G4LUI7_SCHMA Loading...

14-3-3 protein, putative

AlphaFold DB , UniProt , Accession G4LUI7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 251 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	53.8	Low	83.5	Confident	114 Å²	114	93.5 Å²	93.5	56%	0.562	49%	0.489	S	S	*	.				0	129.3	0	-75.9	179.6	-125.1	0	0	108.5	T3 A103 I104	M1-T3 PolarHBondContact O-N 3.21Å; M1-A103 HydrophobicContact CE-CB 4.32Å; M1-I104 HydrophobicContact CE-CG1 4.36Å
2	T	59	Low	84.3	Confident	105 Å²	105	88.9 Å²	88.9	64%	0.644	46%	0.464	S	S	*	.			trans	-54.9	124.3	160.7	-2.2	0	0	0	0	107.1	S4	T2-S4 PolarHBondContact O-N 2.77Å
3	T	76.6	Confident	85.2	Confident	101 Å²	101	86.1 Å²	86.1	62%	0.62	46%	0.457	S	S	*	.			trans	-64.1	107.7	-178.8	-44.1	0	0	0	0	108.3	M1 Q8	M1-T3 PolarHBondContact O-N 3.21Å; T3-Q8 HydrophobicContact CG2-CG 4.45Å
4	S	90.8	Very high	85.9	Confident	9 Å²	9	84.1 Å²	84.1	6%	0.063	45%	0.447	C	S	.	.			trans	-59.5	138.7	173.5	171.9	0	0	0	0	109.3	T2 V6 T7 D32	T2-S4 PolarHBondContact O-N 2.77Å; S4-V6 PolarHBondContact O-N 3.16Å; S4-V6 WeakPolarHBondContact OG-CB 3.42Å; S4-V6 WeakPolarHBondContact OG-CG2 3.49Å; S4-V6 PolarHBondContact OG-N 3.42Å; S4-V6 VanDerWaalsContact OG-N 3.15Å; S4-T7 PolarHBondContact O-N 2.83Å; S4-T7 VanDerWaalsContact O-N 3.11Å; S4-T7 PolarHBondContact O-OG1 2.99Å; S4-D32 WeakPolarHBondContact CA-OD1 3.09Å; S4-D32 WeakPolarHBondContact CB-OD1 3.14Å; S4-D32 WeakPolarHBondContact OG-CA 3.28Å; S4-D32 PolarHBondContact OG-OD1 2.97Å
5	W	94.8	Very high	86.6	Confident	115 Å²	115	85.9 Å²	85.9	44%	0.436	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-61.1	-26.6	174.4	68.4	-85.7	0	0	0	111.5	T7 Q8 C9 I20	W5-T7 PolarHBondContact O-N 3.13Å; W5-Q8 WeakPolarHBondContact O-CB 3.32Å; W5-Q8 PolarHBondContact O-N 3.39Å; W5-C9 VanDerWaalsContact CZ3-SG 3.55Å; W5-C9 PolarHBondContact O-N 2.84Å; W5-I20 HydrophobicContact CH2-CD1 3.89Å; W5-I20 HydrophobicContact CH2-CG1 4.15Å; W5-I20 HydrophobicContact CH2-CG2 4.4Å; W5-I20 HydrophobicContact CZ2-CG2 4.06Å
6	V	95.6	Very high	87.3	Confident	0 Å²	0	84.9 Å²	84.9	0%	0	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-61.4	-28.9	177.6	-176.2	0	0	0	0	111.5	S4 Q8 L12 L17 I20 D32 A35 A36 R39	S4-V6 PolarHBondContact O-N 3.16Å; S4-V6 WeakPolarHBondContact OG-CB 3.42Å; S4-V6 WeakPolarHBondContact OG-CG2 3.49Å; S4-V6 PolarHBondContact OG-N 3.42Å; S4-V6 VanDerWaalsContact OG-N 3.15Å; V6-Q8 VanDerWaalsContact C-N 3.26Å; V6-Q8 PolarHBondContact O-N 3.46Å; V6-L12 HydrophobicContact CG1-CD1 4.03Å; V6-L17 HydrophobicContact CG1-CD2 4.15Å; V6-I20 HydrophobicContact CG2-CG2 3.77Å; V6-D32 HydrophobicContact CG2-CB 4.24Å; V6-A35 HydrophobicContact CB-CB 4.1Å; V6-A35 HydrophobicContact CG1-CB 4.46Å; V6-A36 HydrophobicContact CG1-CB 4.04Å; V6-R39 PolarHBondContact O-NH1 3.18Å
7	T	91.1	Very high	87.9	Confident	82 Å²	82	80.1 Å²	80.1	50%	0.503	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-77.6	-13.4	177	65.7	0	0	0	0	113.3	S4 W5 A35	S4-T7 PolarHBondContact O-N 2.83Å; S4-T7 VanDerWaalsContact O-N 3.11Å; S4-T7 PolarHBondContact O-OG1 2.99Å; W5-T7 PolarHBondContact O-N 3.13Å; T7-A35 HydrophobicContact CG2-CB 3.92Å
8	Q	90.4	Very high	88.5	Confident	135 Å²	135	76.4 Å²	76.4	63%	0.631	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-17	-178.3	-58.4	175.8	0.4	0	0	112.6	T3 W5 V6 E10	T3-Q8 HydrophobicContact CG2-CG 4.45Å; W5-Q8 WeakPolarHBondContact O-CB 3.32Å; W5-Q8 PolarHBondContact O-N 3.39Å; V6-Q8 VanDerWaalsContact C-N 3.26Å; V6-Q8 PolarHBondContact O-N 3.46Å; Q8-E10 PolarHBondContact O-N 3.09Å
9	C	90.3	Very high	89	Confident	43 Å²	43	78.2 Å²	78.2	29%	0.291	42%	0.417	S	S	.	.			trans	-78.2	118	176.8	-70.4	0	0	0	0	111.4	W5 L12 R39	W5-C9 VanDerWaalsContact CZ3-SG 3.55Å; W5-C9 PolarHBondContact O-N 2.84Å; C9-L12 HydrophobicContact CB-CD1 3.85Å; C9-L12 HydrophobicContact CB-CD2 4.39Å; C9-L12 HydrophobicContact CB-CG 3.96Å; C9-R39 PolarHBondContact O-NH1 2.66Å; C9-R39 PolarHBondContact O-NH2 2.97Å
10	E	88	Confident	89.5	Confident	166 Å²	166	75.3 Å²	75.3	78%	0.776	40%	0.401	S	S	*	.	S	Bend	trans	-74.1	162.3	167.1	-62.7	-179.9	172.3	0	0	110.2	Q8 L12	Q8-E10 PolarHBondContact O-N 3.09Å; E10-L12 VanDerWaalsContact C-N 3.33Å; E10-L12 PolarHBondContact O-N 2.98Å; E10-L12 VanDerWaalsContact O-N 3.13Å
11	D	87.8	Confident	89.9	Confident	159 Å²	159	71.7 Å²	71.7	85%	0.85	38%	0.382	S	S	*	.	S	Bend	trans	59.9	23	169.8	-54	-35.2	0	0	0	118.5	S13	D11-S13 PolarHBondContact O-N 2.8Å
12	L	93.9	Very high	92	Very high	38 Å²	38	69.1 Å²	69.1	20%	0.199	37%	0.367	C	S	.	.			trans	-72.7	121.9	168.8	-64.1	-178.8	0	0	0	111	V6 C9 E10 D16 L17 I20	V6-L12 HydrophobicContact CG1-CD1 4.03Å; C9-L12 HydrophobicContact CB-CD1 3.85Å; C9-L12 HydrophobicContact CB-CD2 4.39Å; C9-L12 HydrophobicContact CB-CG 3.96Å; E10-L12 VanDerWaalsContact C-N 3.33Å; E10-L12 PolarHBondContact O-N 2.98Å; E10-L12 VanDerWaalsContact O-N 3.13Å; L12-D16 HydrophobicContact CB-CB 4.39Å; L12-D16 HydrophobicContact CD2-CB 4.14Å; L12-L17 HydrophobicContact CB-CD2 4.01Å; L12-L17 HydrophobicContact CB-CG 4.15Å; L12-L17 HydrophobicContact CD1-CD2 3.87Å; L12-I20 HydrophobicContact CD1-CD1 3.69Å; L12-I20 HydrophobicContact CD2-CD1 4.04Å; L12-I20 HydrophobicContact CG-CD1 4.49Å
13	S	95.6	Very high	93.9	Very high	52 Å²	52	68.1 Å²	68.1	36%	0.364	36%	0.358	S	S	.	.			trans	-72.9	164.6	172	74.6	0	0	0	0	111.7	D11 T15 D16 L17	D11-S13 PolarHBondContact O-N 2.8Å; S13-T15 PolarHBondContact O-N 3.44Å; S13-T15 PolarHBondContact OG-N 3.39Å; S13-D16 VanDerWaalsContact CB-OD2 3.27Å; S13-D16 WeakPolarHBondContact CB-OD2 3.39Å; S13-D16 PolarHBondContact N-OD2 3.4Å; S13-D16 WeakPolarHBondContact O-CB 3.42Å; S13-D16 PolarHBondContact O-N 3.05Å; S13-D16 VanDerWaalsContact O-N 3.09Å; S13-D16 PolarHBondContact OG-N 2.84Å; S13-D16 PolarHBondContact OG-OD2 3.33Å; S13-L17 WeakPolarHBondContact O-CG 3.48Å; S13-L17 PolarHBondContact O-N 3.15Å
14	N	95.5	Very high	95	Very high	59 Å²	59	63.7 Å²	63.7	32%	0.316	33%	0.331	S	S	.	.	H	α-helix	trans	-57.4	-35.7	173.8	-77.5	-1	0	0	0	112.4	L17 V18 Y40	N14-L17 PolarHBondContact O-N 3.28Å; N14-V18 WeakPolarHBondContact O-CG2 3.41Å; N14-V18 PolarHBondContact O-N 3.42Å; N14-V18 VanDerWaalsContact O-N 3.09Å; N14-Y40 HydrophobicContact CB-CD2 3.85Å; N14-Y40 HydrophobicContact CB-CE2 3.63Å; N14-Y40 WeakPolarHBondContact O-CD2 3.47Å
15	T	96.3	Very high	95.3	Very high	110 Å²	110	66.9 Å²	66.9	68%	0.675	35%	0.345	S	S	*	.	H	α-helix	trans	-66.8	-41	175.4	-55.4	0	0	0	0	111.8	S13 L17 V18 H19	S13-T15 PolarHBondContact O-N 3.44Å; S13-T15 PolarHBondContact OG-N 3.39Å; T15-L17 VanDerWaalsContact C-N 3.35Å; T15-V18 PolarHBondContact O-N 3.32Å; T15-H19 WeakPolarHBondContact O-CB 3.43Å; T15-H19 PolarHBondContact O-N 3.04Å
16	D	97.5	Very high	95.5	Very high	70 Å²	70	68.8 Å²	68.8	37%	0.374	36%	0.359	S	S	.	.	H	α-helix	trans	-63.5	-43.1	175.7	-58	-48.2	0	0	0	110.9	L12 S13 V18 H19 I20	L12-D16 HydrophobicContact CB-CB 4.39Å; L12-D16 HydrophobicContact CD2-CB 4.14Å; S13-D16 VanDerWaalsContact CB-OD2 3.27Å; S13-D16 WeakPolarHBondContact CB-OD2 3.39Å; S13-D16 PolarHBondContact N-OD2 3.4Å; S13-D16 WeakPolarHBondContact O-CB 3.42Å; S13-D16 PolarHBondContact O-N 3.05Å; S13-D16 VanDerWaalsContact O-N 3.09Å; S13-D16 PolarHBondContact OG-N 2.84Å; S13-D16 PolarHBondContact OG-OD2 3.33Å; D16-V18 PolarHBondContact O-N 3.32Å; D16-H19 PolarHBondContact O-N 3.29Å; D16-I20 WeakPolarHBondContact O-CB 3.37Å; D16-I20 WeakPolarHBondContact O-CD1 3.4Å; D16-I20 WeakPolarHBondContact O-CG1 3.31Å; D16-I20 PolarHBondContact O-N 2.95Å
17	L	98	Very high	95.6	Very high	3 Å²	3	71.7 Å²	71.7	2%	0.016	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-43.7	178.9	-67.5	169.5	0	0	0	112	V6 L12 S13 N14 T15 I20 A21 A36 R39 Y40	V6-L17 HydrophobicContact CG1-CD2 4.15Å; L12-L17 HydrophobicContact CB-CD2 4.01Å; L12-L17 HydrophobicContact CB-CG 4.15Å; L12-L17 HydrophobicContact CD1-CD2 3.87Å; S13-L17 WeakPolarHBondContact O-CG 3.48Å; S13-L17 PolarHBondContact O-N 3.15Å; N14-L17 PolarHBondContact O-N 3.28Å; T15-L17 VanDerWaalsContact C-N 3.35Å; L17-I20 PolarHBondContact O-N 3.36Å; L17-A21 WeakPolarHBondContact O-CB 3.44Å; L17-A21 PolarHBondContact O-N 3.44Å; L17-A36 HydrophobicContact CD2-CB 4.31Å; L17-R39 HydrophobicContact CD1-CB 3.79Å; L17-R39 HydrophobicContact CD2-CB 3.97Å; L17-Y40 HydrophobicContact CB-CD2 4.41Å
18	V	98.1	Very high	95.9	Very high	14 Å²	14	74.7 Å²	74.7	9%	0.085	39%	0.391	C	S	.	.	H	α-helix	trans	-64.4	-42.1	175.1	170.8	0	0	0	0	111.1	N14 T15 D16 A21 K22 Y40 E51 L54	N14-V18 WeakPolarHBondContact O-CG2 3.41Å; N14-V18 PolarHBondContact O-N 3.42Å; N14-V18 VanDerWaalsContact O-N 3.09Å; T15-V18 PolarHBondContact O-N 3.32Å; D16-V18 PolarHBondContact O-N 3.32Å; V18-A21 PolarHBondContact O-N 3.25Å; V18-K22 HydrophobicContact CG1-CD 4.39Å; V18-K22 WeakPolarHBondContact O-CG 3.32Å; V18-K22 PolarHBondContact O-N 3.01Å; V18-K22 VanDerWaalsContact O-N 3.07Å; V18-Y40 HydrophobicContact CG2-CD2 3.62Å; V18-Y40 HydrophobicContact CG2-CE2 3.46Å; V18-Y40 VanDerWaalsContact CG2-CE2 3.46Å; V18-E51 HydrophobicContact CG2-CG 3.9Å; V18-L54 HydrophobicContact CG1-CD1 4.07Å
19	H	98.2	Very high	96.2	Very high	111 Å²	111	75 Å²	75	51%	0.514	39%	0.387	S	S	.	.	H	α-helix	trans	-63.8	-44	177.3	-173	58.7	0	0	0	112.1	T15 D16 A21 K22 L23	T15-H19 WeakPolarHBondContact O-CB 3.43Å; T15-H19 PolarHBondContact O-N 3.04Å; D16-H19 PolarHBondContact O-N 3.29Å; H19-A21 VanDerWaalsContact C-N 3.34Å; H19-A21 PolarHBondContact O-N 3.09Å; H19-K22 PolarHBondContact O-N 3.27Å; H19-L23 WeakPolarHBondContact O-CG 3.37Å; H19-L23 PolarHBondContact O-N 2.82Å
20	I	98.4	Very high	96.6	Very high	20 Å²	20	75.5 Å²	75.5	10%	0.103	38%	0.383	C	S	.	.	H	α-helix	trans	-59.9	-44.3	174.7	-70.6	163.3	0	0	0	110.5	W5 V6 L12 D16 L17 K22 L23 A24 A36	W5-I20 HydrophobicContact CH2-CD1 3.89Å; W5-I20 HydrophobicContact CH2-CG1 4.15Å; W5-I20 HydrophobicContact CH2-CG2 4.4Å; W5-I20 HydrophobicContact CZ2-CG2 4.06Å; V6-I20 HydrophobicContact CG2-CG2 3.77Å; L12-I20 HydrophobicContact CD1-CD1 3.69Å; L12-I20 HydrophobicContact CD2-CD1 4.04Å; L12-I20 HydrophobicContact CG-CD1 4.49Å; D16-I20 WeakPolarHBondContact O-CB 3.37Å; D16-I20 WeakPolarHBondContact O-CD1 3.4Å; D16-I20 WeakPolarHBondContact O-CG1 3.31Å; D16-I20 PolarHBondContact O-N 2.95Å; L17-I20 PolarHBondContact O-N 3.36Å; I20-K22 VanDerWaalsContact C-N 3.34Å; I20-K22 PolarHBondContact O-N 2.89Å; I20-L23 PolarHBondContact O-N 2.7Å; I20-A24 VanDerWaalsContact O-CB 3.25Å; I20-A24 WeakPolarHBondContact O-CB 3.3Å; I20-A24 PolarHBondContact O-N 3.44Å; I20-A36 HydrophobicContact CB-CB 4.42Å; I20-A36 HydrophobicContact CG2-CB 4.01Å
21	A	98.5	Very high	97	Very high	0 Å²	0	70 Å²	70	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-60.2	-42.9	178.1	0	0	0	0	0	112	L17 V18 H19 A24 E25 M33 A36 M37 L54	L17-A21 WeakPolarHBondContact O-CB 3.44Å; L17-A21 PolarHBondContact O-N 3.44Å; V18-A21 PolarHBondContact O-N 3.25Å; H19-A21 VanDerWaalsContact C-N 3.34Å; H19-A21 PolarHBondContact O-N 3.09Å; A21-A24 PolarHBondContact O-N 3.01Å; A21-E25 WeakPolarHBondContact O-CB 3.43Å; A21-E25 PolarHBondContact O-N 3.44Å; A21-M33 HydrophobicContact CB-CG 4.05Å; A21-A36 HydrophobicContact CB-CB 4.28Å; A21-M37 HydrophobicContact CB-CG 3.96Å; A21-M37 HydrophobicContact CB-SD 3.58Å; A21-M37 VanDerWaalsContact CB-SD 3.58Å; A21-L54 HydrophobicContact CB-CD1 4.41Å
22	K	98.6	Very high	97.5	Very high	59 Å²	59	63 Å²	63	26%	0.257	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-41.8	176.3	-68.2	176.5	-171.7	-174.8	0	112.6	V18 H19 I20 E25 Q26 E50 L54	V18-K22 HydrophobicContact CG1-CD 4.39Å; V18-K22 WeakPolarHBondContact O-CG 3.32Å; V18-K22 PolarHBondContact O-N 3.01Å; V18-K22 VanDerWaalsContact O-N 3.07Å; H19-K22 PolarHBondContact O-N 3.27Å; I20-K22 VanDerWaalsContact C-N 3.34Å; I20-K22 PolarHBondContact O-N 2.89Å; K22-E25 PolarHBondContact O-N 3.21Å; K22-Q26 WeakPolarHBondContact O-CG 3.4Å; K22-Q26 PolarHBondContact O-N 2.81Å; K22-E50 WeakPolarHBondContact CE-OE1 3.24Å; K22-E50 WeakPolarHBondContact CE-OE2 3.45Å; K22-E50 IonicContact NZ-OE1 3.02Å; K22-E50 PolarHBondContact NZ-OE1 3.34Å; K22-E50 IonicContact NZ-OE2 3.88Å; K22-E50 PolarHBondContact NZ-OE2 2.96Å; K22-L54 HydrophobicContact CG-CD1 4.23Å; K22-L54 HydrophobicContact CG-CD2 4.14Å
23	L	98.6	Very high	97.7	Very high	85 Å²	85	61.1 Å²	61.1	45%	0.445	31%	0.311	S	S	.	.	H	α-helix	trans	-66	-40.6	175.1	-70.3	175.5	0	0	0	111.6	H19 I20 Q26 A27	H19-L23 WeakPolarHBondContact O-CG 3.37Å; H19-L23 PolarHBondContact O-N 2.82Å; I20-L23 PolarHBondContact O-N 2.7Å; L23-Q26 PolarHBondContact O-N 3.36Å; L23-A27 WeakPolarHBondContact O-CB 3.41Å; L23-A27 PolarHBondContact O-N 3.18Å
24	A	98.3	Very high	97.8	Very high	8 Å²	8	59 Å²	59	7%	0.066	30%	0.297	C	S	.	.	H	α-helix	trans	-65.7	-37.7	177.6	0	0	0	0	0	111.9	I20 A21 A27 E28 R29 D32 M33	I20-A24 VanDerWaalsContact O-CB 3.25Å; I20-A24 WeakPolarHBondContact O-CB 3.3Å; I20-A24 PolarHBondContact O-N 3.44Å; A21-A24 PolarHBondContact O-N 3.01Å; A24-A27 CarbonylContact O-C 3.51Å; A24-A27 PolarHBondContact O-N 3.32Å; A24-E28 PolarHBondContact O-N 3.2Å; A24-R29 HydrophobicContact CB-CB 4.42Å; A24-R29 PolarHBondContact O-N 3.26Å; A24-D32 HydrophobicContact CB-CB 4.26Å; A24-M33 HydrophobicContact CB-CB 3.82Å; A24-M33 HydrophobicContact CB-CG 4.41Å
25	E	98.3	Very high	97.9	Very high	75 Å²	75	56.7 Å²	56.7	35%	0.35	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-51.1	172.4	-175.8	179.1	-164	0	0	111.4	A21 K22 A27 E28 M33 V57	A21-E25 WeakPolarHBondContact O-CB 3.43Å; A21-E25 PolarHBondContact O-N 3.44Å; K22-E25 PolarHBondContact O-N 3.21Å; E25-A27 PolarHBondContact O-N 2.97Å; E25-E28 PolarHBondContact O-N 2.65Å; E25-M33 HydrophobicContact CB-CE 3.84Å; E25-M33 HydrophobicContact CB-SD 3.93Å; E25-M33 HydrophobicContact CG-CE 4.15Å; E25-M33 HydrophobicContact CG-SD 4.42Å; E25-V57 HydrophobicContact CG-CG1 4.38Å
26	Q	98.1	Very high	98	Very high	156 Å²	156	51.4 Å²	51.4	73%	0.729	25%	0.254	S	S	*	.	H	α-helix	trans	-61.9	-29.9	178.7	-68.7	173.8	24.8	0	0	113.1	K22 L23	K22-Q26 WeakPolarHBondContact O-CG 3.4Å; K22-Q26 PolarHBondContact O-N 2.81Å; L23-Q26 PolarHBondContact O-N 3.36Å
27	A	98	Very high	98	Very high	60 Å²	60	48.1 Å²	48.1	50%	0.496	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	3	177.2	0	0	0	0	0	113.5	L23 A24 E25 R29	L23-A27 WeakPolarHBondContact O-CB 3.41Å; L23-A27 PolarHBondContact O-N 3.18Å; A24-A27 CarbonylContact O-C 3.51Å; A24-A27 PolarHBondContact O-N 3.32Å; E25-A27 PolarHBondContact O-N 2.97Å; A27-R29 HydrophobicContact CB-CG 4.1Å; A27-R29 PolarHBondContact O-N 2.99Å; A27-R29 VanDerWaalsContact O-N 3.11Å
28	E	97.5	Very high	98	Very high	146 Å²	146	50.6 Å²	50.6	68%	0.682	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	27.1	-174.3	-56.7	-173.3	166.6	0	0	114	A24 E25 Y30	A24-E28 PolarHBondContact O-N 3.2Å; E25-E28 PolarHBondContact O-N 2.65Å; E28-Y30 VanDerWaalsContact C-N 3.3Å; E28-Y30 HydrophobicContact CB-CE2 3.84Å; E28-Y30 HydrophobicContact CG-CE2 4.38Å; E28-Y30 WeakPolarHBondContact O-CD2 3.47Å; E28-Y30 PolarHBondContact O-N 3.11Å; E28-Y30 VanDerWaalsContact O-N 3.16Å
29	R	97.6	Very high	97.9	Very high	141 Å²	141	52.9 Å²	52.9	53%	0.532	25%	0.254	S	S	.	.			trans	-90.4	63.3	177.6	-67.7	-167	60.5	157.1	-1.1	110.7	A24 A27 D31 D32 M33	A24-R29 HydrophobicContact CB-CB 4.42Å; A24-R29 PolarHBondContact O-N 3.26Å; A27-R29 HydrophobicContact CB-CG 4.1Å; A27-R29 PolarHBondContact O-N 2.99Å; A27-R29 VanDerWaalsContact O-N 3.11Å; R29-D31 VanDerWaalsContact C-N 3.27Å; R29-D31 PolarHBondContact O-N 3.39Å; R29-D32 HydrophobicContact CB-CB 4.41Å; R29-D32 IonicContact CZ-OD2 3.06Å; R29-D32 IonicContact NE-OD2 3.65Å; R29-D32 PolarHBondContact NE-OD2 3.34Å; R29-D32 IonicContact NH2-OD1 3.96Å; R29-D32 IonicContact NH2-OD2 2.66Å; R29-D32 PolarHBondContact NH2-OD2 2.95Å; R29-D32 WeakPolarHBondContact O-CB 3.34Å; R29-D32 PolarHBondContact O-N 3.36Å; R29-M33 PolarHBondContact O-N 3.1Å; R29-M33 VanDerWaalsContact O-N 3.08Å
30	Y	98	Very high	97.9	Very high	54 Å²	54	48.9 Å²	48.9	21%	0.212	23%	0.234	C	C	.	.	H	α-helix	trans	-63.8	-26.1	-171	-57.4	-70.2	0	0	0	114.8	E28 D32 M33 A34 V57 N61 V62	E28-Y30 VanDerWaalsContact C-N 3.3Å; E28-Y30 HydrophobicContact CB-CE2 3.84Å; E28-Y30 HydrophobicContact CG-CE2 4.38Å; E28-Y30 WeakPolarHBondContact O-CD2 3.47Å; E28-Y30 PolarHBondContact O-N 3.11Å; E28-Y30 VanDerWaalsContact O-N 3.16Å; Y30-D32 VanDerWaalsContact C-N 3.34Å; Y30-M33 HydrophobicContact CD1-SD 4.01Å; Y30-M33 WeakPolarHBondContact O-CB 3.32Å; Y30-M33 PolarHBondContact O-N 3.39Å; Y30-A34 WeakPolarHBondContact O-CB 3.43Å; Y30-A34 PolarHBondContact O-N 3.42Å; Y30-V57 HydrophobicContact CE1-CG1 4.27Å; Y30-N61 HydrophobicContact CD1-CB 3.55Å; Y30-N61 HydrophobicContact CD2-CB 3.46Å; Y30-N61 VanDerWaalsContact CD2-CB 3.46Å; Y30-N61 HydrophobicContact CE1-CB 3.84Å; Y30-N61 WeakPolarHBondContact CE1-ND2 3.45Å; Y30-N61 HydrophobicContact CE2-CB 3.74Å; Y30-N61 HydrophobicContact CG-CB 3.34Å; Y30-N61 VanDerWaalsContact CZ-CG 3.48Å; Y30-V62 VanDerWaalsContact C-CG2 3.43Å; Y30-V62 VanDerWaalsContact O-CG2 3.32Å; Y30-V62 WeakPolarHBondContact O-CG2 3.32Å
31	D	97.2	Very high	97.7	Very high	51 Å²	51	48 Å²	48	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-64.6	-38.1	172.6	-70	-62.7	0	0	0	111.5	R29 A35 R66	R29-D31 VanDerWaalsContact C-N 3.27Å; R29-D31 PolarHBondContact O-N 3.39Å; D31-A35 WeakPolarHBondContact O-CB 3.4Å; D31-A35 PolarHBondContact O-N 3.47Å; D31-A35 VanDerWaalsContact O-N 3.09Å; D31-R66 IonicContact OD1-NH1 3.63Å; D31-R66 IonicContact OD2-NH1 2.69Å
32	D	97.9	Very high	97.6	Very high	10 Å²	10	51.1 Å²	51.1	5%	0.053	24%	0.244	C	C	.	.	H	α-helix	trans	-73	-38.3	174.8	-62.8	-48.4	0	0	0	111.4	S4 V6 A24 R29 Y30 A34 A35 A36	S4-D32 WeakPolarHBondContact CA-OD1 3.09Å; S4-D32 WeakPolarHBondContact CB-OD1 3.14Å; S4-D32 WeakPolarHBondContact OG-CA 3.28Å; S4-D32 PolarHBondContact OG-OD1 2.97Å; V6-D32 HydrophobicContact CG2-CB 4.24Å; A24-D32 HydrophobicContact CB-CB 4.26Å; R29-D32 HydrophobicContact CB-CB 4.41Å; R29-D32 IonicContact CZ-OD2 3.06Å; R29-D32 IonicContact NE-OD2 3.65Å; R29-D32 PolarHBondContact NE-OD2 3.34Å; R29-D32 IonicContact NH2-OD1 3.96Å; R29-D32 IonicContact NH2-OD2 2.66Å; R29-D32 PolarHBondContact NH2-OD2 2.95Å; R29-D32 WeakPolarHBondContact O-CB 3.34Å; R29-D32 PolarHBondContact O-N 3.36Å; Y30-D32 VanDerWaalsContact C-N 3.34Å; D32-A34 VanDerWaalsContact C-N 3.34Å; D32-A34 PolarHBondContact O-N 2.74Å; D32-A35 PolarHBondContact O-N 3.34Å; D32-A36 WeakPolarHBondContact O-CB 3.46Å; D32-A36 PolarHBondContact O-N 3.39Å
33	M	98	Very high	97.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.8	-45.5	173.4	-163.1	-171.1	-178.8	0	0	111.2	A21 A24 E25 R29 Y30 A36 M37 L54 V57 A58	A21-M33 HydrophobicContact CB-CG 4.05Å; A24-M33 HydrophobicContact CB-CB 3.82Å; A24-M33 HydrophobicContact CB-CG 4.41Å; E25-M33 HydrophobicContact CB-CE 3.84Å; E25-M33 HydrophobicContact CB-SD 3.93Å; E25-M33 HydrophobicContact CG-CE 4.15Å; E25-M33 HydrophobicContact CG-SD 4.42Å; R29-M33 PolarHBondContact O-N 3.1Å; R29-M33 VanDerWaalsContact O-N 3.08Å; Y30-M33 HydrophobicContact CD1-SD 4.01Å; Y30-M33 WeakPolarHBondContact O-CB 3.32Å; Y30-M33 PolarHBondContact O-N 3.39Å; M33-A36 PolarHBondContact O-N 3.06Å; M33-M37 WeakPolarHBondContact O-CB 3.38Å; M33-M37 WeakPolarHBondContact O-CG 3.16Å; M33-M37 PolarHBondContact O-N 3.32Å; M33-L54 HydrophobicContact CE-CB 4.01Å; M33-L54 HydrophobicContact CE-CD2 3.51Å; M33-L54 HydrophobicContact CE-CG 4.38Å; M33-L54 VanDerWaalsContact CE-O 3.28Å; M33-L54 WeakPolarHBondContact CE-O 3.25Å; M33-V57 HydrophobicContact CE-CB 4.05Å; M33-V57 HydrophobicContact CE-CG1 3.98Å; M33-V57 HydrophobicContact SD-CG1 4.17Å; M33-A58 HydrophobicContact CB-CB 3.9Å; M33-A58 HydrophobicContact CE-CB 4.29Å; M33-A58 HydrophobicContact CG-CB 3.59Å; M33-A58 VanDerWaalsContact SD-CA 3.57Å; M33-A58 HydrophobicContact SD-CB 3.62Å
34	A	98.1	Very high	96.8	Very high	6 Å²	6	49.6 Å²	49.6	5%	0.05	25%	0.253	C	S	.	.	H	α-helix	trans	-66.6	-38.6	178.8	0	0	0	0	0	111.9	Y30 D32 K38 A58 Y59 V62	Y30-A34 WeakPolarHBondContact O-CB 3.43Å; Y30-A34 PolarHBondContact O-N 3.42Å; D32-A34 VanDerWaalsContact C-N 3.34Å; D32-A34 PolarHBondContact O-N 2.74Å; A34-K38 VanDerWaalsContact O-CB 3.25Å; A34-K38 WeakPolarHBondContact O-CB 3.42Å; A34-K38 PolarHBondContact O-N 3.39Å; A34-A58 HydrophobicContact CB-CB 4.2Å; A34-Y59 HydrophobicContact CB-CD1 4.14Å; A34-Y59 HydrophobicContact CB-CD2 4.49Å; A34-Y59 HydrophobicContact CB-CE1 3.96Å; A34-Y59 HydrophobicContact CB-CE2 4.28Å; A34-Y59 HydrophobicContact CB-CG 4.42Å; A34-V62 HydrophobicContact CB-CG2 4.16Å
35	A	97.5	Very high	96	Very high	11 Å²	11	50.4 Å²	50.4	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-43.5	174.7	0	0	0	0	0	112.3	V6 T7 D31 D32 R39	V6-A35 HydrophobicContact CB-CB 4.1Å; V6-A35 HydrophobicContact CG1-CB 4.46Å; T7-A35 HydrophobicContact CG2-CB 3.92Å; D31-A35 WeakPolarHBondContact O-CB 3.4Å; D31-A35 PolarHBondContact O-N 3.47Å; D31-A35 VanDerWaalsContact O-N 3.09Å; D32-A35 PolarHBondContact O-N 3.34Å; A35-R39 WeakPolarHBondContact O-CG 3.34Å; A35-R39 PolarHBondContact O-N 3.11Å
36	A	97.9	Very high	95.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-49.4	176.1	0	0	0	0	0	111.6	V6 L17 I20 A21 D32 M33 K38 R39 Y40	V6-A36 HydrophobicContact CG1-CB 4.04Å; L17-A36 HydrophobicContact CD2-CB 4.31Å; I20-A36 HydrophobicContact CB-CB 4.42Å; I20-A36 HydrophobicContact CG2-CB 4.01Å; A21-A36 HydrophobicContact CB-CB 4.28Å; D32-A36 WeakPolarHBondContact O-CB 3.46Å; D32-A36 PolarHBondContact O-N 3.39Å; M33-A36 PolarHBondContact O-N 3.06Å; A36-K38 PolarHBondContact O-N 3.12Å; A36-R39 PolarHBondContact O-N 3.29Å; A36-Y40 PolarHBondContact O-N 3.28Å
37	M	98	Very high	95.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-68.9	-32.1	-178.6	-66.6	-49.5	-53.1	0	0	112.9	A21 M33 Y40 T41 E51 L54 L55	A21-M37 HydrophobicContact CB-CG 3.96Å; A21-M37 HydrophobicContact CB-SD 3.58Å; A21-M37 VanDerWaalsContact CB-SD 3.58Å; M33-M37 WeakPolarHBondContact O-CB 3.38Å; M33-M37 WeakPolarHBondContact O-CG 3.16Å; M33-M37 PolarHBondContact O-N 3.32Å; M37-Y40 HydrophobicContact CE-CD1 4.34Å; M37-Y40 HydrophobicContact CE-CG 4.39Å; M37-Y40 PolarHBondContact O-N 3.11Å; M37-T41 WeakPolarHBondContact O-CB 3.44Å; M37-T41 PolarHBondContact O-N 3.16Å; M37-T41 PolarHBondContact O-OG1 3.4Å; M37-T41 VanDerWaalsContact O-OG1 3.06Å; M37-E51 HydrophobicContact CE-CB 3.91Å; M37-E51 VanDerWaalsContact CE-O 3.3Å; M37-E51 WeakPolarHBondContact CE-O 3.33Å; M37-L54 HydrophobicContact CE-CB 4.06Å; M37-L54 HydrophobicContact CG-CB 4.15Å; M37-L54 HydrophobicContact SD-CB 3.75Å; M37-L54 HydrophobicContact SD-CD1 4.27Å; M37-L55 HydrophobicContact CB-CB 4.41Å; M37-L55 HydrophobicContact CB-CD1 3.73Å; M37-L55 HydrophobicContact CE-CB 4.34Å
38	K	97	Very high	95	Very high	56 Å²	56	43.3 Å²	43.3	24%	0.243	23%	0.234	C	C	.	.	H	α-helix	trans	-56.3	-54.6	169.6	177.6	167.6	-175.4	-65.6	0	111.2	A34 A36 Y40 T41 E42 Y59 Q107 L111	A34-K38 VanDerWaalsContact O-CB 3.25Å; A34-K38 WeakPolarHBondContact O-CB 3.42Å; A34-K38 PolarHBondContact O-N 3.39Å; A36-K38 PolarHBondContact O-N 3.12Å; K38-Y40 VanDerWaalsContact C-N 3.28Å; K38-Y40 PolarHBondContact O-N 3.34Å; K38-T41 PolarHBondContact O-N 2.94Å; K38-E42 VanDerWaalsContact CE-OE1 3.26Å; K38-E42 WeakPolarHBondContact CE-OE1 3.47Å; K38-E42 HydrophobicContact CG-CG 4.43Å; K38-E42 IonicContact NZ-OE1 2.7Å; K38-E42 PolarHBondContact NZ-OE1 3.02Å; K38-E42 IonicContact NZ-OE2 3.51Å; K38-E42 PolarHBondContact NZ-OE2 3Å; K38-E42 WeakPolarHBondContact O-CG 3.23Å; K38-E42 PolarHBondContact O-N 3.17Å; K38-Y59 WeakPolarHBondContact CB-OH 3.32Å; K38-Q107 HydrophobicContact CD-CG 4.06Å; K38-L111 HydrophobicContact CB-CD1 4.3Å; K38-L111 HydrophobicContact CG-CD1 4.19Å; K38-L111 HydrophobicContact CG-CD2 4.18Å
39	R	96.5	Very high	94.7	Very high	61 Å²	61	41.2 Å²	41.2	23%	0.23	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-41.4	-179.3	-72.1	-178	63.9	174.3	1.8	111.5	V6 C9 L17 A35 A36 E42 A43	V6-R39 PolarHBondContact O-NH1 3.18Å; C9-R39 PolarHBondContact O-NH1 2.66Å; C9-R39 PolarHBondContact O-NH2 2.97Å; L17-R39 HydrophobicContact CD1-CB 3.79Å; L17-R39 HydrophobicContact CD2-CB 3.97Å; A35-R39 WeakPolarHBondContact O-CG 3.34Å; A35-R39 PolarHBondContact O-N 3.11Å; A36-R39 PolarHBondContact O-N 3.29Å; R39-E42 PolarHBondContact O-N 2.88Å; R39-A43 WeakPolarHBondContact O-CB 3.48Å; R39-A43 PolarHBondContact O-N 2.79Å
40	Y	96.8	Very high	94.6	Very high	28 Å²	28	39 Å²	39	11%	0.11	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-49.8	176.7	-176.7	-77	0	0	0	110.9	N14 L17 V18 A36 M37 K38 E42 A43 S44 L47 E51	N14-Y40 HydrophobicContact CB-CD2 3.85Å; N14-Y40 HydrophobicContact CB-CE2 3.63Å; N14-Y40 WeakPolarHBondContact O-CD2 3.47Å; L17-Y40 HydrophobicContact CB-CD2 4.41Å; V18-Y40 HydrophobicContact CG2-CD2 3.62Å; V18-Y40 HydrophobicContact CG2-CE2 3.46Å; V18-Y40 VanDerWaalsContact CG2-CE2 3.46Å; A36-Y40 PolarHBondContact O-N 3.28Å; M37-Y40 HydrophobicContact CE-CD1 4.34Å; M37-Y40 HydrophobicContact CE-CG 4.39Å; M37-Y40 PolarHBondContact O-N 3.11Å; K38-Y40 VanDerWaalsContact C-N 3.28Å; K38-Y40 PolarHBondContact O-N 3.34Å; Y40-E42 VanDerWaalsContact C-N 3.35Å; Y40-E42 PolarHBondContact O-N 3.05Å; Y40-A43 PolarHBondContact O-N 3.19Å; Y40-S44 VanDerWaalsContact O-CB 3.24Å; Y40-S44 WeakPolarHBondContact O-CB 3.4Å; Y40-S44 PolarHBondContact O-N 3.25Å; Y40-L47 HydrophobicContact CD1-CD2 3.4Å; Y40-L47 HydrophobicContact CE1-CD2 3.39Å; Y40-E51 HydrophobicContact CD1-CB 4.48Å; Y40-E51 HydrophobicContact CD1-CG 4.42Å; Y40-E51 HydrophobicContact CE1-CB 4.05Å; Y40-E51 HydrophobicContact CE1-CG 3.78Å; Y40-E51 HydrophobicContact CE2-CG 4.15Å
41	T	96	Very high	94.5	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-43.6	179.8	-65.8	0	0	0	0	111.8	M37 K38 A43 G45 L111 Y115 L116	M37-T41 WeakPolarHBondContact O-CB 3.44Å; M37-T41 PolarHBondContact O-N 3.16Å; M37-T41 PolarHBondContact O-OG1 3.4Å; M37-T41 VanDerWaalsContact O-OG1 3.06Å; K38-T41 PolarHBondContact O-N 2.94Å; T41-A43 VanDerWaalsContact C-N 3.3Å; T41-A43 PolarHBondContact O-N 3.45Å; T41-G45 PolarHBondContact O-N 3Å; T41-L111 HydrophobicContact CG2-CB 4.37Å; T41-L111 HydrophobicContact CG2-CD2 3.95Å; T41-Y115 HydrophobicContact CG2-CG 4.41Å; T41-L116 HydrophobicContact CG2-CD1 3.98Å; T41-L116 HydrophobicContact CG2-CD2 3.74Å; T41-L116 HydrophobicContact CG2-CG 3.78Å
42	E	94.9	Very high	94.4	Very high	67 Å²	67	36 Å²	36	31%	0.313	21%	0.209	S	C	.	.	H	α-helix	trans	-66.9	-31.1	179.6	-68.9	176.1	147.6	0	0	112.8	K38 R39 Y40 L111 Y115	K38-E42 VanDerWaalsContact CE-OE1 3.26Å; K38-E42 WeakPolarHBondContact CE-OE1 3.47Å; K38-E42 HydrophobicContact CG-CG 4.43Å; K38-E42 IonicContact NZ-OE1 2.7Å; K38-E42 PolarHBondContact NZ-OE1 3.02Å; K38-E42 IonicContact NZ-OE2 3.51Å; K38-E42 PolarHBondContact NZ-OE2 3Å; K38-E42 WeakPolarHBondContact O-CG 3.23Å; K38-E42 PolarHBondContact O-N 3.17Å; R39-E42 PolarHBondContact O-N 2.88Å; Y40-E42 VanDerWaalsContact C-N 3.35Å; Y40-E42 PolarHBondContact O-N 3.05Å; E42-L111 HydrophobicContact CG-CD2 3.7Å; E42-Y115 HydrophobicContact CB-CE1 4.03Å; E42-Y115 HydrophobicContact CG-CE1 4.08Å; E42-Y115 HydrophobicContact CG-CE2 4.04Å
43	A	93.2	Very high	94.3	Very high	71 Å²	71	39.8 Å²	39.8	59%	0.587	23%	0.229	S	C	*	.	H	α-helix	trans	-84.1	-38	178.4	0	0	0	0	0	113.5	R39 Y40 T41	R39-A43 WeakPolarHBondContact O-CB 3.48Å; R39-A43 PolarHBondContact O-N 2.79Å; Y40-A43 PolarHBondContact O-N 3.19Å; T41-A43 VanDerWaalsContact C-N 3.3Å; T41-A43 PolarHBondContact O-N 3.45Å
44	S	88.9	Confident	94.3	Very high	41 Å²	41	40.2 Å²	40.2	29%	0.287	23%	0.232	S	C	.	.	H	α-helix	trans	-87.2	-35.7	-174.2	-174.4	0	0	0	0	113.1	Y40 T46	Y40-S44 VanDerWaalsContact O-CB 3.24Å; Y40-S44 WeakPolarHBondContact O-CB 3.4Å; Y40-S44 PolarHBondContact O-N 3.25Å; S44-T46 WeakPolarHBondContact CB-O 3.38Å; S44-T46 PolarHBondContact O-N 3Å; S44-T46 PolarHBondContact OG-O 3.48Å
45	G	81.4	Confident	94.3	Very high	25 Å²	25	40 Å²	40	26%	0.258	23%	0.23	S	C	.	.	S	Bend	trans	71.2	-22.1	-173	0	0	0	0	0	114.9	T41	T41-G45 PolarHBondContact O-N 3Å
46	T	87.2	Confident	94.3	Very high	95 Å²	95	41.2 Å²	41.2	58%	0.583	24%	0.238	S	C	*	.	S	Bend	trans	-132.3	157.5	174.3	63.1	0	0	0	0	111.4	S44	S44-T46 WeakPolarHBondContact CB-O 3.38Å; S44-T46 PolarHBondContact O-N 3Å; S44-T46 PolarHBondContact OG-O 3.48Å
47	L	92.5	Very high	94.3	Very high	13 Å²	13	43.3 Å²	43.3	7%	0.068	25%	0.25	C	S	.	.			trans	-126.9	136.3	180	-59.8	-179.4	0	0	0	110.4	Y40 E51 R52 L55 L116 F129	Y40-L47 HydrophobicContact CD1-CD2 3.4Å; Y40-L47 HydrophobicContact CE1-CD2 3.39Å; L47-E51 HydrophobicContact CB-CB 4.13Å; L47-E51 HydrophobicContact CD2-CB 3.85Å; L47-E51 HydrophobicContact CG-CB 4.46Å; L47-R52 HydrophobicContact CB-CB 4.2Å; L47-L55 HydrophobicContact CD1-CB 4.21Å; L47-L55 HydrophobicContact CD1-CD2 3.69Å; L47-L55 HydrophobicContact CD1-CG 4.5Å; L47-L116 HydrophobicContact CD1-CD1 4.06Å; L47-L116 HydrophobicContact CD1-CD2 3.67Å; L47-L116 HydrophobicContact CG-CD2 3.59Å; L47-F129 HydrophobicContact CB-CZ 4.47Å; L47-F129 HydrophobicContact CD1-CE1 4.36Å; L47-F129 HydrophobicContact CD1-CZ 4.19Å
48	G	92.3	Very high	94.3	Very high	34 Å²	34	43.3 Å²	43.3	35%	0.351	25%	0.25	S	S	.	.			trans	-75.8	-179.4	164.7	0	0	0	0	0	111.4	E50 E51 R52	G48-E50 VanDerWaalsContact C-N 3.33Å; G48-E50 PolarHBondContact O-N 2.82Å; G48-E51 WeakPolarHBondContact CA-OE2 3.42Å; G48-E51 PolarHBondContact N-OE2 2.92Å; G48-E51 PolarHBondContact O-N 2.96Å; G48-R52 WeakPolarHBondContact O-CB 3.5Å; G48-R52 PolarHBondContact O-N 3.33Å
49	N	91	Very high	94.4	Very high	101 Å²	101	40.7 Å²	40.7	54%	0.54	24%	0.239	S	C	.	.	H	α-helix	trans	-59.7	-43	-178.8	-74	-14.1	0	0	0	112.5	R52 N53	N49-R52 PolarHBondContact OD1-NH2 3.32Å; N49-N53 WeakPolarHBondContact O-CB 3.38Å; N49-N53 VanDerWaalsContact O-CG 3.24Å; N49-N53 PolarHBondContact O-N 3.15Å; N49-N53 VanDerWaalsContact O-N 3.11Å; N49-N53 PolarHBondContact O-ND2 3.43Å
50	E	95.5	Very high	94.4	Very high	96 Å²	96	44.3 Å²	44.3	45%	0.449	26%	0.256	S	S	.	.	H	α-helix	trans	-65.4	-49.4	179.5	-178.6	167.3	-128.6	0	0	111	K22 G48 R52 N53 L54	K22-E50 WeakPolarHBondContact CE-OE1 3.24Å; K22-E50 WeakPolarHBondContact CE-OE2 3.45Å; K22-E50 IonicContact NZ-OE1 3.02Å; K22-E50 PolarHBondContact NZ-OE1 3.34Å; K22-E50 IonicContact NZ-OE2 3.88Å; K22-E50 PolarHBondContact NZ-OE2 2.96Å; G48-E50 VanDerWaalsContact C-N 3.33Å; G48-E50 PolarHBondContact O-N 2.82Å; E50-R52 PolarHBondContact O-N 3.38Å; E50-N53 PolarHBondContact O-N 2.68Å; E50-L54 HydrophobicContact CG-CD1 4.09Å; E50-L54 HydrophobicContact CG-CG 4.49Å; E50-L54 WeakPolarHBondContact O-CG 3.37Å; E50-L54 PolarHBondContact O-N 2.81Å
51	E	96.4	Very high	94.5	Very high	31 Å²	31	45.7 Å²	45.7	15%	0.145	27%	0.265	C	S	.	.	H	α-helix	trans	-68.4	-35.9	-177.3	-60.7	78.4	-155	0	0	112.3	V18 M37 Y40 L47 G48 N53 L54 L55	V18-E51 HydrophobicContact CG2-CG 3.9Å; M37-E51 HydrophobicContact CE-CB 3.91Å; M37-E51 VanDerWaalsContact CE-O 3.3Å; M37-E51 WeakPolarHBondContact CE-O 3.33Å; Y40-E51 HydrophobicContact CD1-CB 4.48Å; Y40-E51 HydrophobicContact CD1-CG 4.42Å; Y40-E51 HydrophobicContact CE1-CB 4.05Å; Y40-E51 HydrophobicContact CE1-CG 3.78Å; Y40-E51 HydrophobicContact CE2-CG 4.15Å; L47-E51 HydrophobicContact CB-CB 4.13Å; L47-E51 HydrophobicContact CD2-CB 3.85Å; L47-E51 HydrophobicContact CG-CB 4.46Å; G48-E51 WeakPolarHBondContact CA-OE2 3.42Å; G48-E51 PolarHBondContact N-OE2 2.92Å; G48-E51 PolarHBondContact O-N 2.96Å; E51-N53 VanDerWaalsContact C-N 3.32Å; E51-N53 PolarHBondContact O-N 2.99Å; E51-L54 PolarHBondContact O-N 2.54Å; E51-L55 WeakPolarHBondContact O-CB 3.35Å; E51-L55 PolarHBondContact O-N 3.32Å
52	R	95.4	Very high	94.6	Very high	11 Å²	11	46 Å²	46	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-60.2	-43.1	172.5	176.6	177.3	60	155.2	-6.6	111.3	L47 G48 N49 E50 S56 F128 F129	L47-R52 HydrophobicContact CB-CB 4.2Å; G48-R52 WeakPolarHBondContact O-CB 3.5Å; G48-R52 PolarHBondContact O-N 3.33Å; N49-R52 PolarHBondContact OD1-NH2 3.32Å; E50-R52 PolarHBondContact O-N 3.38Å; R52-S56 WeakPolarHBondContact O-CB 3.32Å; R52-S56 PolarHBondContact O-N 3.4Å; R52-S56 VanDerWaalsContact O-N 3.09Å; R52-F128 HydrophobicContact CG-CD1 3.58Å; R52-F128 HydrophobicContact CG-CD2 4.33Å; R52-F128 HydrophobicContact CG-CE1 3.31Å; R52-F128 HydrophobicContact CG-CE2 4.08Å; R52-F128 HydrophobicContact CG-CG 4.09Å; R52-F128 HydrophobicContact CG-CZ 3.56Å; R52-F129 HydrophobicContact CG-CE1 3.94Å; R52-F129 HydrophobicContact CG-CZ 4.05Å
53	N	95.3	Very high	94.8	Very high	88 Å²	88	42.8 Å²	42.8	47%	0.471	25%	0.252	S	S	.	.	H	α-helix	trans	-66.7	-45.4	176.7	-74.1	-13.5	0	0	0	111.4	N49 E50 E51 L55 S56 V57	N49-N53 WeakPolarHBondContact O-CB 3.38Å; N49-N53 VanDerWaalsContact O-CG 3.24Å; N49-N53 PolarHBondContact O-N 3.15Å; N49-N53 VanDerWaalsContact O-N 3.11Å; N49-N53 PolarHBondContact O-ND2 3.43Å; E50-N53 PolarHBondContact O-N 2.68Å; E51-N53 VanDerWaalsContact C-N 3.32Å; E51-N53 PolarHBondContact O-N 2.99Å; N53-L55 PolarHBondContact O-N 2.93Å; N53-S56 PolarHBondContact O-N 3.03Å; N53-V57 WeakPolarHBondContact O-CG2 3.37Å; N53-V57 PolarHBondContact O-N 3.23Å
54	L	98.3	Very high	95	Very high	9 Å²	9	40.5 Å²	40.5	5%	0.047	24%	0.235	C	C	.	.	H	α-helix	trans	-58.9	-46.4	176.3	-69.7	170.8	0	0	0	111.7	V18 A21 K22 M33 M37 E50 E51 S56 V57 A58	V18-L54 HydrophobicContact CG1-CD1 4.07Å; A21-L54 HydrophobicContact CB-CD1 4.41Å; K22-L54 HydrophobicContact CG-CD1 4.23Å; K22-L54 HydrophobicContact CG-CD2 4.14Å; M33-L54 HydrophobicContact CE-CB 4.01Å; M33-L54 HydrophobicContact CE-CD2 3.51Å; M33-L54 HydrophobicContact CE-CG 4.38Å; M33-L54 VanDerWaalsContact CE-O 3.28Å; M33-L54 WeakPolarHBondContact CE-O 3.25Å; M37-L54 HydrophobicContact CE-CB 4.06Å; M37-L54 HydrophobicContact CG-CB 4.15Å; M37-L54 HydrophobicContact SD-CB 3.75Å; M37-L54 HydrophobicContact SD-CD1 4.27Å; E50-L54 HydrophobicContact CG-CD1 4.09Å; E50-L54 HydrophobicContact CG-CG 4.49Å; E50-L54 WeakPolarHBondContact O-CG 3.37Å; E50-L54 PolarHBondContact O-N 2.81Å; E51-L54 PolarHBondContact O-N 2.54Å; L54-S56 VanDerWaalsContact C-N 3.31Å; L54-S56 PolarHBondContact O-N 2.91Å; L54-V57 PolarHBondContact O-N 3.23Å; L54-A58 VanDerWaalsContact O-CB 3.28Å; L54-A58 WeakPolarHBondContact O-CB 3.4Å; L54-A58 PolarHBondContact O-N 3.02Å
55	L	98	Very high	95.4	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-56.8	-46.6	175.9	-177.4	77.3	0	0	0	111.3	M37 L47 E51 N53 A58 Y59 L116	M37-L55 HydrophobicContact CB-CB 4.41Å; M37-L55 HydrophobicContact CB-CD1 3.73Å; M37-L55 HydrophobicContact CE-CB 4.34Å; L47-L55 HydrophobicContact CD1-CB 4.21Å; L47-L55 HydrophobicContact CD1-CD2 3.69Å; L47-L55 HydrophobicContact CD1-CG 4.5Å; E51-L55 WeakPolarHBondContact O-CB 3.35Å; E51-L55 PolarHBondContact O-N 3.32Å; N53-L55 PolarHBondContact O-N 2.93Å; L55-A58 PolarHBondContact O-N 3.42Å; L55-Y59 HydrophobicContact CD1-CD2 3.72Å; L55-Y59 HydrophobicContact CD1-CE2 3.46Å; L55-Y59 VanDerWaalsContact CD1-CE2 3.46Å; L55-Y59 HydrophobicContact CG-CD2 4.16Å; L55-Y59 HydrophobicContact CG-CE2 4.37Å; L55-Y59 WeakPolarHBondContact O-CD2 3.3Å; L55-Y59 PolarHBondContact O-N 3.48Å; L55-Y59 VanDerWaalsContact O-N 3.16Å; L55-L116 HydrophobicContact CD2-CD1 3.6Å
56	S	97.3	Very high	96.2	Very high	36 Å²	36	41.8 Å²	41.8	25%	0.252	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-48.5	-179.2	-178.3	0	0	0	0	112.2	R52 N53 L54 A58 K60	R52-S56 WeakPolarHBondContact O-CB 3.32Å; R52-S56 PolarHBondContact O-N 3.4Å; R52-S56 VanDerWaalsContact O-N 3.09Å; N53-S56 PolarHBondContact O-N 3.03Å; L54-S56 VanDerWaalsContact C-N 3.31Å; L54-S56 PolarHBondContact O-N 2.91Å; S56-A58 VanDerWaalsContact C-N 3.34Å; S56-A58 PolarHBondContact O-N 3.16Å; S56-K60 WeakPolarHBondContact O-CB 3.46Å; S56-K60 PolarHBondContact O-N 3.27Å
57	V	98.3	Very high	96.7	Very high	43 Å²	43	38.7 Å²	38.7	26%	0.261	22%	0.216	S	C	.	.	H	α-helix	trans	-59.7	-45.3	177.6	170.6	0	0	0	0	110.8	E25 Y30 M33 N53 L54 N61	E25-V57 HydrophobicContact CG-CG1 4.38Å; Y30-V57 HydrophobicContact CE1-CG1 4.27Å; M33-V57 HydrophobicContact CE-CB 4.05Å; M33-V57 HydrophobicContact CE-CG1 3.98Å; M33-V57 HydrophobicContact SD-CG1 4.17Å; N53-V57 WeakPolarHBondContact O-CG2 3.37Å; N53-V57 PolarHBondContact O-N 3.23Å; L54-V57 PolarHBondContact O-N 3.23Å; V57-N61 PolarHBondContact O-N 3.03Å; V57-N61 PolarHBondContact O-ND2 2.72Å
58	A	98.3	Very high	97	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-56.2	-61.6	179.9	0	0	0	0	0	111.5	M33 A34 L54 L55 S56 K60 N61 V62	M33-A58 HydrophobicContact CB-CB 3.9Å; M33-A58 HydrophobicContact CE-CB 4.29Å; M33-A58 HydrophobicContact CG-CB 3.59Å; M33-A58 VanDerWaalsContact SD-CA 3.57Å; M33-A58 HydrophobicContact SD-CB 3.62Å; A34-A58 HydrophobicContact CB-CB 4.2Å; L54-A58 VanDerWaalsContact O-CB 3.28Å; L54-A58 WeakPolarHBondContact O-CB 3.4Å; L54-A58 PolarHBondContact O-N 3.02Å; L55-A58 PolarHBondContact O-N 3.42Å; S56-A58 VanDerWaalsContact C-N 3.34Å; S56-A58 PolarHBondContact O-N 3.16Å; A58-K60 PolarHBondContact O-N 2.68Å; A58-N61 PolarHBondContact O-N 2.97Å; A58-V62 WeakPolarHBondContact O-CG2 3.36Å; A58-V62 PolarHBondContact O-N 3.32Å; A58-V62 VanDerWaalsContact O-N 3.12Å
59	Y	98.5	Very high	97.3	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-72.8	-31.8	-173.9	-75.4	-79.7	0	0	0	112.9	A34 K38 L55 N61 V62 V63 I104 Q107 V108 L111 Y136	A34-Y59 HydrophobicContact CB-CD1 4.14Å; A34-Y59 HydrophobicContact CB-CD2 4.49Å; A34-Y59 HydrophobicContact CB-CE1 3.96Å; A34-Y59 HydrophobicContact CB-CE2 4.28Å; A34-Y59 HydrophobicContact CB-CG 4.42Å; K38-Y59 WeakPolarHBondContact CB-OH 3.32Å; L55-Y59 HydrophobicContact CD1-CD2 3.72Å; L55-Y59 HydrophobicContact CD1-CE2 3.46Å; L55-Y59 VanDerWaalsContact CD1-CE2 3.46Å; L55-Y59 HydrophobicContact CG-CD2 4.16Å; L55-Y59 HydrophobicContact CG-CE2 4.37Å; L55-Y59 WeakPolarHBondContact O-CD2 3.3Å; L55-Y59 PolarHBondContact O-N 3.48Å; L55-Y59 VanDerWaalsContact O-N 3.16Å; Y59-N61 VanDerWaalsContact C-N 3.3Å; Y59-N61 PolarHBondContact O-N 3.24Å; Y59-V62 PolarHBondContact O-N 2.97Å; Y59-V63 WeakPolarHBondContact O-CB 3.42Å; Y59-V63 VanDerWaalsContact O-CG1 3.24Å; Y59-V63 WeakPolarHBondContact O-CG1 3.41Å; Y59-V63 PolarHBondContact O-N 3.12Å; Y59-I104 HydrophobicContact CD1-CG2 4.15Å; Y59-Q107 HydrophobicContact CE1-CG 4.38Å; Y59-Q107 PolarHBondContact OH-NE2 3.22Å; Y59-V108 HydrophobicContact CD1-CG2 3.21Å; Y59-V108 HydrophobicContact CD2-CG2 3.95Å; Y59-V108 HydrophobicContact CE1-CG2 3.55Å; Y59-V108 HydrophobicContact CE2-CG2 4.26Å; Y59-V108 HydrophobicContact CG-CG2 3.42Å; Y59-V108 VanDerWaalsContact CG-CG2 3.42Å; Y59-L111 HydrophobicContact CE2-CD1 4.02Å; Y59-L111 VanDerWaalsContact OH-CD1 3.31Å; Y59-L111 WeakPolarHBondContact OH-CD1 3.37Å; Y59-Y136 WeakPolarHBondContact CB-OH 3.36Å; Y59-Y136 PolarHBondContact O-OH 2.91Å
60	K	97.9	Very high	97.6	Very high	136 Å²	136	38.5 Å²	38.5	59%	0.591	22%	0.215	S	C	*	.	H	α-helix	trans	-57.6	-44.1	174.3	178.2	-176	173.3	-173.3	0	111.1	S56 A58 G64 Y136	S56-K60 WeakPolarHBondContact O-CB 3.46Å; S56-K60 PolarHBondContact O-N 3.27Å; A58-K60 PolarHBondContact O-N 2.68Å; K60-G64 WeakPolarHBondContact O-CA 3.42Å; K60-G64 PolarHBondContact O-N 3.22Å; K60-Y136 PolarHBondContact N-OH 3.11Å
61	N	98.2	Very high	97.7	Very high	57 Å²	57	38.6 Å²	38.6	31%	0.305	21%	0.211	S	C	.	.	H	α-helix	trans	-71.9	-43.3	179.1	-78.8	-71.1	0	0	0	112	Y30 V57 A58 Y59 G64 A65	Y30-N61 HydrophobicContact CD1-CB 3.55Å; Y30-N61 HydrophobicContact CD2-CB 3.46Å; Y30-N61 VanDerWaalsContact CD2-CB 3.46Å; Y30-N61 HydrophobicContact CE1-CB 3.84Å; Y30-N61 WeakPolarHBondContact CE1-ND2 3.45Å; Y30-N61 HydrophobicContact CE2-CB 3.74Å; Y30-N61 HydrophobicContact CG-CB 3.34Å; Y30-N61 VanDerWaalsContact CZ-CG 3.48Å; V57-N61 PolarHBondContact O-N 3.03Å; V57-N61 PolarHBondContact O-ND2 2.72Å; A58-N61 PolarHBondContact O-N 2.97Å; Y59-N61 VanDerWaalsContact C-N 3.3Å; Y59-N61 PolarHBondContact O-N 3.24Å; N61-G64 PolarHBondContact O-N 3.07Å; N61-A65 PolarHBondContact O-N 3.38Å
62	V	97.9	Very high	97.8	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.036	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-50	177.9	174.4	0	0	0	0	111.5	Y30 A34 A58 Y59 R66 I104	Y30-V62 VanDerWaalsContact C-CG2 3.43Å; Y30-V62 VanDerWaalsContact O-CG2 3.32Å; Y30-V62 WeakPolarHBondContact O-CG2 3.32Å; A34-V62 HydrophobicContact CB-CG2 4.16Å; A58-V62 WeakPolarHBondContact O-CG2 3.36Å; A58-V62 PolarHBondContact O-N 3.32Å; A58-V62 VanDerWaalsContact O-N 3.12Å; Y59-V62 PolarHBondContact O-N 2.97Å; V62-R66 WeakPolarHBondContact O-CD 3.33Å; V62-I104 HydrophobicContact CG1-CD1 3.62Å; V62-I104 HydrophobicContact CG1-CG1 4Å; V62-I104 HydrophobicContact CG1-CG2 4.1Å
63	V	98.1	Very high	97.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-70.9	-37.1	179.2	78.1	0	0	0	0	111.5	Y59 A65 R66 R67 L101 I104 Y136 Y139	Y59-V63 WeakPolarHBondContact O-CB 3.42Å; Y59-V63 VanDerWaalsContact O-CG1 3.24Å; Y59-V63 WeakPolarHBondContact O-CG1 3.41Å; Y59-V63 PolarHBondContact O-N 3.12Å; V63-A65 VanDerWaalsContact C-N 3.35Å; V63-A65 PolarHBondContact O-N 3.48Å; V63-R66 PolarHBondContact O-N 3.46Å; V63-R67 HydrophobicContact CG2-CG 4.47Å; V63-R67 WeakPolarHBondContact O-CG 3.39Å; V63-R67 PolarHBondContact O-N 3Å; V63-L101 HydrophobicContact CG2-CG 4.26Å; V63-I104 HydrophobicContact CB-CG2 4.14Å; V63-I104 HydrophobicContact CG2-CG2 4.45Å; V63-Y136 HydrophobicContact CB-CE1 4.12Å; V63-Y136 HydrophobicContact CG1-CE1 3.96Å; V63-Y136 HydrophobicContact CG2-CE1 4.32Å; V63-Y139 HydrophobicContact CG1-CD2 3.95Å; V63-Y139 HydrophobicContact CG1-CE2 3.83Å; V63-Y139 HydrophobicContact CG2-CD2 3.96Å
64	G	97.9	Very high	97.9	Very high	22 Å²	22	39.3 Å²	39.3	23%	0.227	22%	0.221	C	C	.	.	H	α-helix	trans	-59	-43.8	177.9	0	0	0	0	0	112.4	K60 N61 R66 R67 S68	K60-G64 WeakPolarHBondContact O-CA 3.42Å; K60-G64 PolarHBondContact O-N 3.22Å; N61-G64 PolarHBondContact O-N 3.07Å; G64-R66 PolarHBondContact O-N 2.69Å; G64-R67 PolarHBondContact O-N 3.2Å; G64-S68 PolarHBondContact O-N 2.88Å; G64-S68 PolarHBondContact O-OG 2.83Å
65	A	97.7	Very high	97.8	Very high	56 Å²	56	40.3 Å²	40.3	46%	0.463	23%	0.234	S	C	.	.	H	α-helix	trans	-60.1	-43.2	175.6	0	0	0	0	0	112.3	N61 V63 S68 A69	N61-A65 PolarHBondContact O-N 3.38Å; V63-A65 VanDerWaalsContact C-N 3.35Å; V63-A65 PolarHBondContact O-N 3.48Å; A65-S68 PolarHBondContact O-N 3.28Å; A65-A69 WeakPolarHBondContact O-CB 3.49Å; A65-A69 PolarHBondContact O-N 3.08Å
66	R	98	Very high	97.6	Very high	38 Å²	38	42.6 Å²	42.6	14%	0.143	25%	0.25	C	C	.	.	H	α-helix	trans	-67.8	-40.3	178	-88.2	67.9	-175	-172.6	2	111.9	D31 V62 V63 G64 A69 W70 I97 E100 L101 I104	D31-R66 IonicContact OD1-NH1 3.63Å; D31-R66 IonicContact OD2-NH1 2.69Å; V62-R66 WeakPolarHBondContact O-CD 3.33Å; V63-R66 PolarHBondContact O-N 3.46Å; G64-R66 PolarHBondContact O-N 2.69Å; R66-A69 PolarHBondContact O-N 2.88Å; R66-W70 WeakPolarHBondContact O-CB 3.43Å; R66-W70 PolarHBondContact O-N 2.83Å; R66-I97 HydrophobicContact CB-CG2 4.31Å; R66-I97 HydrophobicContact CG-CG2 4.43Å; R66-I97 VanDerWaalsContact O-CG2 3.32Å; R66-I97 WeakPolarHBondContact O-CG2 3.37Å; R66-E100 HydrophobicContact CG-CB 4.15Å; R66-E100 IonicContact CZ-OE2 3.13Å; R66-E100 IonicContact NE-OE2 2.78Å; R66-E100 PolarHBondContact NE-OE2 3.02Å; R66-E100 IonicContact NH2-OE2 2.78Å; R66-E100 PolarHBondContact NH2-OE2 2.82Å; R66-L101 HydrophobicContact CB-CB 4.21Å; R66-L101 HydrophobicContact CB-CD1 4.48Å; R66-I104 HydrophobicContact CG-CD1 4.08Å
67	R	97.9	Very high	97.4	Very high	29 Å²	29	42.6 Å²	42.6	11%	0.109	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-45.7	175.4	-71.7	177.6	72.5	-134.5	9	112	V63 G64 W70 R71 L101 Y139 E142	V63-R67 HydrophobicContact CG2-CG 4.47Å; V63-R67 WeakPolarHBondContact O-CG 3.39Å; V63-R67 PolarHBondContact O-N 3Å; G64-R67 PolarHBondContact O-N 3.2Å; R67-W70 PolarHBondContact O-N 3.39Å; R67-R71 WeakPolarHBondContact O-CG 3.46Å; R67-R71 PolarHBondContact O-N 3.47Å; R67-L101 HydrophobicContact CG-CD1 3.56Å; R67-Y139 VanDerWaalsContact CZ-CD1 3.47Å; R67-Y139 VanDerWaalsContact NE-CD1 3.32Å; R67-E142 IonicContact CZ-OE2 2.68Å; R67-E142 IonicContact NE-OE2 2.81Å; R67-E142 PolarHBondContact NE-OE2 3.06Å; R67-E142 IonicContact NH2-OE1 2.77Å; R67-E142 IonicContact NH2-OE2 2.63Å; R67-E142 PolarHBondContact NH2-OE2 2.9Å
68	S	98.3	Very high	97.2	Very high	68 Å²	68	45.8 Å²	45.8	48%	0.476	27%	0.266	S	S	.	.	H	α-helix	trans	-61.2	-45.7	176.4	-65.3	0	0	0	0	111.6	G64 A65 R71 V72	G64-S68 PolarHBondContact O-N 2.88Å; G64-S68 PolarHBondContact O-OG 2.83Å; A65-S68 PolarHBondContact O-N 3.28Å; S68-R71 PolarHBondContact O-N 3.25Å; S68-V72 WeakPolarHBondContact O-CG2 3.42Å; S68-V72 PolarHBondContact O-N 2.74Å
69	A	98.2	Very high	97.1	Very high	38 Å²	38	54.5 Å²	54.5	31%	0.314	30%	0.304	S	S	.	.	H	α-helix	trans	-60.6	-46.2	175.3	0	0	0	0	0	111.6	A65 R66 R71 V72 I73 I97	A65-A69 WeakPolarHBondContact O-CB 3.49Å; A65-A69 PolarHBondContact O-N 3.08Å; R66-A69 PolarHBondContact O-N 2.88Å; A69-R71 PolarHBondContact O-N 3.47Å; A69-V72 PolarHBondContact O-N 2.82Å; A69-I73 WeakPolarHBondContact O-CG1 3.44Å; A69-I73 PolarHBondContact O-N 3.34Å; A69-I97 HydrophobicContact CB-CD1 3.96Å; A69-I97 HydrophobicContact CB-CG2 4.44Å
70	W	98.2	Very high	96.8	Very high	39 Å²	39	55.1 Å²	55.1	15%	0.148	31%	0.309	C	S	.	.	H	α-helix	trans	-56.9	-49.7	178.3	-179.1	84.2	0	0	0	111.6	R66 R67 V72 I73 S74 I97 E98 E142 V143	R66-W70 WeakPolarHBondContact O-CB 3.43Å; R66-W70 PolarHBondContact O-N 2.83Å; R67-W70 PolarHBondContact O-N 3.39Å; W70-V72 VanDerWaalsContact C-N 3.32Å; W70-V72 PolarHBondContact O-N 3.26Å; W70-I73 PolarHBondContact O-N 3Å; W70-S74 VanDerWaalsContact CE2-OG 3.27Å; W70-S74 WeakPolarHBondContact O-CB 3.5Å; W70-S74 PolarHBondContact O-N 3.18Å; W70-S74 PolarHBondContact O-OG 3.08Å; W70-I97 HydrophobicContact CB-CG2 3.78Å; W70-E98 VanDerWaalsContact CD1-CG 3.48Å; W70-E98 VanDerWaalsContact NE1-CG 3.32Å; W70-E98 PolarHBondContact NE1-OE1 3.12Å; W70-E142 HydrophobicContact CH2-CG 4.43Å; W70-E142 WeakPolarHBondContact CH2-O 3.5Å; W70-E142 HydrophobicContact CZ3-CG 3.96Å; W70-V143 HydrophobicContact CD2-CG1 3.59Å; W70-V143 HydrophobicContact CE3-CG1 3.97Å; W70-V143 HydrophobicContact CG-CG1 3.96Å; W70-V143 HydrophobicContact CH2-CG1 4.29Å; W70-V143 HydrophobicContact CZ2-CB 4.18Å; W70-V143 HydrophobicContact CZ2-CG1 3.95Å; W70-V143 HydrophobicContact CZ3-CG1 4.3Å
71	R	97.7	Very high	96.5	Very high	98 Å²	98	52 Å²	52	37%	0.37	31%	0.308	S	S	.	.	H	α-helix	trans	-59	-41.2	179	-70.3	-178.3	-174	138.2	-16.7	113.1	R67 S68 A69 G75 E142	R67-R71 WeakPolarHBondContact O-CG 3.46Å; R67-R71 PolarHBondContact O-N 3.47Å; S68-R71 PolarHBondContact O-N 3.25Å; A69-R71 PolarHBondContact O-N 3.47Å; R71-G75 PolarHBondContact O-N 3.34Å; R71-E142 IonicContact CZ-OE1 3.36Å; R71-E142 IonicContact NE-OE1 3.18Å; R71-E142 PolarHBondContact NE-OE1 2.88Å; R71-E142 IonicContact NH2-OE1 3.68Å; R71-E142 PolarHBondContact NH2-OE1 3.38Å; R71-E142 IonicContact NH2-OE2 3.68Å
72	V	98	Very high	96.3	Very high	96 Å²	96	57.4 Å²	57.4	58%	0.582	34%	0.337	S	S	*	.	H	α-helix	trans	-64.7	-44.1	177.9	171.6	0	0	0	0	111	S68 A69 W70 S76	S68-V72 WeakPolarHBondContact O-CG2 3.42Å; S68-V72 PolarHBondContact O-N 2.74Å; A69-V72 PolarHBondContact O-N 2.82Å; W70-V72 VanDerWaalsContact C-N 3.32Å; W70-V72 PolarHBondContact O-N 3.26Å; V72-S76 WeakPolarHBondContact O-CB 3.38Å; V72-S76 PolarHBondContact O-N 3.18Å; V72-S76 PolarHBondContact O-OG 2.69Å
73	I	97.6	Very high	96.2	Very high	28 Å²	28	59.9 Å²	59.9	14%	0.144	35%	0.35	C	S	.	.	H	α-helix	trans	-71.3	-44.8	-179.6	-60.6	-53.3	0	0	0	111.2	A69 W70 G75 S76 E77 A90 Y93 R94 I97	A69-I73 WeakPolarHBondContact O-CG1 3.44Å; A69-I73 PolarHBondContact O-N 3.34Å; W70-I73 PolarHBondContact O-N 3Å; I73-G75 VanDerWaalsContact C-N 3.28Å; I73-G75 PolarHBondContact O-N 3.24Å; I73-S76 CarbonylContact O-C 3.57Å; I73-S76 WeakPolarHBondContact O-CA 3.42Å; I73-S76 WeakPolarHBondContact O-CB 3.47Å; I73-S76 PolarHBondContact O-N 3.3Å; I73-E77 PolarHBondContact O-N 3.09Å; I73-A90 VanDerWaalsContact CG2-O 3.24Å; I73-A90 WeakPolarHBondContact CG2-O 3.03Å; I73-Y93 HydrophobicContact CD1-CD1 3.71Å; I73-Y93 HydrophobicContact CD1-CE1 3.83Å; I73-Y93 HydrophobicContact CG1-CD1 3.97Å; I73-Y93 HydrophobicContact CG1-CE1 4.16Å; I73-Y93 HydrophobicContact CG2-CD1 4.45Å; I73-R94 HydrophobicContact CG2-CB 3.93Å; I73-I97 HydrophobicContact CB-CD1 4.3Å; I73-I97 HydrophobicContact CG1-CD1 3.71Å
74	S	95.9	Very high	96	Very high	21 Å²	21	67 Å²	67	15%	0.147	38%	0.383	C	S	.	.	H	α-helix	trans	-56.7	-42.6	173.6	-58.6	0	0	0	0	111.6	W70 S76 E77 T78 R94	W70-S74 VanDerWaalsContact CE2-OG 3.27Å; W70-S74 WeakPolarHBondContact O-CB 3.5Å; W70-S74 PolarHBondContact O-N 3.18Å; W70-S74 PolarHBondContact O-OG 3.08Å; S74-S76 VanDerWaalsContact C-N 3.3Å; S74-S76 PolarHBondContact O-N 2.9Å; S74-E77 PolarHBondContact O-N 3.13Å; S74-T78 PolarHBondContact O-N 3.35Å; S74-T78 VanDerWaalsContact O-N 3.15Å; S74-T78 PolarHBondContact O-OG1 2.84Å; S74-R94 WeakPolarHBondContact OG-CD 3.33Å
75	G	95.2	Very high	95.9	Very high	30 Å²	30	72.2 Å²	72.2	31%	0.309	40%	0.403	S	S	.	.	H	α-helix	trans	-65.7	-31.3	174.3	0	0	0	0	0	113.7	R71 I73 K79	R71-G75 PolarHBondContact O-N 3.34Å; I73-G75 VanDerWaalsContact C-N 3.28Å; I73-G75 PolarHBondContact O-N 3.24Å; G75-K79 VanDerWaalsContact O-CG 3.31Å; G75-K79 WeakPolarHBondContact O-CG 3.39Å; G75-K79 PolarHBondContact O-N 3.42Å
76	S	94.8	Very high	95.8	Very high	51 Å²	51	75.7 Å²	75.7	36%	0.357	41%	0.408	S	S	.	.	H	α-helix	trans	-74.9	-37.1	176.5	-58.5	0	0	0	0	112.1	V72 I73 S74 K79 A80	V72-S76 WeakPolarHBondContact O-CB 3.38Å; V72-S76 PolarHBondContact O-N 3.18Å; V72-S76 PolarHBondContact O-OG 2.69Å; I73-S76 CarbonylContact O-C 3.57Å; I73-S76 WeakPolarHBondContact O-CA 3.42Å; I73-S76 WeakPolarHBondContact O-CB 3.47Å; I73-S76 PolarHBondContact O-N 3.3Å; S74-S76 VanDerWaalsContact C-N 3.3Å; S74-S76 PolarHBondContact O-N 2.9Å; S76-K79 PolarHBondContact O-N 2.73Å; S76-A80 WeakPolarHBondContact O-CB 3.45Å; S76-A80 PolarHBondContact O-N 2.99Å
77	E	93.9	Very high	95.7	Very high	35 Å²	35	75.2 Å²	75.2	16%	0.164	41%	0.411	C	S	.	.	H	α-helix	trans	-58.7	-50.4	173	-176.1	-179.6	167.7	0	0	110.8	I73 S74 K79 A80 A81 A90 R94	I73-E77 PolarHBondContact O-N 3.09Å; S74-E77 PolarHBondContact O-N 3.13Å; E77-K79 VanDerWaalsContact C-N 3.31Å; E77-K79 PolarHBondContact O-N 2.97Å; E77-A80 CarbonylContact O-C 3.5Å; E77-A80 PolarHBondContact O-N 2.84Å; E77-A81 PolarHBondContact O-N 3.16Å; E77-A90 HydrophobicContact CB-CB 3.75Å; E77-A90 HydrophobicContact CG-CB 4.29Å; E77-R94 IonicContact OE1-CZ 3.06Å; E77-R94 IonicContact OE1-NE 2.73Å; E77-R94 IonicContact OE1-NH2 3.13Å; E77-R94 PolarHBondContact OE1-NH2 2.82Å; E77-R94 VanDerWaalsContact OE2-CD 3.3Å; E77-R94 WeakPolarHBondContact OE2-CD 3.49Å; E77-R94 IonicContact OE2-CZ 3.53Å; E77-R94 IonicContact OE2-NE 3.47Å; E77-R94 PolarHBondContact OE2-NE 3.21Å; E77-R94 IonicContact OE2-NH2 3.72Å
78	T	93.9	Very high	95.6	Very high	111 Å²	111	77.9 Å²	77.9	68%	0.681	42%	0.424	S	S	*	.	H	α-helix	trans	-58.2	-41.4	176.4	-56.6	0	0	0	0	112.3	S74 A80 A81	S74-T78 PolarHBondContact O-N 3.35Å; S74-T78 VanDerWaalsContact O-N 3.15Å; S74-T78 PolarHBondContact O-OG1 2.84Å; T78-A80 VanDerWaalsContact C-N 3.29Å; T78-A80 PolarHBondContact O-N 3.17Å; T78-A81 WeakPolarHBondContact O-CB 3.22Å; T78-A81 PolarHBondContact O-N 3.41Å
79	K	95.3	Very high	95.6	Very high	183 Å²	183	79.2 Å²	79.2	80%	0.796	43%	0.425	S	S	*	.	H	α-helix	trans	-69.6	-26.8	177.5	-72.6	172	-175.3	176	0	113.1	G75 S76 E77 A81	G75-K79 VanDerWaalsContact O-CG 3.31Å; G75-K79 WeakPolarHBondContact O-CG 3.39Å; G75-K79 PolarHBondContact O-N 3.42Å; S76-K79 PolarHBondContact O-N 2.73Å; E77-K79 VanDerWaalsContact C-N 3.31Å; E77-K79 PolarHBondContact O-N 2.97Å; K79-A81 VanDerWaalsContact C-N 3.33Å
80	A	93	Very high	95.5	Very high	15 Å²	15	78 Å²	78	12%	0.124	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	6.9	179.5	0	0	0	0	0	113.4	S76 E77 T78 N82 D83 K86	S76-A80 WeakPolarHBondContact O-CB 3.45Å; S76-A80 PolarHBondContact O-N 2.99Å; E77-A80 CarbonylContact O-C 3.5Å; E77-A80 PolarHBondContact O-N 2.84Å; T78-A80 VanDerWaalsContact C-N 3.29Å; T78-A80 PolarHBondContact O-N 3.17Å; A80-N82 PolarHBondContact O-N 2.96Å; A80-D83 CarbonylContact O-C 3.56Å; A80-D83 PolarHBondContact O-N 3.2Å; A80-D83 VanDerWaalsContact O-O 3.11Å; A80-K86 HydrophobicContact CB-CB 3.78Å
81	A	90.7	Very high	95.5	Very high	69 Å²	69	80 Å²	80	57%	0.57	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-25.9	-173.7	0	0	0	0	0	115.1	E77 T78 K79	E77-A81 PolarHBondContact O-N 3.16Å; T78-A81 WeakPolarHBondContact O-CB 3.22Å; T78-A81 PolarHBondContact O-N 3.41Å; K79-A81 VanDerWaalsContact C-N 3.33Å
82	N	94.5	Very high	95.4	Very high	172 Å²	172	80.1 Å²	80.1	92%	0.92	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-2.5	177.9	-63.2	-34.7	0	0	0	114.1	A80	A80-N82 PolarHBondContact O-N 2.96Å
83	D	95.8	Very high	95.4	Very high	57 Å²	57	81.7 Å²	81.7	31%	0.305	43%	0.427	S	S	.	.			trans	-122	93.2	179.9	-175.9	-27.8	0	0	0	108.5	A80 M85 K86 S87	A80-D83 CarbonylContact O-C 3.56Å; A80-D83 PolarHBondContact O-N 3.2Å; A80-D83 VanDerWaalsContact O-O 3.11Å; D83-M85 PolarHBondContact O-N 3.35Å; D83-M85 VanDerWaalsContact O-N 3.16Å; D83-M85 PolarHBondContact OD1-N 3.46Å; D83-K86 HydrophobicContact CB-CB 4.12Å; D83-K86 HydrophobicContact CB-CD 4.33Å; D83-K86 HydrophobicContact CB-CG 4.41Å; D83-K86 PolarHBondContact O-N 3.02Å; D83-K86 VanDerWaalsContact O-N 3.09Å; D83-K86 PolarHBondContact OD1-N 3.07Å; D83-K86 WeakPolarHBondContact OD2-CD 3.4Å; D83-K86 WeakPolarHBondContact OD2-CE 3.49Å; D83-K86 WeakPolarHBondContact OD2-CG 3.2Å; D83-K86 IonicContact OD2-NZ 2.77Å; D83-K86 PolarHBondContact OD2-NZ 3.37Å; D83-S87 WeakPolarHBondContact O-CB 3.49Å; D83-S87 PolarHBondContact O-N 3.45Å
84	H	93.6	Very high	95.4	Very high	150 Å²	150	82.5 Å²	82.5	69%	0.694	43%	0.428	S	S	*	.	H	α-helix	trans	-52	-41.8	-173.3	-178.3	-71.3	0	0	0	112.8	Q88	H84-Q88 WeakPolarHBondContact O-CB 3.49Å; H84-Q88 PolarHBondContact O-N 3.38Å
85	M	95.2	Very high	95.4	Very high	133 Å²	133	84.1 Å²	84.1	66%	0.655	44%	0.435	S	S	*	.	H	α-helix	trans	-67.9	-44.5	-178.7	-176.8	178.7	173.2	0	0	111.2	D83 I89	D83-M85 PolarHBondContact O-N 3.35Å; D83-M85 VanDerWaalsContact O-N 3.16Å; D83-M85 PolarHBondContact OD1-N 3.46Å; M85-I89 HydrophobicContact CE-CD1 4.13Å; M85-I89 HydrophobicContact CG-CD1 4.11Å; M85-I89 WeakPolarHBondContact O-CD1 3.41Å; M85-I89 VanDerWaalsContact O-CG1 3.28Å; M85-I89 WeakPolarHBondContact O-CG1 3.28Å; M85-I89 PolarHBondContact O-N 3.36Å; M85-I89 VanDerWaalsContact O-N 3.13Å
86	K	95.7	Very high	95.6	Very high	128 Å²	128	89 Å²	89	56%	0.557	45%	0.448	S	S	*	.	H	α-helix	trans	-68.7	-40.1	177.5	-70.5	-176.1	-167	137.1	0	112.5	A80 D83 I89 A90	A80-K86 HydrophobicContact CB-CB 3.78Å; D83-K86 HydrophobicContact CB-CB 4.12Å; D83-K86 HydrophobicContact CB-CD 4.33Å; D83-K86 HydrophobicContact CB-CG 4.41Å; D83-K86 PolarHBondContact O-N 3.02Å; D83-K86 VanDerWaalsContact O-N 3.09Å; D83-K86 PolarHBondContact OD1-N 3.07Å; D83-K86 WeakPolarHBondContact OD2-CD 3.4Å; D83-K86 WeakPolarHBondContact OD2-CE 3.49Å; D83-K86 WeakPolarHBondContact OD2-CG 3.2Å; D83-K86 IonicContact OD2-NZ 2.77Å; D83-K86 PolarHBondContact OD2-NZ 3.37Å; K86-I89 PolarHBondContact O-N 2.93Å; K86-A90 WeakPolarHBondContact O-CB 3.38Å; K86-A90 PolarHBondContact O-N 3.35Å
87	S	95.6	Very high	95.7	Very high	29 Å²	29	86.9 Å²	86.9	20%	0.203	43%	0.432	C	S	.	.	H	α-helix	trans	-60	-47.3	176.7	177	0	0	0	0	110.8	D83 I89 A90 E91	D83-S87 WeakPolarHBondContact O-CB 3.49Å; D83-S87 PolarHBondContact O-N 3.45Å; S87-I89 PolarHBondContact O-N 3.27Å; S87-A90 PolarHBondContact O-N 3.14Å; S87-E91 WeakPolarHBondContact O-CB 3.47Å; S87-E91 PolarHBondContact O-N 2.74Å
88	Q	96.6	Very high	95.8	Very high	84 Å²	84	86.5 Å²	86.5	39%	0.393	43%	0.431	S	S	.	.	H	α-helix	trans	-61.8	-44.1	177.3	-175	-178.3	-5.8	0	0	112.5	H84 A90 E91 E92	H84-Q88 WeakPolarHBondContact O-CB 3.49Å; H84-Q88 PolarHBondContact O-N 3.38Å; Q88-A90 VanDerWaalsContact C-N 3.32Å; Q88-A90 PolarHBondContact O-N 3.45Å; Q88-E91 PolarHBondContact O-N 2.93Å; Q88-E92 PolarHBondContact NE2-OE1 2.88Å; Q88-E92 WeakPolarHBondContact O-CG 3.35Å; Q88-E92 PolarHBondContact O-N 3.43Å
89	I	97.6	Very high	96	Very high	97 Å²	97	88.2 Å²	88.2	50%	0.497	43%	0.429	S	S	.	.	H	α-helix	trans	-61.8	-42.2	177.4	-69.2	166.5	0	0	0	111	M85 K86 S87 Y93	M85-I89 HydrophobicContact CE-CD1 4.13Å; M85-I89 HydrophobicContact CG-CD1 4.11Å; M85-I89 WeakPolarHBondContact O-CD1 3.41Å; M85-I89 VanDerWaalsContact O-CG1 3.28Å; M85-I89 WeakPolarHBondContact O-CG1 3.28Å; M85-I89 PolarHBondContact O-N 3.36Å; M85-I89 VanDerWaalsContact O-N 3.13Å; K86-I89 PolarHBondContact O-N 2.93Å; S87-I89 PolarHBondContact O-N 3.27Å; I89-Y93 WeakPolarHBondContact O-CB 3.48Å; I89-Y93 PolarHBondContact O-N 3.03Å; I89-Y93 VanDerWaalsContact O-N 3.09Å
90	A	97.3	Very high	96.1	Very high	13 Å²	13	83.1 Å²	83.1	11%	0.107	41%	0.407	C	S	.	.	H	α-helix	trans	-65.6	-43.9	178.3	0	0	0	0	0	111.5	I73 E77 K86 S87 Q88 Y93 R94	I73-A90 VanDerWaalsContact CG2-O 3.24Å; I73-A90 WeakPolarHBondContact CG2-O 3.03Å; E77-A90 HydrophobicContact CB-CB 3.75Å; E77-A90 HydrophobicContact CG-CB 4.29Å; K86-A90 WeakPolarHBondContact O-CB 3.38Å; K86-A90 PolarHBondContact O-N 3.35Å; S87-A90 PolarHBondContact O-N 3.14Å; Q88-A90 VanDerWaalsContact C-N 3.32Å; Q88-A90 PolarHBondContact O-N 3.45Å; A90-Y93 PolarHBondContact O-N 3.15Å; A90-R94 WeakPolarHBondContact O-CB 3.46Å; A90-R94 PolarHBondContact O-N 3.09Å
91	E	96.7	Very high	96.3	Very high	81 Å²	81	82.4 Å²	82.4	38%	0.379	40%	0.401	S	S	.	.	H	α-helix	trans	-59.3	-51.1	176	-176.8	-176.8	-176.3	0	0	111.6	S87 Q88 Y93 R94 I95	S87-E91 WeakPolarHBondContact O-CB 3.47Å; S87-E91 PolarHBondContact O-N 2.74Å; Q88-E91 PolarHBondContact O-N 2.93Å; E91-Y93 PolarHBondContact O-N 3.2Å; E91-R94 WeakPolarHBondContact O-CB 3.42Å; E91-R94 PolarHBondContact O-N 3.23Å; E91-I95 HydrophobicContact CG-CD1 3.96Å; E91-I95 WeakPolarHBondContact O-CG1 3.24Å; E91-I95 PolarHBondContact O-N 3.08Å
92	E	97.5	Very high	96.6	Very high	99 Å²	99	81.7 Å²	81.7	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-59.5	-36.9	178.9	-74.4	178.6	-165.3	0	0	111.9	Q88 K96	Q88-E92 PolarHBondContact NE2-OE1 2.88Å; Q88-E92 WeakPolarHBondContact O-CG 3.35Å; Q88-E92 PolarHBondContact O-N 3.43Å; E92-K96 PolarHBondContact O-N 3.09Å
93	Y	97.8	Very high	96.7	Very high	130 Å²	130	75.6 Å²	75.6	51%	0.51	36%	0.362	S	S	.	.	H	α-helix	trans	-73	-42	176.8	-167.4	-165.6	0	0	0	111.9	I73 I89 A90 E91 I95 K96 I97	I73-Y93 HydrophobicContact CD1-CD1 3.71Å; I73-Y93 HydrophobicContact CD1-CE1 3.83Å; I73-Y93 HydrophobicContact CG1-CD1 3.97Å; I73-Y93 HydrophobicContact CG1-CE1 4.16Å; I73-Y93 HydrophobicContact CG2-CD1 4.45Å; I89-Y93 WeakPolarHBondContact O-CB 3.48Å; I89-Y93 PolarHBondContact O-N 3.03Å; I89-Y93 VanDerWaalsContact O-N 3.09Å; A90-Y93 PolarHBondContact O-N 3.15Å; E91-Y93 PolarHBondContact O-N 3.2Å; Y93-I95 VanDerWaalsContact C-N 3.32Å; Y93-I95 PolarHBondContact O-N 3.32Å; Y93-K96 WeakPolarHBondContact O-CB 3Å; Y93-K96 PolarHBondContact O-N 2.94Å; Y93-K96 VanDerWaalsContact O-N 3.12Å; Y93-I97 HydrophobicContact CD2-CD1 4.17Å; Y93-I97 HydrophobicContact CD2-CG1 4.17Å; Y93-I97 HydrophobicContact CE2-CD1 4Å; Y93-I97 HydrophobicContact CE2-CG1 3.99Å; Y93-I97 PolarHBondContact O-N 3.01Å; Y93-I97 VanDerWaalsContact O-N 3.11Å
94	R	97.2	Very high	96.8	Very high	44 Å²	44	73 Å²	73	17%	0.166	35%	0.348	C	S	.	.	H	α-helix	trans	-54.5	-49.4	173.9	-178.4	-177.3	51.3	78.6	-1.3	110.6	I73 S74 E77 A90 E91 K96 I97 E98	I73-R94 HydrophobicContact CG2-CB 3.93Å; S74-R94 WeakPolarHBondContact OG-CD 3.33Å; E77-R94 IonicContact OE1-CZ 3.06Å; E77-R94 IonicContact OE1-NE 2.73Å; E77-R94 IonicContact OE1-NH2 3.13Å; E77-R94 PolarHBondContact OE1-NH2 2.82Å; E77-R94 VanDerWaalsContact OE2-CD 3.3Å; E77-R94 WeakPolarHBondContact OE2-CD 3.49Å; E77-R94 IonicContact OE2-CZ 3.53Å; E77-R94 IonicContact OE2-NE 3.47Å; E77-R94 PolarHBondContact OE2-NE 3.21Å; E77-R94 IonicContact OE2-NH2 3.72Å; A90-R94 WeakPolarHBondContact O-CB 3.46Å; A90-R94 PolarHBondContact O-N 3.09Å; E91-R94 WeakPolarHBondContact O-CB 3.42Å; E91-R94 PolarHBondContact O-N 3.23Å; R94-K96 VanDerWaalsContact C-N 3.27Å; R94-K96 PolarHBondContact O-N 3.48Å; R94-I97 PolarHBondContact O-N 3.41Å; R94-E98 HydrophobicContact CG-CG 4.41Å; R94-E98 WeakPolarHBondContact CG-OE1 3.28Å; R94-E98 IonicContact CZ-OE1 3.67Å; R94-E98 IonicContact NE-OE1 3.99Å; R94-E98 IonicContact NH1-OE1 2.7Å; R94-E98 PolarHBondContact NH1-OE1 2.56Å; R94-E98 IonicContact NH1-OE2 3.74Å; R94-E98 PolarHBondContact NH1-OE2 3.11Å; R94-E98 WeakPolarHBondContact O-CG 3.48Å; R94-E98 PolarHBondContact O-N 2.86Å
95	I	96.6	Very high	97	Very high	56 Å²	56	65.9 Å²	65.9	29%	0.287	32%	0.315	S	S	.	.	H	α-helix	trans	-59.7	-35.6	179.5	-68.7	167.5	0	0	0	112	E91 Y93 K99	E91-I95 HydrophobicContact CG-CD1 3.96Å; E91-I95 WeakPolarHBondContact O-CG1 3.24Å; E91-I95 PolarHBondContact O-N 3.08Å; Y93-I95 VanDerWaalsContact C-N 3.32Å; Y93-I95 PolarHBondContact O-N 3.32Å; I95-K99 WeakPolarHBondContact O-CG 3.28Å; I95-K99 PolarHBondContact O-N 3.23Å; I95-K99 VanDerWaalsContact O-N 3.08Å
96	K	97.6	Very high	97.1	Very high	132 Å²	132	63.3 Å²	63.3	57%	0.574	30%	0.304	S	S	*	.	H	α-helix	trans	-65.2	-45.2	174	-76.6	175.3	180	168.9	0	111.6	E92 Y93 R94 E98 K99 E100	E92-K96 PolarHBondContact O-N 3.09Å; Y93-K96 WeakPolarHBondContact O-CB 3Å; Y93-K96 PolarHBondContact O-N 2.94Å; Y93-K96 VanDerWaalsContact O-N 3.12Å; R94-K96 VanDerWaalsContact C-N 3.27Å; R94-K96 PolarHBondContact O-N 3.48Å; K96-E98 VanDerWaalsContact C-N 3.32Å; K96-E98 PolarHBondContact O-N 3.39Å; K96-K99 PolarHBondContact O-N 3.21Å; K96-E100 PolarHBondContact O-N 3.35Å; K96-E100 VanDerWaalsContact O-N 3.12Å
97	I	97.4	Very high	97.2	Very high	6 Å²	6	59.2 Å²	59.2	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-40.5	178.1	-61.9	168.4	0	0	0	110.5	R66 A69 W70 I73 Y93 R94 K99 E100 L101	R66-I97 HydrophobicContact CB-CG2 4.31Å; R66-I97 HydrophobicContact CG-CG2 4.43Å; R66-I97 VanDerWaalsContact O-CG2 3.32Å; R66-I97 WeakPolarHBondContact O-CG2 3.37Å; A69-I97 HydrophobicContact CB-CD1 3.96Å; A69-I97 HydrophobicContact CB-CG2 4.44Å; W70-I97 HydrophobicContact CB-CG2 3.78Å; I73-I97 HydrophobicContact CB-CD1 4.3Å; I73-I97 HydrophobicContact CG1-CD1 3.71Å; Y93-I97 HydrophobicContact CD2-CD1 4.17Å; Y93-I97 HydrophobicContact CD2-CG1 4.17Å; Y93-I97 HydrophobicContact CE2-CD1 4Å; Y93-I97 HydrophobicContact CE2-CG1 3.99Å; Y93-I97 PolarHBondContact O-N 3.01Å; Y93-I97 VanDerWaalsContact O-N 3.11Å; R94-I97 PolarHBondContact O-N 3.41Å; I97-K99 PolarHBondContact O-N 3.41Å; I97-E100 PolarHBondContact O-N 3.44Å; I97-L101 WeakPolarHBondContact O-CB 3.4Å; I97-L101 PolarHBondContact O-N 3.45Å
98	E	97.1	Very high	97.3	Very high	28 Å²	28	58 Å²	58	13%	0.131	28%	0.278	C	S	.	.	H	α-helix	trans	-57.9	-47.4	174.7	-71.8	173.8	177.6	0	0	111.4	W70 R94 K96 E100 L101 N102 V143	W70-E98 VanDerWaalsContact CD1-CG 3.48Å; W70-E98 VanDerWaalsContact NE1-CG 3.32Å; W70-E98 PolarHBondContact NE1-OE1 3.12Å; R94-E98 HydrophobicContact CG-CG 4.41Å; R94-E98 WeakPolarHBondContact CG-OE1 3.28Å; R94-E98 IonicContact CZ-OE1 3.67Å; R94-E98 IonicContact NE-OE1 3.99Å; R94-E98 IonicContact NH1-OE1 2.7Å; R94-E98 PolarHBondContact NH1-OE1 2.56Å; R94-E98 IonicContact NH1-OE2 3.74Å; R94-E98 PolarHBondContact NH1-OE2 3.11Å; R94-E98 WeakPolarHBondContact O-CG 3.48Å; R94-E98 PolarHBondContact O-N 2.86Å; K96-E98 VanDerWaalsContact C-N 3.32Å; K96-E98 PolarHBondContact O-N 3.39Å; E98-E100 VanDerWaalsContact C-N 3.3Å; E98-E100 PolarHBondContact O-N 3.09Å; E98-L101 PolarHBondContact O-N 3.29Å; E98-N102 WeakPolarHBondContact O-CB 3.43Å; E98-N102 PolarHBondContact O-N 3.32Å; E98-N102 PolarHBondContact O-ND2 2.84Å; E98-V143 HydrophobicContact CG-CB 4.16Å
99	K	96.7	Very high	97.4	Very high	147 Å²	147	54.9 Å²	54.9	64%	0.639	26%	0.264	S	S	*	.	H	α-helix	trans	-59.4	-41.2	177.2	-74.2	174	-179	178.1	0	112.3	I95 K96 I97 A103	I95-K99 WeakPolarHBondContact O-CG 3.28Å; I95-K99 PolarHBondContact O-N 3.23Å; I95-K99 VanDerWaalsContact O-N 3.08Å; K96-K99 PolarHBondContact O-N 3.21Å; I97-K99 PolarHBondContact O-N 3.41Å; K99-A103 WeakPolarHBondContact O-CB 3.47Å; K99-A103 PolarHBondContact O-N 2.91Å; K99-A103 VanDerWaalsContact O-N 3.08Å
100	E	97	Very high	97.4	Very high	75 Å²	75	53.5 Å²	53.5	35%	0.35	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-48	175.3	-69.6	-179.1	-163.8	0	0	112	R66 K96 I97 E98 A103 I104	R66-E100 HydrophobicContact CG-CB 4.15Å; R66-E100 IonicContact CZ-OE2 3.13Å; R66-E100 IonicContact NE-OE2 2.78Å; R66-E100 PolarHBondContact NE-OE2 3.02Å; R66-E100 IonicContact NH2-OE2 2.78Å; R66-E100 PolarHBondContact NH2-OE2 2.82Å; K96-E100 PolarHBondContact O-N 3.35Å; K96-E100 VanDerWaalsContact O-N 3.12Å; I97-E100 PolarHBondContact O-N 3.44Å; E98-E100 VanDerWaalsContact C-N 3.3Å; E98-E100 PolarHBondContact O-N 3.09Å; E100-A103 PolarHBondContact O-N 2.92Å; E100-I104 WeakPolarHBondContact O-CD1 3.37Å; E100-I104 VanDerWaalsContact O-CG1 3.28Å; E100-I104 WeakPolarHBondContact O-CG1 3.21Å; E100-I104 PolarHBondContact O-N 2.84Å
101	L	97.4	Very high	97.4	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-49	179.3	-173.7	159.6	0	0	0	111	V63 R66 R67 I97 E98 A103 I104 C105 V143	V63-L101 HydrophobicContact CG2-CG 4.26Å; R66-L101 HydrophobicContact CB-CB 4.21Å; R66-L101 HydrophobicContact CB-CD1 4.48Å; R67-L101 HydrophobicContact CG-CD1 3.56Å; I97-L101 WeakPolarHBondContact O-CB 3.4Å; I97-L101 PolarHBondContact O-N 3.45Å; E98-L101 PolarHBondContact O-N 3.29Å; L101-A103 VanDerWaalsContact C-N 3.33Å; L101-A103 PolarHBondContact O-N 3.43Å; L101-I104 PolarHBondContact O-N 2.95Å; L101-C105 PolarHBondContact O-N 3.02Å; L101-C105 PolarHBondContact O-SG 3.47Å; L101-C105 VanDerWaalsContact O-SG 3.41Å; L101-V143 HydrophobicContact CD1-CG1 3.89Å; L101-V143 HydrophobicContact CD2-CG2 3.88Å
102	N	96.9	Very high	97.4	Very high	54 Å²	54	49.2 Å²	49.2	29%	0.289	24%	0.238	S	C	.	.	H	α-helix	trans	-56.9	-47.2	177.5	-77.2	-72.7	0	0	0	110.8	E98 I104 C105 D106 L140	E98-N102 WeakPolarHBondContact O-CB 3.43Å; E98-N102 PolarHBondContact O-N 3.32Å; E98-N102 PolarHBondContact O-ND2 2.84Å; N102-I104 VanDerWaalsContact C-N 3.35Å; N102-I104 PolarHBondContact O-N 3.37Å; N102-C105 PolarHBondContact O-N 3.29Å; N102-D106 WeakPolarHBondContact O-CB 3.28Å; N102-D106 VanDerWaalsContact O-CG 3.32Å; N102-D106 PolarHBondContact O-N 3.33Å; N102-L140 HydrophobicContact CB-CD2 4.15Å; N102-L140 WeakPolarHBondContact OD1-CD2 3.04Å
103	A	97.2	Very high	97.3	Very high	45 Å²	45	51.2 Å²	51.2	37%	0.372	25%	0.245	S	C	.	.	H	α-helix	trans	-61.4	-40	178.5	0	0	0	0	0	113.2	M1 K99 E100 L101 Q107	M1-A103 HydrophobicContact CE-CB 4.32Å; K99-A103 WeakPolarHBondContact O-CB 3.47Å; K99-A103 PolarHBondContact O-N 2.91Å; K99-A103 VanDerWaalsContact O-N 3.08Å; E100-A103 PolarHBondContact O-N 2.92Å; L101-A103 VanDerWaalsContact C-N 3.33Å; L101-A103 PolarHBondContact O-N 3.43Å; A103-Q107 WeakPolarHBondContact O-CB 3.35Å; A103-Q107 PolarHBondContact O-N 3.3Å; A103-Q107 VanDerWaalsContact O-N 3.08Å
104	I	97.9	Very high	97.2	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.015	24%	0.241	C	C	.	.	H	α-helix	trans	-64.9	-46.4	175.8	-66.8	154.5	0	0	0	110.4	M1 Y59 V62 V63 R66 E100 L101 N102 Q107 V108	M1-I104 HydrophobicContact CE-CG1 4.36Å; Y59-I104 HydrophobicContact CD1-CG2 4.15Å; V62-I104 HydrophobicContact CG1-CD1 3.62Å; V62-I104 HydrophobicContact CG1-CG1 4Å; V62-I104 HydrophobicContact CG1-CG2 4.1Å; V63-I104 HydrophobicContact CB-CG2 4.14Å; V63-I104 HydrophobicContact CG2-CG2 4.45Å; R66-I104 HydrophobicContact CG-CD1 4.08Å; E100-I104 WeakPolarHBondContact O-CD1 3.37Å; E100-I104 VanDerWaalsContact O-CG1 3.28Å; E100-I104 WeakPolarHBondContact O-CG1 3.21Å; E100-I104 PolarHBondContact O-N 2.84Å; L101-I104 PolarHBondContact O-N 2.95Å; N102-I104 VanDerWaalsContact C-N 3.35Å; N102-I104 PolarHBondContact O-N 3.37Å; I104-Q107 PolarHBondContact O-N 3.4Å; I104-V108 WeakPolarHBondContact O-CG2 3.28Å; I104-V108 PolarHBondContact O-N 2.85Å; I104-V108 VanDerWaalsContact O-N 3.11Å
105	C	98.3	Very high	97.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.8	-46.3	179.8	-71.4	0	0	0	0	112.1	L101 N102 Q107 V108 L109 Y136 L140	L101-C105 PolarHBondContact O-N 3.02Å; L101-C105 PolarHBondContact O-SG 3.47Å; L101-C105 VanDerWaalsContact O-SG 3.41Å; N102-C105 PolarHBondContact O-N 3.29Å; C105-Q107 VanDerWaalsContact C-N 3.3Å; C105-Q107 PolarHBondContact O-N 3.22Å; C105-V108 PolarHBondContact O-N 3.43Å; C105-V108 VanDerWaalsContact O-N 3.17Å; C105-L109 VanDerWaalsContact O-CG 3.27Å; C105-L109 WeakPolarHBondContact O-CG 3.34Å; C105-L109 PolarHBondContact O-N 3.39Å; C105-Y136 HydrophobicContact CB-CD1 4.12Å; C105-L140 HydrophobicContact CB-CD1 4.07Å; C105-L140 HydrophobicContact CB-CD2 3.52Å; C105-L140 HydrophobicContact CB-CG 3.6Å
106	D	97.8	Very high	97.1	Very high	78 Å²	78	48 Å²	48	42%	0.417	24%	0.235	S	C	.	.	H	α-helix	trans	-61.3	-40.2	178.4	-72.5	-25	0	0	0	111.3	N102 V108 L109 V110	N102-D106 WeakPolarHBondContact O-CB 3.28Å; N102-D106 VanDerWaalsContact O-CG 3.32Å; N102-D106 PolarHBondContact O-N 3.33Å; D106-V108 PolarHBondContact O-N 3.16Å; D106-L109 PolarHBondContact O-N 3.36Å; D106-V110 WeakPolarHBondContact O-CB 3.35Å; D106-V110 VanDerWaalsContact O-CG2 3.32Å; D106-V110 WeakPolarHBondContact O-CG2 3.49Å; D106-V110 PolarHBondContact O-N 3.47Å
107	Q	97.5	Very high	96.9	Very high	43 Å²	43	43.7 Å²	43.7	20%	0.201	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-46.1	174.2	177	171.6	-51.8	0	0	111.9	K38 Y59 A103 I104 C105 V110 L111	K38-Q107 HydrophobicContact CD-CG 4.06Å; Y59-Q107 HydrophobicContact CE1-CG 4.38Å; Y59-Q107 PolarHBondContact OH-NE2 3.22Å; A103-Q107 WeakPolarHBondContact O-CB 3.35Å; A103-Q107 PolarHBondContact O-N 3.3Å; A103-Q107 VanDerWaalsContact O-N 3.08Å; I104-Q107 PolarHBondContact O-N 3.4Å; C105-Q107 VanDerWaalsContact C-N 3.3Å; C105-Q107 PolarHBondContact O-N 3.22Å; Q107-V110 PolarHBondContact O-N 3.07Å; Q107-L111 WeakPolarHBondContact O-CG 3.37Å; Q107-L111 PolarHBondContact O-N 2.77Å
108	V	98.1	Very high	96.4	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-43.9	176.5	171.9	0	0	0	0	111.3	Y59 I104 C105 D106 V110 L111 L112 M132 Y136	Y59-V108 HydrophobicContact CD1-CG2 3.21Å; Y59-V108 HydrophobicContact CD2-CG2 3.95Å; Y59-V108 HydrophobicContact CE1-CG2 3.55Å; Y59-V108 HydrophobicContact CE2-CG2 4.26Å; Y59-V108 HydrophobicContact CG-CG2 3.42Å; Y59-V108 VanDerWaalsContact CG-CG2 3.42Å; I104-V108 WeakPolarHBondContact O-CG2 3.28Å; I104-V108 PolarHBondContact O-N 2.85Å; I104-V108 VanDerWaalsContact O-N 3.11Å; C105-V108 PolarHBondContact O-N 3.43Å; C105-V108 VanDerWaalsContact O-N 3.17Å; D106-V108 PolarHBondContact O-N 3.16Å; V108-V110 VanDerWaalsContact C-N 3.28Å; V108-V110 PolarHBondContact O-N 2.98Å; V108-L111 PolarHBondContact O-N 3.5Å; V108-L111 VanDerWaalsContact O-N 3.17Å; V108-L112 HydrophobicContact CG1-CD1 3.8Å; V108-L112 HydrophobicContact CG1-CG 4.19Å; V108-L112 VanDerWaalsContact O-CG 3.28Å; V108-L112 WeakPolarHBondContact O-CG 3.47Å; V108-L112 PolarHBondContact O-N 3.31Å; V108-M132 HydrophobicContact CG1-CE 3.76Å; V108-Y136 HydrophobicContact CB-CD1 3.89Å; V108-Y136 HydrophobicContact CB-CD2 4.37Å; V108-Y136 HydrophobicContact CB-CE1 3.96Å; V108-Y136 HydrophobicContact CB-CE2 4.48Å; V108-Y136 HydrophobicContact CB-CG 4.09Å; V108-Y136 HydrophobicContact CG1-CD1 4.01Å; V108-Y136 HydrophobicContact CG1-CD2 3.58Å; V108-Y136 HydrophobicContact CG1-CE1 4.08Å; V108-Y136 HydrophobicContact CG1-CE2 3.7Å; V108-Y136 HydrophobicContact CG1-CG 3.76Å; V108-Y136 HydrophobicContact CG2-CD1 4.09Å; V108-Y136 HydrophobicContact CG2-CE1 3.66Å
109	L	98.3	Very high	95.2	Very high	19 Å²	19	54.8 Å²	54.8	10%	0.099	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-36.1	179.8	-69.5	173.3	0	0	0	112.1	C105 D106 K113 Q133 N137 L140	C105-L109 VanDerWaalsContact O-CG 3.27Å; C105-L109 WeakPolarHBondContact O-CG 3.34Å; C105-L109 PolarHBondContact O-N 3.39Å; D106-L109 PolarHBondContact O-N 3.36Å; L109-K113 VanDerWaalsContact O-CB 3.24Å; L109-K113 WeakPolarHBondContact O-CB 3.33Å; L109-K113 PolarHBondContact O-N 2.94Å; L109-Q133 HydrophobicContact CD2-CG 3.87Å; L109-N137 WeakPolarHBondContact CD2-ND2 3.32Å; L109-L140 HydrophobicContact CD1-CD1 3.59Å
110	V	97.5	Very high	94.3	Very high	68 Å²	68	49.9 Å²	49.9	41%	0.412	26%	0.255	S	S	.	.	H	α-helix	trans	-64.8	-48.4	171.7	167.3	0	0	0	0	110.8	D106 Q107 V108 L112 K113 D114	D106-V110 WeakPolarHBondContact O-CB 3.35Å; D106-V110 VanDerWaalsContact O-CG2 3.32Å; D106-V110 WeakPolarHBondContact O-CG2 3.49Å; D106-V110 PolarHBondContact O-N 3.47Å; Q107-V110 PolarHBondContact O-N 3.07Å; V108-V110 VanDerWaalsContact C-N 3.28Å; V108-V110 PolarHBondContact O-N 2.98Å; V110-L112 VanDerWaalsContact C-N 3.28Å; V110-L112 PolarHBondContact O-N 2.98Å; V110-K113 PolarHBondContact O-N 3.42Å; V110-D114 WeakPolarHBondContact O-CB 3.43Å; V110-D114 PolarHBondContact O-N 3.45Å
111	L	97.1	Very high	93.4	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-57.9	-41.8	177.1	-70	174.2	0	0	0	112.3	K38 T41 E42 Y59 Q107 V108 Y115 L116	K38-L111 HydrophobicContact CB-CD1 4.3Å; K38-L111 HydrophobicContact CG-CD1 4.19Å; K38-L111 HydrophobicContact CG-CD2 4.18Å; T41-L111 HydrophobicContact CG2-CB 4.37Å; T41-L111 HydrophobicContact CG2-CD2 3.95Å; E42-L111 HydrophobicContact CG-CD2 3.7Å; Y59-L111 HydrophobicContact CE2-CD1 4.02Å; Y59-L111 VanDerWaalsContact OH-CD1 3.31Å; Y59-L111 WeakPolarHBondContact OH-CD1 3.37Å; Q107-L111 WeakPolarHBondContact O-CG 3.37Å; Q107-L111 PolarHBondContact O-N 2.77Å; V108-L111 PolarHBondContact O-N 3.5Å; V108-L111 VanDerWaalsContact O-N 3.17Å; L111-Y115 HydrophobicContact CD2-CD2 4.17Å; L111-Y115 HydrophobicContact CD2-CE2 4.32Å; L111-Y115 WeakPolarHBondContact O-CB 3.49Å; L111-Y115 PolarHBondContact O-N 2.89Å; L111-L116 PolarHBondContact O-N 2.91Å; L111-L116 VanDerWaalsContact O-N 3.11Å
112	L	97.1	Very high	93.1	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.294	C	S	.	.	I	π-helix	trans	-65	-49.8	177.2	-68.1	170.3	0	0	0	111.3	V108 V110 L116 L117 F129 M132 Q133	V108-L112 HydrophobicContact CG1-CD1 3.8Å; V108-L112 HydrophobicContact CG1-CG 4.19Å; V108-L112 VanDerWaalsContact O-CG 3.28Å; V108-L112 WeakPolarHBondContact O-CG 3.47Å; V108-L112 PolarHBondContact O-N 3.31Å; V110-L112 VanDerWaalsContact C-N 3.28Å; V110-L112 PolarHBondContact O-N 2.98Å; L112-L116 HydrophobicContact CD2-CD1 4.04Å; L112-L116 PolarHBondContact O-N 3.27Å; L112-L117 HydrophobicContact CB-CD1 4.24Å; L112-L117 WeakPolarHBondContact O-CB 3.25Å; L112-L117 WeakPolarHBondContact O-CG 3.47Å; L112-L117 PolarHBondContact O-N 3.42Å; L112-F129 HydrophobicContact CD2-CB 3.82Å; L112-F129 HydrophobicContact CD2-CD1 3.72Å; L112-F129 HydrophobicContact CD2-CG 4.06Å; L112-M132 HydrophobicContact CD1-CB 4.16Å; L112-M132 HydrophobicContact CD1-CG 4.08Å; L112-M132 HydrophobicContact CD2-CB 4.34Å; L112-M132 HydrophobicContact CD2-CG 4.43Å; L112-M132 HydrophobicContact CD2-SD 4.03Å; L112-Q133 HydrophobicContact CD1-CB 4Å
113	K	95.8	Very high	92.8	Very high	140 Å²	140	54.7 Å²	54.7	61%	0.609	29%	0.292	S	S	*	.	I	π-helix	trans	-70.6	-46.9	-174.1	-177	-167.3	167.8	-158.6	0	112.7	L109 V110 V118	L109-K113 VanDerWaalsContact O-CB 3.24Å; L109-K113 WeakPolarHBondContact O-CB 3.33Å; L109-K113 PolarHBondContact O-N 2.94Å; V110-K113 PolarHBondContact O-N 3.42Å; K113-V118 VanDerWaalsContact O-CG2 3.25Å; K113-V118 WeakPolarHBondContact O-CG2 3.37Å
114	D	95.4	Very high	92.7	Very high	81 Å²	81	55.7 Å²	55.7	43%	0.433	29%	0.289	S	S	.	.	I	π-helix	trans	-94	-11.8	-165.8	-62.5	-11.3	0	0	0	112.6	V110 V118	V110-D114 WeakPolarHBondContact O-CB 3.43Å; V110-D114 PolarHBondContact O-N 3.45Å; D114-V118 VanDerWaalsContact C-CG2 3.43Å; D114-V118 VanDerWaalsContact O-CG2 3.31Å; D114-V118 WeakPolarHBondContact O-CG2 3.07Å
115	Y	94.8	Very high	92.5	Very high	77 Å²	77	55.9 Å²	55.9	30%	0.302	29%	0.291	S	S	.	.	I	π-helix	trans	-127.6	-61.6	179.3	-55	-95.4	0	0	0	111.6	T41 E42 L111	T41-Y115 HydrophobicContact CG2-CG 4.41Å; E42-Y115 HydrophobicContact CB-CE1 4.03Å; E42-Y115 HydrophobicContact CG-CE1 4.08Å; E42-Y115 HydrophobicContact CG-CE2 4.04Å; L111-Y115 HydrophobicContact CD2-CD2 4.17Å; L111-Y115 HydrophobicContact CD2-CE2 4.32Å; L111-Y115 WeakPolarHBondContact O-CB 3.49Å; L111-Y115 PolarHBondContact O-N 2.89Å
116	L	95.3	Very high	92.4	Very high	4 Å²	4	60 Å²	60	2%	0.021	31%	0.308	C	S	.	.	I	π-helix	trans	-81.8	-20.4	-163.8	-58.4	171.8	0	0	0	115.3	T41 L47 L55 L111 L112 E120 F129	T41-L116 HydrophobicContact CG2-CD1 3.98Å; T41-L116 HydrophobicContact CG2-CD2 3.74Å; T41-L116 HydrophobicContact CG2-CG 3.78Å; L47-L116 HydrophobicContact CD1-CD1 4.06Å; L47-L116 HydrophobicContact CD1-CD2 3.67Å; L47-L116 HydrophobicContact CG-CD2 3.59Å; L55-L116 HydrophobicContact CD2-CD1 3.6Å; L111-L116 PolarHBondContact O-N 2.91Å; L111-L116 VanDerWaalsContact O-N 3.11Å; L112-L116 HydrophobicContact CD2-CD1 4.04Å; L112-L116 PolarHBondContact O-N 3.27Å; L116-E120 WeakPolarHBondContact O-CB 3.29Å; L116-F129 HydrophobicContact CB-CD1 4.31Å; L116-F129 HydrophobicContact CB-CD2 3.92Å; L116-F129 HydrophobicContact CB-CE1 4.38Å; L116-F129 HydrophobicContact CB-CE2 3.97Å; L116-F129 HydrophobicContact CB-CG 4.12Å; L116-F129 HydrophobicContact CB-CZ 4.21Å; L116-F129 HydrophobicContact CD1-CD1 4.06Å; L116-F129 HydrophobicContact CD1-CE1 3.78Å; L116-F129 HydrophobicContact CD1-CZ 4.14Å; L116-F129 HydrophobicContact CD2-CE2 4.38Å; L116-F129 HydrophobicContact CD2-CZ 4.09Å; L116-F129 HydrophobicContact CG-CE1 4.47Å; L116-F129 HydrophobicContact CG-CZ 4.38Å
117	L	93.7	Very high	92.4	Very high	43 Å²	43	56.2 Å²	56.2	23%	0.225	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-0.8	178.8	-69.9	170.1	0	0	0	113.6	L112 F129 L130	L112-L117 HydrophobicContact CB-CD1 4.24Å; L112-L117 WeakPolarHBondContact O-CB 3.25Å; L112-L117 WeakPolarHBondContact O-CG 3.47Å; L112-L117 PolarHBondContact O-N 3.42Å; L117-F129 HydrophobicContact CD2-CB 3.66Å; L117-F129 HydrophobicContact CG-CB 4.06Å; L117-L130 HydrophobicContact CD1-CD2 4.22Å; L117-L130 HydrophobicContact CD2-CD2 4.23Å; L117-L130 HydrophobicContact CD2-CG 4.09Å
118	V	88.2	Confident	92.3	Very high	90 Å²	90	55.6 Å²	55.6	55%	0.545	29%	0.285	S	S	.	.	S	Bend	trans	-70	-41.1	-174.4	-175.7	0	0	0	0	112	K113 D114	K113-V118 VanDerWaalsContact O-CG2 3.25Å; K113-V118 WeakPolarHBondContact O-CG2 3.37Å; D114-V118 VanDerWaalsContact C-CG2 3.43Å; D114-V118 VanDerWaalsContact O-CG2 3.31Å; D114-V118 WeakPolarHBondContact O-CG2 3.07Å
119	Q	72.3	Confident	92.3	Very high	177 Å²	177	55.4 Å²	55.4	83%	0.827	28%	0.284	S	S	*	.	S	Bend	trans	-135	22.8	-176.5	-59.7	-169.3	-4.1	0	0	113.2	S121	Q119-S121 PolarHBondContact O-N 3.02Å; Q119-S121 VanDerWaalsContact O-N 3.17Å
120	E	76.4	Confident	92.3	Very high	43 Å²	43	55.1 Å²	55.1	20%	0.201	28%	0.283	C	S	.	.			trans	-70	117.2	-177	-172.4	53.6	-90.5	0	0	111.3	L116 N122 S125 K126	L116-E120 WeakPolarHBondContact O-CB 3.29Å; E120-N122 VanDerWaalsContact OE1-CB 3.32Å; E120-N122 WeakPolarHBondContact OE1-CB 3.28Å; E120-N122 PolarHBondContact OE1-N 3.4Å; E120-S125 WeakPolarHBondContact OE2-CB 3.36Å; E120-K126 HydrophobicContact CG-CB 4.09Å
121	S	78.5	Confident	92.3	Very high	109 Å²	109	53.6 Å²	53.6	76%	0.762	27%	0.27	S	S	*	.			trans	-108.2	-20.2	-177.8	58.5	0	0	0	0	112.2	Q119 D123	Q119-S121 PolarHBondContact O-N 3.02Å; Q119-S121 VanDerWaalsContact O-N 3.17Å; S121-D123 PolarHBondContact O-N 2.83Å
122	N	90.3	Very high	92.4	Very high	74 Å²	74	53.8 Å²	53.8	40%	0.396	27%	0.271	S	S	.	.			trans	-76.1	124.5	175.7	178.7	-77.3	0	0	0	109.9	E120 E124 S125 K126	E120-N122 VanDerWaalsContact OE1-CB 3.32Å; E120-N122 WeakPolarHBondContact OE1-CB 3.28Å; E120-N122 PolarHBondContact OE1-N 3.4Å; N122-E124 VanDerWaalsContact C-N 3.35Å; N122-E124 PolarHBondContact O-N 2.86Å; N122-E124 WeakPolarHBondContact OD1-CA 3.38Å; N122-E124 VanDerWaalsContact OD1-CB 3.29Å; N122-E124 WeakPolarHBondContact OD1-CB 3.34Å; N122-E124 PolarHBondContact OD1-N 2.78Å; N122-S125 PolarHBondContact O-N 2.88Å; N122-S125 PolarHBondContact OD1-N 2.8Å; N122-K126 VanDerWaalsContact O-CB 3.31Å; N122-K126 WeakPolarHBondContact O-CB 3.4Å; N122-K126 PolarHBondContact O-N 3.3Å
123	D	91.9	Very high	92.4	Very high	47 Å²	47	55.7 Å²	55.7	25%	0.251	28%	0.28	S	S	.	.	H	α-helix	trans	-64.5	-37.1	-175.6	-70.3	-46.2	0	0	0	112.4	S121 K126 V127 K169	S121-D123 PolarHBondContact O-N 2.83Å; D123-K126 PolarHBondContact O-N 3.3Å; D123-V127 WeakPolarHBondContact O-CG2 3.4Å; D123-V127 PolarHBondContact O-N 3.1Å; D123-K169 HydrophobicContact CB-CB 4.43Å; D123-K169 HydrophobicContact CB-CD 4.2Å; D123-K169 VanDerWaalsContact CG-NZ 3.3Å; D123-K169 VanDerWaalsContact OD1-CD 3.29Å; D123-K169 WeakPolarHBondContact OD1-CD 3.29Å; D123-K169 IonicContact OD1-NZ 3.14Å; D123-K169 PolarHBondContact OD1-NZ 3.49Å; D123-K169 WeakPolarHBondContact OD2-CD 3.44Å; D123-K169 IonicContact OD2-NZ 3.82Å; D123-K169 PolarHBondContact OD2-NZ 3.45Å; D123-K169 VanDerWaalsContact OD2-NZ 3.14Å
124	E	93.6	Very high	92.6	Very high	66 Å²	66	49 Å²	49	31%	0.308	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-48.1	176.4	-69	177	-157.8	0	0	112.3	N122 K126 V127 F128 L170 H174 I176	N122-E124 VanDerWaalsContact C-N 3.35Å; N122-E124 PolarHBondContact O-N 2.86Å; N122-E124 WeakPolarHBondContact OD1-CA 3.38Å; N122-E124 VanDerWaalsContact OD1-CB 3.29Å; N122-E124 WeakPolarHBondContact OD1-CB 3.34Å; N122-E124 PolarHBondContact OD1-N 2.78Å; E124-K126 VanDerWaalsContact C-N 3.31Å; E124-K126 PolarHBondContact O-N 3.39Å; E124-V127 PolarHBondContact O-N 3.24Å; E124-F128 VanDerWaalsContact O-CB 3.26Å; E124-F128 WeakPolarHBondContact O-CB 3.28Å; E124-F128 PolarHBondContact O-N 3.24Å; E124-L170 HydrophobicContact CG-CD2 3.62Å; E124-H174 IonicContact OE1-NE2 2.69Å; E124-I176 HydrophobicContact CB-CD1 4.02Å
125	S	94.5	Very high	92.7	Very high	8 Å²	8	45.6 Å²	45.6	6%	0.056	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-40.8	177.5	-69.4	0	0	0	0	111.2	E120 N122 F128 F129	E120-S125 WeakPolarHBondContact OE2-CB 3.36Å; N122-S125 PolarHBondContact O-N 2.88Å; N122-S125 PolarHBondContact OD1-N 2.8Å; S125-F128 WeakPolarHBondContact O-CB 3.27Å; S125-F128 PolarHBondContact O-N 2.57Å; S125-F129 WeakPolarHBondContact O-CB 3.4Å; S125-F129 WeakPolarHBondContact O-CD2 3.12Å; S125-F129 WeakPolarHBondContact O-CG 3.35Å; S125-F129 PolarHBondContact O-N 3.37Å
126	K	95.8	Very high	92.9	Very high	85 Å²	85	42.3 Å²	42.3	37%	0.37	22%	0.22	S	C	.	.	H	α-helix	trans	-60.3	-49	176	-176.3	173	-178.8	176.4	0	111.9	E120 N122 D123 E124 F128 F129 L130 A166	E120-K126 HydrophobicContact CG-CB 4.09Å; N122-K126 VanDerWaalsContact O-CB 3.31Å; N122-K126 WeakPolarHBondContact O-CB 3.4Å; N122-K126 PolarHBondContact O-N 3.3Å; D123-K126 PolarHBondContact O-N 3.3Å; E124-K126 VanDerWaalsContact C-N 3.31Å; E124-K126 PolarHBondContact O-N 3.39Å; K126-F128 VanDerWaalsContact C-N 3.32Å; K126-F128 PolarHBondContact O-N 3.26Å; K126-F129 PolarHBondContact O-N 3.42Å; K126-L130 HydrophobicContact CG-CD1 3.79Å; K126-L130 HydrophobicContact CG-CG 4.47Å; K126-L130 WeakPolarHBondContact O-CB 3.25Å; K126-L130 VanDerWaalsContact O-CG 3.25Å; K126-L130 WeakPolarHBondContact O-CG 3.45Å; K126-L130 PolarHBondContact O-N 3.16Å; K126-A166 HydrophobicContact CD-CB 4.42Å; K126-A166 HydrophobicContact CG-CB 4.45Å
127	V	97.4	Very high	93.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-42.4	176.9	178.8	0	0	0	0	110.4	D123 E124 K131 A166 A167 L170 I176 L180	D123-V127 WeakPolarHBondContact O-CG2 3.4Å; D123-V127 PolarHBondContact O-N 3.1Å; E124-V127 PolarHBondContact O-N 3.24Å; V127-K131 WeakPolarHBondContact O-CB 3.48Å; V127-K131 PolarHBondContact O-N 3.21Å; V127-A166 HydrophobicContact CG2-CB 3.67Å; V127-A167 HydrophobicContact CG1-CB 3.9Å; V127-A167 HydrophobicContact CG2-CB 3.98Å; V127-L170 HydrophobicContact CB-CD1 4.15Å; V127-L170 HydrophobicContact CG1-CD1 4.3Å; V127-L170 HydrophobicContact CG2-CD1 3.98Å; V127-I176 HydrophobicContact CB-CG2 4.05Å; V127-I176 HydrophobicContact CG1-CG2 3.66Å; V127-L180 HydrophobicContact CG1-CD2 4.05Å
128	F	96.7	Very high	93.3	Very high	29 Å²	29	40.9 Å²	40.9	13%	0.127	21%	0.211	C	C	.	.	H	α-helix	trans	-58.6	-51	178.5	-172.9	-82.3	0	0	0	112.3	R52 E124 S125 K126 K131 M132 I176	R52-F128 HydrophobicContact CG-CD1 3.58Å; R52-F128 HydrophobicContact CG-CD2 4.33Å; R52-F128 HydrophobicContact CG-CE1 3.31Å; R52-F128 HydrophobicContact CG-CE2 4.08Å; R52-F128 HydrophobicContact CG-CG 4.09Å; R52-F128 HydrophobicContact CG-CZ 3.56Å; E124-F128 VanDerWaalsContact O-CB 3.26Å; E124-F128 WeakPolarHBondContact O-CB 3.28Å; E124-F128 PolarHBondContact O-N 3.24Å; S125-F128 WeakPolarHBondContact O-CB 3.27Å; S125-F128 PolarHBondContact O-N 2.57Å; K126-F128 VanDerWaalsContact C-N 3.32Å; K126-F128 PolarHBondContact O-N 3.26Å; F128-K131 PolarHBondContact O-N 3Å; F128-M132 HydrophobicContact CE1-SD 4.42Å; F128-M132 WeakPolarHBondContact O-CB 3.21Å; F128-M132 PolarHBondContact O-N 2.87Å; F128-I176 HydrophobicContact CB-CD1 4.36Å; F128-I176 HydrophobicContact CB-CG2 4.34Å; F128-I176 HydrophobicContact CD2-CD1 4.12Å; F128-I176 HydrophobicContact CD2-CG1 4.35Å
129	F	97.4	Very high	93.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-73.1	-35.3	-177.3	-64.6	-42.8	0	0	0	112.8	L47 R52 L112 L116 L117 S125 K126 M132 Q133	L47-F129 HydrophobicContact CB-CZ 4.47Å; L47-F129 HydrophobicContact CD1-CE1 4.36Å; L47-F129 HydrophobicContact CD1-CZ 4.19Å; R52-F129 HydrophobicContact CG-CE1 3.94Å; R52-F129 HydrophobicContact CG-CZ 4.05Å; L112-F129 HydrophobicContact CD2-CB 3.82Å; L112-F129 HydrophobicContact CD2-CD1 3.72Å; L112-F129 HydrophobicContact CD2-CG 4.06Å; L116-F129 HydrophobicContact CB-CD1 4.31Å; L116-F129 HydrophobicContact CB-CD2 3.92Å; L116-F129 HydrophobicContact CB-CE1 4.38Å; L116-F129 HydrophobicContact CB-CE2 3.97Å; L116-F129 HydrophobicContact CB-CG 4.12Å; L116-F129 HydrophobicContact CB-CZ 4.21Å; L116-F129 HydrophobicContact CD1-CD1 4.06Å; L116-F129 HydrophobicContact CD1-CE1 3.78Å; L116-F129 HydrophobicContact CD1-CZ 4.14Å; L116-F129 HydrophobicContact CD2-CE2 4.38Å; L116-F129 HydrophobicContact CD2-CZ 4.09Å; L116-F129 HydrophobicContact CG-CE1 4.47Å; L116-F129 HydrophobicContact CG-CZ 4.38Å; L117-F129 HydrophobicContact CD2-CB 3.66Å; L117-F129 HydrophobicContact CG-CB 4.06Å; S125-F129 WeakPolarHBondContact O-CB 3.4Å; S125-F129 WeakPolarHBondContact O-CD2 3.12Å; S125-F129 WeakPolarHBondContact O-CG 3.35Å; S125-F129 PolarHBondContact O-N 3.37Å; K126-F129 PolarHBondContact O-N 3.42Å; F129-M132 PolarHBondContact O-N 2.82Å; F129-Q133 WeakPolarHBondContact O-CB 3.4Å; F129-Q133 PolarHBondContact O-N 3.4Å
130	L	98.2	Very high	95	Very high	13 Å²	13	29.4 Å²	29.4	7%	0.068	15%	0.151	C	C	.	.	H	α-helix	trans	-67.1	-41.8	172.7	-72.1	169.4	0	0	0	111.8	L117 K126 M132 Q133 G134 K162 A163 A166	L117-L130 HydrophobicContact CD1-CD2 4.22Å; L117-L130 HydrophobicContact CD2-CD2 4.23Å; L117-L130 HydrophobicContact CD2-CG 4.09Å; K126-L130 HydrophobicContact CG-CD1 3.79Å; K126-L130 HydrophobicContact CG-CG 4.47Å; K126-L130 WeakPolarHBondContact O-CB 3.25Å; K126-L130 VanDerWaalsContact O-CG 3.25Å; K126-L130 WeakPolarHBondContact O-CG 3.45Å; K126-L130 PolarHBondContact O-N 3.16Å; L130-M132 VanDerWaalsContact C-N 3.31Å; L130-M132 PolarHBondContact O-N 3.16Å; L130-Q133 WeakPolarHBondContact O-CB 3.5Å; L130-Q133 PolarHBondContact O-N 3.28Å; L130-G134 PolarHBondContact O-N 3.17Å; L130-K162 HydrophobicContact CD1-CB 4.07Å; L130-K162 HydrophobicContact CD2-CB 4.25Å; L130-A163 HydrophobicContact CB-CB 3.65Å; L130-A166 HydrophobicContact CD1-CB 4.47Å
131	K	98.4	Very high	96	Very high	36 Å²	36	27.3 Å²	27.3	16%	0.157	14%	0.142	C	C	.	.	H	α-helix	trans	-57.4	-47.5	171.5	176.4	-167.8	169.1	-68.3	0	110.5	V127 F128 Q133 G134 D135 G179 L180 N183	V127-K131 WeakPolarHBondContact O-CB 3.48Å; V127-K131 PolarHBondContact O-N 3.21Å; F128-K131 PolarHBondContact O-N 3Å; K131-Q133 VanDerWaalsContact C-N 3.32Å; K131-Q133 PolarHBondContact O-N 3.46Å; K131-G134 PolarHBondContact O-N 3.47Å; K131-G134 VanDerWaalsContact O-N 3.16Å; K131-D135 IonicContact NZ-OD2 2.72Å; K131-D135 PolarHBondContact NZ-OD2 2.93Å; K131-D135 VanDerWaalsContact O-CG 3.27Å; K131-D135 PolarHBondContact O-N 2.89Å; K131-G179 WeakPolarHBondContact CE-O 3.29Å; K131-L180 HydrophobicContact CB-CD1 4.03Å; K131-L180 HydrophobicContact CD-CB 4.09Å; K131-L180 HydrophobicContact CG-CB 4.29Å; K131-L180 HydrophobicContact CG-CD1 4.02Å; K131-N183 WeakPolarHBondContact CE-ND2 3.45Å; K131-N183 PolarHBondContact NZ-ND2 3.07Å
132	M	98.3	Very high	96.8	Very high	7 Å²	7	23.6 Å²	23.6	3%	0.034	11%	0.112	C	C	.	.	H	α-helix	trans	-59.6	-43.6	176.8	-165.2	174.5	-178.9	0	0	110.7	V108 L112 F128 F129 L130 G134 D135 Y136	V108-M132 HydrophobicContact CG1-CE 3.76Å; L112-M132 HydrophobicContact CD1-CB 4.16Å; L112-M132 HydrophobicContact CD1-CG 4.08Å; L112-M132 HydrophobicContact CD2-CB 4.34Å; L112-M132 HydrophobicContact CD2-CG 4.43Å; L112-M132 HydrophobicContact CD2-SD 4.03Å; F128-M132 HydrophobicContact CE1-SD 4.42Å; F128-M132 WeakPolarHBondContact O-CB 3.21Å; F128-M132 PolarHBondContact O-N 2.87Å; F129-M132 PolarHBondContact O-N 2.82Å; L130-M132 VanDerWaalsContact C-N 3.31Å; L130-M132 PolarHBondContact O-N 3.16Å; M132-G134 VanDerWaalsContact C-N 3.3Å; M132-G134 PolarHBondContact O-N 3.39Å; M132-D135 WeakPolarHBondContact O-CB 3.46Å; M132-D135 PolarHBondContact O-N 3.04Å; M132-D135 VanDerWaalsContact O-N 3.1Å; M132-Y136 HydrophobicContact CE-CD2 4.47Å; M132-Y136 HydrophobicContact CE-CE2 3.63Å; M132-Y136 HydrophobicContact CG-CD2 3.77Å; M132-Y136 HydrophobicContact CG-CE2 3.62Å; M132-Y136 VanDerWaalsContact O-CD2 3.28Å; M132-Y136 WeakPolarHBondContact O-CD2 3.36Å; M132-Y136 PolarHBondContact O-N 3.02Å; M132-Y136 HydrophobicContact SD-CE2 4.48Å
133	Q	98.5	Very high	97.1	Very high	41 Å²	41	20.6 Å²	20.6	19%	0.192	10%	0.096	C	C	.	.	H	α-helix	trans	-58	-42	174.8	-174.6	176.1	60.5	0	0	112.1	L109 L112 F129 L130 K131 N137 A159	L109-Q133 HydrophobicContact CD2-CG 3.87Å; L112-Q133 HydrophobicContact CD1-CB 4Å; F129-Q133 WeakPolarHBondContact O-CB 3.4Å; F129-Q133 PolarHBondContact O-N 3.4Å; L130-Q133 WeakPolarHBondContact O-CB 3.5Å; L130-Q133 PolarHBondContact O-N 3.28Å; K131-Q133 VanDerWaalsContact C-N 3.32Å; K131-Q133 PolarHBondContact O-N 3.46Å; Q133-N137 PolarHBondContact O-N 2.82Å; Q133-N137 VanDerWaalsContact O-N 3.15Å; Q133-N137 PolarHBondContact O-ND2 2.93Å; Q133-A159 HydrophobicContact CB-CB 4.04Å; Q133-A159 HydrophobicContact CG-CB 3.9Å
134	G	98.7	Very high	97.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.8	-48.7	171.9	0	0	0	0	0	112	L130 K131 M132 Y136 N137 R138 S156 Y160	L130-G134 PolarHBondContact O-N 3.17Å; K131-G134 PolarHBondContact O-N 3.47Å; K131-G134 VanDerWaalsContact O-N 3.16Å; M132-G134 VanDerWaalsContact C-N 3.3Å; M132-G134 PolarHBondContact O-N 3.39Å; G134-Y136 PolarHBondContact O-N 3.48Å; G134-N137 PolarHBondContact O-N 2.91Å; G134-R138 WeakPolarHBondContact O-CB 3.48Å; G134-R138 PolarHBondContact O-N 3.3Å; G134-S156 PolarHBondContact O-OG 3Å; G134-Y160 VanDerWaalsContact C-CZ 3.47Å
135	D	98.7	Very high	96.6	Very high	9 Å²	9	19.8 Å²	19.8	5%	0.048	10%	0.103	C	C	.	.	H	α-helix	trans	-57.3	-46.3	179.9	-66.8	-30.7	0	0	0	112.8	K131 M132 R138 Y139 Y160 N183	K131-D135 IonicContact NZ-OD2 2.72Å; K131-D135 PolarHBondContact NZ-OD2 2.93Å; K131-D135 VanDerWaalsContact O-CG 3.27Å; K131-D135 PolarHBondContact O-N 2.89Å; M132-D135 WeakPolarHBondContact O-CB 3.46Å; M132-D135 PolarHBondContact O-N 3.04Å; M132-D135 VanDerWaalsContact O-N 3.1Å; D135-R138 WeakPolarHBondContact O-CB 3.41Å; D135-R138 PolarHBondContact O-N 3.36Å; D135-Y139 HydrophobicContact CB-CE2 4.16Å; D135-Y139 WeakPolarHBondContact O-CD1 3.49Å; D135-Y139 WeakPolarHBondContact O-CD2 3.26Å; D135-Y139 WeakPolarHBondContact O-CE2 3.25Å; D135-Y139 PolarHBondContact O-N 3.49Å; D135-Y160 WeakPolarHBondContact CA-OH 3.45Å; D135-Y160 PolarHBondContact N-OH 3.3Å; D135-Y160 PolarHBondContact OD1-OH 3.47Å; D135-N183 VanDerWaalsContact OD1-CB 3.28Å; D135-N183 WeakPolarHBondContact OD1-CB 3.33Å; D135-N183 PolarHBondContact OD1-ND2 3.05Å; D135-N183 PolarHBondContact OD2-ND2 3.37Å
136	Y	98.7	Very high	96	Very high	7 Å²	7	26.4 Å²	26.4	3%	0.027	14%	0.138	C	C	.	.	H	α-helix	trans	-74	-33.7	-178.4	-78.3	-91.3	0	0	0	113	Y59 K60 V63 C105 V108 M132 G134 R138 Y139 L140	Y59-Y136 WeakPolarHBondContact CB-OH 3.36Å; Y59-Y136 PolarHBondContact O-OH 2.91Å; K60-Y136 PolarHBondContact N-OH 3.11Å; V63-Y136 HydrophobicContact CB-CE1 4.12Å; V63-Y136 HydrophobicContact CG1-CE1 3.96Å; V63-Y136 HydrophobicContact CG2-CE1 4.32Å; C105-Y136 HydrophobicContact CB-CD1 4.12Å; V108-Y136 HydrophobicContact CB-CD1 3.89Å; V108-Y136 HydrophobicContact CB-CD2 4.37Å; V108-Y136 HydrophobicContact CB-CE1 3.96Å; V108-Y136 HydrophobicContact CB-CE2 4.48Å; V108-Y136 HydrophobicContact CB-CG 4.09Å; V108-Y136 HydrophobicContact CG1-CD1 4.01Å; V108-Y136 HydrophobicContact CG1-CD2 3.58Å; V108-Y136 HydrophobicContact CG1-CE1 4.08Å; V108-Y136 HydrophobicContact CG1-CE2 3.7Å; V108-Y136 HydrophobicContact CG1-CG 3.76Å; V108-Y136 HydrophobicContact CG2-CD1 4.09Å; V108-Y136 HydrophobicContact CG2-CE1 3.66Å; M132-Y136 HydrophobicContact CE-CD2 4.47Å; M132-Y136 HydrophobicContact CE-CE2 3.63Å; M132-Y136 HydrophobicContact CG-CD2 3.77Å; M132-Y136 HydrophobicContact CG-CE2 3.62Å; M132-Y136 VanDerWaalsContact O-CD2 3.28Å; M132-Y136 WeakPolarHBondContact O-CD2 3.36Å; M132-Y136 PolarHBondContact O-N 3.02Å; M132-Y136 HydrophobicContact SD-CE2 4.48Å; G134-Y136 PolarHBondContact O-N 3.48Å; Y136-R138 VanDerWaalsContact C-N 3.34Å; Y136-Y139 HydrophobicContact CD1-CD2 4.02Å; Y136-Y139 HydrophobicContact CD1-CE2 4.43Å; Y136-Y139 HydrophobicContact CD2-CE2 4.47Å; Y136-Y139 HydrophobicContact CE1-CD2 4.32Å; Y136-Y139 HydrophobicContact CE1-CE2 4.44Å; Y136-Y139 HydrophobicContact CE2-CE2 4.44Å; Y136-Y139 HydrophobicContact CG-CD2 4.23Å; Y136-Y139 HydrophobicContact CG-CE2 4.46Å; Y136-Y139 PolarHBondContact O-N 3.27Å; Y136-L140 WeakPolarHBondContact O-CG 3.33Å; Y136-L140 PolarHBondContact O-N 3.21Å; Y136-L140 VanDerWaalsContact O-N 3.07Å
137	N	98.6	Very high	95.3	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-38	168.6	-76.4	-77.4	0	0	0	111.2	L109 Q133 G134 Y139 L140 A141 V152 R155	L109-N137 WeakPolarHBondContact CD2-ND2 3.32Å; Q133-N137 PolarHBondContact O-N 2.82Å; Q133-N137 VanDerWaalsContact O-N 3.15Å; Q133-N137 PolarHBondContact O-ND2 2.93Å; G134-N137 PolarHBondContact O-N 2.91Å; N137-Y139 VanDerWaalsContact C-N 3.33Å; N137-Y139 PolarHBondContact O-N 3Å; N137-L140 WeakPolarHBondContact O-CB 3.47Å; N137-L140 PolarHBondContact O-N 2.6Å; N137-A141 PolarHBondContact O-N 3.18Å; N137-V152 HydrophobicContact CB-CG1 4.33Å; N137-V152 WeakPolarHBondContact O-CG1 3.43Å; N137-R155 HydrophobicContact CB-CB 4.41Å; N137-R155 WeakPolarHBondContact OD1-CB 3.35Å
138	R	98.3	Very high	94.8	Very high	13 Å²	13	34.7 Å²	34.7	5%	0.049	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-43	173.4	176.9	170.4	74.2	92	-4.3	112.3	G134 D135 Y136 A141 E142 S156 Y160 F187 E190 I191	G134-R138 WeakPolarHBondContact O-CB 3.48Å; G134-R138 PolarHBondContact O-N 3.3Å; D135-R138 WeakPolarHBondContact O-CB 3.41Å; D135-R138 PolarHBondContact O-N 3.36Å; Y136-R138 VanDerWaalsContact C-N 3.34Å; R138-A141 WeakPolarHBondContact O-CB 3.46Å; R138-A141 PolarHBondContact O-N 3Å; R138-E142 PolarHBondContact O-N 3.44Å; R138-S156 PolarHBondContact N-OG 3.25Å; R138-Y160 PolarHBondContact NE-OH 3.31Å; R138-F187 HydrophobicContact CB-CD2 4.35Å; R138-F187 HydrophobicContact CG-CD2 4.25Å; R138-E190 IonicContact NH1-OE2 2.63Å; R138-E190 PolarHBondContact NH1-OE2 3.36Å; R138-E190 VanDerWaalsContact NH1-OE2 3.13Å; R138-I191 HydrophobicContact CG-CD1 4.21Å; R138-I191 HydrophobicContact CG-CG1 3.71Å
139	Y	98.3	Very high	94.7	Very high	22 Å²	22	36.4 Å²	36.4	9%	0.086	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-37.9	176.2	-54.7	-30.9	0	0	0	112.6	V63 R67 D135 Y136 N137 A141	V63-Y139 HydrophobicContact CG1-CD2 3.95Å; V63-Y139 HydrophobicContact CG1-CE2 3.83Å; V63-Y139 HydrophobicContact CG2-CD2 3.96Å; R67-Y139 VanDerWaalsContact CZ-CD1 3.47Å; R67-Y139 VanDerWaalsContact NE-CD1 3.32Å; D135-Y139 HydrophobicContact CB-CE2 4.16Å; D135-Y139 WeakPolarHBondContact O-CD1 3.49Å; D135-Y139 WeakPolarHBondContact O-CD2 3.26Å; D135-Y139 WeakPolarHBondContact O-CE2 3.25Å; D135-Y139 PolarHBondContact O-N 3.49Å; Y136-Y139 HydrophobicContact CD1-CD2 4.02Å; Y136-Y139 HydrophobicContact CD1-CE2 4.43Å; Y136-Y139 HydrophobicContact CD2-CE2 4.47Å; Y136-Y139 HydrophobicContact CE1-CD2 4.32Å; Y136-Y139 HydrophobicContact CE1-CE2 4.44Å; Y136-Y139 HydrophobicContact CE2-CE2 4.44Å; Y136-Y139 HydrophobicContact CG-CD2 4.23Å; Y136-Y139 HydrophobicContact CG-CE2 4.46Å; Y136-Y139 PolarHBondContact O-N 3.27Å; N137-Y139 VanDerWaalsContact C-N 3.33Å; N137-Y139 PolarHBondContact O-N 3Å; Y139-A141 VanDerWaalsContact C-N 3.35Å
140	L	97.8	Very high	94.5	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-43	171.3	-70.9	173.8	0	0	0	111	N102 C105 L109 Y136 N137 E142 V143 A144 V152	N102-L140 HydrophobicContact CB-CD2 4.15Å; N102-L140 WeakPolarHBondContact OD1-CD2 3.04Å; C105-L140 HydrophobicContact CB-CD1 4.07Å; C105-L140 HydrophobicContact CB-CD2 3.52Å; C105-L140 HydrophobicContact CB-CG 3.6Å; L109-L140 HydrophobicContact CD1-CD1 3.59Å; Y136-L140 WeakPolarHBondContact O-CG 3.33Å; Y136-L140 PolarHBondContact O-N 3.21Å; Y136-L140 VanDerWaalsContact O-N 3.07Å; N137-L140 WeakPolarHBondContact O-CB 3.47Å; N137-L140 PolarHBondContact O-N 2.6Å; L140-E142 VanDerWaalsContact C-N 3.32Å; L140-E142 PolarHBondContact O-N 3.03Å; L140-V143 PolarHBondContact O-N 2.88Å; L140-A144 VanDerWaalsContact O-CB 3.28Å; L140-A144 WeakPolarHBondContact O-CB 3.32Å; L140-A144 PolarHBondContact O-N 3.47Å; L140-V152 HydrophobicContact CB-CG1 3.44Å; L140-V152 VanDerWaalsContact CB-CG1 3.44Å; L140-V152 HydrophobicContact CD1-CG1 4.47Å
141	A	97.2	Very high	94.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-40	-179.2	0	0	0	0	0	111.7	N137 R138 Y139 V143 A144 R149 V152 V153 I191	N137-A141 PolarHBondContact O-N 3.18Å; R138-A141 WeakPolarHBondContact O-CB 3.46Å; R138-A141 PolarHBondContact O-N 3Å; Y139-A141 VanDerWaalsContact C-N 3.35Å; A141-V143 PolarHBondContact O-N 3.09Å; A141-A144 PolarHBondContact O-N 3.16Å; A141-R149 PolarHBondContact O-NH1 3.06Å; A141-V152 HydrophobicContact CB-CB 4.45Å; A141-V152 HydrophobicContact CB-CG1 3.88Å; A141-V153 HydrophobicContact CB-CG2 3.8Å; A141-I191 HydrophobicContact CB-CD1 4.46Å; A141-I191 HydrophobicContact CB-CG2 4.01Å
142	E	96.3	Very high	94.3	Very high	31 Å²	31	44.2 Å²	44.2	15%	0.145	24%	0.235	C	C	.	.	H	α-helix	trans	-53.8	-38.3	178	-179.8	175.1	-158.7	0	0	112.8	R67 W70 R71 R138 L140 I191	R67-E142 IonicContact CZ-OE2 2.68Å; R67-E142 IonicContact NE-OE2 2.81Å; R67-E142 PolarHBondContact NE-OE2 3.06Å; R67-E142 IonicContact NH2-OE1 2.77Å; R67-E142 IonicContact NH2-OE2 2.63Å; R67-E142 PolarHBondContact NH2-OE2 2.9Å; W70-E142 HydrophobicContact CH2-CG 4.43Å; W70-E142 WeakPolarHBondContact CH2-O 3.5Å; W70-E142 HydrophobicContact CZ3-CG 3.96Å; R71-E142 IonicContact CZ-OE1 3.36Å; R71-E142 IonicContact NE-OE1 3.18Å; R71-E142 PolarHBondContact NE-OE1 2.88Å; R71-E142 IonicContact NH2-OE1 3.68Å; R71-E142 PolarHBondContact NH2-OE1 3.38Å; R71-E142 IonicContact NH2-OE2 3.68Å; R138-E142 PolarHBondContact O-N 3.44Å; L140-E142 VanDerWaalsContact C-N 3.32Å; L140-E142 PolarHBondContact O-N 3.03Å; E142-I191 HydrophobicContact CB-CD1 4.31Å
143	V	95.3	Very high	94.3	Very high	10 Å²	10	44.5 Å²	44.5	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-105.8	0	-176.9	-52.4	0	0	0	0	113.9	W70 E98 L101 L140 A141	W70-V143 HydrophobicContact CD2-CG1 3.59Å; W70-V143 HydrophobicContact CE3-CG1 3.97Å; W70-V143 HydrophobicContact CG-CG1 3.96Å; W70-V143 HydrophobicContact CH2-CG1 4.29Å; W70-V143 HydrophobicContact CZ2-CB 4.18Å; W70-V143 HydrophobicContact CZ2-CG1 3.95Å; W70-V143 HydrophobicContact CZ3-CG1 4.3Å; E98-V143 HydrophobicContact CG-CB 4.16Å; L101-V143 HydrophobicContact CD1-CG1 3.89Å; L101-V143 HydrophobicContact CD2-CG2 3.88Å; L140-V143 PolarHBondContact O-N 2.88Å; A141-V143 PolarHBondContact O-N 3.09Å
144	A	92.9	Very high	94.3	Very high	20 Å²	20	47.1 Å²	47.1	17%	0.165	25%	0.249	C	C	.	.			trans	-74.1	140.1	-176.9	0	0	0	0	0	111.9	L140 A141 R149	L140-A144 VanDerWaalsContact O-CB 3.28Å; L140-A144 WeakPolarHBondContact O-CB 3.32Å; L140-A144 PolarHBondContact O-N 3.47Å; A141-A144 PolarHBondContact O-N 3.16Å; A144-R149 HydrophobicContact CB-CB 4.05Å
145	S	83.5	Confident	94.2	Very high	76 Å²	76	52.4 Å²	52.4	53%	0.531	27%	0.269	S	S	.	.			trans	-67.3	157.9	165	71.7	0	0	0	0	111.8	K147 T148 R149	S145-K147 PolarHBondContact O-N 3.11Å; S145-T148 PolarHBondContact O-N 2.88Å; S145-T148 VanDerWaalsContact O-N 3.09Å; S145-T148 PolarHBondContact O-OG1 3.3Å; S145-R149 WeakPolarHBondContact O-CB 3.5Å; S145-R149 PolarHBondContact O-N 3.45Å
146	D	81.3	Confident	94.2	Very high	147 Å²	147	52 Å²	52	79%	0.786	27%	0.267	S	S	*	.	H	α-helix	trans	-51.1	-35.4	-175.5	-64	-27.6	0	0	0	114.4	T148	D146-T148 PolarHBondContact O-N 2.82Å
147	K	80.8	Confident	94.2	Very high	193 Å²	193	53.2 Å²	53.2	84%	0.839	27%	0.274	S	S	*	.	H	α-helix	trans	-65.6	-36.4	-177.3	-66.7	-175.2	-178.8	179.3	0	113.5	S145	S145-K147 PolarHBondContact O-N 3.11Å
148	T	87.5	Confident	94.2	Very high	67 Å²	67	56.2 Å²	56.2	41%	0.411	29%	0.29	S	S	.	.	H	α-helix	trans	-103.8	-15.1	-176.8	54.1	0	0	0	0	112.4	S145 D146 A150 E151 V152	S145-T148 PolarHBondContact O-N 2.88Å; S145-T148 VanDerWaalsContact O-N 3.09Å; S145-T148 PolarHBondContact O-OG1 3.3Å; D146-T148 PolarHBondContact O-N 2.82Å; T148-A150 PolarHBondContact O-N 3.3Å; T148-E151 PolarHBondContact O-N 3.46Å; T148-V152 WeakPolarHBondContact O-CG2 3.49Å; T148-V152 PolarHBondContact O-N 3.29Å
149	R	93.1	Very high	94.2	Very high	64 Å²	64	55.6 Å²	55.6	24%	0.242	29%	0.288	C	S	.	.	H	α-helix	trans	-57.9	-47.3	-175.6	-175.2	177.1	173.2	97.2	-2.5	111.9	A141 A144 S145 E151 V152 V153 I191	A141-R149 PolarHBondContact O-NH1 3.06Å; A144-R149 HydrophobicContact CB-CB 4.05Å; S145-R149 WeakPolarHBondContact O-CB 3.5Å; S145-R149 PolarHBondContact O-N 3.45Å; R149-E151 VanDerWaalsContact C-N 3.34Å; R149-E151 PolarHBondContact O-N 2.98Å; R149-V152 PolarHBondContact O-N 2.98Å; R149-V153 HydrophobicContact CG-CG2 3.9Å; R149-V153 WeakPolarHBondContact O-CB 3.49Å; R149-V153 WeakPolarHBondContact O-CG2 3.4Å; R149-V153 PolarHBondContact O-N 3.35Å; R149-I191 PolarHBondContact NH2-O 3.46Å; R149-I191 VanDerWaalsContact NH2-O 3.09Å
150	A	94.7	Very high	94.3	Very high	73 Å²	73	54.6 Å²	54.6	60%	0.603	28%	0.284	S	S	*	.	H	α-helix	trans	-56.7	-44.6	-177	0	0	0	0	0	113.1	T148 V153 Q154	T148-A150 PolarHBondContact O-N 3.3Å; A150-V153 PolarHBondContact O-N 3.44Å; A150-Q154 PolarHBondContact O-N 3.23Å
151	E	95.2	Very high	94.3	Very high	131 Å²	131	57.2 Å²	57.2	61%	0.612	30%	0.3	S	S	*	.	H	α-helix	trans	-66.4	-41.9	179.7	-63.1	178.9	172.1	0	0	112.2	T148 R149 Q154 R155	T148-E151 PolarHBondContact O-N 3.46Å; R149-E151 VanDerWaalsContact C-N 3.34Å; R149-E151 PolarHBondContact O-N 2.98Å; E151-Q154 PolarHBondContact O-N 2.69Å; E151-R155 WeakPolarHBondContact O-CG 3.31Å; E151-R155 PolarHBondContact O-N 2.71Å
152	V	96.6	Very high	94.3	Very high	9 Å²	9	62.5 Å²	62.5	6%	0.055	32%	0.323	C	S	.	.	H	α-helix	trans	-68.1	-41.4	178.9	-179.6	0	0	0	0	110.9	N137 L140 A141 T148 R149 Q154 R155 S156	N137-V152 HydrophobicContact CB-CG1 4.33Å; N137-V152 WeakPolarHBondContact O-CG1 3.43Å; L140-V152 HydrophobicContact CB-CG1 3.44Å; L140-V152 VanDerWaalsContact CB-CG1 3.44Å; L140-V152 HydrophobicContact CD1-CG1 4.47Å; A141-V152 HydrophobicContact CB-CB 4.45Å; A141-V152 HydrophobicContact CB-CG1 3.88Å; T148-V152 WeakPolarHBondContact O-CG2 3.49Å; T148-V152 PolarHBondContact O-N 3.29Å; R149-V152 PolarHBondContact O-N 2.98Å; V152-Q154 VanDerWaalsContact C-N 3.34Å; V152-Q154 PolarHBondContact O-N 2.79Å; V152-R155 PolarHBondContact O-N 3.26Å; V152-S156 PolarHBondContact O-N 3.41Å
153	V	98	Very high	94.4	Very high	14 Å²	14	61 Å²	61	9%	0.085	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-45.1	175.4	171	0	0	0	0	110.6	A141 R149 A150 S156 L157 F187 I191	A141-V153 HydrophobicContact CB-CG2 3.8Å; R149-V153 HydrophobicContact CG-CG2 3.9Å; R149-V153 WeakPolarHBondContact O-CB 3.49Å; R149-V153 WeakPolarHBondContact O-CG2 3.4Å; R149-V153 PolarHBondContact O-N 3.35Å; A150-V153 PolarHBondContact O-N 3.44Å; V153-S156 WeakPolarHBondContact O-CB 3.4Å; V153-S156 PolarHBondContact O-N 2.9Å; V153-L157 PolarHBondContact O-N 3.38Å; V153-F187 HydrophobicContact CG1-CE2 4.31Å; V153-F187 HydrophobicContact CG1-CZ 3.99Å; V153-I191 HydrophobicContact CB-CG2 4.49Å; V153-I191 HydrophobicContact CG1-CG2 4.25Å; V153-I191 HydrophobicContact CG2-CG2 3.57Å
154	Q	97.8	Very high	94.6	Very high	96 Å²	96	63 Å²	63	45%	0.449	33%	0.329	S	S	.	.	H	α-helix	trans	-63.3	-44.1	177	-170.9	60.8	49.9	0	0	111.8	A150 E151 V152 S156 L157 D158	A150-Q154 PolarHBondContact O-N 3.23Å; E151-Q154 PolarHBondContact O-N 2.69Å; V152-Q154 VanDerWaalsContact C-N 3.34Å; V152-Q154 PolarHBondContact O-N 2.79Å; Q154-S156 VanDerWaalsContact C-N 3.28Å; Q154-S156 PolarHBondContact O-N 3.27Å; Q154-L157 PolarHBondContact O-N 2.87Å; Q154-D158 PolarHBondContact NE2-OD1 3.09Å; Q154-D158 WeakPolarHBondContact O-CB 3.38Å; Q154-D158 VanDerWaalsContact O-CG 3.28Å; Q154-D158 PolarHBondContact O-N 3.08Å
155	R	98.2	Very high	94.8	Very high	110 Å²	110	68.4 Å²	68.4	42%	0.415	35%	0.35	S	S	.	.	H	α-helix	trans	-59	-39.9	175.2	-75.3	-173.1	-73.5	160.5	-9.1	112.4	N137 E151 V152 A159	N137-R155 HydrophobicContact CB-CB 4.41Å; N137-R155 WeakPolarHBondContact OD1-CB 3.35Å; E151-R155 WeakPolarHBondContact O-CG 3.31Å; E151-R155 PolarHBondContact O-N 2.71Å; V152-R155 PolarHBondContact O-N 3.26Å; R155-A159 WeakPolarHBondContact O-CB 3.27Å; R155-A159 PolarHBondContact O-N 3.4Å; R155-A159 VanDerWaalsContact O-N 3.11Å
156	S	98.6	Very high	95.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-47.6	175.1	-170.6	0	0	0	0	111.6	G134 R138 V152 V153 Q154 A159 Y160 F187	G134-S156 PolarHBondContact O-OG 3Å; R138-S156 PolarHBondContact N-OG 3.25Å; V152-S156 PolarHBondContact O-N 3.41Å; V153-S156 WeakPolarHBondContact O-CB 3.4Å; V153-S156 PolarHBondContact O-N 2.9Å; Q154-S156 VanDerWaalsContact C-N 3.28Å; Q154-S156 PolarHBondContact O-N 3.27Å; S156-A159 PolarHBondContact O-N 3.46Å; S156-Y160 WeakPolarHBondContact O-CD2 3.37Å; S156-Y160 PolarHBondContact O-N 3.22Å; S156-Y160 WeakPolarHBondContact OG-CE2 3.3Å; S156-F187 WeakPolarHBondContact OG-CD2 3.35Å; S156-F187 WeakPolarHBondContact OG-CE2 3.32Å
157	L	98.7	Very high	96.2	Very high	33 Å²	33	58.4 Å²	58.4	17%	0.173	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-45.4	178.8	177.5	59.7	0	0	0	111.6	V153 Q154 A159 Y160 T161 F184 F187 Y188	V153-L157 PolarHBondContact O-N 3.38Å; Q154-L157 PolarHBondContact O-N 2.87Å; L157-A159 VanDerWaalsContact C-N 3.34Å; L157-A159 PolarHBondContact O-N 3.43Å; L157-Y160 PolarHBondContact O-N 3.22Å; L157-T161 VanDerWaalsContact O-CB 3.32Å; L157-T161 WeakPolarHBondContact O-CB 3.04Å; L157-T161 PolarHBondContact O-N 3.01Å; L157-T161 PolarHBondContact O-OG1 3.47Å; L157-F184 HydrophobicContact CD1-CE2 3.85Å; L157-F184 HydrophobicContact CD1-CZ 3.79Å; L157-F187 HydrophobicContact CB-CE1 4.11Å; L157-F187 HydrophobicContact CB-CZ 3.97Å; L157-F187 HydrophobicContact CD1-CE1 4.06Å; L157-Y188 HydrophobicContact CD1-CE1 4.38Å
158	D	98.6	Very high	97	Very high	67 Å²	67	54.4 Å²	54.4	36%	0.358	28%	0.28	S	S	.	.	H	α-helix	trans	-60.3	-43.9	178.3	-72.6	-3	0	0	0	111.6	Q154 T161 K162	Q154-D158 PolarHBondContact NE2-OD1 3.09Å; Q154-D158 WeakPolarHBondContact O-CB 3.38Å; Q154-D158 VanDerWaalsContact O-CG 3.28Å; Q154-D158 PolarHBondContact O-N 3.08Å; D158-T161 PolarHBondContact O-N 3.45Å; D158-K162 WeakPolarHBondContact O-CB 3.4Å; D158-K162 VanDerWaalsContact O-CG 3.27Å; D158-K162 WeakPolarHBondContact O-CG 3.18Å; D158-K162 PolarHBondContact O-N 3.07Å
159	A	98.6	Very high	97.4	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.008	29%	0.29	C	S	.	.	H	α-helix	trans	-65.9	-46.3	179.9	0	0	0	0	0	111.8	Q133 R155 S156 L157 T161 K162 A163	Q133-A159 HydrophobicContact CB-CB 4.04Å; Q133-A159 HydrophobicContact CG-CB 3.9Å; R155-A159 WeakPolarHBondContact O-CB 3.27Å; R155-A159 PolarHBondContact O-N 3.4Å; R155-A159 VanDerWaalsContact O-N 3.11Å; S156-A159 PolarHBondContact O-N 3.46Å; L157-A159 VanDerWaalsContact C-N 3.34Å; L157-A159 PolarHBondContact O-N 3.43Å; A159-T161 VanDerWaalsContact C-N 3.34Å; A159-T161 PolarHBondContact O-N 3.11Å; A159-K162 PolarHBondContact O-N 3.17Å; A159-A163 WeakPolarHBondContact O-CB 3.49Å; A159-A163 PolarHBondContact O-N 2.87Å
160	Y	98.8	Very high	97.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-36.9	176.1	-74.5	-52.7	0	0	0	112.9	G134 D135 R138 S156 L157 A163 T164 L180 N183 F184 F187	G134-Y160 VanDerWaalsContact C-CZ 3.47Å; D135-Y160 WeakPolarHBondContact CA-OH 3.45Å; D135-Y160 PolarHBondContact N-OH 3.3Å; D135-Y160 PolarHBondContact OD1-OH 3.47Å; R138-Y160 PolarHBondContact NE-OH 3.31Å; S156-Y160 WeakPolarHBondContact O-CD2 3.37Å; S156-Y160 PolarHBondContact O-N 3.22Å; S156-Y160 WeakPolarHBondContact OG-CE2 3.3Å; L157-Y160 PolarHBondContact O-N 3.22Å; Y160-A163 PolarHBondContact O-N 3.41Å; Y160-T164 WeakPolarHBondContact O-CB 3.03Å; Y160-T164 PolarHBondContact O-N 2.88Å; Y160-T164 PolarHBondContact O-OG1 3.49Å; Y160-L180 HydrophobicContact CD1-CD1 3.69Å; Y160-L180 HydrophobicContact CE1-CD1 4.37Å; Y160-N183 HydrophobicContact CE1-CB 4.21Å; Y160-F184 VanDerWaalsContact CB-CD2 3.43Å; Y160-F184 VanDerWaalsContact CB-CE2 3.47Å; Y160-F184 HydrophobicContact CD1-CB 3.97Å; Y160-F184 HydrophobicContact CD1-CD2 4.38Å; Y160-F184 HydrophobicContact CD1-CG 4.21Å; Y160-F184 HydrophobicContact CD2-CB 4.49Å; Y160-F184 AromaticContact CD2-CD2 3.53Å; Y160-F184 HydrophobicContact CD2-CD2 3.53Å; Y160-F184 AromaticContact CD2-CE2 3.96Å; Y160-F184 HydrophobicContact CD2-CE2 3.96Å; Y160-F184 HydrophobicContact CD2-CG 4.19Å; Y160-F184 HydrophobicContact CE1-CB 4.41Å; Y160-F184 HydrophobicContact CE2-CD2 4.34Å; Y160-F184 HydrophobicContact CG-CB 4.02Å; Y160-F184 HydrophobicContact CG-CD1 4.39Å; Y160-F184 AromaticContact CG-CD2 3.55Å; Y160-F184 HydrophobicContact CG-CD2 3.55Å; Y160-F184 HydrophobicContact CG-CE2 4.02Å; Y160-F184 AromaticContact CG-CG 3.77Å; Y160-F184 HydrophobicContact CG-CG 3.77Å; Y160-F187 HydrophobicContact CD2-CB 4.14Å; Y160-F187 HydrophobicContact CD2-CD1 4.34Å; Y160-F187 HydrophobicContact CD2-CD2 4.43Å; Y160-F187 HydrophobicContact CD2-CG 4.05Å; Y160-F187 HydrophobicContact CE2-CB 3.65Å; Y160-F187 HydrophobicContact CE2-CD2 4.08Å; Y160-F187 AromaticContact CE2-CG 3.86Å; Y160-F187 HydrophobicContact CE2-CG 3.86Å
161	T	98.7	Very high	97.5	Very high	60 Å²	60	55.4 Å²	55.4	37%	0.368	28%	0.275	S	S	.	.	H	α-helix	trans	-64.6	-48.2	176.9	-58	0	0	0	0	110.8	L157 D158 A159 A163 T164 E165	L157-T161 VanDerWaalsContact O-CB 3.32Å; L157-T161 WeakPolarHBondContact O-CB 3.04Å; L157-T161 PolarHBondContact O-N 3.01Å; L157-T161 PolarHBondContact O-OG1 3.47Å; D158-T161 PolarHBondContact O-N 3.45Å; A159-T161 VanDerWaalsContact C-N 3.34Å; A159-T161 PolarHBondContact O-N 3.11Å; T161-A163 VanDerWaalsContact C-N 3.31Å; T161-A163 PolarHBondContact O-N 2.87Å; T161-T164 WeakPolarHBondContact O-CB 3.38Å; T161-T164 PolarHBondContact O-N 3.46Å; T161-T164 VanDerWaalsContact O-N 3.1Å; T161-E165 PolarHBondContact O-N 3.41Å
162	K	98.1	Very high	97.6	Very high	111 Å²	111	50.2 Å²	50.2	48%	0.483	25%	0.252	S	S	.	.	H	α-helix	trans	-60.9	-39.3	174.4	-71.1	168.1	-176.3	168.8	0	112.3	L130 D158 A159 T164 A166	L130-K162 HydrophobicContact CD1-CB 4.07Å; L130-K162 HydrophobicContact CD2-CB 4.25Å; D158-K162 WeakPolarHBondContact O-CB 3.4Å; D158-K162 VanDerWaalsContact O-CG 3.27Å; D158-K162 WeakPolarHBondContact O-CG 3.18Å; D158-K162 PolarHBondContact O-N 3.07Å; A159-K162 PolarHBondContact O-N 3.17Å; K162-T164 VanDerWaalsContact C-N 3.3Å; K162-A166 WeakPolarHBondContact O-CB 3.42Å; K162-A166 PolarHBondContact O-N 3.2Å
163	A	98.3	Very high	97.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-41	175	0	0	0	0	0	111	L130 A159 Y160 T161 A166 A167 L180	L130-A163 HydrophobicContact CB-CB 3.65Å; A159-A163 WeakPolarHBondContact O-CB 3.49Å; A159-A163 PolarHBondContact O-N 2.87Å; Y160-A163 PolarHBondContact O-N 3.41Å; T161-A163 VanDerWaalsContact C-N 3.31Å; T161-A163 PolarHBondContact O-N 2.87Å; A163-A166 PolarHBondContact O-N 2.78Å; A163-A167 VanDerWaalsContact O-CB 3.25Å; A163-A167 WeakPolarHBondContact O-CB 3.28Å; A163-A167 PolarHBondContact O-N 2.63Å; A163-L180 VanDerWaalsContact C-CD2 3.43Å; A163-L180 HydrophobicContact CB-CD1 3.65Å; A163-L180 HydrophobicContact CB-CD2 3.67Å; A163-L180 HydrophobicContact CB-CG 4.32Å; A163-L180 WeakPolarHBondContact O-CD2 3.44Å
164	T	98.5	Very high	97.4	Very high	52 Å²	52	50.9 Å²	50.9	32%	0.319	26%	0.255	S	S	.	.	H	α-helix	trans	-65.9	-44.4	-179.7	-59.3	0	0	0	0	111.2	Y160 T161 K162 A167 N168	Y160-T164 WeakPolarHBondContact O-CB 3.03Å; Y160-T164 PolarHBondContact O-N 2.88Å; Y160-T164 PolarHBondContact O-OG1 3.49Å; T161-T164 WeakPolarHBondContact O-CB 3.38Å; T161-T164 PolarHBondContact O-N 3.46Å; T161-T164 VanDerWaalsContact O-N 3.1Å; K162-T164 VanDerWaalsContact C-N 3.3Å; T164-A167 PolarHBondContact O-N 3.37Å; T164-N168 PolarHBondContact O-N 2.91Å
165	E	97.9	Very high	97.4	Very high	133 Å²	133	47.3 Å²	47.3	62%	0.621	24%	0.24	S	C	*	.	H	α-helix	trans	-60.5	-45.5	173.9	-78.7	-177.2	152.2	0	0	112.3	T161 A167 N168	T161-E165 PolarHBondContact O-N 3.41Å; E165-A167 VanDerWaalsContact C-N 3.28Å; E165-A167 PolarHBondContact O-N 2.97Å; E165-N168 WeakPolarHBondContact O-CB 3.44Å; E165-N168 PolarHBondContact O-N 3.15Å; E165-N168 PolarHBondContact O-ND2 3.09Å
166	A	96.7	Very high	97.3	Very high	12 Å²	12	43.2 Å²	43.2	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-33.7	177.5	0	0	0	0	0	112.2	K126 V127 L130 K162 A163 N168 K169	K126-A166 HydrophobicContact CD-CB 4.42Å; K126-A166 HydrophobicContact CG-CB 4.45Å; V127-A166 HydrophobicContact CG2-CB 3.67Å; L130-A166 HydrophobicContact CD1-CB 4.47Å; K162-A166 WeakPolarHBondContact O-CB 3.42Å; K162-A166 PolarHBondContact O-N 3.2Å; A163-A166 PolarHBondContact O-N 2.78Å; A166-N168 PolarHBondContact O-N 3.21Å; A166-K169 PolarHBondContact O-N 2.84Å
167	A	97.8	Very high	97.2	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-69.6	-13	-178.9	0	0	0	0	0	113.8	V127 A163 T164 E165 K169 L170 R177 L180	V127-A167 HydrophobicContact CG1-CB 3.9Å; V127-A167 HydrophobicContact CG2-CB 3.98Å; A163-A167 VanDerWaalsContact O-CB 3.25Å; A163-A167 WeakPolarHBondContact O-CB 3.28Å; A163-A167 PolarHBondContact O-N 2.63Å; T164-A167 PolarHBondContact O-N 3.37Å; E165-A167 VanDerWaalsContact C-N 3.28Å; E165-A167 PolarHBondContact O-N 2.97Å; A167-K169 PolarHBondContact O-N 3.39Å; A167-K169 VanDerWaalsContact O-N 3.11Å; A167-L170 WeakPolarHBondContact O-CB 3.4Å; A167-L170 PolarHBondContact O-N 2.8Å; A167-R177 HydrophobicContact CB-CB 4.42Å; A167-R177 HydrophobicContact CB-CG 4.05Å; A167-R177 WeakPolarHBondContact O-CD 3.46Å; A167-L180 HydrophobicContact CB-CD2 3.94Å
168	N	96.8	Very high	97.2	Very high	108 Å²	108	44.8 Å²	44.8	58%	0.578	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.2	173.6	-72.3	-34.4	0	0	0	113.3	T164 E165 A166 L170	T164-N168 PolarHBondContact O-N 2.91Å; E165-N168 WeakPolarHBondContact O-CB 3.44Å; E165-N168 PolarHBondContact O-N 3.15Å; E165-N168 PolarHBondContact O-ND2 3.09Å; A166-N168 PolarHBondContact O-N 3.21Å; N168-L170 VanDerWaalsContact C-N 3.34Å
169	K	95.4	Very high	97.2	Very high	139 Å²	139	42.1 Å²	42.1	60%	0.604	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.8	175.9	-59.4	-178.2	-179.7	-178.2	0	113.9	D123 A166 A167	D123-K169 HydrophobicContact CB-CB 4.43Å; D123-K169 HydrophobicContact CB-CD 4.2Å; D123-K169 VanDerWaalsContact CG-NZ 3.3Å; D123-K169 VanDerWaalsContact OD1-CD 3.29Å; D123-K169 WeakPolarHBondContact OD1-CD 3.29Å; D123-K169 IonicContact OD1-NZ 3.14Å; D123-K169 PolarHBondContact OD1-NZ 3.49Å; D123-K169 WeakPolarHBondContact OD2-CD 3.44Å; D123-K169 IonicContact OD2-NZ 3.82Å; D123-K169 PolarHBondContact OD2-NZ 3.45Å; D123-K169 VanDerWaalsContact OD2-NZ 3.14Å; A166-K169 PolarHBondContact O-N 2.84Å; A167-K169 PolarHBondContact O-N 3.39Å; A167-K169 VanDerWaalsContact O-N 3.11Å
170	L	95.6	Very high	97.2	Very high	13 Å²	13	42.2 Å²	42.2	7%	0.068	22%	0.218	C	C	.	.	S	Bend	trans	-98.1	144.1	176.8	-55.4	-178.4	0	0	0	109.5	E124 V127 A167 N168 H174 I176 R177	E124-L170 HydrophobicContact CG-CD2 3.62Å; V127-L170 HydrophobicContact CB-CD1 4.15Å; V127-L170 HydrophobicContact CG1-CD1 4.3Å; V127-L170 HydrophobicContact CG2-CD1 3.98Å; A167-L170 WeakPolarHBondContact O-CB 3.4Å; A167-L170 PolarHBondContact O-N 2.8Å; N168-L170 VanDerWaalsContact C-N 3.34Å; L170-H174 HydrophobicContact CB-CB 4.01Å; L170-I176 HydrophobicContact CD1-CB 4.43Å; L170-I176 HydrophobicContact CD1-CG2 4.46Å; L170-R177 HydrophobicContact CB-CB 4.35Å; L170-R177 HydrophobicContact CD1-CB 4.5Å; L170-R177 PolarHBondContact O-NH1 3.1Å
171	P	95.2	Very high	97.2	Very high	74 Å²	74	42.7 Å²	42.7	48%	0.481	22%	0.222	S	C	.	.			trans	-51.6	149.1	171.5	-26	33.8	0	0	0	112.1	T173 H174 R177	P171-T173 PolarHBondContact O-N 3.03Å; P171-H174 HydrophobicContact CB-CB 4.41Å; P171-H174 WeakPolarHBondContact O-CB 3.34Å; P171-H174 PolarHBondContact O-N 3.27Å; P171-R177 WeakPolarHBondContact O-CD 3.15Å
172	T	96.7	Very high	97.2	Very high	21 Å²	21	40.8 Å²	40.8	13%	0.129	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-29	179.8	65.3	0	0	0	0	112.2	H174 S208 E212	T172-H174 VanDerWaalsContact C-N 3.34Å; T172-S208 PolarHBondContact OG1-O 3.35Å; T172-E212 PolarHBondContact OG1-OE2 3.33Å
173	T	96	Very high	97.3	Very high	9 Å²	9	37 Å²	37	6%	0.055	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.2	176.7	52.3	0	0	0	0	114.4	P171 A209 E212 L216 S224	P171-T173 PolarHBondContact O-N 3.03Å; T173-A209 HydrophobicContact CG2-CB 4.37Å; T173-A209 WeakPolarHBondContact CG2-O 3.27Å; T173-E212 HydrophobicContact CG2-CB 3.78Å; T173-L216 HydrophobicContact CG2-CD1 3.96Å; T173-L216 HydrophobicContact CG2-CG 4.08Å; T173-L216 WeakPolarHBondContact OG1-CD2 3.47Å; T173-S224 WeakPolarHBondContact O-CB 3.42Å; T173-S224 PolarHBondContact O-OG 3.49Å
174	H	95.5	Very high	97.3	Very high	29 Å²	29	37.4 Å²	37.4	13%	0.134	20%	0.196	C	C	.	.			trans	-67.9	129.4	-175.6	-169.3	-75.7	0	0	0	111.5	E124 L170 P171 T172 I176 R177 L178	E124-H174 IonicContact OE1-NE2 2.69Å; L170-H174 HydrophobicContact CB-CB 4.01Å; P171-H174 HydrophobicContact CB-CB 4.41Å; P171-H174 WeakPolarHBondContact O-CB 3.34Å; P171-H174 PolarHBondContact O-N 3.27Å; T172-H174 VanDerWaalsContact C-N 3.34Å; H174-I176 VanDerWaalsContact C-N 3.31Å; H174-I176 PolarHBondContact ND1-N 3.35Å; H174-I176 VanDerWaalsContact ND1-N 3.17Å; H174-I176 PolarHBondContact O-N 2.95Å; H174-R177 HydrophobicContact CB-CB 4.23Å; H174-R177 PolarHBondContact O-N 3.49Å; H174-L178 PolarHBondContact O-N 2.95Å
175	P	96	Very high	97.3	Very high	20 Å²	20	34.9 Å²	34.9	13%	0.13	18%	0.181	C	C	.	.	H	α-helix	trans	-54.2	-41.3	-175.6	-27.1	31.7	0	0	0	114.3	R177 L178 G179 D223 S224 I227	P175-R177 PolarHBondContact O-N 2.99Å; P175-L178 PolarHBondContact O-N 3.47Å; P175-G179 PolarHBondContact O-N 3.17Å; P175-D223 HydrophobicContact CB-CB 4.14Å; P175-D223 HydrophobicContact CG-CB 4.05Å; P175-S224 WeakPolarHBondContact CD-OG 3.38Å; P175-S224 WeakPolarHBondContact CG-OG 3.18Å; P175-I227 HydrophobicContact CB-CD1 4.09Å; P175-I227 VanDerWaalsContact O-CD1 3.29Å; P175-I227 WeakPolarHBondContact O-CD1 3.39Å
176	I	96.6	Very high	97.3	Very high	24 Å²	24	29.5 Å²	29.5	12%	0.123	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-40.4	177.5	-61.2	176.3	0	0	0	112	E124 V127 F128 L170 H174 G179 L180	E124-I176 HydrophobicContact CB-CD1 4.02Å; V127-I176 HydrophobicContact CB-CG2 4.05Å; V127-I176 HydrophobicContact CG1-CG2 3.66Å; F128-I176 HydrophobicContact CB-CD1 4.36Å; F128-I176 HydrophobicContact CB-CG2 4.34Å; F128-I176 HydrophobicContact CD2-CD1 4.12Å; F128-I176 HydrophobicContact CD2-CG1 4.35Å; L170-I176 HydrophobicContact CD1-CB 4.43Å; L170-I176 HydrophobicContact CD1-CG2 4.46Å; H174-I176 VanDerWaalsContact C-N 3.31Å; H174-I176 PolarHBondContact ND1-N 3.35Å; H174-I176 VanDerWaalsContact ND1-N 3.17Å; H174-I176 PolarHBondContact O-N 2.95Å; I176-G179 PolarHBondContact O-N 3.11Å; I176-L180 WeakPolarHBondContact O-CB 3.43Å; I176-L180 PolarHBondContact O-N 3.41Å
177	R	97.9	Very high	97.4	Very high	66 Å²	66	29 Å²	29	25%	0.249	15%	0.152	C	C	.	.	H	α-helix	trans	-69.3	-44	179.6	178.8	172.6	-179.2	173.7	-0.4	111	A167 L170 P171 H174 P175 L180 A181	A167-R177 HydrophobicContact CB-CB 4.42Å; A167-R177 HydrophobicContact CB-CG 4.05Å; A167-R177 WeakPolarHBondContact O-CD 3.46Å; L170-R177 HydrophobicContact CB-CB 4.35Å; L170-R177 HydrophobicContact CD1-CB 4.5Å; L170-R177 PolarHBondContact O-NH1 3.1Å; P171-R177 WeakPolarHBondContact O-CD 3.15Å; H174-R177 HydrophobicContact CB-CB 4.23Å; H174-R177 PolarHBondContact O-N 3.49Å; P175-R177 PolarHBondContact O-N 2.99Å; R177-L180 WeakPolarHBondContact O-CB 3.44Å; R177-L180 PolarHBondContact O-N 3.43Å; R177-A181 PolarHBondContact O-N 3.16Å; R177-A181 VanDerWaalsContact O-N 3.1Å
178	L	98.4	Very high	97.4	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-60.7	-45.8	173	-74.4	172.9	0	0	0	111.7	H174 P175 L180 A181 L182 A209 I227 M228 L231	H174-L178 PolarHBondContact O-N 2.95Å; P175-L178 PolarHBondContact O-N 3.47Å; L178-L180 VanDerWaalsContact C-N 3.27Å; L178-L180 PolarHBondContact O-N 3.42Å; L178-A181 PolarHBondContact O-N 3.3Å; L178-A181 VanDerWaalsContact O-N 3.17Å; L178-L182 PolarHBondContact O-N 2.96Å; L178-A209 HydrophobicContact CD1-CB 4.46Å; L178-A209 HydrophobicContact CD2-CB 3.69Å; L178-I227 HydrophobicContact CB-CB 4.18Å; L178-I227 HydrophobicContact CB-CD1 4.42Å; L178-I227 HydrophobicContact CB-CG2 3.64Å; L178-M228 HydrophobicContact CD1-CG 3.95Å; L178-M228 HydrophobicContact CD1-SD 4.42Å; L178-M228 HydrophobicContact CD2-CG 4.15Å; L178-L231 HydrophobicContact CD2-CD1 4.12Å
179	G	98.3	Very high	97.5	Very high	10 Å²	10	28.5 Å²	28.5	10%	0.103	14%	0.143	C	C	.	.	H	α-helix	trans	-64.1	-32.3	178.4	0	0	0	0	0	112.9	K131 P175 I176 N183	K131-G179 WeakPolarHBondContact CE-O 3.29Å; P175-G179 PolarHBondContact O-N 3.17Å; I176-G179 PolarHBondContact O-N 3.11Å; G179-N183 PolarHBondContact O-N 3.35Å; G179-N183 VanDerWaalsContact O-N 3.1Å
180	L	98.8	Very high	97.5	Very high	4 Å²	4	25.7 Å²	25.7	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-63.9	-50.1	170.6	168.2	63.4	0	0	0	111.2	V127 K131 Y160 A163 A167 I176 R177 L178 L182 N183 F184	V127-L180 HydrophobicContact CG1-CD2 4.05Å; K131-L180 HydrophobicContact CB-CD1 4.03Å; K131-L180 HydrophobicContact CD-CB 4.09Å; K131-L180 HydrophobicContact CG-CB 4.29Å; K131-L180 HydrophobicContact CG-CD1 4.02Å; Y160-L180 HydrophobicContact CD1-CD1 3.69Å; Y160-L180 HydrophobicContact CE1-CD1 4.37Å; A163-L180 VanDerWaalsContact C-CD2 3.43Å; A163-L180 HydrophobicContact CB-CD1 3.65Å; A163-L180 HydrophobicContact CB-CD2 3.67Å; A163-L180 HydrophobicContact CB-CG 4.32Å; A163-L180 WeakPolarHBondContact O-CD2 3.44Å; A167-L180 HydrophobicContact CB-CD2 3.94Å; I176-L180 WeakPolarHBondContact O-CB 3.43Å; I176-L180 PolarHBondContact O-N 3.41Å; R177-L180 WeakPolarHBondContact O-CB 3.44Å; R177-L180 PolarHBondContact O-N 3.43Å; L178-L180 VanDerWaalsContact C-N 3.27Å; L178-L180 PolarHBondContact O-N 3.42Å; L180-L182 VanDerWaalsContact C-N 3.3Å; L180-L182 PolarHBondContact O-N 2.9Å; L180-N183 PolarHBondContact O-N 2.93Å; L180-F184 VanDerWaalsContact O-CB 3.29Å; L180-F184 WeakPolarHBondContact O-CB 3.21Å; L180-F184 PolarHBondContact O-N 3.39Å
181	A	98.8	Very high	97.6	Very high	10 Å²	10	25.6 Å²	25.6	8%	0.083	13%	0.131	C	C	.	.	H	α-helix	trans	-60.3	-40.5	178.6	0	0	0	0	0	112.1	R177 L178 S185 A205	R177-A181 PolarHBondContact O-N 3.16Å; R177-A181 VanDerWaalsContact O-N 3.1Å; L178-A181 PolarHBondContact O-N 3.3Å; L178-A181 VanDerWaalsContact O-N 3.17Å; A181-S185 WeakPolarHBondContact O-CB 3.41Å; A181-S185 PolarHBondContact O-N 3.37Å; A181-S185 PolarHBondContact O-OG 2.93Å; A181-A205 HydrophobicContact CB-CB 3.41Å; A181-A205 VanDerWaalsContact CB-CB 3.41Å
182	L	98.7	Very high	97.7	Very high	20 Å²	20	25.6 Å²	25.6	11%	0.105	13%	0.125	C	C	.	.	H	α-helix	trans	-58.4	-51.5	174.5	177.1	63.8	0	0	0	111.4	L178 L180 S185 V186 I227 L230 L231 N234	L178-L182 PolarHBondContact O-N 2.96Å; L180-L182 VanDerWaalsContact C-N 3.3Å; L180-L182 PolarHBondContact O-N 2.9Å; L182-S185 PolarHBondContact O-OG 3.47Å; L182-V186 VanDerWaalsContact O-CG2 3.32Å; L182-V186 WeakPolarHBondContact O-CG2 3.27Å; L182-V186 PolarHBondContact O-N 3.5Å; L182-I227 HydrophobicContact CB-CG2 4.26Å; L182-I227 HydrophobicContact CD2-CG2 4.15Å; L182-L230 HydrophobicContact CD1-CB 4.08Å; L182-L230 HydrophobicContact CD2-CB 3.89Å; L182-L230 HydrophobicContact CD2-CD1 3.87Å; L182-L231 HydrophobicContact CB-CD2 3.92Å; L182-L231 HydrophobicContact CB-CG 4.24Å; L182-L231 HydrophobicContact CD1-CD2 3.98Å; L182-L231 HydrophobicContact CD1-CG 4.2Å; L182-N234 VanDerWaalsContact CD1-ND2 3.33Å; L182-N234 WeakPolarHBondContact CD1-ND2 3.39Å
183	N	98.6	Very high	97.6	Very high	30 Å²	30	31.2 Å²	31.2	16%	0.16	15%	0.154	C	C	.	.	H	α-helix	trans	-72.3	-34.7	-176.5	-77.6	14.1	0	0	0	113.1	K131 D135 Y160 G179 L180 V186 F187	K131-N183 WeakPolarHBondContact CE-ND2 3.45Å; K131-N183 PolarHBondContact NZ-ND2 3.07Å; D135-N183 VanDerWaalsContact OD1-CB 3.28Å; D135-N183 WeakPolarHBondContact OD1-CB 3.33Å; D135-N183 PolarHBondContact OD1-ND2 3.05Å; D135-N183 PolarHBondContact OD2-ND2 3.37Å; Y160-N183 HydrophobicContact CE1-CB 4.21Å; G179-N183 PolarHBondContact O-N 3.35Å; G179-N183 VanDerWaalsContact O-N 3.1Å; L180-N183 PolarHBondContact O-N 2.93Å; N183-V186 PolarHBondContact O-N 3Å; N183-F187 PolarHBondContact O-N 3.48Å
184	F	98.8	Very high	97.7	Very high	9 Å²	9	33.6 Å²	33.6	4%	0.039	17%	0.167	C	C	.	.	H	α-helix	trans	-73.9	-33.5	179.3	-169.1	-166.7	0	0	0	112	L157 Y160 L180 F187 Y188 L201	L157-F184 HydrophobicContact CD1-CE2 3.85Å; L157-F184 HydrophobicContact CD1-CZ 3.79Å; Y160-F184 VanDerWaalsContact CB-CD2 3.43Å; Y160-F184 VanDerWaalsContact CB-CE2 3.47Å; Y160-F184 HydrophobicContact CD1-CB 3.97Å; Y160-F184 HydrophobicContact CD1-CD2 4.38Å; Y160-F184 HydrophobicContact CD1-CG 4.21Å; Y160-F184 HydrophobicContact CD2-CB 4.49Å; Y160-F184 AromaticContact CD2-CD2 3.53Å; Y160-F184 HydrophobicContact CD2-CD2 3.53Å; Y160-F184 AromaticContact CD2-CE2 3.96Å; Y160-F184 HydrophobicContact CD2-CE2 3.96Å; Y160-F184 HydrophobicContact CD2-CG 4.19Å; Y160-F184 HydrophobicContact CE1-CB 4.41Å; Y160-F184 HydrophobicContact CE2-CD2 4.34Å; Y160-F184 HydrophobicContact CG-CB 4.02Å; Y160-F184 HydrophobicContact CG-CD1 4.39Å; Y160-F184 AromaticContact CG-CD2 3.55Å; Y160-F184 HydrophobicContact CG-CD2 3.55Å; Y160-F184 HydrophobicContact CG-CE2 4.02Å; Y160-F184 AromaticContact CG-CG 3.77Å; Y160-F184 HydrophobicContact CG-CG 3.77Å; L180-F184 VanDerWaalsContact O-CB 3.29Å; L180-F184 WeakPolarHBondContact O-CB 3.21Å; L180-F184 PolarHBondContact O-N 3.39Å; F184-F187 HydrophobicContact CD2-CB 4.19Å; F184-F187 AromaticContact CD2-CD1 3.78Å; F184-F187 HydrophobicContact CD2-CD1 3.78Å; F184-F187 HydrophobicContact CD2-CG 4.33Å; F184-F187 AromaticContact CE2-CD1 3.69Å; F184-F187 HydrophobicContact CE2-CD1 3.69Å; F184-F187 HydrophobicContact CE2-CE1 4.12Å; F184-F187 WeakPolarHBondContact O-CB 3.34Å; F184-F187 PolarHBondContact O-N 2.97Å; F184-Y188 HydrophobicContact CD1-CE2 4.23Å; F184-Y188 AromaticContact CD2-CD2 3.95Å; F184-Y188 HydrophobicContact CD2-CD2 3.95Å; F184-Y188 AromaticContact CD2-CE2 3.64Å; F184-Y188 HydrophobicContact CD2-CE2 3.64Å; F184-Y188 AromaticContact CE1-CE2 3.95Å; F184-Y188 HydrophobicContact CE1-CE2 3.95Å; F184-Y188 AromaticContact CE2-CD2 3.99Å; F184-Y188 HydrophobicContact CE2-CD2 3.99Å; F184-Y188 HydrophobicContact CE2-CE1 4.35Å; F184-Y188 AromaticContact CE2-CE2 3.3Å; F184-Y188 HydrophobicContact CE2-CE2 3.3Å; F184-Y188 AromaticContact CE2-CZ 3.52Å; F184-Y188 HydrophobicContact CG-CD2 4.46Å; F184-Y188 HydrophobicContact CG-CE2 4.11Å; F184-Y188 AromaticContact CZ-CE2 3.49Å; F184-Y188 HydrophobicContact CZ-CE2 3.49Å; F184-Y188 VanDerWaalsContact CZ-CE2 3.49Å; F184-Y188 AromaticContact CZ-CZ 3.57Å; F184-Y188 WeakPolarHBondContact CZ-OH 3.36Å; F184-Y188 VanDerWaalsContact O-CD2 3.29Å; F184-Y188 WeakPolarHBondContact O-CD2 3.35Å; F184-Y188 PolarHBondContact O-N 3.31Å; F184-L201 HydrophobicContact CB-CD2 3.79Å; F184-L201 HydrophobicContact CD1-CD2 3.64Å; F184-L201 HydrophobicContact CE1-CD2 4.44Å; F184-L201 HydrophobicContact CG-CD2 3.72Å
185	S	98.7	Very high	97.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-41.9	170.6	57	0	0	0	0	111.5	A181 L182 F187 Y188 Y189 A198	A181-S185 WeakPolarHBondContact O-CB 3.41Å; A181-S185 PolarHBondContact O-N 3.37Å; A181-S185 PolarHBondContact O-OG 2.93Å; L182-S185 PolarHBondContact O-OG 3.47Å; S185-F187 VanDerWaalsContact C-N 3.29Å; S185-F187 PolarHBondContact O-N 3.17Å; S185-Y188 PolarHBondContact O-N 3.38Å; S185-Y188 VanDerWaalsContact O-N 3.16Å; S185-Y189 PolarHBondContact O-N 3.12Å; S185-A198 WeakPolarHBondContact CB-O 3.31Å; S185-A198 VanDerWaalsContact O-CB 3.25Å; S185-A198 WeakPolarHBondContact O-CB 3.28Å
186	V	98.4	Very high	97.7	Very high	20 Å²	20	36.3 Å²	36.3	12%	0.121	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-37.4	172.5	174.3	0	0	0	0	111.8	L182 N183 Y189 E190 W238	L182-V186 VanDerWaalsContact O-CG2 3.32Å; L182-V186 WeakPolarHBondContact O-CG2 3.27Å; L182-V186 PolarHBondContact O-N 3.5Å; N183-V186 PolarHBondContact O-N 3Å; V186-Y189 PolarHBondContact O-N 2.97Å; V186-E190 HydrophobicContact CG1-CG 3.85Å; V186-E190 VanDerWaalsContact CG1-OE2 3.3Å; V186-E190 WeakPolarHBondContact CG1-OE2 3.44Å; V186-E190 WeakPolarHBondContact O-CB 3.47Å; V186-E190 PolarHBondContact O-N 3.18Å; V186-W238 HydrophobicContact CG2-CH2 4.17Å; V186-W238 HydrophobicContact CG2-CZ2 4.09Å
187	F	98.7	Very high	97.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-49.1	172.3	168.4	-97.4	0	0	0	112.3	R138 V153 S156 L157 Y160 N183 F184 S185 Y189 I191 Q192	R138-F187 HydrophobicContact CB-CD2 4.35Å; R138-F187 HydrophobicContact CG-CD2 4.25Å; V153-F187 HydrophobicContact CG1-CE2 4.31Å; V153-F187 HydrophobicContact CG1-CZ 3.99Å; S156-F187 WeakPolarHBondContact OG-CD2 3.35Å; S156-F187 WeakPolarHBondContact OG-CE2 3.32Å; L157-F187 HydrophobicContact CB-CE1 4.11Å; L157-F187 HydrophobicContact CB-CZ 3.97Å; L157-F187 HydrophobicContact CD1-CE1 4.06Å; Y160-F187 HydrophobicContact CD2-CB 4.14Å; Y160-F187 HydrophobicContact CD2-CD1 4.34Å; Y160-F187 HydrophobicContact CD2-CD2 4.43Å; Y160-F187 HydrophobicContact CD2-CG 4.05Å; Y160-F187 HydrophobicContact CE2-CB 3.65Å; Y160-F187 HydrophobicContact CE2-CD2 4.08Å; Y160-F187 AromaticContact CE2-CG 3.86Å; Y160-F187 HydrophobicContact CE2-CG 3.86Å; N183-F187 PolarHBondContact O-N 3.48Å; F184-F187 HydrophobicContact CD2-CB 4.19Å; F184-F187 AromaticContact CD2-CD1 3.78Å; F184-F187 HydrophobicContact CD2-CD1 3.78Å; F184-F187 HydrophobicContact CD2-CG 4.33Å; F184-F187 AromaticContact CE2-CD1 3.69Å; F184-F187 HydrophobicContact CE2-CD1 3.69Å; F184-F187 HydrophobicContact CE2-CE1 4.12Å; F184-F187 WeakPolarHBondContact O-CB 3.34Å; F184-F187 PolarHBondContact O-N 2.97Å; S185-F187 VanDerWaalsContact C-N 3.29Å; S185-F187 PolarHBondContact O-N 3.17Å; F187-Y189 VanDerWaalsContact C-N 3.28Å; F187-Y189 PolarHBondContact O-N 3.17Å; F187-I191 HydrophobicContact CD2-CB 3.84Å; F187-I191 HydrophobicContact CD2-CG1 3.95Å; F187-I191 HydrophobicContact CD2-CG2 4.14Å; F187-I191 HydrophobicContact CE2-CB 3.95Å; F187-I191 HydrophobicContact CE2-CG1 4.4Å; F187-I191 HydrophobicContact CE2-CG2 3.75Å; F187-I191 WeakPolarHBondContact O-CA 3.24Å; F187-I191 VanDerWaalsContact O-CB 3.32Å; F187-I191 WeakPolarHBondContact O-CB 3.42Å; F187-I191 PolarHBondContact O-N 2.92Å; F187-Q192 HydrophobicContact CD1-CG 4.21Å; F187-Q192 HydrophobicContact CE1-CG 3.51Å; F187-Q192 HydrophobicContact CE2-CG 4.49Å; F187-Q192 HydrophobicContact CZ-CG 3.7Å; F187-Q192 PolarHBondContact O-N 3.1Å
188	Y	98.5	Very high	97.7	Very high	35 Å²	35	35.3 Å²	35.3	14%	0.137	19%	0.186	C	C	.	.	H	α-helix	trans	-59.9	-41.9	178.8	-79.8	-61.6	0	0	0	111.7	L157 F184 S185 Q192 N193 N194 Q197 L201	L157-Y188 HydrophobicContact CD1-CE1 4.38Å; F184-Y188 HydrophobicContact CD1-CE2 4.23Å; F184-Y188 AromaticContact CD2-CD2 3.95Å; F184-Y188 HydrophobicContact CD2-CD2 3.95Å; F184-Y188 AromaticContact CD2-CE2 3.64Å; F184-Y188 HydrophobicContact CD2-CE2 3.64Å; F184-Y188 AromaticContact CE1-CE2 3.95Å; F184-Y188 HydrophobicContact CE1-CE2 3.95Å; F184-Y188 AromaticContact CE2-CD2 3.99Å; F184-Y188 HydrophobicContact CE2-CD2 3.99Å; F184-Y188 HydrophobicContact CE2-CE1 4.35Å; F184-Y188 AromaticContact CE2-CE2 3.3Å; F184-Y188 HydrophobicContact CE2-CE2 3.3Å; F184-Y188 AromaticContact CE2-CZ 3.52Å; F184-Y188 HydrophobicContact CG-CD2 4.46Å; F184-Y188 HydrophobicContact CG-CE2 4.11Å; F184-Y188 AromaticContact CZ-CE2 3.49Å; F184-Y188 HydrophobicContact CZ-CE2 3.49Å; F184-Y188 VanDerWaalsContact CZ-CE2 3.49Å; F184-Y188 AromaticContact CZ-CZ 3.57Å; F184-Y188 WeakPolarHBondContact CZ-OH 3.36Å; F184-Y188 VanDerWaalsContact O-CD2 3.29Å; F184-Y188 WeakPolarHBondContact O-CD2 3.35Å; F184-Y188 PolarHBondContact O-N 3.31Å; S185-Y188 PolarHBondContact O-N 3.38Å; S185-Y188 VanDerWaalsContact O-N 3.16Å; Y188-Q192 HydrophobicContact CD1-CB 4.39Å; Y188-Q192 HydrophobicContact CD1-CG 4.32Å; Y188-Q192 CarbonylContact O-C 3.6Å; Y188-Q192 WeakPolarHBondContact O-CB 3.4Å; Y188-N193 PolarHBondContact O-N 3.26Å; Y188-N194 PolarHBondContact O-N 3.37Å; Y188-Q197 HydrophobicContact CD1-CB 4.17Å; Y188-Q197 HydrophobicContact CD1-CG 3.68Å; Y188-Q197 HydrophobicContact CD2-CG 3.85Å; Y188-Q197 HydrophobicContact CE1-CG 3.69Å; Y188-Q197 HydrophobicContact CE2-CG 3.85Å; Y188-Q197 HydrophobicContact CG-CB 4.19Å; Y188-Q197 HydrophobicContact CG-CG 3.76Å; Y188-L201 HydrophobicContact CD2-CD2 4.04Å; Y188-L201 HydrophobicContact CE2-CD2 4Å
189	Y	98	Very high	97.7	Very high	64 Å²	64	36.3 Å²	36.3	25%	0.251	19%	0.193	S	C	.	.	H	α-helix	trans	-70.2	-59.9	179.3	-177.3	-91.8	0	0	0	112.2	S185 V186 F187 N193 A195 W238 D241	S185-Y189 PolarHBondContact O-N 3.12Å; V186-Y189 PolarHBondContact O-N 2.97Å; F187-Y189 VanDerWaalsContact C-N 3.28Å; F187-Y189 PolarHBondContact O-N 3.17Å; Y189-N193 WeakPolarHBondContact O-CA 3.38Å; Y189-N193 PolarHBondContact O-N 3.21Å; Y189-A195 HydrophobicContact CD2-CB 3.94Å; Y189-A195 HydrophobicContact CE2-CB 4.19Å; Y189-W238 AromaticContact CD1-CD1 3.99Å; Y189-W238 AromaticContact CD1-CE2 3.9Å; Y189-W238 HydrophobicContact CD1-CZ2 4.3Å; Y189-W238 AromaticContact CD1-NE1 3.38Å; Y189-W238 HydrophobicContact CD2-CB 4.2Å; Y189-W238 AromaticContact CD2-CD1 3.4Å; Y189-W238 AromaticContact CD2-CD2 3.79Å; Y189-W238 HydrophobicContact CD2-CD2 3.79Å; Y189-W238 AromaticContact CD2-CE2 3.78Å; Y189-W238 AromaticContact CD2-CG 3.55Å; Y189-W238 HydrophobicContact CD2-CG 3.55Å; Y189-W238 AromaticContact CD2-NE1 3.52Å; Y189-W238 AromaticContact CE1-CD1 3.75Å; Y189-W238 AromaticContact CE1-NE1 3.47Å; Y189-W238 HydrophobicContact CE2-CB 4Å; Y189-W238 AromaticContact CE2-CD1 3.1Å; Y189-W238 HydrophobicContact CE2-CD2 4.27Å; Y189-W238 AromaticContact CE2-CG 3.54Å; Y189-W238 HydrophobicContact CE2-CG 3.54Å; Y189-W238 AromaticContact CE2-NE1 3.59Å; Y189-W238 AromaticContact CG-CD1 3.83Å; Y189-W238 HydrophobicContact CG-CD2 4.06Å; Y189-W238 AromaticContact CG-CE2 3.57Å; Y189-W238 HydrophobicContact CG-CG 4.19Å; Y189-W238 AromaticContact CG-CZ2 4Å; Y189-W238 HydrophobicContact CG-CZ2 4Å; Y189-W238 AromaticContact CG-NE1 3.41Å; Y189-W238 AromaticContact CZ-CD1 3.3Å; Y189-W238 AromaticContact CZ-NE1 3.56Å; Y189-D241 PolarHBondContact OH-OD2 3.35Å
190	E	96	Very high	97.7	Very high	81 Å²	81	41.9 Å²	41.9	38%	0.379	22%	0.216	S	C	.	.	H	α-helix	trans	-78.3	-29.8	-169.8	-63.4	-176.3	159.9	0	0	114.2	R138 V186	R138-E190 IonicContact NH1-OE2 2.63Å; R138-E190 PolarHBondContact NH1-OE2 3.36Å; R138-E190 VanDerWaalsContact NH1-OE2 3.13Å; V186-E190 HydrophobicContact CG1-CG 3.85Å; V186-E190 VanDerWaalsContact CG1-OE2 3.3Å; V186-E190 WeakPolarHBondContact CG1-OE2 3.44Å; V186-E190 WeakPolarHBondContact O-CB 3.47Å; V186-E190 PolarHBondContact O-N 3.18Å
191	I	97.1	Very high	97.6	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.051	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-43.4	-172.1	-57.8	-51.7	0	0	0	112.5	R138 A141 E142 R149 V153 F187	R138-I191 HydrophobicContact CG-CD1 4.21Å; R138-I191 HydrophobicContact CG-CG1 3.71Å; A141-I191 HydrophobicContact CB-CD1 4.46Å; A141-I191 HydrophobicContact CB-CG2 4.01Å; E142-I191 HydrophobicContact CB-CD1 4.31Å; R149-I191 PolarHBondContact NH2-O 3.46Å; R149-I191 VanDerWaalsContact NH2-O 3.09Å; V153-I191 HydrophobicContact CB-CG2 4.49Å; V153-I191 HydrophobicContact CG1-CG2 4.25Å; V153-I191 HydrophobicContact CG2-CG2 3.57Å; F187-I191 HydrophobicContact CD2-CB 3.84Å; F187-I191 HydrophobicContact CD2-CG1 3.95Å; F187-I191 HydrophobicContact CD2-CG2 4.14Å; F187-I191 HydrophobicContact CE2-CB 3.95Å; F187-I191 HydrophobicContact CE2-CG1 4.4Å; F187-I191 HydrophobicContact CE2-CG2 3.75Å; F187-I191 WeakPolarHBondContact O-CA 3.24Å; F187-I191 VanDerWaalsContact O-CB 3.32Å; F187-I191 WeakPolarHBondContact O-CB 3.42Å; F187-I191 PolarHBondContact O-N 2.92Å
192	Q	96.6	Very high	97.6	Very high	75 Å²	75	43 Å²	43	35%	0.35	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-5.8	-179.4	-66.1	-79.9	10.3	0	0	112.8	F187 Y188 N194	F187-Q192 HydrophobicContact CD1-CG 4.21Å; F187-Q192 HydrophobicContact CE1-CG 3.51Å; F187-Q192 HydrophobicContact CE2-CG 4.49Å; F187-Q192 HydrophobicContact CZ-CG 3.7Å; F187-Q192 PolarHBondContact O-N 3.1Å; Y188-Q192 HydrophobicContact CD1-CB 4.39Å; Y188-Q192 HydrophobicContact CD1-CG 4.32Å; Y188-Q192 CarbonylContact O-C 3.6Å; Y188-Q192 WeakPolarHBondContact O-CB 3.4Å; Q192-N194 HydrophobicContact CB-CB 4.2Å; Q192-N194 PolarHBondContact O-N 3.02Å; Q192-N194 VanDerWaalsContact O-N 3.16Å
193	N	95.7	Very high	97.6	Very high	138 Å²	138	47.8 Å²	47.8	74%	0.738	24%	0.24	S	C	*	.			trans	49.5	37.6	-174	-60.3	-34.6	0	0	0	112.4	Y188 Y189	Y188-N193 PolarHBondContact O-N 3.26Å; Y189-N193 WeakPolarHBondContact O-CA 3.38Å; Y189-N193 PolarHBondContact O-N 3.21Å
194	N	96.6	Very high	97.6	Very high	60 Å²	60	49.5 Å²	49.5	32%	0.321	26%	0.255	S	S	.	.			trans	-115	73.5	-176.4	-170.1	-15.6	0	0	0	109.7	Y188 Q192 Q197 A198	Y188-N194 PolarHBondContact O-N 3.37Å; Q192-N194 HydrophobicContact CB-CB 4.2Å; Q192-N194 PolarHBondContact O-N 3.02Å; Q192-N194 VanDerWaalsContact O-N 3.16Å; N194-Q197 HydrophobicContact CB-CB 4.26Å; N194-Q197 WeakPolarHBondContact ND2-CB 3.28Å; N194-Q197 PolarHBondContact O-N 2.64Å; N194-Q197 VanDerWaalsContact OD1-CB 3.25Å; N194-Q197 WeakPolarHBondContact OD1-CB 3.42Å; N194-Q197 PolarHBondContact OD1-N 3.13Å; N194-Q197 VanDerWaalsContact OD1-N 3.11Å; N194-A198 PolarHBondContact O-N 3.36Å
195	A	96.5	Very high	97.5	Very high	18 Å²	18	50 Å²	50	15%	0.149	26%	0.261	C	S	.	.	H	α-helix	trans	-59.1	-40.6	179.2	0	0	0	0	0	113.5	Y189 Q197 A198 C199 Q242	Y189-A195 HydrophobicContact CD2-CB 3.94Å; Y189-A195 HydrophobicContact CE2-CB 4.19Å; A195-Q197 PolarHBondContact O-N 3.47Å; A195-A198 PolarHBondContact O-N 2.99Å; A195-C199 WeakPolarHBondContact O-CB 3.24Å; A195-C199 PolarHBondContact O-N 3.46Å; A195-C199 PolarHBondContact O-SG 2.96Å; A195-C199 VanDerWaalsContact O-SG 3.37Å; A195-Q242 HydrophobicContact CB-CG 4.48Å
196	P	95.9	Very high	97.5	Very high	87 Å²	87	52 Å²	52	57%	0.565	27%	0.269	S	S	*	.	H	α-helix	trans	-57	-48.5	175.8	-27.5	36.6	0	0	0	113	A198 C199 E200	P196-A198 VanDerWaalsContact C-N 3.35Å; P196-A198 PolarHBondContact O-N 2.92Å; P196-C199 PolarHBondContact O-N 3.45Å; P196-E200 WeakPolarHBondContact O-CB 3.39Å; P196-E200 PolarHBondContact O-N 2.74Å
197	Q	97.2	Very high	97.5	Very high	70 Å²	70	54.7 Å²	54.7	33%	0.327	28%	0.283	S	S	.	.	H	α-helix	trans	-65.2	-38.6	178.3	-171.5	71.3	23.2	0	0	112.1	Y188 N194 A195 E200 L201	Y188-Q197 HydrophobicContact CD1-CB 4.17Å; Y188-Q197 HydrophobicContact CD1-CG 3.68Å; Y188-Q197 HydrophobicContact CD2-CG 3.85Å; Y188-Q197 HydrophobicContact CE1-CG 3.69Å; Y188-Q197 HydrophobicContact CE2-CG 3.85Å; Y188-Q197 HydrophobicContact CG-CB 4.19Å; Y188-Q197 HydrophobicContact CG-CG 3.76Å; N194-Q197 HydrophobicContact CB-CB 4.26Å; N194-Q197 WeakPolarHBondContact ND2-CB 3.28Å; N194-Q197 PolarHBondContact O-N 2.64Å; N194-Q197 VanDerWaalsContact OD1-CB 3.25Å; N194-Q197 WeakPolarHBondContact OD1-CB 3.42Å; N194-Q197 PolarHBondContact OD1-N 3.13Å; N194-Q197 VanDerWaalsContact OD1-N 3.11Å; A195-Q197 PolarHBondContact O-N 3.47Å; Q197-E200 PolarHBondContact O-N 3.42Å; Q197-L201 WeakPolarHBondContact O-CB 3.41Å; Q197-L201 PolarHBondContact O-N 2.61Å
198	A	98	Very high	97.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-47.7	176.3	0	0	0	0	0	111.5	S185 N194 A195 P196 L201 A202 W238	S185-A198 WeakPolarHBondContact CB-O 3.31Å; S185-A198 VanDerWaalsContact O-CB 3.25Å; S185-A198 WeakPolarHBondContact O-CB 3.28Å; N194-A198 PolarHBondContact O-N 3.36Å; A195-A198 PolarHBondContact O-N 2.99Å; P196-A198 VanDerWaalsContact C-N 3.35Å; P196-A198 PolarHBondContact O-N 2.92Å; A198-L201 PolarHBondContact O-N 3.18Å; A198-A202 WeakPolarHBondContact O-CB 3.16Å; A198-A202 PolarHBondContact O-N 3.41Å; A198-W238 HydrophobicContact CB-CE3 4.09Å; A198-W238 HydrophobicContact CB-CH2 4.36Å; A198-W238 HydrophobicContact CB-CZ3 3.86Å
199	C	97.8	Very high	97.3	Very high	22 Å²	22	55.2 Å²	55.2	15%	0.149	29%	0.292	C	S	.	.	H	α-helix	trans	-65	-43.7	177.7	-71	0	0	0	0	112	A195 P196 L201 A202 K203 L235	A195-C199 WeakPolarHBondContact O-CB 3.24Å; A195-C199 PolarHBondContact O-N 3.46Å; A195-C199 PolarHBondContact O-SG 2.96Å; A195-C199 VanDerWaalsContact O-SG 3.37Å; P196-C199 PolarHBondContact O-N 3.45Å; C199-L201 PolarHBondContact O-N 3.09Å; C199-A202 PolarHBondContact O-N 3.38Å; C199-K203 WeakPolarHBondContact O-CB 3.15Å; C199-K203 PolarHBondContact O-N 3.04Å; C199-L235 HydrophobicContact CB-CD2 4.09Å; C199-L235 WeakPolarHBondContact O-CD2 3.44Å
200	E	97.7	Very high	97.2	Very high	126 Å²	126	56 Å²	56	59%	0.589	30%	0.3	S	S	*	.	H	α-helix	trans	-58.3	-48.5	177.1	-175.7	-179.3	171.8	0	0	111.2	P196 Q197 S204	P196-E200 WeakPolarHBondContact O-CB 3.39Å; P196-E200 PolarHBondContact O-N 2.74Å; Q197-E200 PolarHBondContact O-N 3.42Å; E200-S204 WeakPolarHBondContact O-CB 3.48Å; E200-S204 PolarHBondContact O-N 3.44Å
201	L	98.4	Very high	97.1	Very high	39 Å²	39	56 Å²	56	20%	0.204	31%	0.313	C	S	.	.	H	α-helix	trans	-64	-48	179.8	179.9	61.9	0	0	0	112.2	F184 Y188 Q197 A198 C199 A205	F184-L201 HydrophobicContact CB-CD2 3.79Å; F184-L201 HydrophobicContact CD1-CD2 3.64Å; F184-L201 HydrophobicContact CE1-CD2 4.44Å; F184-L201 HydrophobicContact CG-CD2 3.72Å; Y188-L201 HydrophobicContact CD2-CD2 4.04Å; Y188-L201 HydrophobicContact CE2-CD2 4Å; Q197-L201 WeakPolarHBondContact O-CB 3.41Å; Q197-L201 PolarHBondContact O-N 2.61Å; A198-L201 PolarHBondContact O-N 3.18Å; C199-L201 PolarHBondContact O-N 3.09Å; L201-A205 WeakPolarHBondContact O-CB 3.48Å; L201-A205 PolarHBondContact O-N 3.26Å; L201-A205 VanDerWaalsContact O-N 3.09Å
202	A	98.3	Very high	96.9	Very high	0 Å²	0	59 Å²	59	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-42.3	-179.6	0	0	0	0	0	111.8	A198 C199 F206 L231 L235 W238	A198-A202 WeakPolarHBondContact O-CB 3.16Å; A198-A202 PolarHBondContact O-N 3.41Å; C199-A202 PolarHBondContact O-N 3.38Å; A202-F206 WeakPolarHBondContact O-CB 3.36Å; A202-F206 PolarHBondContact O-N 2.94Å; A202-L231 HydrophobicContact CB-CD2 3.85Å; A202-L235 HydrophobicContact CB-CD1 4.46Å; A202-L235 HydrophobicContact CB-CD2 3.89Å; A202-L235 HydrophobicContact CB-CG 4.02Å; A202-W238 HydrophobicContact CB-CZ3 4.27Å
203	K	98	Very high	96.6	Very high	119 Å²	119	56.2 Å²	56.2	52%	0.517	32%	0.315	S	S	.	.	H	α-helix	trans	-65.7	-47.5	177.7	-178.1	171.7	-178.6	171.3	0	111.7	C199 A205 F206 D207 L235	C199-K203 WeakPolarHBondContact O-CB 3.15Å; C199-K203 PolarHBondContact O-N 3.04Å; K203-A205 VanDerWaalsContact C-N 3.3Å; K203-A205 PolarHBondContact O-N 2.77Å; K203-F206 PolarHBondContact O-N 3.21Å; K203-D207 WeakPolarHBondContact CE-OD2 3.33Å; K203-D207 WeakPolarHBondContact CG-OD2 3.25Å; K203-D207 WeakPolarHBondContact O-CB 3.44Å; K203-D207 VanDerWaalsContact O-CG 3.3Å; K203-D207 PolarHBondContact O-N 2.92Å; K203-L235 HydrophobicContact CB-CD1 4.16Å; K203-L235 HydrophobicContact CB-CD2 4.1Å
204	S	98.2	Very high	96.3	Very high	67 Å²	67	57.1 Å²	57.1	47%	0.469	32%	0.32	S	S	.	.	H	α-helix	trans	-57.7	-43.2	177.9	178.7	0	0	0	0	112.2	E200 S208	E200-S204 WeakPolarHBondContact O-CB 3.48Å; E200-S204 PolarHBondContact O-N 3.44Å; S204-S208 VanDerWaalsContact O-CB 3.31Å; S204-S208 WeakPolarHBondContact O-CB 3.35Å; S204-S208 PolarHBondContact O-N 3.44Å; S204-S208 PolarHBondContact O-OG 3.32Å
205	A	98.3	Very high	95.9	Very high	19 Å²	19	61.7 Å²	61.7	16%	0.157	34%	0.339	C	S	.	.	H	α-helix	trans	-66	-43.4	176.1	0	0	0	0	0	112.6	A181 L201 K203 A209 L231	A181-A205 HydrophobicContact CB-CB 3.41Å; A181-A205 VanDerWaalsContact CB-CB 3.41Å; L201-A205 WeakPolarHBondContact O-CB 3.48Å; L201-A205 PolarHBondContact O-N 3.26Å; L201-A205 VanDerWaalsContact O-N 3.09Å; K203-A205 VanDerWaalsContact C-N 3.3Å; K203-A205 PolarHBondContact O-N 2.77Å; A205-A209 WeakPolarHBondContact O-CB 3.11Å; A205-A209 PolarHBondContact O-N 2.63Å; A205-L231 HydrophobicContact CB-CD1 4.34Å
206	F	98	Very high	95.2	Very high	41 Å²	41	62.6 Å²	62.6	18%	0.18	34%	0.341	C	S	.	.	H	α-helix	trans	-62.6	-49.3	177.1	-176.3	-87.4	0	0	0	111.7	A202 K203 S208 A209 I210 M228 L231 R232	A202-F206 WeakPolarHBondContact O-CB 3.36Å; A202-F206 PolarHBondContact O-N 2.94Å; K203-F206 PolarHBondContact O-N 3.21Å; F206-S208 VanDerWaalsContact C-N 3.34Å; F206-S208 PolarHBondContact O-N 3.05Å; F206-A209 PolarHBondContact O-N 3.44Å; F206-I210 HydrophobicContact CE1-CB 4.48Å; F206-I210 WeakPolarHBondContact O-CB 3.46Å; F206-I210 WeakPolarHBondContact O-CG2 3.48Å; F206-I210 PolarHBondContact O-N 3.11Å; F206-M228 HydrophobicContact CD2-CB 4.08Å; F206-M228 HydrophobicContact CD2-CE 4.35Å; F206-M228 WeakPolarHBondContact CD2-O 3.31Å; F206-M228 HydrophobicContact CE2-CB 4.05Å; F206-M228 HydrophobicContact CE2-CE 4.23Å; F206-M228 WeakPolarHBondContact CE2-O 3.25Å; F206-L231 HydrophobicContact CD2-CB 4.48Å; F206-R232 HydrophobicContact CD2-CB 4.4Å; F206-R232 HydrophobicContact CE2-CB 4.03Å
207	D	97.9	Very high	94.3	Very high	77 Å²	77	66.1 Å²	66.1	41%	0.412	35%	0.35	S	S	.	.	H	α-helix	trans	-66.2	-35	-177.7	-70.5	-12.2	0	0	0	112	K203 I210 A211	K203-D207 WeakPolarHBondContact CE-OD2 3.33Å; K203-D207 WeakPolarHBondContact CG-OD2 3.25Å; K203-D207 WeakPolarHBondContact O-CB 3.44Å; K203-D207 VanDerWaalsContact O-CG 3.3Å; K203-D207 PolarHBondContact O-N 2.92Å; D207-I210 VanDerWaalsContact O-CG2 3.28Å; D207-I210 WeakPolarHBondContact O-CG2 3.26Å; D207-A211 PolarHBondContact O-N 2.85Å
208	S	96.9	Very high	93.3	Very high	47 Å²	47	69.9 Å²	69.9	33%	0.329	37%	0.373	S	S	.	.	H	α-helix	trans	-69.2	-45	174.5	-57.8	0	0	0	0	111.4	T172 S204 F206 A211	T172-S208 PolarHBondContact OG1-O 3.35Å; S204-S208 VanDerWaalsContact O-CB 3.31Å; S204-S208 WeakPolarHBondContact O-CB 3.35Å; S204-S208 PolarHBondContact O-N 3.44Å; S204-S208 PolarHBondContact O-OG 3.32Å; F206-S208 VanDerWaalsContact C-N 3.34Å; F206-S208 PolarHBondContact O-N 3.05Å; S208-A211 PolarHBondContact O-N 3.06Å
209	A	96.6	Very high	92.4	Very high	0 Å²	0	77 Å²	77	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-71.2	-37.2	-178	0	0	0	0	0	112.8	T173 L178 A205 F206 A211 E212 L213 M228	T173-A209 HydrophobicContact CG2-CB 4.37Å; T173-A209 WeakPolarHBondContact CG2-O 3.27Å; L178-A209 HydrophobicContact CD1-CB 4.46Å; L178-A209 HydrophobicContact CD2-CB 3.69Å; A205-A209 WeakPolarHBondContact O-CB 3.11Å; A205-A209 PolarHBondContact O-N 2.63Å; F206-A209 PolarHBondContact O-N 3.44Å; A209-A211 VanDerWaalsContact C-N 3.26Å; A209-A211 PolarHBondContact O-N 2.89Å; A209-E212 CarbonylContact O-C 3.5Å; A209-E212 PolarHBondContact O-N 3.28Å; A209-L213 WeakPolarHBondContact O-CA 3.29Å; A209-L213 WeakPolarHBondContact O-CB 3.42Å; A209-L213 PolarHBondContact O-N 3.37Å; A209-M228 HydrophobicContact CB-CE 3.96Å; A209-M228 HydrophobicContact CB-CG 4.37Å; A209-M228 HydrophobicContact CB-SD 3.88Å
210	I	95.6	Very high	91.8	Very high	80 Å²	80	78.1 Å²	78.1	41%	0.41	42%	0.418	S	S	.	.	H	α-helix	trans	-64	-33.1	177.8	-165.4	65.6	0	0	0	111.8	F206 D207 E212 L213 M228	F206-I210 HydrophobicContact CE1-CB 4.48Å; F206-I210 WeakPolarHBondContact O-CB 3.46Å; F206-I210 WeakPolarHBondContact O-CG2 3.48Å; F206-I210 PolarHBondContact O-N 3.11Å; D207-I210 VanDerWaalsContact O-CG2 3.28Å; D207-I210 WeakPolarHBondContact O-CG2 3.26Å; I210-E212 PolarHBondContact O-N 3.17Å; I210-L213 HydrophobicContact CD1-CD2 3.85Å; I210-M228 HydrophobicContact CB-CE 3.84Å; I210-M228 HydrophobicContact CD1-CE 3.91Å; I210-M228 HydrophobicContact CG1-CE 4.49Å
211	A	94.8	Very high	91.4	Very high	80 Å²	80	77 Å²	77	66%	0.661	41%	0.409	S	S	*	.	H	α-helix	trans	-67.5	-23.9	178.1	0	0	0	0	0	113.5	D207 S208 A209	D207-A211 PolarHBondContact O-N 2.85Å; S208-A211 PolarHBondContact O-N 3.06Å; A209-A211 VanDerWaalsContact C-N 3.26Å; A209-A211 PolarHBondContact O-N 2.89Å
212	E	93.1	Very high	91.2	Very high	74 Å²	74	82.8 Å²	82.8	35%	0.346	43%	0.433	S	S	.	.	H	α-helix	trans	-112.9	-1.7	-177.9	-69.3	175.3	-166.6	0	0	112.8	T172 T173 A209 I210 D214 Q215	T172-E212 PolarHBondContact OG1-OE2 3.33Å; T173-E212 HydrophobicContact CG2-CB 3.78Å; A209-E212 CarbonylContact O-C 3.5Å; A209-E212 PolarHBondContact O-N 3.28Å; I210-E212 PolarHBondContact O-N 3.17Å; E212-D214 VanDerWaalsContact C-N 3.3Å; E212-D214 PolarHBondContact O-N 2.84Å; E212-Q215 WeakPolarHBondContact O-CB 3.32Å; E212-Q215 PolarHBondContact O-N 3.24Å
213	L	90.4	Very high	90.9	Very high	16 Å²	16	87 Å²	87	8%	0.084	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-60.3	-37.3	-171.2	-175.5	59.7	0	0	0	112.9	A209 I210 Q215 L216 Y221 T225 M228	A209-L213 WeakPolarHBondContact O-CA 3.29Å; A209-L213 WeakPolarHBondContact O-CB 3.42Å; A209-L213 PolarHBondContact O-N 3.37Å; I210-L213 HydrophobicContact CD1-CD2 3.85Å; L213-Q215 PolarHBondContact O-N 2.95Å; L213-Q215 VanDerWaalsContact O-N 3.11Å; L213-L216 HydrophobicContact CD1-CD1 3.54Å; L213-L216 WeakPolarHBondContact O-CB 3.22Å; L213-L216 PolarHBondContact O-N 3.01Å; L213-L216 VanDerWaalsContact O-N 3.16Å; L213-Y221 HydrophobicContact CD1-CD2 4.29Å; L213-Y221 HydrophobicContact CD1-CE2 4.03Å; L213-Y221 HydrophobicContact CG-CE2 4.1Å; L213-T225 HydrophobicContact CD1-CG2 4.09Å; L213-T225 HydrophobicContact CD2-CG2 4.23Å; L213-M228 HydrophobicContact CD1-SD 4.11Å; L213-M228 HydrophobicContact CD2-CE 4.19Å; L213-M228 HydrophobicContact CD2-SD 4.28Å
214	D	88.2	Confident	90.8	Very high	158 Å²	158	81.3 Å²	81.3	85%	0.845	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-66.4	-11	179.4	-66.6	-23.7	0	0	0	113.4	E212	E212-D214 VanDerWaalsContact C-N 3.3Å; E212-D214 PolarHBondContact O-N 2.84Å
215	Q	87.5	Confident	90.7	Very high	155 Å²	155	80.1 Å²	80.1	72%	0.724	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-94.3	-6.5	178.9	-53.4	177.7	14.5	0	0	112.9	E212 L213	E212-Q215 WeakPolarHBondContact O-CB 3.32Å; E212-Q215 PolarHBondContact O-N 3.24Å; L213-Q215 PolarHBondContact O-N 2.95Å; L213-Q215 VanDerWaalsContact O-N 3.11Å
216	L	82.9	Confident	90.6	Very high	38 Å²	38	84.1 Å²	84.1	20%	0.199	44%	0.439	C	S	.	.			trans	-70.8	145	-178	-86.7	172.9	0	0	0	112.6	T173 L213 Y221	T173-L216 HydrophobicContact CG2-CD1 3.96Å; T173-L216 HydrophobicContact CG2-CG 4.08Å; T173-L216 WeakPolarHBondContact OG1-CD2 3.47Å; L213-L216 HydrophobicContact CD1-CD1 3.54Å; L213-L216 WeakPolarHBondContact O-CB 3.22Å; L213-L216 PolarHBondContact O-N 3.01Å; L213-L216 VanDerWaalsContact O-N 3.16Å; L216-Y221 HydrophobicContact CB-CD2 4.17Å
217	Q	76.2	Confident	90.6	Very high	161 Å²	161	83.5 Å²	83.5	75%	0.752	44%	0.437	S	S	*	.			trans	-81.4	153.3	167.1	-63.9	-175.8	-23.6	0	0	110.8	D219 S220 Y221	Q217-D219 VanDerWaalsContact C-N 3.26Å; Q217-D219 PolarHBondContact O-N 3.11Å; Q217-D219 VanDerWaalsContact O-N 3.12Å; Q217-S220 PolarHBondContact O-N 2.87Å; Q217-Y221 PolarHBondContact O-N 3.19Å
218	D	76.5	Confident	90.6	Very high	149 Å²	149	80.1 Å²	80.1	80%	0.797	42%	0.419	S	S	*	.	H	α-helix	trans	-52.7	-37.6	-171.7	-70.4	-22	0	0	0	114	S220 Y221	D218-S220 VanDerWaalsContact C-N 3.34Å; D218-S220 PolarHBondContact O-N 3.46Å; D218-Y221 PolarHBondContact O-N 3.05Å
219	D	79.8	Confident	90.7	Very high	149 Å²	149	80.9 Å²	80.9	80%	0.797	42%	0.417	S	S	*	.	H	α-helix	trans	-63.3	-32.6	-171.6	-68.3	-18.5	0	0	0	114.2	Q217	Q217-D219 VanDerWaalsContact C-N 3.26Å; Q217-D219 PolarHBondContact O-N 3.11Å; Q217-D219 VanDerWaalsContact O-N 3.12Å
220	S	84.8	Confident	90.8	Very high	45 Å²	45	84.4 Å²	84.4	32%	0.315	44%	0.436	S	S	.	.	H	α-helix	trans	-101.2	-13	178	-64.1	0	0	0	0	113.4	Q217 D218 K222 D223 S224	Q217-S220 PolarHBondContact O-N 2.87Å; D218-S220 VanDerWaalsContact C-N 3.34Å; D218-S220 PolarHBondContact O-N 3.46Å; S220-K222 VanDerWaalsContact C-N 3.32Å; S220-K222 PolarHBondContact O-N 2.92Å; S220-D223 PolarHBondContact O-N 3.4Å; S220-S224 PolarHBondContact O-N 2.88Å; S220-S224 PolarHBondContact O-OG 3.48Å
221	Y	90.2	Very high	90.9	Very high	102 Å²	102	80.6 Å²	80.6	40%	0.4	42%	0.416	S	S	.	.	H	α-helix	trans	-57.8	-44	-172.3	-173.1	-91	0	0	0	112.2	L213 L216 Q217 D218 T225	L213-Y221 HydrophobicContact CD1-CD2 4.29Å; L213-Y221 HydrophobicContact CD1-CE2 4.03Å; L213-Y221 HydrophobicContact CG-CE2 4.1Å; L216-Y221 HydrophobicContact CB-CD2 4.17Å; Q217-Y221 PolarHBondContact O-N 3.19Å; D218-Y221 PolarHBondContact O-N 3.05Å; Y221-T225 HydrophobicContact CD1-CG2 4.08Å; Y221-T225 HydrophobicContact CE1-CG2 3.75Å; Y221-T225 HydrophobicContact CE2-CG2 4.32Å; Y221-T225 HydrophobicContact CG-CG2 4.5Å; Y221-T225 WeakPolarHBondContact O-CB 3.49Å; Y221-T225 VanDerWaalsContact O-CG2 3.28Å; Y221-T225 WeakPolarHBondContact O-CG2 3.25Å; Y221-T225 PolarHBondContact O-N 2.98Å; Y221-T225 PolarHBondContact O-OG1 3.27Å
222	K	92.6	Very high	91.1	Very high	162 Å²	162	82.5 Å²	82.5	70%	0.704	41%	0.407	S	S	*	.	H	α-helix	trans	-63.8	-44.6	-179	-175.2	-177.7	175.1	-173	0	112.7	S220 T225 L226	S220-K222 VanDerWaalsContact C-N 3.32Å; S220-K222 PolarHBondContact O-N 2.92Å; K222-T225 PolarHBondContact O-OG1 2.88Å; K222-T225 VanDerWaalsContact O-OG1 3.09Å; K222-L226 WeakPolarHBondContact O-CB 3.48Å; K222-L226 PolarHBondContact O-N 3.42Å; K222-L226 VanDerWaalsContact O-N 3.14Å
223	D	93.3	Very high	91.3	Very high	88 Å²	88	82.3 Å²	82.3	47%	0.471	41%	0.408	S	S	.	.	H	α-helix	trans	-71.7	-42.6	-177.7	-71.5	-16	0	0	0	111.1	P175 S220 L226 I227	P175-D223 HydrophobicContact CB-CB 4.14Å; P175-D223 HydrophobicContact CG-CB 4.05Å; S220-D223 PolarHBondContact O-N 3.4Å; D223-L226 PolarHBondContact O-N 3.5Å; D223-I227 VanDerWaalsContact O-CG1 3.28Å; D223-I227 WeakPolarHBondContact O-CG1 3.42Å; D223-I227 PolarHBondContact O-N 3.47Å
224	S	95.7	Very high	91.6	Very high	0 Å²	0	83.1 Å²	83.1	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-62.6	-46.3	177.4	-63.3	0	0	0	0	112.1	T173 P175 S220 L226 I227 M228	T173-S224 WeakPolarHBondContact O-CB 3.42Å; T173-S224 PolarHBondContact O-OG 3.49Å; P175-S224 WeakPolarHBondContact CD-OG 3.38Å; P175-S224 WeakPolarHBondContact CG-OG 3.18Å; S220-S224 PolarHBondContact O-N 2.88Å; S220-S224 PolarHBondContact O-OG 3.48Å; S224-L226 VanDerWaalsContact C-N 3.35Å; S224-L226 PolarHBondContact O-N 2.9Å; S224-I227 PolarHBondContact O-N 3.44Å; S224-M228 WeakPolarHBondContact O-CB 3.39Å; S224-M228 VanDerWaalsContact O-CG 3.27Å; S224-M228 WeakPolarHBondContact O-CG 3.41Å; S224-M228 PolarHBondContact O-N 2.78Å
225	T	96	Very high	92	Very high	41 Å²	41	77.2 Å²	77.2	25%	0.252	38%	0.38	S	S	.	.	H	α-helix	trans	-64.7	-37.4	178.8	50.4	0	0	0	0	112.5	L213 Y221 K222 M228 Q229	L213-T225 HydrophobicContact CD1-CG2 4.09Å; L213-T225 HydrophobicContact CD2-CG2 4.23Å; Y221-T225 HydrophobicContact CD1-CG2 4.08Å; Y221-T225 HydrophobicContact CE1-CG2 3.75Å; Y221-T225 HydrophobicContact CE2-CG2 4.32Å; Y221-T225 HydrophobicContact CG-CG2 4.5Å; Y221-T225 WeakPolarHBondContact O-CB 3.49Å; Y221-T225 VanDerWaalsContact O-CG2 3.28Å; Y221-T225 WeakPolarHBondContact O-CG2 3.25Å; Y221-T225 PolarHBondContact O-N 2.98Å; Y221-T225 PolarHBondContact O-OG1 3.27Å; K222-T225 PolarHBondContact O-OG1 2.88Å; K222-T225 VanDerWaalsContact O-OG1 3.09Å; T225-M228 PolarHBondContact O-N 2.74Å; T225-Q229 WeakPolarHBondContact O-CB 3.21Å; T225-Q229 PolarHBondContact O-N 2.9Å
226	L	96.6	Very high	92.4	Very high	104 Å²	104	74.1 Å²	74.1	55%	0.545	37%	0.372	S	S	.	.	H	α-helix	trans	-61.5	-43.7	173	178.6	62.1	0	0	0	111.7	K222 D223 S224 Q229 L230	K222-L226 WeakPolarHBondContact O-CB 3.48Å; K222-L226 PolarHBondContact O-N 3.42Å; K222-L226 VanDerWaalsContact O-N 3.14Å; D223-L226 PolarHBondContact O-N 3.5Å; S224-L226 VanDerWaalsContact C-N 3.35Å; S224-L226 PolarHBondContact O-N 2.9Å; L226-Q229 WeakPolarHBondContact O-CB 3.16Å; L226-Q229 PolarHBondContact O-N 3.44Å; L226-L230 WeakPolarHBondContact O-CG 3.07Å; L226-L230 PolarHBondContact O-N 3.38Å; L226-L230 VanDerWaalsContact O-N 3.16Å
227	I	97.9	Very high	92.9	Very high	28 Å²	28	76.8 Å²	76.8	14%	0.144	39%	0.386	C	S	.	.	H	α-helix	trans	-69.6	-40.1	179.2	-61.7	164.6	0	0	0	111.2	P175 L178 L182 D223 S224 Q229 L230 L231	P175-I227 HydrophobicContact CB-CD1 4.09Å; P175-I227 VanDerWaalsContact O-CD1 3.29Å; P175-I227 WeakPolarHBondContact O-CD1 3.39Å; L178-I227 HydrophobicContact CB-CB 4.18Å; L178-I227 HydrophobicContact CB-CD1 4.42Å; L178-I227 HydrophobicContact CB-CG2 3.64Å; L182-I227 HydrophobicContact CB-CG2 4.26Å; L182-I227 HydrophobicContact CD2-CG2 4.15Å; D223-I227 VanDerWaalsContact O-CG1 3.28Å; D223-I227 WeakPolarHBondContact O-CG1 3.42Å; D223-I227 PolarHBondContact O-N 3.47Å; S224-I227 PolarHBondContact O-N 3.44Å; I227-Q229 VanDerWaalsContact C-N 3.28Å; I227-Q229 PolarHBondContact O-N 2.98Å; I227-L230 WeakPolarHBondContact O-CB 3.4Å; I227-L230 PolarHBondContact O-N 3.01Å; I227-L230 VanDerWaalsContact O-N 3.17Å; I227-L231 PolarHBondContact O-N 3.46Å
228	M	97.9	Very high	93.7	Very high	6 Å²	6	69.4 Å²	69.4	3%	0.03	35%	0.351	C	S	.	.	H	α-helix	trans	-61	-37.9	174.4	-71.3	174	71.2	0	0	112	L178 F206 A209 I210 L213 S224 T225 L231 R232	L178-M228 HydrophobicContact CD1-CG 3.95Å; L178-M228 HydrophobicContact CD1-SD 4.42Å; L178-M228 HydrophobicContact CD2-CG 4.15Å; F206-M228 HydrophobicContact CD2-CB 4.08Å; F206-M228 HydrophobicContact CD2-CE 4.35Å; F206-M228 WeakPolarHBondContact CD2-O 3.31Å; F206-M228 HydrophobicContact CE2-CB 4.05Å; F206-M228 HydrophobicContact CE2-CE 4.23Å; F206-M228 WeakPolarHBondContact CE2-O 3.25Å; A209-M228 HydrophobicContact CB-CE 3.96Å; A209-M228 HydrophobicContact CB-CG 4.37Å; A209-M228 HydrophobicContact CB-SD 3.88Å; I210-M228 HydrophobicContact CB-CE 3.84Å; I210-M228 HydrophobicContact CD1-CE 3.91Å; I210-M228 HydrophobicContact CG1-CE 4.49Å; L213-M228 HydrophobicContact CD1-SD 4.11Å; L213-M228 HydrophobicContact CD2-CE 4.19Å; L213-M228 HydrophobicContact CD2-SD 4.28Å; S224-M228 WeakPolarHBondContact O-CB 3.39Å; S224-M228 VanDerWaalsContact O-CG 3.27Å; S224-M228 WeakPolarHBondContact O-CG 3.41Å; S224-M228 PolarHBondContact O-N 2.78Å; T225-M228 PolarHBondContact O-N 2.74Å; M228-L231 WeakPolarHBondContact O-CB 3.32Å; M228-L231 PolarHBondContact O-N 2.87Å; M228-R232 PolarHBondContact O-N 3.1Å
229	Q	97.9	Very high	94.2	Very high	62 Å²	62	64.6 Å²	64.6	29%	0.29	33%	0.333	S	S	.	.	H	α-helix	trans	-60.3	-46.2	173.2	177.9	55.1	38	0	0	111.4	T225 L226 I227 L231 R232 D233	T225-Q229 WeakPolarHBondContact O-CB 3.21Å; T225-Q229 PolarHBondContact O-N 2.9Å; L226-Q229 WeakPolarHBondContact O-CB 3.16Å; L226-Q229 PolarHBondContact O-N 3.44Å; I227-Q229 VanDerWaalsContact C-N 3.28Å; I227-Q229 PolarHBondContact O-N 2.98Å; Q229-L231 PolarHBondContact O-N 2.78Å; Q229-R232 WeakPolarHBondContact O-CB 3.43Å; Q229-R232 PolarHBondContact O-N 2.73Å; Q229-D233 PolarHBondContact NE2-OD1 2.88Å; Q229-D233 PolarHBondContact NE2-OD2 2.99Å; Q229-D233 PolarHBondContact O-N 2.88Å
230	L	98.4	Very high	94.4	Very high	75 Å²	75	60.3 Å²	60.3	39%	0.393	31%	0.314	S	S	.	.	H	α-helix	trans	-63.1	-38.9	177	-65.4	171.9	0	0	0	112.6	L182 L226 I227 D233 N234	L182-L230 HydrophobicContact CD1-CB 4.08Å; L182-L230 HydrophobicContact CD2-CB 3.89Å; L182-L230 HydrophobicContact CD2-CD1 3.87Å; L226-L230 WeakPolarHBondContact O-CG 3.07Å; L226-L230 PolarHBondContact O-N 3.38Å; L226-L230 VanDerWaalsContact O-N 3.16Å; I227-L230 WeakPolarHBondContact O-CB 3.4Å; I227-L230 PolarHBondContact O-N 3.01Å; I227-L230 VanDerWaalsContact O-N 3.17Å; L230-D233 PolarHBondContact O-N 3.37Å; L230-N234 PolarHBondContact O-N 3.11Å
231	L	98.4	Very high	94.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.9	-46.2	173.7	-77.4	168	0	0	0	111.5	L178 L182 A202 A205 F206 I227 M228 Q229 D233 N234 L235	L178-L231 HydrophobicContact CD2-CD1 4.12Å; L182-L231 HydrophobicContact CB-CD2 3.92Å; L182-L231 HydrophobicContact CB-CG 4.24Å; L182-L231 HydrophobicContact CD1-CD2 3.98Å; L182-L231 HydrophobicContact CD1-CG 4.2Å; A202-L231 HydrophobicContact CB-CD2 3.85Å; A205-L231 HydrophobicContact CB-CD1 4.34Å; F206-L231 HydrophobicContact CD2-CB 4.48Å; I227-L231 PolarHBondContact O-N 3.46Å; M228-L231 WeakPolarHBondContact O-CB 3.32Å; M228-L231 PolarHBondContact O-N 2.87Å; Q229-L231 PolarHBondContact O-N 2.78Å; L231-D233 VanDerWaalsContact C-N 3.33Å; L231-D233 PolarHBondContact O-N 3.4Å; L231-N234 PolarHBondContact O-N 2.94Å; L231-L235 WeakPolarHBondContact O-CG 3.31Å; L231-L235 PolarHBondContact O-N 2.75Å
232	R	97.7	Very high	93.3	Very high	120 Å²	120	59.5 Å²	59.5	45%	0.453	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-40.5	177.4	-171.9	-173.7	73.7	-174.9	6.1	112.3	F206 M228 Q229 L235 T236	F206-R232 HydrophobicContact CD2-CB 4.4Å; F206-R232 HydrophobicContact CE2-CB 4.03Å; M228-R232 PolarHBondContact O-N 3.1Å; Q229-R232 WeakPolarHBondContact O-CB 3.43Å; Q229-R232 PolarHBondContact O-N 2.73Å; R232-L235 PolarHBondContact O-N 3.26Å; R232-T236 PolarHBondContact O-N 3.43Å; R232-T236 PolarHBondContact O-OG1 2.97Å
233	D	97.7	Very high	92	Very high	69 Å²	69	56.2 Å²	56.2	37%	0.369	30%	0.304	S	S	.	.	H	α-helix	trans	-66.9	-41	-179.8	-64.8	-12.8	0	0	0	110.8	Q229 L230 L231 T236 L237	Q229-D233 PolarHBondContact NE2-OD1 2.88Å; Q229-D233 PolarHBondContact NE2-OD2 2.99Å; Q229-D233 PolarHBondContact O-N 2.88Å; L230-D233 PolarHBondContact O-N 3.37Å; L231-D233 VanDerWaalsContact C-N 3.33Å; L231-D233 PolarHBondContact O-N 3.4Å; D233-T236 PolarHBondContact O-N 3.35Å; D233-L237 PolarHBondContact O-N 2.75Å
234	N	96.7	Very high	90.6	Very high	33 Å²	33	55.2 Å²	55.2	18%	0.176	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-45.6	172.1	-78.2	-0.4	0	0	0	112.5	L182 L230 L231 T236 L237 W238	L182-N234 VanDerWaalsContact CD1-ND2 3.33Å; L182-N234 WeakPolarHBondContact CD1-ND2 3.39Å; L230-N234 PolarHBondContact O-N 3.11Å; L231-N234 PolarHBondContact O-N 2.94Å; N234-T236 PolarHBondContact O-N 3.47Å; N234-L237 PolarHBondContact O-N 2.97Å; N234-W238 HydrophobicContact CB-CD2 4.24Å; N234-W238 HydrophobicContact CB-CE3 4.13Å; N234-W238 HydrophobicContact CB-CH2 3.69Å; N234-W238 HydrophobicContact CB-CZ2 3.79Å; N234-W238 HydrophobicContact CB-CZ3 3.86Å; N234-W238 VanDerWaalsContact O-CD2 3.27Å; N234-W238 PolarHBondContact O-N 3.25Å
235	L	96.8	Very high	88.7	Confident	34 Å²	34	62.8 Å²	62.8	18%	0.178	34%	0.343	C	S	.	.	H	α-helix	trans	-58.2	-38.8	176.6	-74.6	169.4	0	0	0	112.1	C199 A202 K203 L231 R232 A239	C199-L235 HydrophobicContact CB-CD2 4.09Å; C199-L235 WeakPolarHBondContact O-CD2 3.44Å; A202-L235 HydrophobicContact CB-CD1 4.46Å; A202-L235 HydrophobicContact CB-CD2 3.89Å; A202-L235 HydrophobicContact CB-CG 4.02Å; K203-L235 HydrophobicContact CB-CD1 4.16Å; K203-L235 HydrophobicContact CB-CD2 4.1Å; L231-L235 WeakPolarHBondContact O-CG 3.31Å; L231-L235 PolarHBondContact O-N 2.75Å; R232-L235 PolarHBondContact O-N 3.26Å; L235-A239 VanDerWaalsContact O-CB 3.23Å; L235-A239 WeakPolarHBondContact O-CB 3.29Å; L235-A239 PolarHBondContact O-N 3.49Å; L235-A239 VanDerWaalsContact O-N 3.07Å
236	T	95.5	Very high	86.3	Confident	91 Å²	91	63.5 Å²	63.5	56%	0.558	36%	0.359	S	S	*	.	H	α-helix	trans	-67.1	-45.3	178.2	-55	0	0	0	0	111.1	R232 D233 N234 S240	R232-T236 PolarHBondContact O-N 3.43Å; R232-T236 PolarHBondContact O-OG1 2.97Å; D233-T236 PolarHBondContact O-N 3.35Å; N234-T236 PolarHBondContact O-N 3.47Å; T236-S240 PolarHBondContact O-N 2.93Å
237	L	93.7	Very high	83.8	Confident	93 Å²	93	65.5 Å²	65.5	49%	0.487	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-50.8	178.1	-178.4	65.5	0	0	0	111.5	D233 N234 A239 S240 D241	D233-L237 PolarHBondContact O-N 2.75Å; N234-L237 PolarHBondContact O-N 2.97Å; L237-A239 VanDerWaalsContact C-N 3.35Å; L237-A239 PolarHBondContact O-N 2.82Å; L237-S240 PolarHBondContact O-N 3.35Å; L237-S240 VanDerWaalsContact O-N 3.16Å; L237-S240 PolarHBondContact O-OG 3.4Å; L237-D241 PolarHBondContact O-N 2.96Å
238	W	94.5	Very high	81	Confident	6 Å²	6	67.1 Å²	67.1	2%	0.023	40%	0.395	C	S	.	.	H	α-helix	trans	-73	-27	-174.8	-56.2	-27	0	0	0	113.4	V186 Y189 A198 A202 N234 S240 D241 Q242	V186-W238 HydrophobicContact CG2-CH2 4.17Å; V186-W238 HydrophobicContact CG2-CZ2 4.09Å; Y189-W238 AromaticContact CD1-CD1 3.99Å; Y189-W238 AromaticContact CD1-CE2 3.9Å; Y189-W238 HydrophobicContact CD1-CZ2 4.3Å; Y189-W238 AromaticContact CD1-NE1 3.38Å; Y189-W238 HydrophobicContact CD2-CB 4.2Å; Y189-W238 AromaticContact CD2-CD1 3.4Å; Y189-W238 AromaticContact CD2-CD2 3.79Å; Y189-W238 HydrophobicContact CD2-CD2 3.79Å; Y189-W238 AromaticContact CD2-CE2 3.78Å; Y189-W238 AromaticContact CD2-CG 3.55Å; Y189-W238 HydrophobicContact CD2-CG 3.55Å; Y189-W238 AromaticContact CD2-NE1 3.52Å; Y189-W238 AromaticContact CE1-CD1 3.75Å; Y189-W238 AromaticContact CE1-NE1 3.47Å; Y189-W238 HydrophobicContact CE2-CB 4Å; Y189-W238 AromaticContact CE2-CD1 3.1Å; Y189-W238 HydrophobicContact CE2-CD2 4.27Å; Y189-W238 AromaticContact CE2-CG 3.54Å; Y189-W238 HydrophobicContact CE2-CG 3.54Å; Y189-W238 AromaticContact CE2-NE1 3.59Å; Y189-W238 AromaticContact CG-CD1 3.83Å; Y189-W238 HydrophobicContact CG-CD2 4.06Å; Y189-W238 AromaticContact CG-CE2 3.57Å; Y189-W238 HydrophobicContact CG-CG 4.19Å; Y189-W238 AromaticContact CG-CZ2 4Å; Y189-W238 HydrophobicContact CG-CZ2 4Å; Y189-W238 AromaticContact CG-NE1 3.41Å; Y189-W238 AromaticContact CZ-CD1 3.3Å; Y189-W238 AromaticContact CZ-NE1 3.56Å; A198-W238 HydrophobicContact CB-CE3 4.09Å; A198-W238 HydrophobicContact CB-CH2 4.36Å; A198-W238 HydrophobicContact CB-CZ3 3.86Å; A202-W238 HydrophobicContact CB-CZ3 4.27Å; N234-W238 HydrophobicContact CB-CD2 4.24Å; N234-W238 HydrophobicContact CB-CE3 4.13Å; N234-W238 HydrophobicContact CB-CH2 3.69Å; N234-W238 HydrophobicContact CB-CZ2 3.79Å; N234-W238 HydrophobicContact CB-CZ3 3.86Å; N234-W238 VanDerWaalsContact O-CD2 3.27Å; N234-W238 PolarHBondContact O-N 3.25Å; W238-S240 VanDerWaalsContact C-N 3.3Å; W238-D241 PolarHBondContact O-N 3.41Å; W238-Q242 WeakPolarHBondContact O-CG 3.4Å; W238-Q242 PolarHBondContact O-N 2.86Å
239	A	86.8	Confident	77.9	Confident	49 Å²	49	74 Å²	74	41%	0.405	43%	0.431	S	S	.	.	H	α-helix	trans	-64.3	-36.5	171.2	0	0	0	0	0	111.8	L235 L237 T243	L235-A239 VanDerWaalsContact O-CB 3.23Å; L235-A239 WeakPolarHBondContact O-CB 3.29Å; L235-A239 PolarHBondContact O-N 3.49Å; L235-A239 VanDerWaalsContact O-N 3.07Å; L237-A239 VanDerWaalsContact C-N 3.35Å; L237-A239 PolarHBondContact O-N 2.82Å; A239-T243 PolarHBondContact O-N 3.23Å; A239-T243 PolarHBondContact O-OG1 3.36Å
240	S	82.9	Confident	74.9	Confident	58 Å²	58	78.4 Å²	78.4	41%	0.406	46%	0.457	S	S	.	.	H	α-helix	trans	-68.8	-33	176.2	58	0	0	0	0	113.4	T236 L237 W238 T243 A244	T236-S240 PolarHBondContact O-N 2.93Å; L237-S240 PolarHBondContact O-N 3.35Å; L237-S240 VanDerWaalsContact O-N 3.16Å; L237-S240 PolarHBondContact O-OG 3.4Å; W238-S240 VanDerWaalsContact C-N 3.3Å; S240-T243 WeakPolarHBondContact CA-OG1 3.04Å; S240-T243 PolarHBondContact O-N 3.48Å; S240-T243 PolarHBondContact O-OG1 2.89Å; S240-A244 PolarHBondContact O-N 3.43Å; S240-A244 VanDerWaalsContact O-N 3.1Å
241	D	80.2	Confident	71.9	Confident	49 Å²	49	84.3 Å²	84.3	26%	0.262	51%	0.505	S	S	.	.	H	α-helix	trans	-68.8	-40.7	176.9	-61.4	-32.1	0	0	0	111.7	Y189 L237 W238 T243 A244 E245	Y189-D241 PolarHBondContact OH-OD2 3.35Å; L237-D241 PolarHBondContact O-N 2.96Å; W238-D241 PolarHBondContact O-N 3.41Å; D241-T243 VanDerWaalsContact C-N 3.27Å; D241-T243 PolarHBondContact O-N 3.5Å; D241-A244 PolarHBondContact O-N 3.25Å; D241-A244 VanDerWaalsContact O-N 3.11Å; D241-E245 PolarHBondContact O-N 3.06Å
242	Q	71.4	Confident	70.5	Confident	82 Å²	82	88.6 Å²	88.6	38%	0.383	53%	0.53	S	S	.	.	H	α-helix	trans	-62.1	-34.4	176.4	-70.3	180	10.3	0	0	112.4	A195 W238 G246	A195-Q242 HydrophobicContact CB-CG 4.48Å; W238-Q242 WeakPolarHBondContact O-CG 3.4Å; W238-Q242 PolarHBondContact O-N 2.86Å; Q242-G246 PolarHBondContact O-N 3.17Å
243	T	66.9	Low	69.1	Low	92 Å²	92	86.9 Å²	86.9	56%	0.564	53%	0.534	S	S	*	.	H	α-helix	trans	-72.2	-35.5	173.7	50.8	0	0	0	0	112.6	A239 S240 D241 G246 D247	A239-T243 PolarHBondContact O-N 3.23Å; A239-T243 PolarHBondContact O-OG1 3.36Å; S240-T243 WeakPolarHBondContact CA-OG1 3.04Å; S240-T243 PolarHBondContact O-N 3.48Å; S240-T243 PolarHBondContact O-OG1 2.89Å; D241-T243 VanDerWaalsContact C-N 3.27Å; D241-T243 PolarHBondContact O-N 3.5Å; T243-G246 PolarHBondContact O-N 2.7Å; T243-D247 PolarHBondContact O-N 3.14Å
244	A	62	Low	67.5	Low	67 Å²	67	87.9 Å²	87.9	55%	0.554	54%	0.543	S	S	*	.	H	α-helix	trans	-72.9	-35.5	179.9	0	0	0	0	0	112.9	S240 D241 G246	S240-A244 PolarHBondContact O-N 3.43Å; S240-A244 VanDerWaalsContact O-N 3.1Å; D241-A244 PolarHBondContact O-N 3.25Å; D241-A244 VanDerWaalsContact O-N 3.11Å; A244-G246 VanDerWaalsContact C-N 3.33Å
245	E	56.2	Low	65.8	Low	159 Å²	159	91.1 Å²	91.1	74%	0.743	57%	0.565	S	S	*	*	H	α-helix	trans	-71.6	-27.6	174	-70	-177.1	171.1	0	0	112.4	D241	D241-E245 PolarHBondContact O-N 3.06Å
246	G	46.8	Very low	63.8	Low	57 Å²	57	94.7 Å²	94.7	59%	0.588	59%	0.589	S	S	*	*	H	α-helix	trans	-71.3	-32.1	176.8	0	0	0	0	0	114.6	Q242 T243 A244 G248	Q242-G246 PolarHBondContact O-N 3.17Å; T243-G246 PolarHBondContact O-N 2.7Å; A244-G246 VanDerWaalsContact C-N 3.33Å; G246-G248 VanDerWaalsContact C-N 3.33Å
247	D	43.7	Very low	61.7	Low	145 Å²	145	94.9 Å²	94.9	78%	0.775	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-0.7	-179.1	-77.5	-15.8	0	0	0	113.5	T243	T243-D247 PolarHBondContact O-N 3.14Å
248	G	38.9	Very low	59.4	Low	63 Å²	63	95.1 Å²	95.1	65%	0.649	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-1.5	-177.6	0	0	0	0	0	116	G246	G246-G248 VanDerWaalsContact C-N 3.33Å
249	N	33.5	Very low	56.8	Low	149 Å²	149	101.9 Å²	101.9	80%	0.797	64%	0.642	S	S	*	*	S	Bend	trans	-120.4	14.3	-171.6	-134.7	28.2	0	0	0	115.5
250	D	33.5	Very low	54.3	Low	156 Å²	156	106.3 Å²	106.3	83%	0.834	66%	0.662	S	S	*	*			trans	-109.3	76.4	168	-87.1	-12.8	0	0	0	110
251	S	35.1	Very low	51.6	Low	199 Å²	199	110.7 Å²	110.7	100%	1.392	69%	0.686	S	S	*	*			trans	-163.5	0	155.8	-77.1	0	0	0	0	111.9

Retrieved 251 of 251 residues in 249 ms (Link to these results)

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