A0A077Z207_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z207, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 241 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	58	Low	80.2	Confident	156 Å²	156	95.6 Å²	95.6	77%	0.768	44%	0.444	S	S	*	.				0	-44.8	0	-155.3	175.6	-77.4	0	0	110.4	Y3 Q4	M1-Y3 VanDerWaalsContact C-N 3.27Å; M1-Y3 PolarHBondContact O-N 3.4Å; M1-Y3 VanDerWaalsContact O-N 3.14Å; M1-Q4 PolarHBondContact O-N 2.84Å
2	E	72.5	Confident	81	Confident	148 Å²	148	89.5 Å²	89.5	69%	0.692	42%	0.416	S	S	*	.	H	α-helix	trans	-46.9	-41.4	176.8	-68.1	171.7	174.5	0	0	115.1	Q4 D5 E6	E2-Q4 VanDerWaalsContact C-N 3.3Å; E2-Q4 PolarHBondContact O-N 3.25Å; E2-D5 PolarHBondContact O-N 3.12Å; E2-D5 VanDerWaalsContact O-N 3.16Å; E2-E6 PolarHBondContact O-N 2.69Å
3	Y	75.8	Confident	81.7	Confident	165 Å²	165	92.2 Å²	92.2	65%	0.647	43%	0.429	S	S	*	.	H	α-helix	trans	-55	-38.9	176.5	179	-104.8	0	0	0	114.6	M1 M7	M1-Y3 VanDerWaalsContact C-N 3.27Å; M1-Y3 PolarHBondContact O-N 3.4Å; M1-Y3 VanDerWaalsContact O-N 3.14Å; Y3-M7 HydrophobicContact CD1-CE 4.1Å; Y3-M7 HydrophobicContact CE1-CE 3.21Å; Y3-M7 HydrophobicContact CE2-CE 4.45Å; Y3-M7 VanDerWaalsContact CZ-CE 3.42Å; Y3-M7 WeakPolarHBondContact O-CB 3.45Å; Y3-M7 PolarHBondContact O-N 2.89Å; Y3-M7 VanDerWaalsContact OH-CE 3.3Å; Y3-M7 WeakPolarHBondContact OH-CE 3.47Å
4	Q	78.1	Confident	82.1	Confident	120 Å²	120	93.4 Å²	93.4	56%	0.561	44%	0.439	S	S	*	.	H	α-helix	trans	-72.2	-34.2	-179.1	-72.9	-179	-21.3	0	0	111.8	M1 E2 M7 C8	M1-Q4 PolarHBondContact O-N 2.84Å; E2-Q4 VanDerWaalsContact C-N 3.3Å; E2-Q4 PolarHBondContact O-N 3.25Å; Q4-M7 PolarHBondContact O-N 2.88Å; Q4-C8 WeakPolarHBondContact O-CB 3.36Å; Q4-C8 PolarHBondContact O-N 3.43Å
5	D	79.3	Confident	82.4	Confident	27 Å²	27	87.7 Å²	87.7	14%	0.144	41%	0.413	C	S	.	.	H	α-helix	trans	-70.2	-45.4	176.1	-73.9	69	0	0	0	111.2	E2 M7 C8 E9 R52	E2-D5 PolarHBondContact O-N 3.12Å; E2-D5 VanDerWaalsContact O-N 3.16Å; D5-M7 PolarHBondContact O-N 3.16Å; D5-C8 PolarHBondContact O-N 3.49Å; D5-C8 VanDerWaalsContact O-N 3.17Å; D5-E9 PolarHBondContact O-N 3.21Å; D5-R52 IonicContact OD1-CZ 3.39Å; D5-R52 IonicContact OD1-NE 2.65Å; D5-R52 IonicContact OD1-NH2 3.25Å; D5-R52 PolarHBondContact OD1-NH2 3.32Å; D5-R52 IonicContact OD2-CZ 3.43Å; D5-R52 IonicContact OD2-NE 3.44Å; D5-R52 PolarHBondContact OD2-NE 2.85Å; D5-R52 VanDerWaalsContact OD2-NE 3.17Å; D5-R52 IonicContact OD2-NH1 2.81Å; D5-R52 PolarHBondContact OD2-NH1 2.82Å; D5-R52 VanDerWaalsContact OD2-NH1 3.12Å; D5-R52 IonicContact OD2-NH2 3.49Å; D5-R52 PolarHBondContact OD2-NH2 3.15Å
6	E	84.2	Confident	82.7	Confident	98 Å²	98	89.8 Å²	89.8	46%	0.458	42%	0.421	S	S	.	.	H	α-helix	trans	-59	-39.1	173.8	-72.3	-177.9	-157.4	0	0	111.8	E2 K10	E2-E6 PolarHBondContact O-N 2.69Å; E6-K10 WeakPolarHBondContact O-CB 3.49Å; E6-K10 VanDerWaalsContact O-CG 3.27Å; E6-K10 WeakPolarHBondContact O-CG 3.43Å; E6-K10 PolarHBondContact O-N 2.97Å; E6-K10 IonicContact OE2-NZ 3.52Å
7	M	83.8	Confident	82.7	Confident	79 Å²	79	87.8 Å²	87.8	39%	0.389	42%	0.424	S	S	.	.	H	α-helix	trans	-65.4	-44.9	175.8	-174.7	-173.4	-62.6	0	0	111.6	Y3 Q4 D5 E9 K10 L11	Y3-M7 HydrophobicContact CD1-CE 4.1Å; Y3-M7 HydrophobicContact CE1-CE 3.21Å; Y3-M7 HydrophobicContact CE2-CE 4.45Å; Y3-M7 VanDerWaalsContact CZ-CE 3.42Å; Y3-M7 WeakPolarHBondContact O-CB 3.45Å; Y3-M7 PolarHBondContact O-N 2.89Å; Y3-M7 VanDerWaalsContact OH-CE 3.3Å; Y3-M7 WeakPolarHBondContact OH-CE 3.47Å; Q4-M7 PolarHBondContact O-N 2.88Å; D5-M7 PolarHBondContact O-N 3.16Å; M7-E9 VanDerWaalsContact C-N 3.31Å; M7-E9 PolarHBondContact O-N 3.38Å; M7-K10 PolarHBondContact O-N 3.02Å; M7-L11 HydrophobicContact CG-CD1 4.13Å; M7-L11 WeakPolarHBondContact O-CB 3.31Å; M7-L11 VanDerWaalsContact O-CG 3.31Å; M7-L11 WeakPolarHBondContact O-CG 3.44Å; M7-L11 PolarHBondContact O-N 3.38Å
8	C	84.3	Confident	82.9	Confident	11 Å²	11	89.9 Å²	89.9	7%	0.074	43%	0.431	C	S	.	.	H	α-helix	trans	-60.6	-43.4	177.8	-170	0	0	0	0	111	Q4 D5 L11 I12	Q4-C8 WeakPolarHBondContact O-CB 3.36Å; Q4-C8 PolarHBondContact O-N 3.43Å; D5-C8 PolarHBondContact O-N 3.49Å; D5-C8 VanDerWaalsContact O-N 3.17Å; C8-L11 PolarHBondContact O-N 2.92Å; C8-I12 VanDerWaalsContact O-CG1 3.3Å; C8-I12 WeakPolarHBondContact O-CG1 3.32Å; C8-I12 PolarHBondContact O-N 2.89Å
9	E	86.5	Confident	83	Confident	81 Å²	81	86.1 Å²	86.1	38%	0.379	41%	0.412	S	S	.	.	H	α-helix	trans	-62.1	-47.9	176.7	-173.8	147.3	-123.6	0	0	112.4	D5 M7 L11 I12 E13 R45	D5-E9 PolarHBondContact O-N 3.21Å; M7-E9 VanDerWaalsContact C-N 3.31Å; M7-E9 PolarHBondContact O-N 3.38Å; E9-L11 VanDerWaalsContact C-N 3.29Å; E9-L11 PolarHBondContact O-N 3.38Å; E9-I12 WeakPolarHBondContact O-CB 3.3Å; E9-I12 PolarHBondContact O-N 3.18Å; E9-I12 VanDerWaalsContact O-N 3.12Å; E9-E13 PolarHBondContact O-N 2.88Å; E9-R45 IonicContact OE1-CZ 3.6Å; E9-R45 VanDerWaalsContact OE1-CZ 3.27Å; E9-R45 IonicContact OE1-NH1 2.76Å; E9-R45 PolarHBondContact OE1-NH1 2.94Å; E9-R45 IonicContact OE1-NH2 3.52Å; E9-R45 PolarHBondContact OE1-NH2 3.39Å; E9-R45 IonicContact OE2-NH2 3.27Å
10	K	90.6	Very high	83	Confident	117 Å²	117	85.5 Å²	85.5	51%	0.509	41%	0.414	S	S	.	.	H	α-helix	trans	-59.9	-38.1	175.2	-73	169.8	-176	166	0	112.4	E6 M7 E13 L14	E6-K10 WeakPolarHBondContact O-CB 3.49Å; E6-K10 VanDerWaalsContact O-CG 3.27Å; E6-K10 WeakPolarHBondContact O-CG 3.43Å; E6-K10 PolarHBondContact O-N 2.97Å; E6-K10 IonicContact OE2-NZ 3.52Å; M7-K10 PolarHBondContact O-N 3.02Å; K10-E13 PolarHBondContact O-N 3.16Å; K10-L14 WeakPolarHBondContact O-CB 3.35Å; K10-L14 VanDerWaalsContact O-CG 3.27Å; K10-L14 WeakPolarHBondContact O-CG 3.44Å; K10-L14 PolarHBondContact O-N 3.41Å
11	L	89.4	Confident	82.8	Confident	50 Å²	50	84.9 Å²	84.9	26%	0.262	42%	0.419	S	S	.	.	H	α-helix	trans	-67.8	-38.3	176.3	-74.3	170.9	0	0	0	112	M7 C8 E9 L14 S15 L41 F234	M7-L11 HydrophobicContact CG-CD1 4.13Å; M7-L11 WeakPolarHBondContact O-CB 3.31Å; M7-L11 VanDerWaalsContact O-CG 3.31Å; M7-L11 WeakPolarHBondContact O-CG 3.44Å; M7-L11 PolarHBondContact O-N 3.38Å; C8-L11 PolarHBondContact O-N 2.92Å; E9-L11 VanDerWaalsContact C-N 3.29Å; E9-L11 PolarHBondContact O-N 3.38Å; L11-L14 PolarHBondContact O-N 3.49Å; L11-S15 WeakPolarHBondContact O-CB 3.37Å; L11-S15 PolarHBondContact O-N 3.17Å; L11-S15 PolarHBondContact O-OG 3.46Å; L11-L41 HydrophobicContact CB-CD1 3.79Å; L11-L41 HydrophobicContact CB-CD2 3.91Å; L11-L41 HydrophobicContact CD1-CD2 4.09Å; L11-F234 HydrophobicContact CD1-CD1 4.31Å; L11-F234 HydrophobicContact CD1-CE1 3.75Å; L11-F234 HydrophobicContact CD1-CZ 4.5Å
12	I	89	Confident	83.6	Confident	22 Å²	22	77.5 Å²	77.5	11%	0.113	38%	0.383	C	S	.	.	H	α-helix	trans	-60.9	-48.2	174.5	-70	167.1	0	0	0	109.7	C8 E9 L14 S15 F16 F38 L41 R45	C8-I12 VanDerWaalsContact O-CG1 3.3Å; C8-I12 WeakPolarHBondContact O-CG1 3.32Å; C8-I12 PolarHBondContact O-N 2.89Å; E9-I12 WeakPolarHBondContact O-CB 3.3Å; E9-I12 PolarHBondContact O-N 3.18Å; E9-I12 VanDerWaalsContact O-N 3.12Å; I12-L14 PolarHBondContact O-N 3.34Å; I12-S15 WeakPolarHBondContact CA-OG 3.09Å; I12-S15 PolarHBondContact O-N 3.21Å; I12-S15 PolarHBondContact O-OG 3.33Å; I12-F16 PolarHBondContact O-N 2.97Å; I12-F38 HydrophobicContact CG2-CD2 4.25Å; I12-F38 HydrophobicContact CG2-CE2 3.84Å; I12-L41 HydrophobicContact CD1-CB 4.38Å; I12-L41 HydrophobicContact CG1-CB 3.62Å; I12-L41 HydrophobicContact CG1-CD1 4.4Å; I12-R45 HydrophobicContact CD1-CB 4.15Å
13	E	91.1	Very high	83.4	Confident	124 Å²	124	77.8 Å²	77.8	58%	0.579	38%	0.381	S	S	*	.	H	α-helix	trans	-59	-47.5	177.7	-69.5	175.1	179.4	0	0	112.2	E9 K10 S15 F16 A17	E9-E13 PolarHBondContact O-N 2.88Å; K10-E13 PolarHBondContact O-N 3.16Å; E13-S15 VanDerWaalsContact C-N 3.33Å; E13-S15 PolarHBondContact O-N 3.33Å; E13-F16 PolarHBondContact O-N 3.41Å; E13-A17 PolarHBondContact O-N 3.01Å
14	L	87.4	Confident	82.9	Confident	110 Å²	110	76.8 Å²	76.8	58%	0.576	39%	0.387	S	S	*	.	H	α-helix	trans	-61.9	-40.1	176.7	-72.9	171.3	0	0	0	112.1	K10 L11 I12 F16 A17 K18	K10-L14 WeakPolarHBondContact O-CB 3.35Å; K10-L14 VanDerWaalsContact O-CG 3.27Å; K10-L14 WeakPolarHBondContact O-CG 3.44Å; K10-L14 PolarHBondContact O-N 3.41Å; L11-L14 PolarHBondContact O-N 3.49Å; I12-L14 PolarHBondContact O-N 3.34Å; L14-F16 VanDerWaalsContact C-N 3.35Å; L14-A17 PolarHBondContact O-N 3.21Å; L14-K18 PolarHBondContact O-N 2.92Å
15	S	86.6	Confident	82.4	Confident	7 Å²	7	75.5 Å²	75.5	5%	0.049	38%	0.381	C	S	.	.	H	α-helix	trans	-67	-36.4	177.6	70.3	0	0	0	0	111.9	L11 I12 E13 K18 I19 F38	L11-S15 WeakPolarHBondContact O-CB 3.37Å; L11-S15 PolarHBondContact O-N 3.17Å; L11-S15 PolarHBondContact O-OG 3.46Å; I12-S15 WeakPolarHBondContact CA-OG 3.09Å; I12-S15 PolarHBondContact O-N 3.21Å; I12-S15 PolarHBondContact O-OG 3.33Å; E13-S15 VanDerWaalsContact C-N 3.33Å; E13-S15 PolarHBondContact O-N 3.33Å; S15-K18 PolarHBondContact O-N 3.44Å; S15-I19 VanDerWaalsContact O-CG1 3.27Å; S15-I19 WeakPolarHBondContact O-CG1 3.33Å; S15-I19 PolarHBondContact O-N 3.38Å; S15-F38 WeakPolarHBondContact OG-CD2 3.38Å
16	F	86.2	Confident	81.7	Confident	121 Å²	121	82.1 Å²	82.1	53%	0.531	40%	0.404	S	S	.	.	H	α-helix	trans	-64.1	-44.9	173.5	-170	-100.1	0	0	0	111.6	I12 E13 L14 K18 I19 V20 F38	I12-F16 PolarHBondContact O-N 2.97Å; E13-F16 PolarHBondContact O-N 3.41Å; L14-F16 VanDerWaalsContact C-N 3.35Å; F16-K18 VanDerWaalsContact C-N 3.3Å; F16-K18 PolarHBondContact O-N 3.25Å; F16-I19 PolarHBondContact O-N 2.8Å; F16-V20 HydrophobicContact CD1-CG2 4.16Å; F16-V20 HydrophobicContact CE1-CG2 3.85Å; F16-V20 HydrophobicContact CZ-CG2 4.17Å; F16-V20 WeakPolarHBondContact O-CG2 3.42Å; F16-V20 PolarHBondContact O-N 2.76Å; F16-F38 HydrophobicContact CD2-CE2 4.5Å
17	A	84	Confident	80.7	Confident	57 Å²	57	80.2 Å²	80.2	47%	0.471	41%	0.411	S	S	.	.	H	α-helix	trans	-57.9	-43.2	174.9	0	0	0	0	0	111.8	E13 L14 V20 S21	E13-A17 PolarHBondContact O-N 3.01Å; L14-A17 PolarHBondContact O-N 3.21Å; A17-V20 PolarHBondContact O-N 3.43Å; A17-S21 WeakPolarHBondContact O-CB 3.47Å; A17-S21 PolarHBondContact O-N 3.14Å; A17-S21 PolarHBondContact O-OG 3.35Å
18	K	85.9	Confident	80.3	Confident	126 Å²	126	77.5 Å²	77.5	55%	0.548	40%	0.403	S	S	.	.	H	α-helix	trans	-64.1	-41.3	175.1	-80.3	-172.5	166	-171	0	113.4	L14 S15 F16 V20 S21 S22	L14-K18 PolarHBondContact O-N 2.92Å; S15-K18 PolarHBondContact O-N 3.44Å; F16-K18 VanDerWaalsContact C-N 3.3Å; F16-K18 PolarHBondContact O-N 3.25Å; K18-V20 VanDerWaalsContact C-N 3.33Å; K18-V20 PolarHBondContact O-N 3.34Å; K18-S21 WeakPolarHBondContact CA-OG 3.37Å; K18-S21 PolarHBondContact O-N 3Å; K18-S21 PolarHBondContact O-OG 3.25Å; K18-S21 VanDerWaalsContact O-OG 3.05Å; K18-S22 WeakPolarHBondContact O-CB 3.45Å; K18-S22 PolarHBondContact O-N 3.02Å; K18-S22 PolarHBondContact O-OG 3.44Å
19	I	85.1	Confident	80	Confident	17 Å²	17	78.3 Å²	78.3	9%	0.087	41%	0.411	C	S	.	.	H	α-helix	trans	-59.2	-49	175.6	-72.2	164.8	0	0	0	109.5	S15 F16 S21 S22 K23 L31 N34 L35 F38	S15-I19 VanDerWaalsContact O-CG1 3.27Å; S15-I19 WeakPolarHBondContact O-CG1 3.33Å; S15-I19 PolarHBondContact O-N 3.38Å; F16-I19 PolarHBondContact O-N 2.8Å; I19-S21 PolarHBondContact O-N 3.05Å; I19-S22 PolarHBondContact O-N 3.44Å; I19-S22 PolarHBondContact O-OG 3.48Å; I19-S22 VanDerWaalsContact O-OG 3.05Å; I19-K23 PolarHBondContact O-N 3.33Å; I19-L31 HydrophobicContact CB-CD1 4.45Å; I19-L31 HydrophobicContact CG2-CD1 3.73Å; I19-N34 HydrophobicContact CG1-CB 3.63Å; I19-L35 HydrophobicContact CD1-CD2 3.93Å; I19-L35 HydrophobicContact CD1-CG 4.45Å; I19-L35 HydrophobicContact CG1-CD2 4.42Å; I19-L35 HydrophobicContact CG2-CD2 4.28Å; I19-F38 HydrophobicContact CD1-CB 3.7Å; I19-F38 HydrophobicContact CD1-CD2 4.36Å; I19-F38 HydrophobicContact CD1-CG 3.98Å
20	V	81.4	Confident	79.6	Confident	73 Å²	73	76.3 Å²	76.3	44%	0.442	41%	0.405	S	S	.	.	H	α-helix	trans	-62.3	-42.4	179.6	175.1	0	0	0	0	111.2	F16 A17 K18	F16-V20 HydrophobicContact CD1-CG2 4.16Å; F16-V20 HydrophobicContact CE1-CG2 3.85Å; F16-V20 HydrophobicContact CZ-CG2 4.17Å; F16-V20 WeakPolarHBondContact O-CG2 3.42Å; F16-V20 PolarHBondContact O-N 2.76Å; A17-V20 PolarHBondContact O-N 3.43Å; K18-V20 VanDerWaalsContact C-N 3.33Å; K18-V20 PolarHBondContact O-N 3.34Å
21	S	79.6	Confident	79.2	Confident	74 Å²	74	72.9 Å²	72.9	52%	0.517	39%	0.392	S	S	.	.	H	α-helix	trans	-72.2	-26.6	178.8	71.3	0	0	0	0	113.6	A17 K18 I19 N24	A17-S21 WeakPolarHBondContact O-CB 3.47Å; A17-S21 PolarHBondContact O-N 3.14Å; A17-S21 PolarHBondContact O-OG 3.35Å; K18-S21 WeakPolarHBondContact CA-OG 3.37Å; K18-S21 PolarHBondContact O-N 3Å; K18-S21 PolarHBondContact O-OG 3.25Å; K18-S21 VanDerWaalsContact O-OG 3.05Å; I19-S21 PolarHBondContact O-N 3.05Å; S21-N24 PolarHBondContact O-OD1 2.87Å
22	S	74.7	Confident	78.8	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.007	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-86.3	-0.4	-178.2	66.6	0	0	0	0	114.5	K18 I19 N24 E25 N34	K18-S22 WeakPolarHBondContact O-CB 3.45Å; K18-S22 PolarHBondContact O-N 3.02Å; K18-S22 PolarHBondContact O-OG 3.44Å; I19-S22 PolarHBondContact O-N 3.44Å; I19-S22 PolarHBondContact O-OG 3.48Å; I19-S22 VanDerWaalsContact O-OG 3.05Å; S22-N24 PolarHBondContact O-N 3.41Å; S22-E25 WeakPolarHBondContact O-CB 3.44Å; S22-E25 PolarHBondContact O-N 3.48Å; S22-N34 PolarHBondContact OG-ND2 3.16Å
23	K	68.4	Low	78.6	Confident	153 Å²	153	80.1 Å²	80.1	67%	0.665	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-58.3	-30.7	-177.6	-81	-175.2	170	-177.5	0	114	I19	I19-K23 PolarHBondContact O-N 3.33Å
24	N	65.6	Low	78.2	Confident	145 Å²	145	74.9 Å²	74.9	78%	0.775	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-98.3	3.9	-179	51.5	7.1	0	0	0	112.8	S21 S22	S21-N24 PolarHBondContact O-OD1 2.87Å; S22-N24 PolarHBondContact O-N 3.41Å
25	E	66.6	Low	78.2	Confident	93 Å²	93	73.2 Å²	73.2	44%	0.435	39%	0.386	S	S	.	.	S	Bend	trans	-74.1	134.6	176.5	-73	-172.4	-154.4	0	0	111.9	S22 G27 G28 C30	S22-E25 WeakPolarHBondContact O-CB 3.44Å; S22-E25 PolarHBondContact O-N 3.48Å; E25-G27 PolarHBondContact O-N 3Å; E25-G28 PolarHBondContact O-N 3.28Å; E25-C30 HydrophobicContact CB-CB 4.49Å; E25-C30 WeakPolarHBondContact OE2-CB 3.39Å; E25-C30 PolarHBondContact OE2-SG 3.02Å
26	R	64.8	Low	78.3	Confident	165 Å²	165	75.8 Å²	75.8	62%	0.623	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	125	-175.3	-166.3	171.5	178.1	-161	-6.4	110.9	T156	R26-T156 PolarHBondContact NH2-OG1 2.84Å
27	G	63.9	Low	78.4	Confident	58 Å²	58	73.5 Å²	73.5	60%	0.598	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	1	173.6	0	0	0	0	0	115.7	E25 A29 R32	E25-G27 PolarHBondContact O-N 3Å; G27-A29 PolarHBondContact O-N 2.92Å; G27-R32 PolarHBondContact O-NH2 3.34Å; G27-R32 VanDerWaalsContact O-NH2 3.1Å
28	G	74.6	Confident	78.6	Confident	22 Å²	22	72.8 Å²	72.8	23%	0.227	38%	0.377	C	S	.	.	S	Bend	trans	56.9	13.3	174.1	0	0	0	0	0	114.6	E25 L31 R32	E25-G28 PolarHBondContact O-N 3.28Å; G28-L31 PolarHBondContact O-N 3.47Å; G28-R32 WeakPolarHBondContact O-CB 3.27Å; G28-R32 VanDerWaalsContact O-CG 3.3Å; G28-R32 WeakPolarHBondContact O-CG 3.31Å; G28-R32 PolarHBondContact O-N 3.38Å; G28-R32 PolarHBondContact O-NE 3.34Å
29	A	77.9	Confident	78.7	Confident	29 Å²	29	72.2 Å²	72.2	24%	0.24	38%	0.377	C	S	.	.	H	α-helix	trans	-70.8	-44.5	-177.6	0	0	0	0	0	110.2	G27 R32 K33 W93	G27-A29 PolarHBondContact O-N 2.92Å; A29-R32 PolarHBondContact O-N 3.2Å; A29-K33 WeakPolarHBondContact O-CG 3.46Å; A29-K33 PolarHBondContact O-N 3.29Å; A29-W93 HydrophobicContact CB-CH2 3.72Å; A29-W93 HydrophobicContact CB-CZ3 4.02Å
30	C	78.7	Confident	79	Confident	38 Å²	38	75.6 Å²	75.6	26%	0.257	39%	0.394	S	S	.	.	H	α-helix	trans	-61.1	-45.6	172.4	-172.9	0	0	0	0	111.2	E25 R32 K33 N34	E25-C30 HydrophobicContact CB-CB 4.49Å; E25-C30 WeakPolarHBondContact OE2-CB 3.39Å; E25-C30 PolarHBondContact OE2-SG 3.02Å; C30-R32 VanDerWaalsContact C-N 3.33Å; C30-R32 PolarHBondContact O-N 3.34Å; C30-K33 PolarHBondContact O-N 3.03Å; C30-N34 WeakPolarHBondContact O-CB 3.3Å; C30-N34 PolarHBondContact O-N 3.34Å; C30-N34 PolarHBondContact O-ND2 3.25Å; C30-N34 VanDerWaalsContact O-ND2 3.16Å; C30-N34 PolarHBondContact SG-ND2 2.95Å
31	L	81.5	Confident	79.3	Confident	45 Å²	45	72.7 Å²	72.7	24%	0.236	38%	0.376	C	S	.	.	H	α-helix	trans	-55.9	-46.9	174.6	-178.9	63	0	0	0	111.7	I19 G28 N34 L35	I19-L31 HydrophobicContact CB-CD1 4.45Å; I19-L31 HydrophobicContact CG2-CD1 3.73Å; G28-L31 PolarHBondContact O-N 3.47Å; L31-N34 PolarHBondContact O-N 3.5Å; L31-L35 HydrophobicContact CD1-CD1 4.39Å; L31-L35 HydrophobicContact CD1-CG 4.44Å; L31-L35 HydrophobicContact CG-CD1 4.11Å; L31-L35 WeakPolarHBondContact O-CB 3.41Å; L31-L35 VanDerWaalsContact O-CG 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.46Å; L31-L35 PolarHBondContact O-N 2.77Å
32	R	81.7	Confident	79.8	Confident	99 Å²	99	73.8 Å²	73.8	37%	0.374	37%	0.373	S	S	.	.	H	α-helix	trans	-61	-47	176.8	-78.9	-178.3	-80.9	-179.7	-4.9	112.4	G27 G28 A29 C30 N34 L35 L36	G27-R32 PolarHBondContact O-NH2 3.34Å; G27-R32 VanDerWaalsContact O-NH2 3.1Å; G28-R32 WeakPolarHBondContact O-CB 3.27Å; G28-R32 VanDerWaalsContact O-CG 3.3Å; G28-R32 WeakPolarHBondContact O-CG 3.31Å; G28-R32 PolarHBondContact O-N 3.38Å; G28-R32 PolarHBondContact O-NE 3.34Å; A29-R32 PolarHBondContact O-N 3.2Å; C30-R32 VanDerWaalsContact C-N 3.33Å; C30-R32 PolarHBondContact O-N 3.34Å; R32-N34 VanDerWaalsContact C-N 3.35Å; R32-N34 PolarHBondContact O-N 3.02Å; R32-L35 PolarHBondContact O-N 2.8Å; R32-L36 WeakPolarHBondContact O-CG 3.46Å; R32-L36 PolarHBondContact O-N 3.17Å
33	K	84.7	Confident	80.3	Confident	126 Å²	126	77.5 Å²	77.5	55%	0.548	39%	0.389	S	S	.	.	H	α-helix	trans	-59.6	-45	175.5	-73	-176.6	177.4	-171.6	0	111.4	A29 C30 L35 L36 I37	A29-K33 WeakPolarHBondContact O-CG 3.46Å; A29-K33 PolarHBondContact O-N 3.29Å; C30-K33 PolarHBondContact O-N 3.03Å; K33-L35 PolarHBondContact O-N 3.12Å; K33-L36 PolarHBondContact O-N 3.36Å; K33-I37 WeakPolarHBondContact O-CG1 3.46Å; K33-I37 PolarHBondContact O-N 3.04Å
34	N	83.8	Confident	81.1	Confident	14 Å²	14	72.3 Å²	72.3	8%	0.075	38%	0.375	C	S	.	.	H	α-helix	trans	-65.3	-38.4	179.4	-67.4	-30.7	0	0	0	112.1	I19 S22 C30 L31 R32 I37 F38	I19-N34 HydrophobicContact CG1-CB 3.63Å; S22-N34 PolarHBondContact OG-ND2 3.16Å; C30-N34 WeakPolarHBondContact O-CB 3.3Å; C30-N34 PolarHBondContact O-N 3.34Å; C30-N34 PolarHBondContact O-ND2 3.25Å; C30-N34 VanDerWaalsContact O-ND2 3.16Å; C30-N34 PolarHBondContact SG-ND2 2.95Å; L31-N34 PolarHBondContact O-N 3.5Å; R32-N34 VanDerWaalsContact C-N 3.35Å; R32-N34 PolarHBondContact O-N 3.02Å; N34-I37 PolarHBondContact O-N 3.26Å; N34-F38 WeakPolarHBondContact O-CB 3.42Å; N34-F38 PolarHBondContact O-N 3.03Å
35	L	87.1	Confident	82.1	Confident	75 Å²	75	69.4 Å²	69.4	39%	0.393	35%	0.353	S	S	.	.	H	α-helix	trans	-63	-41.2	173.6	-74.7	168.1	0	0	0	112.1	I19 L31 R32 K33 F38 Q39	I19-L35 HydrophobicContact CD1-CD2 3.93Å; I19-L35 HydrophobicContact CD1-CG 4.45Å; I19-L35 HydrophobicContact CG1-CD2 4.42Å; I19-L35 HydrophobicContact CG2-CD2 4.28Å; L31-L35 HydrophobicContact CD1-CD1 4.39Å; L31-L35 HydrophobicContact CD1-CG 4.44Å; L31-L35 HydrophobicContact CG-CD1 4.11Å; L31-L35 WeakPolarHBondContact O-CB 3.41Å; L31-L35 VanDerWaalsContact O-CG 3.29Å; L31-L35 WeakPolarHBondContact O-CG 3.46Å; L31-L35 PolarHBondContact O-N 2.77Å; R32-L35 PolarHBondContact O-N 2.8Å; K33-L35 PolarHBondContact O-N 3.12Å; L35-F38 PolarHBondContact O-N 2.9Å; L35-Q39 WeakPolarHBondContact O-CG 3.41Å; L35-Q39 PolarHBondContact O-N 3.36Å
36	L	88.4	Confident	82.9	Confident	60 Å²	60	68.3 Å²	68.3	31%	0.314	36%	0.356	S	S	.	.	H	α-helix	trans	-63.5	-45.2	175.7	-73.2	168.8	0	0	0	111.7	R32 K33 F38 Q39 L40	R32-L36 WeakPolarHBondContact O-CG 3.46Å; R32-L36 PolarHBondContact O-N 3.17Å; K33-L36 PolarHBondContact O-N 3.36Å; L36-F38 VanDerWaalsContact C-N 3.31Å; L36-F38 PolarHBondContact O-N 3.23Å; L36-Q39 PolarHBondContact O-N 3.19Å; L36-L40 WeakPolarHBondContact O-CG 3.4Å; L36-L40 PolarHBondContact O-N 3.39Å
37	I	88	Confident	83.9	Confident	73 Å²	73	62.8 Å²	62.8	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-58.5	-46.3	175.9	-67.4	165.6	0	0	0	110.2	K33 N34 Q39 L40 L41	K33-I37 WeakPolarHBondContact O-CG1 3.46Å; K33-I37 PolarHBondContact O-N 3.04Å; N34-I37 PolarHBondContact O-N 3.26Å; I37-Q39 PolarHBondContact O-N 2.94Å; I37-L40 PolarHBondContact O-N 3.45Å; I37-L41 HydrophobicContact CG2-CD1 3.92Å; I37-L41 HydrophobicContact CG2-CG 4.43Å; I37-L41 WeakPolarHBondContact O-CG 3.27Å; I37-L41 PolarHBondContact O-N 3.32Å
38	F	88.3	Confident	84.8	Confident	42 Å²	42	62 Å²	62	18%	0.184	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-43.6	177.8	175	-99.3	0	0	0	112.5	I12 S15 F16 I19 N34 L35 L36 L40 L41 Q42	I12-F38 HydrophobicContact CG2-CD2 4.25Å; I12-F38 HydrophobicContact CG2-CE2 3.84Å; S15-F38 WeakPolarHBondContact OG-CD2 3.38Å; F16-F38 HydrophobicContact CD2-CE2 4.5Å; I19-F38 HydrophobicContact CD1-CB 3.7Å; I19-F38 HydrophobicContact CD1-CD2 4.36Å; I19-F38 HydrophobicContact CD1-CG 3.98Å; N34-F38 WeakPolarHBondContact O-CB 3.42Å; N34-F38 PolarHBondContact O-N 3.03Å; L35-F38 PolarHBondContact O-N 2.9Å; L36-F38 VanDerWaalsContact C-N 3.31Å; L36-F38 PolarHBondContact O-N 3.23Å; F38-L40 PolarHBondContact O-N 2.96Å; F38-L41 PolarHBondContact O-N 3.18Å; F38-Q42 HydrophobicContact CD1-CG 4.47Å; F38-Q42 HydrophobicContact CE1-CG 4.13Å; F38-Q42 HydrophobicContact CE2-CG 4.42Å; F38-Q42 HydrophobicContact CZ-CG 4.15Å; F38-Q42 PolarHBondContact O-N 3.44Å
39	Q	88.8	Confident	85.2	Confident	115 Å²	115	65.3 Å²	65.3	54%	0.537	33%	0.327	S	S	.	.	H	α-helix	trans	-62	-41.8	176.2	-75.3	177.3	-20.1	0	0	112.4	L35 L36 I37 K43	L35-Q39 WeakPolarHBondContact O-CG 3.41Å; L35-Q39 PolarHBondContact O-N 3.36Å; L36-Q39 PolarHBondContact O-N 3.19Å; I37-Q39 PolarHBondContact O-N 2.94Å; Q39-K43 WeakPolarHBondContact O-CB 3.46Å; Q39-K43 PolarHBondContact O-N 2.65Å
40	L	89.5	Confident	85.6	Confident	88 Å²	88	67.9 Å²	67.9	46%	0.461	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-43.8	176	-74.3	169.2	0	0	0	111.6	L36 I37 F38 K43 A44 L84	L36-L40 WeakPolarHBondContact O-CG 3.4Å; L36-L40 PolarHBondContact O-N 3.39Å; I37-L40 PolarHBondContact O-N 3.45Å; F38-L40 PolarHBondContact O-N 2.96Å; L40-K43 PolarHBondContact O-N 3.15Å; L40-A44 WeakPolarHBondContact O-CB 3.33Å; L40-A44 PolarHBondContact O-N 3.25Å; L40-L84 HydrophobicContact CD2-CD1 3.45Å; L40-L84 VanDerWaalsContact CD2-CD1 3.45Å; L40-L84 HydrophobicContact CG-CD1 4.5Å
41	L	89.4	Confident	85.6	Confident	12 Å²	12	70.5 Å²	70.5	6%	0.063	34%	0.34	C	S	.	.	H	α-helix	trans	-66.5	-44	178.4	-70.2	169.8	0	0	0	112.4	L11 I12 I37 F38 K43 A44 R45 F234	L11-L41 HydrophobicContact CB-CD1 3.79Å; L11-L41 HydrophobicContact CB-CD2 3.91Å; L11-L41 HydrophobicContact CD1-CD2 4.09Å; I12-L41 HydrophobicContact CD1-CB 4.38Å; I12-L41 HydrophobicContact CG1-CB 3.62Å; I12-L41 HydrophobicContact CG1-CD1 4.4Å; I37-L41 HydrophobicContact CG2-CD1 3.92Å; I37-L41 HydrophobicContact CG2-CG 4.43Å; I37-L41 WeakPolarHBondContact O-CG 3.27Å; I37-L41 PolarHBondContact O-N 3.32Å; F38-L41 PolarHBondContact O-N 3.18Å; L41-K43 VanDerWaalsContact C-N 3.26Å; L41-K43 PolarHBondContact O-N 2.88Å; L41-A44 PolarHBondContact O-N 2.81Å; L41-R45 PolarHBondContact O-N 2.91Å; L41-F234 HydrophobicContact CD2-CZ 4.2Å
42	Q	88.7	Confident	85.6	Confident	97 Å²	97	72.7 Å²	72.7	45%	0.453	35%	0.346	S	S	.	.	H	α-helix	trans	-57.8	-42.2	174.1	-80.2	-151.6	9.1	0	0	111.7	F38 R45 S46	F38-Q42 HydrophobicContact CD1-CG 4.47Å; F38-Q42 HydrophobicContact CE1-CG 4.13Å; F38-Q42 HydrophobicContact CE2-CG 4.42Å; F38-Q42 HydrophobicContact CZ-CG 4.15Å; F38-Q42 PolarHBondContact O-N 3.44Å; Q42-R45 WeakPolarHBondContact O-CB 3.46Å; Q42-R45 PolarHBondContact O-N 3.29Å; Q42-S46 PolarHBondContact O-N 3.09Å; Q42-S46 PolarHBondContact O-OG 3.39Å
43	K	86	Confident	85.5	Confident	79 Å²	79	74.5 Å²	74.5	34%	0.343	36%	0.358	S	S	.	.	H	α-helix	trans	-67.1	-42.3	178	-174.4	177.4	175.1	-173.5	0	112.2	Q39 L40 L41 R45 S46 E47 A82 L84	Q39-K43 WeakPolarHBondContact O-CB 3.46Å; Q39-K43 PolarHBondContact O-N 2.65Å; L40-K43 PolarHBondContact O-N 3.15Å; L41-K43 VanDerWaalsContact C-N 3.26Å; L41-K43 PolarHBondContact O-N 2.88Å; K43-R45 VanDerWaalsContact C-N 3.26Å; K43-R45 PolarHBondContact O-N 3.31Å; K43-S46 PolarHBondContact O-N 2.75Å; K43-E47 WeakPolarHBondContact O-CB 3.35Å; K43-E47 PolarHBondContact O-N 2.91Å; K43-A82 PolarHBondContact NZ-O 2.74Å; K43-L84 HydrophobicContact CD-CD1 4.49Å
44	A	84.8	Confident	85	Confident	44 Å²	44	73.7 Å²	73.7	36%	0.364	35%	0.352	S	S	.	.	H	α-helix	trans	-57.6	-41.3	174	0	0	0	0	0	111.2	L40 L41 E47 Q48	L40-A44 WeakPolarHBondContact O-CB 3.33Å; L40-A44 PolarHBondContact O-N 3.25Å; L41-A44 PolarHBondContact O-N 2.81Å; A44-E47 PolarHBondContact O-N 3.48Å; A44-Q48 WeakPolarHBondContact O-CG 3.47Å; A44-Q48 PolarHBondContact O-N 3.01Å
45	R	85.9	Confident	84.6	Confident	83 Å²	83	76.7 Å²	76.7	31%	0.313	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-48.7	174.4	-174.9	-179	-176.2	146.6	9	112.3	E9 I12 L41 Q42 K43 E47 Q48 Q49	E9-R45 IonicContact OE1-CZ 3.6Å; E9-R45 VanDerWaalsContact OE1-CZ 3.27Å; E9-R45 IonicContact OE1-NH1 2.76Å; E9-R45 PolarHBondContact OE1-NH1 2.94Å; E9-R45 IonicContact OE1-NH2 3.52Å; E9-R45 PolarHBondContact OE1-NH2 3.39Å; E9-R45 IonicContact OE2-NH2 3.27Å; I12-R45 HydrophobicContact CD1-CB 4.15Å; L41-R45 PolarHBondContact O-N 2.91Å; Q42-R45 WeakPolarHBondContact O-CB 3.46Å; Q42-R45 PolarHBondContact O-N 3.29Å; K43-R45 VanDerWaalsContact C-N 3.26Å; K43-R45 PolarHBondContact O-N 3.31Å; R45-E47 PolarHBondContact O-N 3.19Å; R45-Q48 PolarHBondContact O-N 3.37Å; R45-Q49 WeakPolarHBondContact O-CG 3.42Å; R45-Q49 PolarHBondContact O-N 3.46Å
46	S	85.1	Confident	83.7	Confident	71 Å²	71	76.9 Å²	76.9	50%	0.497	38%	0.376	S	S	.	.	H	α-helix	trans	-58.7	-37.9	176.9	-64.1	0	0	0	0	111.7	Q42 K43 Q49 R50	Q42-S46 PolarHBondContact O-N 3.09Å; Q42-S46 PolarHBondContact O-OG 3.39Å; K43-S46 PolarHBondContact O-N 2.75Å; S46-Q49 PolarHBondContact O-N 2.93Å; S46-R50 WeakPolarHBondContact O-CB 3.47Å; S46-R50 PolarHBondContact O-N 3.29Å
47	E	84.1	Confident	82.6	Confident	48 Å²	48	79.3 Å²	79.3	22%	0.224	39%	0.385	C	S	.	.	H	α-helix	trans	-69.7	-42.9	177	-175.9	60.6	-166.5	0	0	112.1	K43 A44 R45 Q49 R50 M51	K43-E47 WeakPolarHBondContact O-CB 3.35Å; K43-E47 PolarHBondContact O-N 2.91Å; A44-E47 PolarHBondContact O-N 3.48Å; R45-E47 PolarHBondContact O-N 3.19Å; E47-Q49 VanDerWaalsContact C-N 3.29Å; E47-Q49 PolarHBondContact O-N 2.95Å; E47-R50 WeakPolarHBondContact O-CB 3.35Å; E47-R50 PolarHBondContact O-N 3.17Å; E47-R50 IonicContact OE1-CZ 3.87Å; E47-R50 IonicContact OE1-NE 2.8Å; E47-R50 PolarHBondContact OE1-NE 2.93Å; E47-R50 IonicContact OE1-NH2 2.89Å; E47-R50 PolarHBondContact OE1-NH2 2.72Å; E47-R50 IonicContact OE2-CZ 3.12Å; E47-R50 IonicContact OE2-NE 2.77Å; E47-R50 PolarHBondContact OE2-NE 2.94Å; E47-R50 IonicContact OE2-NH2 3.98Å; E47-R50 PolarHBondContact OE2-NH2 3.28Å; E47-M51 HydrophobicContact CG-CE 4.04Å; E47-M51 WeakPolarHBondContact O-CG 3.44Å; E47-M51 PolarHBondContact O-N 3.25Å; E47-M51 WeakPolarHBondContact OE1-CE 3.42Å
48	Q	83.1	Confident	81.1	Confident	42 Å²	42	82.3 Å²	82.3	20%	0.196	40%	0.395	C	S	.	.	H	α-helix	trans	-57.6	-42.8	172.5	-75.5	174.3	-27.9	0	0	111.5	A44 R45 M51 R52	A44-Q48 WeakPolarHBondContact O-CG 3.47Å; A44-Q48 PolarHBondContact O-N 3.01Å; R45-Q48 PolarHBondContact O-N 3.37Å; Q48-M51 PolarHBondContact O-N 3.32Å; Q48-R52 WeakPolarHBondContact O-CG 3.37Å; Q48-R52 PolarHBondContact O-N 3.18Å
49	Q	84.4	Confident	79.6	Confident	91 Å²	91	86 Å²	86	43%	0.425	42%	0.421	S	S	.	.	H	α-helix	trans	-64.3	-43.5	175.8	-71.8	179.8	-19.1	0	0	112	R45 S46 E47 M51 R52 Q53	R45-Q49 WeakPolarHBondContact O-CG 3.42Å; R45-Q49 PolarHBondContact O-N 3.46Å; S46-Q49 PolarHBondContact O-N 2.93Å; E47-Q49 VanDerWaalsContact C-N 3.29Å; E47-Q49 PolarHBondContact O-N 2.95Å; Q49-M51 PolarHBondContact O-N 2.94Å; Q49-R52 WeakPolarHBondContact O-CB 3.39Å; Q49-R52 PolarHBondContact O-N 3.35Å; Q49-Q53 WeakPolarHBondContact O-CG 3.27Å; Q49-Q53 PolarHBondContact O-N 3.27Å
50	R	85	Confident	78	Confident	83 Å²	83	84.1 Å²	84.1	31%	0.313	42%	0.421	S	S	.	.	H	α-helix	trans	-60.1	-44.8	175.7	-170.2	-177.1	74.9	94.3	-3.4	111.6	S46 E47 R52 Q53 W54	S46-R50 WeakPolarHBondContact O-CB 3.47Å; S46-R50 PolarHBondContact O-N 3.29Å; E47-R50 WeakPolarHBondContact O-CB 3.35Å; E47-R50 PolarHBondContact O-N 3.17Å; E47-R50 IonicContact OE1-CZ 3.87Å; E47-R50 IonicContact OE1-NE 2.8Å; E47-R50 PolarHBondContact OE1-NE 2.93Å; E47-R50 IonicContact OE1-NH2 2.89Å; E47-R50 PolarHBondContact OE1-NH2 2.72Å; E47-R50 IonicContact OE2-CZ 3.12Å; E47-R50 IonicContact OE2-NE 2.77Å; E47-R50 PolarHBondContact OE2-NE 2.94Å; E47-R50 IonicContact OE2-NH2 3.98Å; E47-R50 PolarHBondContact OE2-NH2 3.28Å; R50-R52 VanDerWaalsContact C-N 3.32Å; R50-R52 PolarHBondContact O-N 3.24Å; R50-Q53 PolarHBondContact O-N 3.34Å; R50-W54 PolarHBondContact O-N 2.89Å
51	M	80.1	Confident	76	Confident	93 Å²	93	85.9 Å²	85.9	46%	0.458	43%	0.427	S	S	.	.	H	α-helix	trans	-62.5	-38.6	176.9	-71.8	-171.2	-179.9	0	0	112.1	E47 Q48 Q49 W54 N55	E47-M51 HydrophobicContact CG-CE 4.04Å; E47-M51 WeakPolarHBondContact O-CG 3.44Å; E47-M51 PolarHBondContact O-N 3.25Å; E47-M51 WeakPolarHBondContact OE1-CE 3.42Å; Q48-M51 PolarHBondContact O-N 3.32Å; Q49-M51 PolarHBondContact O-N 2.94Å; M51-W54 PolarHBondContact O-N 3.39Å; M51-N55 WeakPolarHBondContact O-CB 3.47Å; M51-N55 PolarHBondContact O-N 3.08Å; M51-N55 PolarHBondContact O-ND2 2.82Å
52	R	80.7	Confident	74	Confident	92 Å²	92	91 Å²	91	35%	0.347	46%	0.461	S	S	.	.	H	α-helix	trans	-63.7	-44.5	174.7	-73.4	170.2	173.1	-153.2	-9.4	112.1	D5 Q48 Q49 R50 W54 N55 S56	D5-R52 IonicContact OD1-CZ 3.39Å; D5-R52 IonicContact OD1-NE 2.65Å; D5-R52 IonicContact OD1-NH2 3.25Å; D5-R52 PolarHBondContact OD1-NH2 3.32Å; D5-R52 IonicContact OD2-CZ 3.43Å; D5-R52 IonicContact OD2-NE 3.44Å; D5-R52 PolarHBondContact OD2-NE 2.85Å; D5-R52 VanDerWaalsContact OD2-NE 3.17Å; D5-R52 IonicContact OD2-NH1 2.81Å; D5-R52 PolarHBondContact OD2-NH1 2.82Å; D5-R52 VanDerWaalsContact OD2-NH1 3.12Å; D5-R52 IonicContact OD2-NH2 3.49Å; D5-R52 PolarHBondContact OD2-NH2 3.15Å; Q48-R52 WeakPolarHBondContact O-CG 3.37Å; Q48-R52 PolarHBondContact O-N 3.18Å; Q49-R52 WeakPolarHBondContact O-CB 3.39Å; Q49-R52 PolarHBondContact O-N 3.35Å; R50-R52 VanDerWaalsContact C-N 3.32Å; R50-R52 PolarHBondContact O-N 3.24Å; R52-W54 VanDerWaalsContact C-N 3.34Å; R52-W54 PolarHBondContact O-N 2.9Å; R52-N55 PolarHBondContact O-N 2.96Å; R52-S56 WeakPolarHBondContact O-CB 3.45Å; R52-S56 PolarHBondContact O-N 2.75Å; R52-S56 PolarHBondContact O-OG 2.76Å; R52-S56 VanDerWaalsContact O-OG 3.05Å
53	Q	79.2	Confident	72	Confident	136 Å²	136	93.3 Å²	93.3	64%	0.636	48%	0.475	S	S	*	.	H	α-helix	trans	-61.2	-44.6	176.8	-69.2	173.7	11.2	0	0	111.5	Q49 R50 S56 Q57	Q49-Q53 WeakPolarHBondContact O-CG 3.27Å; Q49-Q53 PolarHBondContact O-N 3.27Å; R50-Q53 PolarHBondContact O-N 3.34Å; Q53-S56 PolarHBondContact O-N 2.73Å; Q53-Q57 PolarHBondContact O-N 3.46Å
54	W	75.6	Confident	69.7	Low	109 Å²	109	91.8 Å²	91.8	41%	0.413	48%	0.481	S	S	.	.	H	α-helix	trans	-61.7	-44.3	176.5	-175.5	-102.9	0	0	0	112.6	R50 M51 R52 Q57 K58 M77	R50-W54 PolarHBondContact O-N 2.89Å; M51-W54 PolarHBondContact O-N 3.39Å; R52-W54 VanDerWaalsContact C-N 3.34Å; R52-W54 PolarHBondContact O-N 2.9Å; W54-Q57 PolarHBondContact O-N 2.58Å; W54-K58 VanDerWaalsContact NE1-CE 3.27Å; W54-K58 PolarHBondContact O-N 2.82Å; W54-M77 HydrophobicContact CH2-CE 3.86Å; W54-M77 HydrophobicContact CZ2-CE 3.28Å
55	N	73.6	Confident	67.8	Low	77 Å²	77	95.9 Å²	95.9	41%	0.412	50%	0.504	S	S	.	.	H	α-helix	trans	-65.7	-39.7	177.4	-71.7	-25.7	0	0	0	111.8	M51 R52 Q57 K58 V59	M51-N55 WeakPolarHBondContact O-CB 3.47Å; M51-N55 PolarHBondContact O-N 3.08Å; M51-N55 PolarHBondContact O-ND2 2.82Å; R52-N55 PolarHBondContact O-N 2.96Å; N55-Q57 VanDerWaalsContact C-N 3.34Å; N55-Q57 PolarHBondContact O-N 3.36Å; N55-K58 PolarHBondContact O-N 3.23Å; N55-V59 WeakPolarHBondContact O-CG2 3.49Å; N55-V59 PolarHBondContact O-N 2.91Å
56	S	69.8	Low	65.6	Low	80 Å²	80	101.4 Å²	101.4	56%	0.559	53%	0.526	S	S	*	.	H	α-helix	trans	-63.6	-39.1	174.9	-66.2	0	0	0	0	112.3	R52 Q53 K58 V59 S60	R52-S56 WeakPolarHBondContact O-CB 3.45Å; R52-S56 PolarHBondContact O-N 2.75Å; R52-S56 PolarHBondContact O-OG 2.76Å; R52-S56 VanDerWaalsContact O-OG 3.05Å; Q53-S56 PolarHBondContact O-N 2.73Å; S56-K58 PolarHBondContact O-N 3.16Å; S56-V59 PolarHBondContact O-N 2.89Å; S56-S60 PolarHBondContact O-N 2.87Å; S56-S60 VanDerWaalsContact O-N 3.16Å; S56-S60 PolarHBondContact O-OG 3.33Å
57	Q	63.5	Low	63.2	Low	111 Å²	111	108 Å²	108	52%	0.519	55%	0.547	S	S	.	.	H	α-helix	trans	-64.8	-37.9	179	-169.2	173.6	-3.7	0	0	112.4	Q53 W54 N55 V59 S60 H61	Q53-Q57 PolarHBondContact O-N 3.46Å; W54-Q57 PolarHBondContact O-N 2.58Å; N55-Q57 VanDerWaalsContact C-N 3.34Å; N55-Q57 PolarHBondContact O-N 3.36Å; Q57-V59 VanDerWaalsContact C-N 3.27Å; Q57-V59 PolarHBondContact O-N 3Å; Q57-S60 PolarHBondContact O-N 3.25Å; Q57-S60 PolarHBondContact O-OG 3.46Å; Q57-H61 PolarHBondContact O-N 3.02Å
58	K	57.9	Low	61.3	Low	135 Å²	135	111 Å²	111	59%	0.587	57%	0.568	S	S	*	*	H	α-helix	trans	-63	-31.3	174.4	-74.9	-176.6	171.9	-176.3	0	113.1	W54 N55 S56	W54-K58 VanDerWaalsContact NE1-CE 3.27Å; W54-K58 PolarHBondContact O-N 2.82Å; N55-K58 PolarHBondContact O-N 3.23Å; S56-K58 PolarHBondContact O-N 3.16Å
59	V	56.1	Low	59.4	Low	120 Å²	120	117.8 Å²	117.8	73%	0.727	60%	0.599	S	S	*	*	H	α-helix	trans	-80.1	-33.4	179.8	-177.5	0	0	0	0	111.5	N55 S56 Q57 H61	N55-V59 WeakPolarHBondContact O-CG2 3.49Å; N55-V59 PolarHBondContact O-N 2.91Å; S56-V59 PolarHBondContact O-N 2.89Å; Q57-V59 VanDerWaalsContact C-N 3.27Å; Q57-V59 PolarHBondContact O-N 3Å; V59-H61 VanDerWaalsContact C-N 3.29Å; V59-H61 PolarHBondContact O-N 3.47Å
60	S	56.4	Low	57.5	Low	76 Å²	76	122.6 Å²	122.6	53%	0.531	62%	0.622	S	S	.	*	H	α-helix	trans	-75.2	-12.2	-179.6	53.2	0	0	0	0	115	S56 Q57 P62	S56-S60 PolarHBondContact O-N 2.87Å; S56-S60 VanDerWaalsContact O-N 3.16Å; S56-S60 PolarHBondContact O-OG 3.33Å; Q57-S60 PolarHBondContact O-N 3.25Å; Q57-S60 PolarHBondContact O-OG 3.46Å; S60-P62 WeakPolarHBondContact O-CD 3.41Å
61	H	45.9	Very low	55.7	Low	125 Å²	125	126.4 Å²	126.4	58%	0.579	64%	0.643	S	S	*	*			trans	-120.5	85.4	173.6	-69.7	-20	0	0	0	109.8	Q57 V59 I63	Q57-H61 PolarHBondContact O-N 3.02Å; V59-H61 VanDerWaalsContact C-N 3.29Å; V59-H61 PolarHBondContact O-N 3.47Å; H61-I63 PolarHBondContact O-N 3.12Å
62	P	47.6	Very low	54.1	Low	120 Å²	120	127.5 Å²	127.5	78%	0.779	65%	0.651	S	S	*	*			trans	-63.3	96.6	161.1	26.8	-30.7	0	0	0	106.8	S60 G64	S60-P62 WeakPolarHBondContact O-CD 3.41Å; P62-G64 VanDerWaalsContact C-N 3.28Å; P62-G64 PolarHBondContact O-N 2.91Å
63	I	47.3	Very low	52.5	Low	145 Å²	145	130.1 Å²	130.1	74%	0.744	67%	0.672	S	S	*	*			trans	-62.1	95.3	175.1	-63.5	162.3	0	0	0	106.2	H61	H61-I63 PolarHBondContact O-N 3.12Å
64	G	37.4	Very low	51	Low	47 Å²	47	127.5 Å²	127.5	49%	0.485	67%	0.673	S	S	.	*			trans	-54	146.5	157.3	0	0	0	0	0	107.9	P62 Y66	P62-G64 VanDerWaalsContact C-N 3.28Å; P62-G64 PolarHBondContact O-N 2.91Å; G64-Y66 PolarHBondContact O-N 3.42Å
65	P	44.6	Very low	49.7	Very low	129 Å²	129	127.3 Å²	127.3	84%	0.838	68%	0.684	S	S	*	*	S	Bend	trans	-68.6	84.3	-171.3	29.2	-34.9	0	0	0	109.7
66	Y	39.3	Very low	48.6	Very low	200 Å²	200	128 Å²	128	78%	0.784	69%	0.688	S	S	*	*			trans	-104.9	104.9	165.8	-141.7	-97.1	0	0	0	105.7	G64 V68	G64-Y66 PolarHBondContact O-N 3.42Å; Y66-V68 VanDerWaalsContact C-N 3.33Å; Y66-V68 HydrophobicContact CD1-CG2 3.83Å; Y66-V68 PolarHBondContact O-N 3Å
67	F	35.5	Very low	47.4	Very low	210 Å²	210	128.9 Å²	128.9	92%	0.921	68%	0.684	S	S	*	*			trans	-52.7	99	167.1	-93.7	-104.6	0	0	0	108.1
68	V	43.4	Very low	46.6	Very low	111 Å²	111	131.5 Å²	131.5	67%	0.673	70%	0.696	S	S	*	*			trans	-124.5	121.8	159.5	-171.8	0	0	0	0	105.2	Y66 E70	Y66-V68 VanDerWaalsContact C-N 3.33Å; Y66-V68 HydrophobicContact CD1-CG2 3.83Å; Y66-V68 PolarHBondContact O-N 3Å; V68-E70 PolarHBondContact O-N 3.32Å
69	E	44	Very low	46.1	Very low	183 Å²	183	132.6 Å²	132.6	86%	0.855	70%	0.703	S	S	*	*			trans	-52.4	103.7	-178.4	-60.3	179.5	154.6	0	0	109.6	E71	E69-E71 PolarHBondContact O-N 2.98Å
70	E	45.1	Very low	45.6	Very low	193 Å²	193	135 Å²	135	90%	0.902	70%	0.699	S	S	*	*			trans	-78.9	68.3	177.6	-121.8	178.1	-178.6	0	0	108.8	V68 N72	V68-E70 PolarHBondContact O-N 3.32Å; E70-N72 PolarHBondContact O-N 3.27Å
71	E	46.5	Very low	44.8	Very low	162 Å²	162	138.9 Å²	138.9	76%	0.757	70%	0.704	S	S	*	*			trans	-73.9	103.3	164.3	-90.3	-167	144.2	0	0	109.2	E69 N73	E69-E71 PolarHBondContact O-N 2.98Å; E71-N73 PolarHBondContact O-N 3.48Å
72	N	46.3	Very low	44.7	Very low	116 Å²	116	135.9 Å²	135.9	62%	0.62	70%	0.701	S	S	*	*			trans	69.4	32.1	138	-59.5	-41.7	0	0	0	120.5	E70 A74	E70-N72 PolarHBondContact O-N 3.27Å; N72-A74 PolarHBondContact O-N 3.46Å
73	N	46.4	Very low	44.4	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	4.4	162.3	-91.3	-16.3	0	0	0	114.4	E71 V75 D76	E71-N73 PolarHBondContact O-N 3.48Å; N73-V75 PolarHBondContact O-N 3.43Å; N73-D76 PolarHBondContact O-N 2.99Å
74	A	49	Very low	44.2	Very low	80 Å²	80	133.3 Å²	133.3	66%	0.661	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-20.7	173.5	0	0	0	0	0	113.2	N72 D76 M77	N72-A74 PolarHBondContact O-N 3.46Å; A74-D76 VanDerWaalsContact C-N 3.32Å; A74-D76 PolarHBondContact O-N 3.26Å; A74-M77 PolarHBondContact O-N 2.96Å
75	V	48.6	Very low	44.6	Very low	105 Å²	105	138.4 Å²	138.4	64%	0.636	70%	0.702	S	S	*	*	H	α-helix	trans	-66.4	-32.2	179.3	-174.3	0	0	0	0	111.9	N73 M77 Q78	N73-V75 PolarHBondContact O-N 3.43Å; V75-M77 VanDerWaalsContact C-N 3.31Å; V75-M77 PolarHBondContact O-N 3.37Å; V75-Q78 PolarHBondContact O-N 2.97Å
76	D	48.9	Very low	44.8	Very low	92 Å²	92	135 Å²	135	49%	0.492	68%	0.676	S	S	.	*	H	α-helix	trans	-73.9	-20.1	-177.9	-169.1	39.1	0	0	0	113.2	N73 A74	N73-D76 PolarHBondContact O-N 2.99Å; A74-D76 VanDerWaalsContact C-N 3.32Å; A74-D76 PolarHBondContact O-N 3.26Å
77	M	45.5	Very low	45	Very low	98 Å²	98	128.1 Å²	128.1	48%	0.483	66%	0.657	S	S	.	*	H	α-helix	trans	-78.5	-25	178.8	-73.6	-126.4	-141.8	0	0	113.4	W54 A74 V75 E79	W54-M77 HydrophobicContact CH2-CE 3.86Å; W54-M77 HydrophobicContact CZ2-CE 3.28Å; A74-M77 PolarHBondContact O-N 2.96Å; V75-M77 VanDerWaalsContact C-N 3.31Å; V75-M77 PolarHBondContact O-N 3.37Å; M77-E79 VanDerWaalsContact C-N 3.29Å
78	Q	46.9	Very low	45.6	Very low	167 Å²	167	126 Å²	126	78%	0.78	65%	0.65	S	S	*	*	H	α-helix	trans	-76.6	-20.7	-179.2	-165	137.7	14.5	0	0	112	V75 R80	V75-Q78 PolarHBondContact O-N 2.97Å; Q78-R80 PolarHBondContact O-N 3.04Å
79	E	48.1	Very low	45.7	Very low	157 Å²	157	125 Å²	125	73%	0.734	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-7	-170.8	-111.4	178.1	-173.6	0	0	115.6	M77	M77-E79 VanDerWaalsContact C-N 3.29Å
80	R	44.2	Very low	45.9	Very low	170 Å²	170	119.4 Å²	119.4	64%	0.642	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	11.4	-177.6	-64.9	-158.9	-157.1	172.2	9.6	116.6	Q78 A82	Q78-R80 PolarHBondContact O-N 3.04Å; R80-A82 PolarHBondContact O-N 2.83Å
81	Y	40.5	Very low	45.9	Very low	158 Å²	158	115.6 Å²	115.6	62%	0.62	61%	0.612	S	S	*	*	S	Bend	trans	-71.9	89.9	153.4	-62	-78.3	0	0	0	106	V83	Y81-V83 PolarHBondContact O-N 3.24Å
82	A	43.6	Very low	45.9	Very low	63 Å²	63	111.5 Å²	111.5	52%	0.521	60%	0.595	S	S	.	*			trans	-57	97.7	168.8	0	0	0	0	0	106.1	K43 R80 L84	K43-A82 PolarHBondContact NZ-O 2.74Å; R80-A82 PolarHBondContact O-N 2.83Å; A82-L84 PolarHBondContact O-N 2.91Å; A82-L84 VanDerWaalsContact O-N 3.08Å
83	V	42	Very low	45.8	Very low	126 Å²	126	112.4 Å²	112.4	76%	0.764	59%	0.59	S	S	*	*			trans	-63.6	116.6	172.6	177.8	0	0	0	0	104.2	Y81 D85	Y81-V83 PolarHBondContact O-N 3.24Å; V83-D85 VanDerWaalsContact C-N 3.31Å; V83-D85 PolarHBondContact O-N 3.18Å
84	L	43.4	Very low	45.8	Very low	84 Å²	84	112.2 Å²	112.2	44%	0.44	59%	0.589	S	S	.	*			trans	-67	102.4	170.8	-83.5	161.5	0	0	0	105	L40 K43 A82 I86	L40-L84 HydrophobicContact CD2-CD1 3.45Å; L40-L84 VanDerWaalsContact CD2-CD1 3.45Å; L40-L84 HydrophobicContact CG-CD1 4.5Å; K43-L84 HydrophobicContact CD-CD1 4.49Å; A82-L84 PolarHBondContact O-N 2.91Å; A82-L84 VanDerWaalsContact O-N 3.08Å; L84-I86 HydrophobicContact CB-CD1 4.42Å; L84-I86 HydrophobicContact CB-CG1 4.05Å; L84-I86 PolarHBondContact O-N 2.79Å
85	D	45.6	Very low	45.5	Very low	155 Å²	155	115.2 Å²	115.2	83%	0.829	59%	0.589	S	S	*	*			trans	-74	70.9	170.2	-158.4	6.8	0	0	0	107.5	V83 S87	V83-D85 VanDerWaalsContact C-N 3.31Å; V83-D85 PolarHBondContact O-N 3.18Å; D85-S87 VanDerWaalsContact C-N 3.35Å; D85-S87 PolarHBondContact O-N 3.18Å
86	I	47.6	Very low	45.3	Very low	57 Å²	57	120.6 Å²	120.6	29%	0.292	60%	0.597	S	S	.	*			trans	-75.1	101.5	165.3	-55.2	176.6	0	0	0	103.1	L84 E88 V90 L91	L84-I86 HydrophobicContact CB-CD1 4.42Å; L84-I86 HydrophobicContact CB-CG1 4.05Å; L84-I86 PolarHBondContact O-N 2.79Å; I86-E88 PolarHBondContact O-N 2.76Å; I86-V90 HydrophobicContact CG2-CB 3.83Å; I86-V90 HydrophobicContact CG2-CG1 3.99Å; I86-L91 HydrophobicContact CG2-CD1 4.31Å; I86-L91 HydrophobicContact CG2-CD2 4.34Å; I86-L91 HydrophobicContact CG2-CG 3.97Å
87	S	43.4	Very low	44.9	Very low	56 Å²	56	119.2 Å²	119.2	39%	0.392	61%	0.605	S	S	.	*			trans	-50.9	133.7	176.4	59.1	0	0	0	0	108.7	D85 S89 V90	D85-S87 VanDerWaalsContact C-N 3.35Å; D85-S87 PolarHBondContact O-N 3.18Å; S87-S89 WeakPolarHBondContact CB-OG 3.38Å; S87-S89 PolarHBondContact O-N 3.37Å; S87-S89 PolarHBondContact OG-OG 3.02Å; S87-V90 WeakPolarHBondContact O-CB 3.45Å; S87-V90 PolarHBondContact O-N 3.43Å; S87-V90 WeakPolarHBondContact OG-CG2 3.08Å
88	E	49.4	Very low	44.8	Very low	165 Å²	165	121.8 Å²	121.8	77%	0.771	62%	0.621	S	S	*	*	H	α-helix	trans	-51.2	-28.9	-178.6	-135.2	177.2	-169.7	0	0	111.6	I86 V90 L91 D92	I86-E88 PolarHBondContact O-N 2.76Å; E88-V90 PolarHBondContact O-N 3.22Å; E88-L91 CarbonylContact O-C 3.48Å; E88-L91 WeakPolarHBondContact O-CA 3.43Å; E88-L91 PolarHBondContact O-N 3Å; E88-D92 WeakPolarHBondContact O-CB 3.49Å; E88-D92 PolarHBondContact O-N 2.94Å
89	S	44.4	Very low	44.5	Very low	90 Å²	90	120.1 Å²	120.1	63%	0.629	61%	0.608	S	S	*	*	H	α-helix	trans	-57.3	-24.7	172.6	60.8	0	0	0	0	115.5	S87	S87-S89 WeakPolarHBondContact CB-OG 3.38Å; S87-S89 PolarHBondContact O-N 3.37Å; S87-S89 PolarHBondContact OG-OG 3.02Å
90	V	48.2	Very low	44	Very low	66 Å²	66	120.1 Å²	120.1	40%	0.4	61%	0.613	S	S	.	*	H	α-helix	trans	-83.4	-23.2	175.2	179.3	0	0	0	0	110.9	I86 S87 E88 W93	I86-V90 HydrophobicContact CG2-CB 3.83Å; I86-V90 HydrophobicContact CG2-CG1 3.99Å; S87-V90 WeakPolarHBondContact O-CB 3.45Å; S87-V90 PolarHBondContact O-N 3.43Å; S87-V90 WeakPolarHBondContact OG-CG2 3.08Å; E88-V90 PolarHBondContact O-N 3.22Å; V90-W93 PolarHBondContact O-NE1 2.72Å
91	L	45.3	Very low	43.7	Very low	113 Å²	113	117.6 Å²	117.6	59%	0.592	62%	0.618	S	S	*	*	H	α-helix	trans	-97.4	-26.2	177.8	-64.4	175.3	0	0	0	112.6	I86 E88 W93	I86-L91 HydrophobicContact CG2-CD1 4.31Å; I86-L91 HydrophobicContact CG2-CD2 4.34Å; I86-L91 HydrophobicContact CG2-CG 3.97Å; E88-L91 CarbonylContact O-C 3.48Å; E88-L91 WeakPolarHBondContact O-CA 3.43Å; E88-L91 PolarHBondContact O-N 3Å; L91-W93 PolarHBondContact O-N 3.24Å
92	D	46.9	Very low	43.8	Very low	76 Å²	76	118 Å²	118	41%	0.406	63%	0.628	S	S	.	*			trans	-76.3	67.8	174.9	-172.1	13.6	0	0	0	110.3	E88 N94 H95	E88-D92 WeakPolarHBondContact O-CB 3.49Å; E88-D92 PolarHBondContact O-N 2.94Å; D92-N94 PolarHBondContact O-N 2.91Å; D92-N94 PolarHBondContact OD1-N 3.25Å; D92-H95 IonicContact OD1-CD2 3.68Å; D92-H95 IonicContact OD1-CG 3.89Å; D92-H95 PolarHBondContact OD1-N 3.04Å; D92-H95 IonicContact OD2-CD2 2.73Å; D92-H95 IonicContact OD2-CG 3.12Å
93	W	43.1	Very low	43.5	Very low	135 Å²	135	124 Å²	124	51%	0.511	65%	0.645	S	S	.	*			trans	-72.5	-13.6	171.4	-77	72.5	0	0	0	112	A29 V90 L91	A29-W93 HydrophobicContact CB-CH2 3.72Å; A29-W93 HydrophobicContact CB-CZ3 4.02Å; V90-W93 PolarHBondContact O-NE1 2.72Å; L91-W93 PolarHBondContact O-N 3.24Å
94	N	47.7	Very low	43.6	Very low	143 Å²	143	126 Å²	126	77%	0.765	65%	0.646	S	S	*	*	S	Bend	trans	-93.5	-9.7	-168.1	-76.9	-17	0	0	0	114.3	D92	D92-N94 PolarHBondContact O-N 2.91Å; D92-N94 PolarHBondContact OD1-N 3.25Å
95	H	43	Very low	43.2	Very low	143 Å²	143	126.5 Å²	126.5	66%	0.662	66%	0.656	S	S	*	*	S	Bend	trans	-113.9	-0.9	-172.6	-68	-16	0	0	0	117.5	D92 G97	D92-H95 IonicContact OD1-CD2 3.68Å; D92-H95 IonicContact OD1-CG 3.89Å; D92-H95 PolarHBondContact OD1-N 3.04Å; D92-H95 IonicContact OD2-CD2 2.73Å; D92-H95 IonicContact OD2-CG 3.12Å; H95-G97 PolarHBondContact O-N 3.47Å; H95-G97 VanDerWaalsContact O-N 3.12Å
96	R	44	Very low	43	Very low	218 Å²	218	127.2 Å²	127.2	82%	0.823	66%	0.659	S	S	*	*			trans	-87.7	48.6	166	-84.1	-174.3	-173.8	-108	2.9	112.9	D98 Y99	R96-D98 VanDerWaalsContact C-N 3.28Å; R96-Y99 WeakPolarHBondContact O-CD2 3.38Å; R96-Y99 WeakPolarHBondContact O-CE2 3.19Å
97	G	41.1	Very low	42.7	Very low	63 Å²	63	134.5 Å²	134.5	65%	0.649	68%	0.684	S	S	*	*			trans	-79.8	-1.3	171.5	0	0	0	0	0	114.5	H95 Y99	H95-G97 PolarHBondContact O-N 3.47Å; H95-G97 VanDerWaalsContact O-N 3.12Å; G97-Y99 PolarHBondContact O-N 2.89Å
98	D	42.3	Very low	42.4	Very low	153 Å²	153	136.6 Å²	136.6	82%	0.818	70%	0.699	S	S	*	*			trans	-75.1	32.8	-178.3	-65.4	-27.8	0	0	0	114.1	R96 L100	R96-D98 VanDerWaalsContact C-N 3.28Å; D98-L100 VanDerWaalsContact C-N 3.28Å; D98-L100 PolarHBondContact O-N 3.33Å
99	Y	41	Very low	42.2	Very low	131 Å²	131	136.1 Å²	136.1	51%	0.514	70%	0.702	S	S	.	*			trans	-72.4	89.7	166.1	-73.6	-80.9	0	0	0	108.4	R96 G97 C153	R96-Y99 WeakPolarHBondContact O-CD2 3.38Å; R96-Y99 WeakPolarHBondContact O-CE2 3.19Å; G97-Y99 PolarHBondContact O-N 2.89Å; Y99-C153 WeakPolarHBondContact OH-CB 3.29Å
100	L	37.5	Very low	42.1	Very low	158 Å²	158	140.4 Å²	140.4	83%	0.827	71%	0.712	S	S	*	*			trans	-49.9	130.5	162.2	-71.4	173.8	0	0	0	108.4	D98 M102	D98-L100 VanDerWaalsContact C-N 3.28Å; D98-L100 PolarHBondContact O-N 3.33Å; L100-M102 PolarHBondContact O-N 3.47Å
101	P	38.7	Very low	41.6	Very low	117 Å²	117	144.6 Å²	144.6	76%	0.76	73%	0.732	S	S	*	*			trans	-62.6	105.3	-177.1	22.9	-30.9	0	0	0	109.1	E103	P101-E103 PolarHBondContact O-N 3.34Å; P101-E103 VanDerWaalsContact O-N 3.1Å
102	M	41.2	Very low	41.4	Very low	166 Å²	166	144.8 Å²	144.8	82%	0.818	74%	0.743	S	S	*	*			trans	-68.2	107.8	170.6	-166.1	163.3	-131.4	0	0	106.9	L100 H104	L100-M102 PolarHBondContact O-N 3.47Å; M102-H104 PolarHBondContact O-N 2.84Å
103	E	37.9	Very low	41.2	Very low	190 Å²	190	150.6 Å²	150.6	89%	0.888	77%	0.77	S	S	*	*			trans	-60.3	100.4	-179.5	-66.7	-142.2	143.8	0	0	110.1	P101 S105	P101-E103 PolarHBondContact O-N 3.34Å; P101-E103 VanDerWaalsContact O-N 3.1Å; E103-S105 PolarHBondContact O-N 3.23Å
104	H	43.2	Very low	41.2	Very low	168 Å²	168	153.2 Å²	153.2	78%	0.778	79%	0.788	S	S	*	*			trans	-73.7	94.2	169.6	-89.3	-81.6	0	0	0	108.6	M102 L106	M102-H104 PolarHBondContact O-N 2.84Å; H104-L106 PolarHBondContact O-N 2.73Å
105	S	36.7	Very low	40.6	Very low	94 Å²	94	152 Å²	152	66%	0.657	79%	0.79	S	S	*	*			trans	-54	104.2	159.5	151.9	0	0	0	0	108.6	E103 Y107	E103-S105 PolarHBondContact O-N 3.23Å; S105-Y107 PolarHBondContact O-N 2.93Å
106	L	41.3	Very low	40.5	Very low	170 Å²	170	150.4 Å²	150.4	89%	0.89	80%	0.796	S	S	*	*			trans	-66.2	78.1	169.2	-69.3	163.9	0	0	0	108.9	H104	H104-L106 PolarHBondContact O-N 2.73Å
107	Y	41.2	Very low	40.1	Very low	209 Å²	209	148 Å²	148	82%	0.82	79%	0.793	S	S	*	*			trans	-120	120.9	164.9	-100.4	-87.9	0	0	0	109.1	S105	S105-Y107 PolarHBondContact O-N 2.93Å
108	S	37.2	Very low	40	Very low	101 Å²	101	152.7 Å²	152.7	71%	0.706	80%	0.803	S	S	*	*			trans	-54.9	136	178.2	-45.3	0	0	0	0	112.5
109	D	43.7	Very low	39.9	Very low	155 Å²	155	151.9 Å²	151.9	83%	0.829	80%	0.799	S	S	*	*			trans	-138.3	84.7	149.1	-95.8	-29.4	0	0	0	107	D111	D109-D111 PolarHBondContact O-N 2.93Å; D109-D111 VanDerWaalsContact O-N 3.15Å
110	E	42.5	Very low	40	Very low	180 Å²	180	155.3 Å²	155.3	84%	0.841	81%	0.812	S	S	*	*			trans	-78.7	62.9	166.6	-72.6	-83.7	128.4	0	0	108.2
111	D	39	Very low	40.1	Very low	153 Å²	153	155.2 Å²	155.2	82%	0.818	81%	0.813	S	S	*	*			trans	-159.4	73.4	175.5	-85.9	-41.8	0	0	0	111.8	D109	D109-D111 PolarHBondContact O-N 2.93Å; D109-D111 VanDerWaalsContact O-N 3.15Å
112	S	40.8	Very low	40.1	Very low	117 Å²	117	154 Å²	154	82%	0.818	81%	0.807	S	S	*	*			trans	-151.2	65.7	153.9	49.1	0	0	0	0	111.3	E114	S112-E114 VanDerWaalsContact C-N 3.33Å; S112-E114 PolarHBondContact O-N 3.34Å; S112-E114 VanDerWaalsContact O-N 3.1Å
113	M	41.4	Very low	39.9	Very low	198 Å²	198	151.9 Å²	151.9	98%	0.975	81%	0.808	S	S	*	*			trans	-69.9	88.1	158.6	-79.3	-173.8	151.6	0	0	109.4
114	E	43	Very low	39.8	Very low	191 Å²	191	147 Å²	147	89%	0.893	79%	0.794	S	S	*	*			trans	-135.1	77.5	160.7	-135.3	-177.3	165.7	0	0	109.4	S112	S112-E114 VanDerWaalsContact C-N 3.33Å; S112-E114 PolarHBondContact O-N 3.34Å; S112-E114 VanDerWaalsContact O-N 3.1Å
115	S	35.3	Very low	39.6	Very low	116 Å²	116	147.8 Å²	147.8	81%	0.811	79%	0.792	S	S	*	*			trans	-104.7	104.2	164.1	-73.9	0	0	0	0	107.4
116	S	41.2	Very low	39.7	Very low	111 Å²	111	150.6 Å²	150.6	78%	0.776	80%	0.799	S	S	*	*			trans	-161.3	113.4	159.5	-80.8	0	0	0	0	111.2
117	Q	35.1	Very low	39.7	Very low	166 Å²	166	148.8 Å²	148.8	78%	0.776	79%	0.789	S	S	*	*			trans	73	69.1	132.6	-150.9	163.1	18.8	0	0	116.9	D119	Q117-D119 PolarHBondContact O-N 3.46Å
118	L	40.5	Very low	39.7	Very low	162 Å²	162	147.6 Å²	147.6	85%	0.848	79%	0.791	S	S	*	*			trans	-77.2	106.8	151.6	-81.8	166.6	0	0	0	108.1	Y120	L118-Y120 VanDerWaalsContact C-N 3.27Å; L118-Y120 PolarHBondContact O-N 3.47Å
119	D	40.2	Very low	39.7	Very low	137 Å²	137	150.3 Å²	150.3	73%	0.733	79%	0.793	S	S	*	*			trans	-57.9	89.4	164.7	-70	-39.4	0	0	0	109	Q117 D121	Q117-D119 PolarHBondContact O-N 3.46Å; D119-D121 PolarHBondContact O-N 3.18Å
120	Y	42.1	Very low	39.4	Very low	203 Å²	203	148.4 Å²	148.4	80%	0.796	79%	0.79	S	S	*	*			trans	-85.7	86.9	173.1	-130.6	-93.8	0	0	0	107.5	L118 S122	L118-Y120 VanDerWaalsContact C-N 3.27Å; L118-Y120 PolarHBondContact O-N 3.47Å; Y120-S122 PolarHBondContact O-N 2.71Å
121	D	39.4	Very low	39	Very low	156 Å²	156	146.7 Å²	146.7	83%	0.834	78%	0.782	S	S	*	*			trans	-61	86.1	163.5	-96.6	-27.2	0	0	0	108.2	D119 S123	D119-D121 PolarHBondContact O-N 3.18Å; D121-S123 VanDerWaalsContact C-N 3.3Å; D121-S123 PolarHBondContact O-N 2.79Å
122	S	39.9	Very low	38.9	Very low	91 Å²	91	148.5 Å²	148.5	64%	0.636	79%	0.785	S	S	*	*			trans	-79.8	81.3	175.2	-162.1	0	0	0	0	107.9	Y120 C124	Y120-S122 PolarHBondContact O-N 2.71Å; S122-C124 PolarHBondContact O-N 2.82Å
123	S	37.1	Very low	38.7	Very low	121 Å²	121	147.9 Å²	147.9	85%	0.846	78%	0.777	S	S	*	*			trans	-70.5	81.3	164.8	50.4	0	0	0	0	108.8	D121 Y125	D121-S123 VanDerWaalsContact C-N 3.3Å; D121-S123 PolarHBondContact O-N 2.79Å; S123-Y125 PolarHBondContact O-N 2.94Å
124	C	35.7	Very low	38.5	Very low	88 Å²	88	146.2 Å²	146.2	60%	0.595	77%	0.772	S	S	*	*			trans	-71.5	109.3	178.9	-140.9	0	0	0	0	109.1	S122	S122-C124 PolarHBondContact O-N 2.82Å
125	Y	39.1	Very low	38	Very low	185 Å²	185	146.7 Å²	146.7	73%	0.725	77%	0.767	S	S	*	*			trans	58.4	107	154.8	-53.8	-78.1	0	0	0	119.7	S123	S123-Y125 PolarHBondContact O-N 2.94Å
126	D	38.9	Very low	38	Very low	153 Å²	153	145 Å²	145	82%	0.818	76%	0.755	S	S	*	*			trans	-139.7	84	135.2	-100.8	-29.7	0	0	0	107.9	E128	D126-E128 VanDerWaalsContact C-N 3.32Å
127	I	41.4	Very low	37.8	Very low	132 Å²	132	145.6 Å²	145.6	68%	0.677	76%	0.756	S	S	*	*			trans	-101.4	52.2	170.3	-46.7	174.2	0	0	0	107.6	Q129	I127-Q129 VanDerWaalsContact C-N 3.33Å
128	E	41.3	Very low	37.8	Very low	183 Å²	183	143.5 Å²	143.5	86%	0.855	75%	0.751	S	S	*	*			trans	-92.5	9	170.9	-71.8	-155.1	159.2	0	0	112.9	D126	D126-E128 VanDerWaalsContact C-N 3.32Å
129	Q	36.8	Very low	37.7	Very low	159 Å²	159	144.7 Å²	144.7	74%	0.743	75%	0.752	S	S	*	*			trans	-107.6	49.8	177.9	-148.7	168.4	74.1	0	0	112.3	I127 Q131	I127-Q129 VanDerWaalsContact C-N 3.33Å; Q129-Q131 HydrophobicContact CG-CG 4.27Å; Q129-Q131 PolarHBondContact O-N 3.36Å
130	C	36.8	Very low	37.6	Very low	115 Å²	115	143.9 Å²	143.9	78%	0.777	75%	0.752	S	S	*	*			trans	-74.6	72.3	157.7	-73.3	0	0	0	0	108.5	E132	C130-E132 PolarHBondContact O-N 3.05Å
131	Q	34.6	Very low	37.1	Very low	143 Å²	143	140.3 Å²	140.3	67%	0.668	75%	0.751	S	S	*	*			trans	-69.5	102.5	163	-81	-175.9	15.3	0	0	107.8	Q129 T133	Q129-Q131 HydrophobicContact CG-CG 4.27Å; Q129-Q131 PolarHBondContact O-N 3.36Å; Q131-T133 VanDerWaalsContact C-N 3.27Å; Q131-T133 PolarHBondContact O-N 2.93Å; Q131-T133 PolarHBondContact O-OG1 3.46Å
132	E	35.4	Very low	36.7	Very low	191 Å²	191	140.9 Å²	140.9	89%	0.893	75%	0.751	S	S	*	*			trans	-22.5	85.1	152.1	-152.6	170	-149.8	0	0	111.1	C130	C130-E132 PolarHBondContact O-N 3.05Å
133	T	37.3	Very low	36.3	Very low	105 Å²	105	141.3 Å²	141.3	64%	0.644	75%	0.754	S	S	*	*			trans	-111.2	111.6	170.9	23	0	0	0	0	105.4	Q131 Y135	Q131-T133 VanDerWaalsContact C-N 3.27Å; Q131-T133 PolarHBondContact O-N 2.93Å; Q131-T133 PolarHBondContact O-OG1 3.46Å; T133-Y135 PolarHBondContact O-N 3.37Å
134	D	38.1	Very low	36.2	Very low	163 Å²	163	140.3 Å²	140.3	87%	0.872	75%	0.753	S	S	*	*			trans	-53.4	77.8	173	-67.9	-54.3	0	0	0	110.7	S136	D134-S136 PolarHBondContact O-N 3.38Å
135	Y	32.8	Very low	36.3	Very low	200 Å²	200	141.6 Å²	141.6	78%	0.784	76%	0.758	S	S	*	*			trans	-82.8	97.2	172.8	-114.6	-89.6	0	0	0	107.3	T133	T133-Y135 PolarHBondContact O-N 3.37Å
136	S	33.8	Very low	36	Very low	81 Å²	81	141.4 Å²	141.4	57%	0.566	76%	0.764	S	S	*	*			trans	-58.7	143.8	165.9	77.5	0	0	0	0	109	D134 N138	D134-S136 PolarHBondContact O-N 3.38Å; S136-N138 VanDerWaalsContact C-N 3.34Å; S136-N138 PolarHBondContact O-N 3.32Å
137	P	37.3	Very low	35.9	Very low	123 Å²	123	143.5 Å²	143.5	80%	0.799	76%	0.76	S	S	*	*			trans	-72	92.4	-176.7	28.8	-31.7	0	0	0	108.4	E139	P137-E139 PolarHBondContact O-N 3.38Å
138	N	35.9	Very low	35.4	Very low	123 Å²	123	146.2 Å²	146.2	66%	0.658	77%	0.77	S	S	*	*			trans	-62	124.8	164.7	-80.9	-26.4	0	0	0	107.5	S136 V140	S136-N138 VanDerWaalsContact C-N 3.34Å; S136-N138 PolarHBondContact O-N 3.32Å; N138-V140 VanDerWaalsContact C-N 3.26Å; N138-V140 PolarHBondContact O-N 2.98Å
139	E	37.8	Very low	34.9	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	77%	0.769	S	S	*	*			trans	-56.3	86.7	174.5	-65.4	176.8	154.9	0	0	109.6	P137 T141	P137-E139 PolarHBondContact O-N 3.38Å; E139-T141 VanDerWaalsContact C-N 3.25Å; E139-T141 PolarHBondContact O-N 2.7Å
140	V	37.5	Very low	34.6	Very low	121 Å²	121	149.4 Å²	149.4	73%	0.733	78%	0.776	S	S	*	*			trans	-73.2	92.1	170.8	-177.5	0	0	0	0	106.5	N138 M142	N138-V140 VanDerWaalsContact C-N 3.26Å; N138-V140 PolarHBondContact O-N 2.98Å; V140-M142 PolarHBondContact O-N 3.2Å
141	T	32	Very low	34.7	Very low	127 Å²	127	149.1 Å²	149.1	78%	0.779	77%	0.765	S	S	*	*			trans	-57.1	106.1	163.7	8.1	0	0	0	0	106.7	E139 S143	E139-T141 VanDerWaalsContact C-N 3.25Å; E139-T141 PolarHBondContact O-N 2.7Å; T141-S143 PolarHBondContact O-N 3.16Å
142	M	30.5	Very low	34.6	Very low	169 Å²	169	148.6 Å²	148.6	83%	0.833	77%	0.771	S	S	*	*			trans	-67.7	96.6	179.3	-71.7	-120.6	70	0	0	108.9	V140 A144	V140-M142 PolarHBondContact O-N 3.2Å; M142-A144 PolarHBondContact O-N 3.32Å; M142-A144 VanDerWaalsContact O-N 3.17Å
143	S	32.5	Very low	34.3	Very low	100 Å²	100	141.9 Å²	141.9	70%	0.699	75%	0.745	S	S	*	*			trans	-60.2	116	168.7	-52.1	0	0	0	0	108.7	T141 T145	T141-S143 PolarHBondContact O-N 3.16Å; S143-T145 PolarHBondContact O-N 3.3Å
144	A	34.6	Very low	34.2	Very low	99 Å²	99	141 Å²	141	82%	0.818	74%	0.742	S	S	*	*			trans	-64.7	59.7	-177.2	0	0	0	0	0	113.8	M142 Q146	M142-A144 PolarHBondContact O-N 3.32Å; M142-A144 VanDerWaalsContact O-N 3.17Å; A144-Q146 PolarHBondContact O-N 2.86Å; A144-Q146 VanDerWaalsContact O-N 3.08Å
145	T	36.9	Very low	34	Very low	115 Å²	115	139.1 Å²	139.1	71%	0.706	73%	0.732	S	S	*	*			trans	-85.7	67.9	165.6	54.9	0	0	0	0	108.5	S143 R147	S143-T145 PolarHBondContact O-N 3.3Å; T145-R147 PolarHBondContact O-N 3.27Å
146	Q	34.5	Very low	34.2	Very low	182 Å²	182	133.9 Å²	133.9	85%	0.85	72%	0.721	S	S	*	*			trans	-63.9	86.5	167.6	-172.9	172.6	2.4	0	0	107.3	A144 E148	A144-Q146 PolarHBondContact O-N 2.86Å; A144-Q146 VanDerWaalsContact O-N 3.08Å; Q146-E148 PolarHBondContact O-N 3.05Å; Q146-E148 VanDerWaalsContact O-N 3.15Å
147	R	35.8	Very low	34.3	Very low	197 Å²	197	133 Å²	133	74%	0.743	72%	0.719	S	S	*	*			trans	-66.5	110	171	-77.2	-177.9	-179.9	147.2	0.8	107.3	T145 W149	T145-R147 PolarHBondContact O-N 3.27Å; R147-W149 PolarHBondContact O-N 2.92Å; R147-W149 VanDerWaalsContact O-N 3.11Å
148	E	30.5	Very low	34.1	Very low	188 Å²	188	136.1 Å²	136.1	88%	0.879	72%	0.72	S	S	*	*			trans	-53.2	110.2	163.9	-84.6	174.4	131.6	0	0	108.6	Q146	Q146-E148 PolarHBondContact O-N 3.05Å; Q146-E148 VanDerWaalsContact O-N 3.15Å
149	W	30.8	Very low	34	Very low	218 Å²	218	138.6 Å²	138.6	83%	0.826	73%	0.728	S	S	*	*			trans	-87	107.9	166.6	-68.7	90.7	0	0	0	106.8	R147 I151	R147-W149 PolarHBondContact O-N 2.92Å; R147-W149 VanDerWaalsContact O-N 3.11Å; W149-I151 WeakPolarHBondContact O-CG1 2.83Å; W149-I151 PolarHBondContact O-N 3.5Å
150	E	30.7	Very low	33.8	Very low	192 Å²	192	140.3 Å²	140.3	90%	0.897	73%	0.726	S	S	*	*			trans	-70	121.8	171.3	-77.5	-175.6	146.4	0	0	109.7
151	I	39.6	Very low	33.6	Very low	109 Å²	109	140.8 Å²	140.8	56%	0.559	73%	0.73	S	S	*	*			trans	-97.7	118.4	-168.9	-63.2	160.1	0	0	0	109	W149	W149-I151 WeakPolarHBondContact O-CG1 2.83Å; W149-I151 PolarHBondContact O-N 3.5Å
152	V	32.3	Very low	33.8	Very low	131 Å²	131	142.9 Å²	142.9	79%	0.794	73%	0.73	S	S	*	*			trans	-101.4	104.1	169.5	-179.3	0	0	0	0	108.6
153	C	29.8	Very low	34.1	Very low	50 Å²	50	144.4 Å²	144.4	34%	0.338	73%	0.732	S	S	.	*			trans	-82.2	131.3	178.3	-57.6	0	0	0	0	111.2	Y99	Y99-C153 WeakPolarHBondContact OH-CB 3.29Å
154	C	34.5	Very low	34.1	Very low	86 Å²	86	150.9 Å²	150.9	58%	0.581	74%	0.742	S	S	*	*			trans	-114.3	90.6	170.6	-71.4	0	0	0	0	109.8	T156	C154-T156 PolarHBondContact O-N 3.43Å
155	N	33.9	Very low	34.2	Very low	124 Å²	124	154.9 Å²	154.9	66%	0.663	74%	0.741	S	S	*	*			trans	-78.1	12.8	-179.3	-82.7	-8.2	0	0	0	115.1	A157	N155-A157 PolarHBondContact O-N 3.21Å; N155-A157 VanDerWaalsContact O-N 3.11Å
156	T	36.5	Very low	33.8	Very low	91 Å²	91	155 Å²	155	56%	0.558	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	7.9	-172.1	52.3	0	0	0	0	115.7	R26 C154	R26-T156 PolarHBondContact NH2-OG1 2.84Å; C154-T156 PolarHBondContact O-N 3.43Å
157	A	37.4	Very low	33.7	Very low	62 Å²	62	154.6 Å²	154.6	51%	0.512	74%	0.744	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	-25.9	178.2	0	0	0	0	0	114.2	N155	N155-A157 PolarHBondContact O-N 3.21Å; N155-A157 VanDerWaalsContact O-N 3.11Å
158	F	33	Very low	33.4	Very low	188 Å²	188	149.8 Å²	149.8	83%	0.825	74%	0.741	S	S	*	*	S	Bend	trans	-91.3	-17.7	-167.9	-162.6	-103.6	0	0	0	114.7
159	E	34.2	Very low	33.6	Very low	176 Å²	176	148.3 Å²	148.3	82%	0.822	74%	0.736	S	S	*	*	S	Bend	trans	-92	-2.5	-175.3	-76	-169.7	143.3	0	0	115.8
160	R	32.7	Very low	33.9	Very low	221 Å²	221	145.1 Å²	145.1	83%	0.834	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-5.3	-175.2	-80.4	-169.8	-172.9	157.1	3.3	116.6
161	T	33.6	Very low	34.1	Very low	131 Å²	131	143.2 Å²	143.2	80%	0.804	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	3.5	-176.1	32.3	0	0	0	0	116.2
162	Q	35.8	Very low	34.1	Very low	171 Å²	171	142.5 Å²	142.5	80%	0.799	73%	0.733	S	S	*	*			trans	-108.1	22.1	176.9	-79.3	-151.2	27.8	0	0	116.1	R164	Q162-R164 PolarHBondContact O-N 3.14Å; Q162-R164 VanDerWaalsContact O-N 3.08Å
163	K	37.4	Very low	34.5	Very low	201 Å²	201	140.5 Å²	140.5	87%	0.874	73%	0.725	S	S	*	*			trans	-85.6	85.5	170.4	-147.4	172.5	-173.7	175.8	0	110.4	K165	K163-K165 PolarHBondContact O-N 3.5Å; K163-K165 VanDerWaalsContact O-N 3.07Å
164	R	32.7	Very low	35	Very low	236 Å²	236	146.1 Å²	146.1	89%	0.891	75%	0.746	S	S	*	*			trans	-39.7	110.1	168.4	-66.5	174.6	176.7	146.6	0.3	110.4	Q162	Q162-R164 PolarHBondContact O-N 3.14Å; Q162-R164 VanDerWaalsContact O-N 3.08Å
165	K	35.9	Very low	35.2	Very low	184 Å²	184	148 Å²	148	80%	0.8	75%	0.75	S	S	*	*			trans	-118.1	100.4	158.5	-156.6	172.4	179.9	-172.2	0	106.6	K163 E167	K163-K165 PolarHBondContact O-N 3.5Å; K163-K165 VanDerWaalsContact O-N 3.07Å; K165-E167 PolarHBondContact O-N 3.37Å
166	S	29.2	Very low	35.4	Very low	116 Å²	116	153.4 Å²	153.4	81%	0.811	76%	0.762	S	S	*	*			trans	-56.9	112.5	168.7	49.4	0	0	0	0	109.6
167	E	32.3	Very low	35.2	Very low	175 Å²	175	151.7 Å²	151.7	82%	0.818	76%	0.757	S	S	*	*			trans	-148.4	144.2	157.6	-131.5	165.1	158.5	0	0	109	K165	K165-E167 PolarHBondContact O-N 3.37Å
168	S	29.2	Very low	35.2	Very low	96 Å²	96	155.2 Å²	155.2	67%	0.671	77%	0.767	S	S	*	*			trans	-91.8	164.1	-154.8	54.6	0	0	0	0	114.2
169	M	33.8	Very low	35.3	Very low	156 Å²	156	154.4 Å²	154.4	77%	0.768	77%	0.765	S	S	*	*			trans	70.2	96.6	158.8	-59.8	-75.7	96.7	0	0	115.5
170	D	37.5	Very low	35.4	Very low	151 Å²	151	154 Å²	154	81%	0.807	76%	0.761	S	S	*	*				166.7	107.7	112.9	-86.5	-38.6	0	0	0	106.5	P172	D170-P172 WeakPolarHBondContact O-CD 3.47Å
171	D	34.5	Very low	35.5	Very low	153 Å²	153	153.6 Å²	153.6	82%	0.818	76%	0.759	S	S	*	*			trans	-101.4	85.8	171.9	-175.1	12.6	0	0	0	108	S173	D171-S173 PolarHBondContact OD1-N 2.9Å
172	P	40.4	Very low	35.5	Very low	93 Å²	93	153.6 Å²	153.6	60%	0.604	76%	0.759	S	S	*	*			trans	-89.5	96.9	146.5	31.6	-21.5	0	0	0	105.3	D170 E174	D170-P172 WeakPolarHBondContact O-CD 3.47Å; P172-E174 VanDerWaalsContact C-N 3.34Å; P172-E174 PolarHBondContact O-N 2.77Å
173	S	39.5	Very low	35.2	Very low	90 Å²	90	150.3 Å²	150.3	63%	0.629	75%	0.754	S	S	*	*			trans	-30	98.6	162.3	55.6	0	0	0	0	110.3	D171 D175	D171-S173 PolarHBondContact OD1-N 2.9Å; S173-D175 VanDerWaalsContact C-N 3.27Å; S173-D175 PolarHBondContact O-N 3.29Å
174	E	41.7	Very low	35.1	Very low	167 Å²	167	146.4 Å²	146.4	78%	0.78	75%	0.748	S	S	*	*			trans	-71.1	96.2	174.4	-73.9	-171.9	136.6	0	0	105.7	P172 W176	P172-E174 VanDerWaalsContact C-N 3.34Å; P172-E174 PolarHBondContact O-N 2.77Å; E174-W176 PolarHBondContact O-N 3.25Å
175	D	37.3	Very low	34.9	Very low	125 Å²	125	142.8 Å²	142.8	67%	0.668	75%	0.746	S	S	*	*			trans	-68.3	52.1	178.8	-130.1	3.5	0	0	0	110.3	S173 A177	S173-D175 VanDerWaalsContact C-N 3.27Å; S173-D175 PolarHBondContact O-N 3.29Å; D175-A177 PolarHBondContact O-N 3.08Å; D175-A177 VanDerWaalsContact O-N 3.16Å
176	W	39.2	Very low	34.8	Very low	239 Å²	239	139.6 Å²	139.6	91%	0.905	74%	0.744	S	S	*	*			trans	-67.1	-9.3	174.4	58.5	-96.8	0	0	0	111.9	E174	E174-W176 PolarHBondContact O-N 3.25Å
177	A	33.2	Very low	34.8	Very low	55 Å²	55	140.1 Å²	140.1	46%	0.455	74%	0.743	S	S	.	*	S	Bend	trans	-91.5	110.5	164.8	0	0	0	0	0	109.6	D175	D175-A177 PolarHBondContact O-N 3.08Å; D175-A177 VanDerWaalsContact O-N 3.16Å
178	L	35.9	Very low	34.7	Very low	136 Å²	136	138.3 Å²	138.3	71%	0.712	74%	0.743	S	S	*	*			trans	79.9	48.6	163.9	-45	171	0	0	0	116.7	K180	L178-K180 HydrophobicContact CB-CG 4.42Å; L178-K180 PolarHBondContact O-N 2.85Å
179	Q	34.8	Very low	34.9	Very low	171 Å²	171	141 Å²	141	80%	0.799	75%	0.75	S	S	*	*			trans	-67	78	145.3	-120.1	175.5	13.3	0	0	108.4	R181	Q179-R181 PolarHBondContact O-N 3.36Å
180	K	36	Very low	34.5	Very low	168 Å²	168	137.9 Å²	137.9	73%	0.73	75%	0.749	S	S	*	*			trans	-59.3	84.9	163.9	-72.3	-176.7	178.3	-179.8	0	106.1	L178 V182	L178-K180 HydrophobicContact CB-CG 4.42Å; L178-K180 PolarHBondContact O-N 2.85Å; K180-V182 PolarHBondContact O-N 2.89Å
181	R	35.7	Very low	34.1	Very low	212 Å²	212	137 Å²	137	80%	0.8	75%	0.749	S	S	*	*			trans	-61.5	97.7	161	-77.7	-167	-179.2	163.5	2.4	105.5	Q179 C183	Q179-R181 PolarHBondContact O-N 3.36Å; R181-C183 VanDerWaalsContact C-N 3.25Å; R181-C183 PolarHBondContact O-N 3Å
182	V	33.9	Very low	33.7	Very low	131 Å²	131	134.8 Å²	134.8	79%	0.794	75%	0.745	S	S	*	*			trans	-60	96.8	164.3	177.5	0	0	0	0	105.1	K180 P184	K180-V182 PolarHBondContact O-N 2.89Å; V182-P184 WeakPolarHBondContact O-CD 3.3Å
183	C	29.5	Very low	33.3	Very low	102 Å²	102	135.2 Å²	135.2	69%	0.689	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-62.3	124.7	170.4	-77.3	0	0	0	0	107.5	R181 L185	R181-C183 VanDerWaalsContact C-N 3.25Å; R181-C183 PolarHBondContact O-N 3Å; C183-L185 PolarHBondContact O-N 2.91Å
184	P	35.1	Very low	32.8	Very low	118 Å²	118	138.6 Å²	138.6	77%	0.766	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-56.6	125.9	172.2	-21.2	31.8	0	0	0	109.2	V182	V182-P184 WeakPolarHBondContact O-CD 3.3Å
185	L	28.2	Very low	32.4	Very low	161 Å²	161	139.7 Å²	139.7	84%	0.843	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-54.5	129.5	173.2	-107.4	76	0	0	0	109	C183 T187	C183-L185 PolarHBondContact O-N 2.91Å; L185-T187 PolarHBondContact O-N 3.17Å
186	P	33.1	Very low	32.2	Very low	116 Å²	116	142.9 Å²	142.9	75%	0.753	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.9	128.4	176	25	-30.5	0	0	0	109.8	V188	P186-V188 PolarHBondContact O-N 3.12Å
187	T	30.1	Very low	32.2	Very low	128 Å²	128	136.6 Å²	136.6	79%	0.785	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-58.2	124.2	174.3	-38.3	0	0	0	0	109.3	L185 N189	L185-T187 PolarHBondContact O-N 3.17Å; T187-N189 PolarHBondContact O-N 3.05Å
188	V	30.3	Very low	32.4	Very low	137 Å²	137	139.3 Å²	139.3	83%	0.83	78%	0.784	S	S	*	*			trans	-59.6	95.4	179.1	-177.6	0	0	0	0	109.7	P186	P186-V188 PolarHBondContact O-N 3.12Å
189	N	32.4	Very low	32.6	Very low	151 Å²	151	139.4 Å²	139.4	81%	0.807	79%	0.785	S	S	*	*			trans	-120.3	105.7	162.1	-81.1	-18.5	0	0	0	108.5	T187	T187-N189 PolarHBondContact O-N 3.05Å
190	A	25.9	Very low	32.5	Very low	91 Å²	91	133.8 Å²	133.8	75%	0.752	77%	0.773	S	S	*	*			trans	-25.3	132.5	161.9	0	0	0	0	0	114.6
191	V	30.1	Very low	32.8	Very low	134 Å²	134	132.4 Å²	132.4	81%	0.812	77%	0.772	S	S	*	*				172.7	120.5	116.7	154.3	0	0	0	0	108.5
192	S	25.9	Very low	32.7	Very low	105 Å²	105	125 Å²	125	73%	0.734	76%	0.762	S	S	*	*			trans	30.3	112.4	145.6	-164	0	0	0	0	118.7
193	S	30.4	Very low	32.9	Very low	103 Å²	103	124.9 Å²	124.9	72%	0.72	75%	0.753	S	S	*	*				164.3	141	105.1	-79.2	0	0	0	0	109.5	E195	S193-E195 PolarHBondContact O-N 3.29Å
194	D	30.1	Very low	33.7	Very low	160 Å²	160	124.9 Å²	124.9	86%	0.856	75%	0.745	S	S	*	*			trans	-44	116.8	178.9	-57.2	-84.9	0	0	0	113.4
195	E	32.2	Very low	33.7	Very low	190 Å²	190	127.7 Å²	127.7	89%	0.888	75%	0.746	S	S	*	*			trans	-146.3	122.3	144	-81.6	-141.6	122.1	0	0	109.2	S193 P197	S193-E195 PolarHBondContact O-N 3.29Å; E195-P197 WeakPolarHBondContact O-CD 3.4Å
196	E	33.8	Very low	34.1	Very low	192 Å²	192	124.6 Å²	124.6	90%	0.897	74%	0.738	S	S	*	*			trans	-63.5	114.3	-178.2	-153.9	177.7	167.1	0	0	109.3	S198	E196-S198 PolarHBondContact O-N 3.05Å; E196-S198 VanDerWaalsContact O-N 3.09Å
197	P	40	Very low	34.5	Very low	107 Å²	107	126.2 Å²	126.2	70%	0.695	74%	0.739	S	S	*	*			trans	-74.4	109.9	-179.2	28	-30.2	0	0	0	108.7	E195 N199	E195-P197 WeakPolarHBondContact O-CD 3.4Å; P197-N199 PolarHBondContact O-N 2.99Å
198	S	36.9	Very low	35.1	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	74%	0.738	S	S	*	*			trans	-49.4	121.4	167.8	55.8	0	0	0	0	109.4	E196 G200	E196-S198 PolarHBondContact O-N 3.05Å; E196-S198 VanDerWaalsContact O-N 3.09Å; S198-G200 PolarHBondContact O-N 3.18Å
199	N	39.1	Very low	35	Very low	137 Å²	137	124.1 Å²	124.1	73%	0.733	72%	0.721	S	S	*	*			trans	-71.6	70.8	-178.7	-70.7	-53.3	0	0	0	110	P197	P197-N199 PolarHBondContact O-N 2.99Å
200	G	33.1	Very low	34.8	Very low	54 Å²	54	125.9 Å²	125.9	56%	0.557	73%	0.725	S	S	*	*			trans	-84.5	115.9	179.6	0	0	0	0	0	111.6	S198 G202	S198-G200 PolarHBondContact O-N 3.18Å; G200-G202 PolarHBondContact O-N 3.33Å
201	I	42.5	Very low	35	Very low	138 Å²	138	127 Å²	127	71%	0.708	73%	0.727	S	S	*	*	S	Bend	trans	66.7	-29.1	153	-52.6	169.9	0	0	0	116.6	Q203 L204	I201-Q203 VanDerWaalsContact C-N 3.31Å; I201-Q203 PolarHBondContact O-N 3.3Å; I201-L204 HydrophobicContact CG2-CD1 4.45Å; I201-L204 PolarHBondContact O-N 3.07Å
202	G	34.4	Very low	34.9	Very low	57 Å²	57	127.1 Å²	127.1	59%	0.588	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-22	-176.7	0	0	0	0	0	115.3	G200 L204	G200-G202 PolarHBondContact O-N 3.33Å; G202-L204 VanDerWaalsContact C-N 3.33Å
203	Q	38.6	Very low	35.1	Very low	129 Å²	129	130.8 Å²	130.8	60%	0.603	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-14.8	177.6	-75.6	-178.5	-1.2	0	0	113.6	I201 F205 S206 L207	I201-Q203 VanDerWaalsContact C-N 3.31Å; I201-Q203 PolarHBondContact O-N 3.3Å; Q203-F205 VanDerWaalsContact C-N 3.31Å; Q203-F205 PolarHBondContact O-N 3.11Å; Q203-S206 PolarHBondContact O-N 3.1Å; Q203-L207 PolarHBondContact O-N 3.23Å
204	L	44.7	Very low	35	Very low	102 Å²	102	131 Å²	131	53%	0.534	73%	0.728	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	-38.7	-178.8	-79	167.8	0	0	0	112	I201 G202 L207 F208	I201-L204 HydrophobicContact CG2-CD1 4.45Å; I201-L204 PolarHBondContact O-N 3.07Å; G202-L204 VanDerWaalsContact C-N 3.33Å; L204-L207 PolarHBondContact O-N 2.84Å; L204-F208 WeakPolarHBondContact O-CD2 3.39Å; L204-F208 WeakPolarHBondContact O-CE2 3.44Å
205	F	35.7	Very low	34.9	Very low	177 Å²	177	129.1 Å²	129.1	78%	0.776	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-19.3	-179.8	-70.3	-75.9	0	0	0	114	Q203 L207	Q203-F205 VanDerWaalsContact C-N 3.31Å; Q203-F205 PolarHBondContact O-N 3.11Å; F205-L207 VanDerWaalsContact C-N 3.3Å
206	S	37.6	Very low	34.8	Very low	96 Å²	96	125.8 Å²	125.8	67%	0.671	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-17	172.8	-61.6	0	0	0	0	112.4	Q203	Q203-S206 PolarHBondContact O-N 3.1Å
207	L	41.6	Very low	35	Very low	150 Å²	150	124 Å²	124	79%	0.785	70%	0.703	S	S	*	*	S	Bend	trans	-83.5	-16.8	-179.5	-132.7	83.8	0	0	0	114	Q203 L204 F205	Q203-L207 PolarHBondContact O-N 3.23Å; L204-L207 PolarHBondContact O-N 2.84Å; F205-L207 VanDerWaalsContact C-N 3.3Å
208	F	41.6	Very low	34.6	Very low	175 Å²	175	126.1 Å²	126.1	77%	0.768	71%	0.709	S	S	*	*	S	Bend	trans	-92.5	-6.2	178.3	-67.2	-75.8	0	0	0	113.5	L204	L204-F208 WeakPolarHBondContact O-CD2 3.39Å; L204-F208 WeakPolarHBondContact O-CE2 3.44Å
209	G	28.2	Very low	34.1	Very low	46 Å²	46	124.4 Å²	124.4	47%	0.474	71%	0.709	S	S	.	*	S	Bend	trans	-90.4	114.8	177.1	0	0	0	0	0	111.3
210	E	28.9	Very low	33.6	Very low	188 Å²	188	123.9 Å²	123.9	88%	0.879	72%	0.716	S	S	*	*			trans	73.1	83.9	160.6	-65.6	165.6	143.9	0	0	117.3
211	S	29.3	Very low	33.3	Very low	115 Å²	115	124.2 Å²	124.2	80%	0.804	72%	0.72	S	S	*	*			trans	-128.8	75.9	140.1	-167	0	0	0	0	109.6	R213	S211-R213 VanDerWaalsContact C-N 3.29Å; S211-R213 PolarHBondContact O-N 2.73Å; S211-R213 VanDerWaalsContact O-N 3.16Å
212	T	28.7	Very low	32.7	Very low	136 Å²	136	127 Å²	127	83%	0.834	73%	0.729	S	S	*	*			trans	-72.4	87.8	156.3	50.6	0	0	0	0	107.6
213	R	30	Very low	32.6	Very low	181 Å²	181	128.8 Å²	128.8	68%	0.683	74%	0.738	S	S	*	*			trans	-111	91.6	164.6	-168.4	170.8	168.6	166.7	-1.9	109.5	S211 E215	S211-R213 VanDerWaalsContact C-N 3.29Å; S211-R213 PolarHBondContact O-N 2.73Å; S211-R213 VanDerWaalsContact O-N 3.16Å; R213-E215 IonicContact CZ-OE1 3.17Å; R213-E215 IonicContact CZ-OE2 3.71Å; R213-E215 IonicContact NE-OE1 3.75Å; R213-E215 IonicContact NE-OE2 3.74Å; R213-E215 PolarHBondContact NE-OE2 3.42Å; R213-E215 VanDerWaalsContact NE-OE2 3.12Å; R213-E215 VanDerWaalsContact NH2-CD 3.34Å; R213-E215 IonicContact NH2-OE1 3.48Å; R213-E215 PolarHBondContact NH2-OE1 2.93Å; R213-E215 IonicContact NH2-OE2 2.84Å; R213-E215 PolarHBondContact NH2-OE2 3.11Å; R213-E215 PolarHBondContact O-N 3.15Å
214	S	27.1	Very low	32.3	Very low	109 Å²	109	127.3 Å²	127.3	76%	0.762	75%	0.749	S	S	*	*			trans	-62.6	116	158.6	51.4	0	0	0	0	109.4
215	E	29.5	Very low	31.6	Very low	120 Å²	120	126.6 Å²	126.6	56%	0.561	77%	0.766	S	S	*	*			trans	-125.7	108.1	159	-97.7	176.1	148.7	0	0	108.8	R213 I217	R213-E215 IonicContact CZ-OE1 3.17Å; R213-E215 IonicContact CZ-OE2 3.71Å; R213-E215 IonicContact NE-OE1 3.75Å; R213-E215 IonicContact NE-OE2 3.74Å; R213-E215 PolarHBondContact NE-OE2 3.42Å; R213-E215 VanDerWaalsContact NE-OE2 3.12Å; R213-E215 VanDerWaalsContact NH2-CD 3.34Å; R213-E215 IonicContact NH2-OE1 3.48Å; R213-E215 PolarHBondContact NH2-OE1 2.93Å; R213-E215 IonicContact NH2-OE2 2.84Å; R213-E215 PolarHBondContact NH2-OE2 3.11Å; R213-E215 PolarHBondContact O-N 3.15Å; E215-I217 PolarHBondContact O-N 3.08Å
216	P	30	Very low	31.3	Very low	120 Å²	120	121 Å²	121	78%	0.779	76%	0.758	S	S	*	*			trans	-79.6	104.5	165.1	30.6	-26.3	0	0	0	107.3
217	I	36.7	Very low	31.5	Very low	153 Å²	153	126.9 Å²	126.9	79%	0.785	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-96.6	125.1	169.8	-78.5	172.1	0	0	0	109.1	E215	E215-I217 PolarHBondContact O-N 3.08Å
218	D	33.2	Very low	31.7	Very low	152 Å²	152	126.8 Å²	126.8	81%	0.813	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-54.2	145.4	-175.9	-69.9	-54.9	0	0	0	114
219	G	26.1	Very low	32	Very low	77 Å²	77	126.1 Å²	126.1	79%	0.794	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-66.6	148	176.2	0	0	0	0	0	113.8
220	S	28.2	Very low	33.1	Very low	126 Å²	126	128.5 Å²	128.5	88%	0.881	78%	0.778	S	S	*	*			trans	176	128.3	148.2	168.1	0	0	0	0	109
221	G	27.7	Very low	34.1	Very low	61 Å²	61	125 Å²	125	63%	0.629	77%	0.774	S	S	*	*			trans	95.7	92.4	163.1	0	0	0	0	0	113.5
222	H	29.5	Very low	35.4	Very low	196 Å²	196	123 Å²	123	91%	0.907	76%	0.757	S	S	*	*				69.5	119.7	90.7	-83.7	-58.1	0	0	0	115.5
223	A	30.9	Very low	36.2	Very low	95 Å²	95	119.3 Å²	119.3	79%	0.785	74%	0.738	S	S	*	*			trans	89.9	110.2	144.4	0	0	0	0	0	118.3
224	A	33.4	Very low	37.1	Very low	99 Å²	99	115.2 Å²	115.2	82%	0.818	73%	0.725	S	S	*	*			trans	67.7	94.4	138.2	0	0	0	0	0	118.1	G226	A224-G226 VanDerWaalsContact C-N 3.27Å; A224-G226 PolarHBondContact O-N 2.85Å
225	G	29.3	Very low	37.9	Very low	86 Å²	86	116 Å²	116	89%	0.887	72%	0.72	S	S	*	*				70.1	11.7	121.5	0	0	0	0	0	118.2	R227	G225-R227 PolarHBondContact O-N 2.97Å
226	G	30.4	Very low	39	Very low	59 Å²	59	115.5 Å²	115.5	61%	0.608	72%	0.718	S	S	*	*			trans	-70.7	76.8	161.7	0	0	0	0	0	108.9	A224 D228	A224-G226 VanDerWaalsContact C-N 3.27Å; A224-G226 PolarHBondContact O-N 2.85Å; G226-D228 PolarHBondContact O-N 2.98Å
227	R	41.1	Very low	40.2	Very low	221 Å²	221	114.7 Å²	114.7	83%	0.834	71%	0.706	S	S	*	*			trans	-63.5	97.9	151.5	-77.2	-176.2	175.2	-177.6	-2.3	103.4	G225 L229	G225-R227 PolarHBondContact O-N 2.97Å; R227-L229 PolarHBondContact O-N 2.79Å
228	D	47	Very low	41	Very low	148 Å²	148	111.6 Å²	111.6	79%	0.791	69%	0.69	S	S	*	*			trans	-52.5	100	164.1	-71.1	-39.8	0	0	0	105.1	G226 S230	G226-D228 PolarHBondContact O-N 2.98Å; D228-S230 PolarHBondContact O-N 3.1Å
229	L	47.7	Very low	41.8	Very low	160 Å²	160	109.4 Å²	109.4	84%	0.838	69%	0.686	S	S	*	*			trans	-72.1	62.1	166.7	-61.8	173.9	0	0	0	105	R227 C231	R227-L229 PolarHBondContact O-N 2.79Å; L229-C231 PolarHBondContact O-N 3.23Å
230	S	51.1	Low	42.7	Very low	96 Å²	96	114.2 Å²	114.2	67%	0.671	69%	0.687	S	S	*	*			trans	-61.5	111.2	165.2	59	0	0	0	0	104.3	D228 P232	D228-S230 PolarHBondContact O-N 3.1Å; S230-P232 VanDerWaalsContact O-N 3.16Å
231	C	48.6	Very low	43.3	Very low	116 Å²	116	115.6 Å²	115.6	78%	0.784	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-46.9	127.5	173.3	-60	0	0	0	0	107.5	L229 S233	L229-C231 PolarHBondContact O-N 3.23Å; C231-S233 PolarHBondContact O-N 2.91Å
232	P	57	Low	44.1	Very low	71 Å²	71	118.3 Å²	118.3	46%	0.461	70%	0.7	S	S	.	*	P	Polyproline II helix	trans	-53.4	138.4	-178.3	20.7	-31.4	0	0	0	108.7	S230 E236 L237	S230-P232 VanDerWaalsContact O-N 3.16Å; P232-E236 VanDerWaalsContact CA-OE2 3.31Å; P232-E236 WeakPolarHBondContact CA-OE2 3.39Å; P232-E236 HydrophobicContact CB-CB 4.14Å; P232-L237 HydrophobicContact CB-CG 4.38Å; P232-L237 HydrophobicContact CG-CD1 4.47Å; P232-L237 HydrophobicContact CG-CD2 4.18Å; P232-L237 HydrophobicContact CG-CG 4.16Å
233	S	45.2	Very low	44.8	Very low	60 Å²	60	114.2 Å²	114.2	42%	0.42	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-61.7	151.1	177.6	75.7	0	0	0	0	109	C231 L235 E236 L237	C231-S233 PolarHBondContact O-N 2.91Å; S233-L235 PolarHBondContact O-N 2.89Å; S233-E236 PolarHBondContact N-OE2 3.22Å; S233-E236 WeakPolarHBondContact O-CB 3.45Å; S233-E236 PolarHBondContact O-N 2.87Å; S233-E236 PolarHBondContact OG-N 3.38Å; S233-L237 PolarHBondContact O-N 3.38Å
234	F	48.6	Very low	45.6	Very low	95 Å²	95	115.3 Å²	115.3	42%	0.417	68%	0.684	S	S	.	*	H	α-helix	trans	-53.2	-30	177.3	178.9	-106.1	0	0	0	112.8	L11 L41 I238	L11-F234 HydrophobicContact CD1-CD1 4.31Å; L11-F234 HydrophobicContact CD1-CE1 3.75Å; L11-F234 HydrophobicContact CD1-CZ 4.5Å; L41-F234 HydrophobicContact CD2-CZ 4.2Å; F234-I238 HydrophobicContact CD1-CD1 3.72Å; F234-I238 HydrophobicContact CE1-CD1 3.27Å; F234-I238 HydrophobicContact CE1-CG1 4.43Å; F234-I238 HydrophobicContact CE2-CD1 4.25Å; F234-I238 HydrophobicContact CG-CD1 4.39Å; F234-I238 HydrophobicContact CZ-CD1 3.58Å; F234-I238 HydrophobicContact CZ-CG1 4.43Å; F234-I238 WeakPolarHBondContact O-CG1 3.49Å; F234-I238 PolarHBondContact O-N 3.1Å
235	L	44.5	Very low	46.3	Very low	124 Å²	124	116.2 Å²	116.2	65%	0.649	68%	0.676	S	S	*	*	H	α-helix	trans	-68.7	-39.7	174	-82.8	164.3	0	0	0	112.8	S233 L237 I238 C239	S233-L235 PolarHBondContact O-N 2.89Å; L235-L237 VanDerWaalsContact C-N 3.34Å; L235-I238 PolarHBondContact O-N 2.86Å; L235-C239 PolarHBondContact O-N 3.06Å; L235-C239 PolarHBondContact O-SG 2.99Å; L235-C239 VanDerWaalsContact O-SG 3.36Å
236	E	53.8	Low	47.4	Very low	111 Å²	111	118.1 Å²	118.1	52%	0.519	66%	0.663	S	S	.	*	H	α-helix	trans	-63.3	-41.4	175.5	-76.3	171.1	147.7	0	0	111.2	P232 S233 I238 C239 E240	P232-E236 VanDerWaalsContact CA-OE2 3.31Å; P232-E236 WeakPolarHBondContact CA-OE2 3.39Å; P232-E236 HydrophobicContact CB-CB 4.14Å; S233-E236 PolarHBondContact N-OE2 3.22Å; S233-E236 WeakPolarHBondContact O-CB 3.45Å; S233-E236 PolarHBondContact O-N 2.87Å; S233-E236 PolarHBondContact OG-N 3.38Å; E236-I238 VanDerWaalsContact C-N 3.27Å; E236-I238 PolarHBondContact O-N 3.04Å; E236-C239 PolarHBondContact O-N 2.8Å; E236-E240 PolarHBondContact O-N 2.88Å; E236-E240 VanDerWaalsContact O-N 3.15Å
237	L	54.6	Low	48.5	Very low	103 Å²	103	122.1 Å²	122.1	54%	0.539	67%	0.667	S	S	.	*	H	α-helix	trans	-63.2	-30.6	176.6	-74.8	166.1	0	0	0	113.3	P232 S233 L235	P232-L237 HydrophobicContact CB-CG 4.38Å; P232-L237 HydrophobicContact CG-CD1 4.47Å; P232-L237 HydrophobicContact CG-CD2 4.18Å; P232-L237 HydrophobicContact CG-CG 4.16Å; S233-L237 PolarHBondContact O-N 3.38Å; L235-L237 VanDerWaalsContact C-N 3.34Å
238	I	54.3	Low	49.1	Very low	87 Å²	87	115 Å²	115	45%	0.446	66%	0.655	S	S	.	*	H	α-helix	trans	-80	-35.3	177.4	-68.7	169.3	0	0	0	111.2	F234 L235 E236 E240 S241	F234-I238 HydrophobicContact CD1-CD1 3.72Å; F234-I238 HydrophobicContact CE1-CD1 3.27Å; F234-I238 HydrophobicContact CE1-CG1 4.43Å; F234-I238 HydrophobicContact CE2-CD1 4.25Å; F234-I238 HydrophobicContact CG-CD1 4.39Å; F234-I238 HydrophobicContact CZ-CD1 3.58Å; F234-I238 HydrophobicContact CZ-CG1 4.43Å; F234-I238 WeakPolarHBondContact O-CG1 3.49Å; F234-I238 PolarHBondContact O-N 3.1Å; L235-I238 PolarHBondContact O-N 2.86Å; E236-I238 VanDerWaalsContact C-N 3.27Å; E236-I238 PolarHBondContact O-N 3.04Å; I238-E240 VanDerWaalsContact C-N 3.35Å; I238-S241 PolarHBondContact O-OG 3.15Å
239	C	48.4	Very low	49.2	Very low	107 Å²	107	112.5 Å²	112.5	72%	0.723	64%	0.644	S	S	*	*	H	α-helix	trans	-77	-20.1	-177.7	-71.2	0	0	0	0	113.6	L235 E236	L235-C239 PolarHBondContact O-N 3.06Å; L235-C239 PolarHBondContact O-SG 2.99Å; L235-C239 VanDerWaalsContact O-SG 3.36Å; E236-C239 PolarHBondContact O-N 2.8Å
240	E	45.8	Very low	49.4	Very low	177 Å²	177	108.5 Å²	108.5	83%	0.827	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-1	-180	-141.9	174.2	-171.2	0	0	114.2	E236 I238	E236-E240 PolarHBondContact O-N 2.88Å; E236-E240 VanDerWaalsContact O-N 3.15Å; I238-E240 VanDerWaalsContact C-N 3.35Å
241	S	40.6	Very low	49.2	Very low	155 Å²	155	109.6 Å²	109.6	100%	1.084	62%	0.624	S	S	*	*			trans	-108.5	0	-177.5	66.9	0	0	0	0	115.4	I238	I238-S241 PolarHBondContact O-OG 3.15Å

Retrieved 241 of 241 residues in 353.3 ms (Link to these results)

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