	162	141.5 Å²	141.5	85%	0.848	79%	0.785	S	S	*	*			trans	-140.2	128	168	-83.6	-176.5	0	0	0	114
486	H	32.7	Very low	31.6	Very low	147 Å²	147	139.8 Å²	139.8	68%	0.681	78%	0.782	S	S	*	*			trans	-42.8	139.1	-178.3	-92.1	-84.9	0	0	0	120.5
487	S	29.1	Very low	31.7	Very low	92 Å²	92	141.1 Å²	141.1	64%	0.643	77%	0.774	S	S	*	*				37.5	121.5	119.3	-47.9	0	0	0	0	121.3
488	V	32.9	Very low	32	Very low	153 Å²	153	143.1 Å²	143.1	93%	0.927	77%	0.772	S	S	*	*			trans	-134.6	145	132	-173.1	0	0	0	0	109.9
489	N	31.4	Very low	31.7	Very low	135 Å²	135	142 Å²	142	72%	0.722	77%	0.773	S	S	*	*			trans	-96.6	145.7	-165.3	-98.8	-20.5	0	0	0	111.5
490	V	30.9	Very low	31.8	Very low	126 Å²	126	141 Å²	141	76%	0.764	77%	0.77	S	S	*	*				100.6	146.4	101.4	153.1	0	0	0	0	114.9
491	P	35.4	Very low	31.5	Very low	107 Å²	107	139.1 Å²	139.1	70%	0.695	77%	0.767	S	S	*	*				-141.7	-147.3	-60.1	45.1	-23.1	0	0	0	112.1
492	S	31.2	Very low	31.4	Very low	90 Å²	90	139.9 Å²	139.9	63%	0.629	77%	0.768	S	S	*	*			trans	90.9	112.9	142.9	-96.2	0	0	0	0	122.5
493	D	32.1	Very low	31.1	Very low	138 Å²	138	143.6 Å²	143.6	74%	0.738	77%	0.77	S	S	*	*				116.4	145.6	120.7	-66.6	-3.9	0	0	0	120.9
494	T	33.1	Very low	31	Very low	131 Å²	131	142.6 Å²	142.6	80%	0.804	77%	0.772	S	S	*	*			trans	69	87.1	166.7	49.4	0	0	0	0	119.8
495	V	31.3	Very low	31.2	Very low	129 Å²	129	138.1 Å²	138.1	78%	0.782	77%	0.768	S	S	*	*				10.8	116	116.9	-175.3	0	0	0	0	115.9
496	N	32.5	Very low	30.9	Very low	161 Å²	161	137.2 Å²	137.2	86%	0.861	76%	0.763	S	S	*	*				-167.5	173	121.3	-106.6	-42.5	0	0	0	114.1
497	N	32.3	Very low	30.9	Very low	129 Å²	129	137 Å²	137	69%	0.69	76%	0.762	S	S	*	*			trans	-93.1	179.9	-153.8	-162.1	27.1	0	0	0	115
498	D	33.4	Very low	30.9	Very low	136 Å²	136	138.5 Å²	138.5	73%	0.727	76%	0.763	S	S	*	*			trans	89.1	116.2	154.2	-60.4	-49	0	0	0	120.8	S500	D498-S500 PolarHBondContact O-N 2.75Å
499	N	28.6	Very low	30.6	Very low	171 Å²	171	142 Å²	142	91%	0.914	76%	0.759	S	S	*	*			trans	-68.7	119.3	169.1	-69.8	-70.6	0	0	0	111.5
500	S	30.8	Very low	30.6	Very low	95 Å²	95	142.6 Å²	142.6	66%	0.664	76%	0.762	S	S	*	*			trans	-159	145.8	146.5	84.7	0	0	0	0	112.9	D498	D498-S500 PolarHBondContact O-N 2.75Å
501	I	28.6	Very low	30.4	Very low	142 Å²	142	141.8 Å²	141.8	73%	0.728	76%	0.762	S	S	*	*			trans	58.9	101.6	150.8	-53.2	158.3	0	0	0	117.4
502	K	32	Very low	30.3	Very low	201 Å²	201	142.5 Å²	142.5	87%	0.874	77%	0.766	S	S	*	*				-170.9	129.2	116.6	-100.4	144	-165.3	177.3	0	113.3
503	R	24.8	Very low	30.4	Very low	231 Å²	231	143.4 Å²	143.4	87%	0.872	77%	0.773	S	S	*	*			trans	-83.6	168.6	159.8	-76.5	179.9	165.3	125.5	-6.9	109.4
504	T	28.5	Very low	30.1	Very low	143 Å²	143	143 Å²	143	88%	0.877	78%	0.775	S	S	*	*			trans	74.6	118.8	152.2	1.6	0	0	0	0	117.3
505	A	30.3	Very low	30.1	Very low	82 Å²	82	144.6 Å²	144.6	68%	0.678	78%	0.777	S	S	*	*				-179.6	124.4	126.8	0	0	0	0	0	111
506	L	27.8	Very low	30	Very low	143 Å²	143	145.8 Å²	145.8	75%	0.749	78%	0.78	S	S	*	*			trans	56.2	141	143.3	-71.9	66.6	0	0	0	119.3
507	E	31.5	Very low	30.1	Very low	142 Å²	142	143 Å²	143	66%	0.664	77%	0.773	S	S	*	*			cis	-165.1	150.5	-1.6	-121.3	167.2	-170.3	0	0	112
508	N	28.8	Very low	30.1	Very low	123 Å²	123	140 Å²	140	66%	0.658	77%	0.772	S	S	*	*			trans	53.5	138.3	148	-54.8	-26	0	0	0	119
509	W	28.3	Very low	29.8	Very low	226 Å²	226	142 Å²	142	86%	0.856	78%	0.777	S	S	*	*			cis	-139.2	131.5	45.7	-86.3	47.1	0	0	0	114.2
510	L	30.4	Very low	29.9	Very low	148 Å²	148	141.7 Å²	141.7	78%	0.775	77%	0.768	S	S	*	*			trans	58.3	99.8	141.8	-56.3	175.5	0	0	0	121.1
511	S	25.8	Very low	30	Very low	110 Å²	110	145 Å²	145	77%	0.769	77%	0.773	S	S	*	*			trans	-82.7	-168.9	141.9	-39.5	0	0	0	0	109.4
512	P	34.2	Very low	29.9	Very low	121 Å²	121	146.9 Å²	146.9	79%	0.786	78%	0.778	S	S	*	*			cis	-125.8	-162.3	-0.6	37.9	-14.8	0	0	0	111.2
513	S	32.3	Very low	29.8	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	77%	0.771	S	S	*	*			cis	-164	158	27.3	49	0	0	0	0	113.4
514	T	27.2	Very low	29.9	Very low	129 Å²	129	136.9 Å²	136.9	79%	0.791	77%	0.769	S	S	*	*			trans	-70.4	148.2	172.2	46	0	0	0	0	113.7
515	I	32.6	Very low	30.1	Very low	165 Å²	165	140.4 Å²	140.4	85%	0.846	77%	0.768	S	S	*	*			trans	-152.9	146.6	141.3	-95.3	141.9	0	0	0	108.1
516	D	29.1	Very low	30	Very low	155 Å²	155	139.9 Å²	139.9	83%	0.829	77%	0.771	S	S	*	*			trans	-109.9	133.9	-179.9	172.6	28.5	0	0	0	109.6
517	S	34.6	Very low	30.1	Very low	102 Å²	102	140.7 Å²	140.7	71%	0.713	78%	0.775	S	S	*	*			trans	-170.5	121.9	166.2	59.9	0	0	0	0	113.8
518	G	32.3	Very low	29.9	Very low	66 Å²	66	141.5 Å²	141.5	68%	0.68	78%	0.784	S	S	*	*			trans	39.5	109.4	133.9	0	0	0	0	0	121.1
519	E	27.4	Very low	30	Very low	179 Å²	179	144.9 Å²	144.9	84%	0.836	79%	0.793	S	S	*	*				31.4	102.4	107.1	-158.2	-178.9	-133.3	0	0	117.2
520	F	31.3	Very low	29.8	Very low	164 Å²	164	139.3 Å²	139.3	72%	0.719	79%	0.789	S	S	*	*				-179.6	137.8	126.7	-117	-120.5	0	0	0	114.4
521	Q	31.6	Very low	29.7	Very low	163 Å²	163	137.5 Å²	137.5	76%	0.762	79%	0.785	S	S	*	*			trans	60.6	145.2	146	-79.3	178.1	-18.3	0	0	124.6
522	E	26.9	Very low	30.1	Very low	182 Å²	182	140.7 Å²	140.7	85%	0.85	79%	0.785	S	S	*	*			trans	-58.1	145.7	175.4	-61.8	158.4	106.7	0	0	114.3
523	A	31	Very low	29.7	Very low	86 Å²	86	144.2 Å²	144.2	71%	0.711	79%	0.789	S	S	*	*			trans	-142.9	96.9	153.2	0	0	0	0	0	110.1	Y525	A523-Y525 HydrophobicContact CB-CD2 4.49Å; A523-Y525 PolarHBondContact O-N 2.67Å
524	T	27.1	Very low	29.8	Very low	136 Å²	136	145.2 Å²	145.2	83%	0.834	79%	0.786	S	S	*	*			trans	-70.5	114.4	167.2	27.2	0	0	0	0	110.2
525	Y	31.5	Very low	29.8	Very low	217 Å²	217	144.1 Å²	144.1	85%	0.851	78%	0.779	S	S	*	*			trans	-127.9	108.7	162.7	-85.1	-83.1	0	0	0	109.7	A523	A523-Y525 HydrophobicContact CB-CD2 4.49Å; A523-Y525 PolarHBondContact O-N 2.67Å
526	G	27.5	Very low	29.8	Very low	72 Å²	72	146.3 Å²	146.3	74%	0.742	78%	0.778	S	S	*	*			trans	-77.2	140.8	174.7	0	0	0	0	0	111.5
527	L	30	Very low	29.8	Very low	159 Å²	159	145.7 Å²	145.7	83%	0.832	78%	0.775	S	S	*	*			trans	-114.2	100.9	163.2	-71.9	177	0	0	0	109
528	N	28.3	Very low	29.7	Very low	159 Å²	159	152.7 Å²	152.7	85%	0.85	80%	0.802	S	S	*	*			trans	-73.9	121.9	166.8	-77.3	-52	0	0	0	109.3
529	F	29.7	Very low	29.6	Very low	194 Å²	194	157 Å²	157	85%	0.851	81%	0.809	S	S	*	*			trans	-139.7	85.1	158.9	-90.2	-75.8	0	0	0	111.1
530	S	24.9	Very low	29.7	Very low	110 Å²	110	155.8 Å²	155.8	77%	0.769	81%	0.807	S	S	*	*			trans	-96.4	171	138.1	-79.5	0	0	0	0	107.7
531	P	29.5	Very low	29.6	Very low	109 Å²	109	155.4 Å²	155.4	71%	0.708	81%	0.812	S	S	*	*			cis	-129.9	179.5	1.5	36.5	-18.5	0	0	0	113.5
532	K	32.6	Very low	29.5	Very low	177 Å²	177	154.9 Å²	154.9	77%	0.77	82%	0.815	S	S	*	*				178.5	124.4	112.8	-95.8	172.6	-176.9	-175.2	0	111.9
533	F	26.6	Very low	29.6	Very low	196 Å²	196	153.3 Å²	153.3	86%	0.86	81%	0.813	S	S	*	*			trans	-70.5	133.6	151.3	-82.2	-109.6	0	0	0	107.7
534	D	34	Very low	29.5	Very low	129 Å²	129	157.7 Å²	157.7	69%	0.69	82%	0.819	S	S	*	*			trans	-119	107.2	155.3	-83.7	-45.1	0	0	0	108.4	Y536	D534-Y536 HydrophobicContact CB-CD2 4.4Å; D534-Y536 HydrophobicContact CB-CE2 4.34Å
535	V	27.9	Very low	29.7	Very low	107 Å²	107	159.3 Å²	159.3	65%	0.648	82%	0.818	S	S	*	*			trans	-82.5	118.9	169.9	172.6	0	0	0	0	107.3
536	Y	33	Very low	29.6	Very low	210 Å²	210	154.8 Å²	154.8	82%	0.824	82%	0.816	S	S	*	*			trans	-118.5	107.6	163.2	-85.1	-82.4	0	0	0	109.6	D534	D534-Y536 HydrophobicContact CB-CD2 4.4Å; D534-Y536 HydrophobicContact CB-CE2 4.34Å
537	N	29.1	Very low	29.8	Very low	143 Å²	143	161.8 Å²	161.8	77%	0.765	82%	0.822	S	S	*	*			trans	-71.3	130	165.2	-70.4	-66.4	0	0	0	109.3
538	L	31.5	Very low	29.7	Very low	248 Å²	248	162 Å²	162	100%	1.298	82%	0.821	S	S	*	*			trans	-167.6	0	137.9	-105.1	165.7	0	0	0	109.9

Retrieved 538 of 538 residues in 160.1 ms (Link to these results)

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