A0A077ZJ38_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZJ38, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 199 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	49.7	Very low	71.1	Confident	208 Å²	208	91 Å²	91	100%	1.025	48%	0.475	S	S	*	.				0	49.2	0	-62	-162.3	176.4	0	0	109
2	D	58.6	Low	71.6	Confident	97 Å²	97	90.4 Å²	90.4	52%	0.519	47%	0.472	S	S	.	.				87.5	86.3	73.3	-56	-23.3	0	0	0	108.1	N4 N5	D2-N4 PolarHBondContact O-N 2.79Å; D2-N5 HydrophobicContact CB-CB 4.47Å; D2-N5 WeakPolarHBondContact O-CB 3.17Å; D2-N5 PolarHBondContact O-N 3.05Å
3	S	69.2	Low	72.2	Confident	90 Å²	90	92.5 Å²	92.5	63%	0.629	48%	0.478	S	S	*	.	H	α-helix	trans	-44.3	-34.4	173.5	41.9	0	0	0	0	112.4	N5 K6 E7	S3-N5 VanDerWaalsContact C-N 3.32Å; S3-N5 PolarHBondContact O-N 3.22Å; S3-K6 PolarHBondContact O-N 2.89Å; S3-E7 PolarHBondContact O-N 2.94Å
4	N	68.7	Low	72.7	Confident	70 Å²	70	94.3 Å²	94.3	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-62.9	-35	178.4	-61.4	-2.9	0	0	0	112.5	D2 L8 N57	D2-N4 PolarHBondContact O-N 2.79Å; N4-L8 VanDerWaalsContact O-CB 3.29Å; N4-L8 WeakPolarHBondContact O-CB 3.36Å; N4-L8 PolarHBondContact O-N 2.74Å; N4-N57 PolarHBondContact ND2-OD1 3.12Å
5	N	72.1	Confident	73.1	Confident	83 Å²	83	90.3 Å²	90.3	44%	0.444	46%	0.461	S	S	.	.	H	α-helix	trans	-72.3	-35.7	177.2	-70.7	-13.8	0	0	0	111.6	D2 S3 L8 V9	D2-N5 HydrophobicContact CB-CB 4.47Å; D2-N5 WeakPolarHBondContact O-CB 3.17Å; D2-N5 PolarHBondContact O-N 3.05Å; S3-N5 VanDerWaalsContact C-N 3.32Å; S3-N5 PolarHBondContact O-N 3.22Å; N5-L8 PolarHBondContact O-N 3.16Å; N5-V9 VanDerWaalsContact O-CG2 3.26Å; N5-V9 WeakPolarHBondContact O-CG2 3.49Å; N5-V9 PolarHBondContact O-N 3.07Å
6	K	76.5	Confident	73.3	Confident	154 Å²	154	94.3 Å²	94.3	67%	0.67	47%	0.474	S	S	*	.	H	α-helix	trans	-67	-42.6	174.6	-69.6	-174.2	178.2	-177.2	0	111.2	S3 V9 L10	S3-K6 PolarHBondContact O-N 2.89Å; K6-V9 PolarHBondContact O-N 3.21Å; K6-L10 WeakPolarHBondContact O-CG 3.34Å; K6-L10 PolarHBondContact O-N 3.17Å
7	E	78.6	Confident	73.7	Confident	78 Å²	78	92.3 Å²	92.3	36%	0.364	48%	0.475	S	S	.	.	H	α-helix	trans	-64.2	-42.4	176	-172.8	58.4	-152.6	0	0	111.2	S3 V9 L10 Q11 I53	S3-E7 PolarHBondContact O-N 2.94Å; E7-V9 PolarHBondContact O-N 3.34Å; E7-L10 PolarHBondContact O-N 2.88Å; E7-Q11 HydrophobicContact CG-CG 4.43Å; E7-Q11 VanDerWaalsContact O-CG 3.28Å; E7-Q11 WeakPolarHBondContact O-CG 3.3Å; E7-Q11 PolarHBondContact O-N 3.21Å; E7-Q11 PolarHBondContact OE1-NE2 3.4Å; E7-I53 HydrophobicContact CG-CD1 3.91Å
8	L	76.1	Confident	73.8	Confident	36 Å²	36	90.4 Å²	90.4	19%	0.188	47%	0.466	C	S	.	.	H	α-helix	trans	-57.9	-46.9	175.6	-174.1	64.5	0	0	0	112.1	N4 N5 Q11 L12 I50 I53	N4-L8 VanDerWaalsContact O-CB 3.29Å; N4-L8 WeakPolarHBondContact O-CB 3.36Å; N4-L8 PolarHBondContact O-N 2.74Å; N5-L8 PolarHBondContact O-N 3.16Å; L8-Q11 PolarHBondContact O-N 3.2Å; L8-L12 HydrophobicContact CG-CD1 4.13Å; L8-L12 WeakPolarHBondContact O-CB 3.46Å; L8-L12 WeakPolarHBondContact O-CG 3.28Å; L8-L12 PolarHBondContact O-N 3.44Å; L8-I50 HydrophobicContact CD1-CB 4.37Å; L8-I50 HydrophobicContact CD1-CG1 4.29Å; L8-I50 HydrophobicContact CD1-CG2 3.84Å; L8-I53 HydrophobicContact CB-CG2 4.14Å; L8-I53 HydrophobicContact CD1-CB 4.42Å; L8-I53 HydrophobicContact CD1-CG2 4.15Å
9	V	76.5	Confident	74	Confident	75 Å²	75	87.2 Å²	87.2	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-61.9	-44.9	177.2	171.4	0	0	0	0	110.7	N5 K6 E7 Q11 L12 E13	N5-V9 VanDerWaalsContact O-CG2 3.26Å; N5-V9 WeakPolarHBondContact O-CG2 3.49Å; N5-V9 PolarHBondContact O-N 3.07Å; K6-V9 PolarHBondContact O-N 3.21Å; E7-V9 PolarHBondContact O-N 3.34Å; V9-Q11 VanDerWaalsContact C-N 3.34Å; V9-Q11 PolarHBondContact O-N 2.91Å; V9-L12 PolarHBondContact O-N 2.83Å; V9-E13 HydrophobicContact CG1-CG 4.38Å; V9-E13 WeakPolarHBondContact O-CB 3.41Å; V9-E13 WeakPolarHBondContact O-CG 3.29Å; V9-E13 PolarHBondContact O-N 3.04Å
10	L	79.7	Confident	74.1	Confident	83 Å²	83	88.9 Å²	88.9	44%	0.435	46%	0.458	S	S	.	.	H	α-helix	trans	-62.2	-39.7	177.6	-73.9	170.4	0	0	0	112.6	K6 E7 E13 K14	K6-L10 WeakPolarHBondContact O-CG 3.34Å; K6-L10 PolarHBondContact O-N 3.17Å; E7-L10 PolarHBondContact O-N 2.88Å; L10-E13 PolarHBondContact O-N 3Å; L10-K14 WeakPolarHBondContact O-CG 3.47Å; L10-K14 PolarHBondContact O-N 3.12Å
11	Q	76.3	Confident	74.2	Confident	27 Å²	27	89.1 Å²	89.1	13%	0.126	46%	0.46	C	S	.	.	H	α-helix	trans	-68.3	-40.8	176.7	-66.8	-65.6	-22.7	0	0	111.4	E7 L8 V9 K14 L15 C46 I50 I53	E7-Q11 HydrophobicContact CG-CG 4.43Å; E7-Q11 VanDerWaalsContact O-CG 3.28Å; E7-Q11 WeakPolarHBondContact O-CG 3.3Å; E7-Q11 PolarHBondContact O-N 3.21Å; E7-Q11 PolarHBondContact OE1-NE2 3.4Å; L8-Q11 PolarHBondContact O-N 3.2Å; V9-Q11 VanDerWaalsContact C-N 3.34Å; V9-Q11 PolarHBondContact O-N 2.91Å; Q11-K14 PolarHBondContact O-N 3.13Å; Q11-L15 WeakPolarHBondContact O-CB 3.49Å; Q11-L15 PolarHBondContact O-N 3.21Å; Q11-C46 PolarHBondContact O-SG 2.85Å; Q11-I50 HydrophobicContact CB-CG1 4.1Å; Q11-I53 HydrophobicContact CG-CD1 4.01Å
12	L	77.2	Confident	75.5	Confident	84 Å²	84	80.4 Å²	80.4	44%	0.44	42%	0.418	S	S	.	.	H	α-helix	trans	-63.5	-40.5	174.2	-74.5	167.9	0	0	0	112.4	L8 V9 L15 F16 I50	L8-L12 HydrophobicContact CG-CD1 4.13Å; L8-L12 WeakPolarHBondContact O-CB 3.46Å; L8-L12 WeakPolarHBondContact O-CG 3.28Å; L8-L12 PolarHBondContact O-N 3.44Å; V9-L12 PolarHBondContact O-N 2.83Å; L12-L15 WeakPolarHBondContact O-CB 3.35Å; L12-L15 PolarHBondContact O-N 3.42Å; L12-F16 WeakPolarHBondContact O-CB 3.27Å; L12-F16 PolarHBondContact O-N 2.9Å; L12-I50 HydrophobicContact CD2-CD1 3.63Å; L12-I50 HydrophobicContact CD2-CG1 4.5Å; L12-I50 HydrophobicContact CG-CD1 4.12Å
13	E	78.8	Confident	76.2	Confident	118 Å²	118	79.7 Å²	79.7	55%	0.551	42%	0.42	S	S	*	.	H	α-helix	trans	-63.2	-43.4	175.6	-76.6	177.1	176.5	0	0	111.7	V9 L10 L15 F16 A17	V9-E13 HydrophobicContact CG1-CG 4.38Å; V9-E13 WeakPolarHBondContact O-CB 3.41Å; V9-E13 WeakPolarHBondContact O-CG 3.29Å; V9-E13 PolarHBondContact O-N 3.04Å; L10-E13 PolarHBondContact O-N 3Å; E13-L15 VanDerWaalsContact C-N 3.33Å; E13-L15 PolarHBondContact O-N 2.91Å; E13-F16 PolarHBondContact O-N 3.17Å; E13-A17 WeakPolarHBondContact O-CB 3.24Å; E13-A17 PolarHBondContact O-N 2.89Å
14	K	80	Confident	76.4	Confident	117 Å²	117	80.1 Å²	80.1	51%	0.509	41%	0.412	S	S	.	.	H	α-helix	trans	-60.3	-44.1	173.6	-74.2	173.8	-176.8	175.3	0	111.5	L10 Q11 F16 A17 L18	L10-K14 WeakPolarHBondContact O-CG 3.47Å; L10-K14 PolarHBondContact O-N 3.12Å; Q11-K14 PolarHBondContact O-N 3.13Å; K14-F16 VanDerWaalsContact C-N 3.33Å; K14-F16 PolarHBondContact O-N 2.9Å; K14-A17 PolarHBondContact O-N 2.97Å; K14-L18 WeakPolarHBondContact O-CB 3.47Å; K14-L18 WeakPolarHBondContact O-CG 3.5Å; K14-L18 PolarHBondContact O-N 2.92Å
15	L	78.7	Confident	76.6	Confident	35 Å²	35	83.5 Å²	83.5	18%	0.183	42%	0.42	C	S	.	.	H	α-helix	trans	-59.8	-45.7	177.7	-167.1	60.2	0	0	0	111.5	Q11 L12 E13 L18 A19 F43 C46 I50	Q11-L15 WeakPolarHBondContact O-CB 3.49Å; Q11-L15 PolarHBondContact O-N 3.21Å; L12-L15 WeakPolarHBondContact O-CB 3.35Å; L12-L15 PolarHBondContact O-N 3.42Å; E13-L15 VanDerWaalsContact C-N 3.33Å; E13-L15 PolarHBondContact O-N 2.91Å; L15-L18 PolarHBondContact O-N 3.45Å; L15-A19 WeakPolarHBondContact O-CB 3.28Å; L15-A19 PolarHBondContact O-N 2.88Å; L15-F43 HydrophobicContact CD1-CD1 3.32Å; L15-F43 HydrophobicContact CD1-CE1 3.94Å; L15-F43 HydrophobicContact CD1-CG 4.28Å; L15-F43 HydrophobicContact CG-CD1 4.08Å; L15-F43 HydrophobicContact CG-CE1 4.31Å; L15-C46 HydrophobicContact CD1-CB 3.58Å; L15-I50 HydrophobicContact CD2-CD1 3.91Å
16	F	75.5	Confident	76.5	Confident	154 Å²	154	80.8 Å²	80.8	68%	0.675	41%	0.407	S	S	*	.	H	α-helix	trans	-64.8	-42.5	179.3	-174.4	-97	0	0	0	112.1	L12 E13 K14 A19 K20	L12-F16 WeakPolarHBondContact O-CB 3.27Å; L12-F16 PolarHBondContact O-N 2.9Å; E13-F16 PolarHBondContact O-N 3.17Å; K14-F16 VanDerWaalsContact C-N 3.33Å; K14-F16 PolarHBondContact O-N 2.9Å; F16-A19 WeakPolarHBondContact O-CB 3.39Å; F16-A19 PolarHBondContact O-N 3.16Å; F16-K20 WeakPolarHBondContact O-CB 3.32Å; F16-K20 PolarHBondContact O-N 3.33Å
17	A	79.8	Confident	76.3	Confident	60 Å²	60	77.4 Å²	77.4	50%	0.496	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-43.9	177	0	0	0	0	0	112.1	E13 K14 A19 K20 L21	E13-A17 WeakPolarHBondContact O-CB 3.24Å; E13-A17 PolarHBondContact O-N 2.89Å; K14-A17 PolarHBondContact O-N 2.97Å; A17-A19 VanDerWaalsContact C-N 3.32Å; A17-K20 PolarHBondContact O-N 3.47Å; A17-L21 WeakPolarHBondContact O-CB 3.34Å; A17-L21 PolarHBondContact O-N 3.29Å
18	L	76.9	Confident	76	Confident	59 Å²	59	80.3 Å²	80.3	31%	0.309	43%	0.425	S	S	.	.	H	α-helix	trans	-61.5	-43	174	-74.3	170.8	0	0	0	111	K14 L15 K20 L21 V22 L42	K14-L18 WeakPolarHBondContact O-CB 3.47Å; K14-L18 WeakPolarHBondContact O-CG 3.5Å; K14-L18 PolarHBondContact O-N 2.92Å; L15-L18 PolarHBondContact O-N 3.45Å; L18-K20 VanDerWaalsContact C-N 3.34Å; L18-K20 PolarHBondContact O-N 3.04Å; L18-L21 PolarHBondContact O-N 3.3Å; L18-V22 WeakPolarHBondContact O-CB 3.46Å; L18-V22 WeakPolarHBondContact O-CG2 3.33Å; L18-V22 PolarHBondContact O-N 2.85Å; L18-L42 HydrophobicContact CD1-CB 4.38Å; L18-L42 HydrophobicContact CD2-CD1 4.31Å
19	A	76.2	Confident	75.6	Confident	29 Å²	29	82 Å²	82	24%	0.24	44%	0.435	C	S	.	.	H	α-helix	trans	-59.9	-45.6	178.8	0	0	0	0	0	113.2	L15 F16 A17 V22 S23 F43	L15-A19 WeakPolarHBondContact O-CB 3.28Å; L15-A19 PolarHBondContact O-N 2.88Å; F16-A19 WeakPolarHBondContact O-CB 3.39Å; F16-A19 PolarHBondContact O-N 3.16Å; A17-A19 VanDerWaalsContact C-N 3.32Å; A19-V22 PolarHBondContact O-N 3.04Å; A19-S23 VanDerWaalsContact O-CB 3.31Å; A19-S23 WeakPolarHBondContact O-CB 3.38Å; A19-S23 PolarHBondContact O-N 3.4Å; A19-F43 HydrophobicContact CB-CE1 3.46Å; A19-F43 VanDerWaalsContact CB-CE1 3.46Å; A19-F43 HydrophobicContact CB-CZ 3.34Å
20	K	77.1	Confident	75	Confident	120 Å²	120	83.2 Å²	83.2	52%	0.522	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-47.6	177.6	-175.8	173.4	174.8	176.5	0	111	F16 A17 L18 V22 S23 E24	F16-K20 WeakPolarHBondContact O-CB 3.32Å; F16-K20 PolarHBondContact O-N 3.33Å; A17-K20 PolarHBondContact O-N 3.47Å; L18-K20 VanDerWaalsContact C-N 3.34Å; L18-K20 PolarHBondContact O-N 3.04Å; K20-V22 VanDerWaalsContact C-N 3.31Å; K20-V22 PolarHBondContact O-N 3.22Å; K20-S23 PolarHBondContact O-N 2.86Å; K20-E24 WeakPolarHBondContact CE-OE1 3.43Å; K20-E24 HydrophobicContact CG-CG 4.49Å; K20-E24 WeakPolarHBondContact CG-OE1 3.33Å; K20-E24 WeakPolarHBondContact O-CB 3.39Å; K20-E24 WeakPolarHBondContact O-CG 3.48Å; K20-E24 PolarHBondContact O-N 3.47Å
21	L	76.9	Confident	74.3	Confident	95 Å²	95	83.2 Å²	83.2	50%	0.497	46%	0.456	S	S	.	.	H	α-helix	trans	-58.8	-44.2	178.6	-169.3	88.7	0	0	0	111.6	A17 L18 R25	A17-L21 WeakPolarHBondContact O-CB 3.34Å; A17-L21 PolarHBondContact O-N 3.29Å; L18-L21 PolarHBondContact O-N 3.3Å; L21-R25 WeakPolarHBondContact O-CB 3.31Å; L21-R25 WeakPolarHBondContact O-CG 3.01Å; L21-R25 PolarHBondContact O-N 3.26Å
22	V	76.4	Confident	73.9	Confident	24 Å²	24	84.7 Å²	84.7	15%	0.145	46%	0.464	C	S	.	.	H	α-helix	trans	-67.3	-45	179.5	171.4	0	0	0	0	110.4	L18 A19 K20 E24 R25 C26 A39	L18-V22 WeakPolarHBondContact O-CB 3.46Å; L18-V22 WeakPolarHBondContact O-CG2 3.33Å; L18-V22 PolarHBondContact O-N 2.85Å; A19-V22 PolarHBondContact O-N 3.04Å; K20-V22 VanDerWaalsContact C-N 3.31Å; K20-V22 PolarHBondContact O-N 3.22Å; V22-E24 VanDerWaalsContact C-N 3.34Å; V22-E24 PolarHBondContact O-N 3.02Å; V22-R25 PolarHBondContact O-N 2.85Å; V22-C26 VanDerWaalsContact O-CB 3.3Å; V22-C26 WeakPolarHBondContact O-CB 3.35Å; V22-C26 PolarHBondContact O-N 3.27Å; V22-C26 PolarHBondContact O-SG 2.9Å; V22-A39 HydrophobicContact CB-CB 3.88Å; V22-A39 HydrophobicContact CG1-CB 3.31Å; V22-A39 HydrophobicContact CG2-CB 3.27Å
23	S	71.9	Confident	73.3	Confident	82 Å²	82	87.8 Å²	87.8	57%	0.573	48%	0.477	S	S	*	.	H	α-helix	trans	-58.9	-45.7	177	-173.6	0	0	0	0	111.6	A19 K20 C26 A27	A19-S23 VanDerWaalsContact O-CB 3.31Å; A19-S23 WeakPolarHBondContact O-CB 3.38Å; A19-S23 PolarHBondContact O-N 3.4Å; K20-S23 PolarHBondContact O-N 2.86Å; S23-C26 PolarHBondContact O-N 2.88Å; S23-A27 WeakPolarHBondContact O-CB 3.26Å; S23-A27 PolarHBondContact O-N 3.07Å
24	E	75.1	Confident	72.7	Confident	99 Å²	99	88.7 Å²	88.7	46%	0.463	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-42.2	177.3	-72.8	173.1	-176.2	0	0	111.5	K20 V22 A27 L28	K20-E24 WeakPolarHBondContact CE-OE1 3.43Å; K20-E24 HydrophobicContact CG-CG 4.49Å; K20-E24 WeakPolarHBondContact CG-OE1 3.33Å; K20-E24 WeakPolarHBondContact O-CB 3.39Å; K20-E24 WeakPolarHBondContact O-CG 3.48Å; K20-E24 PolarHBondContact O-N 3.47Å; V22-E24 VanDerWaalsContact C-N 3.34Å; V22-E24 PolarHBondContact O-N 3.02Å; E24-A27 PolarHBondContact O-N 3.23Å; E24-L28 WeakPolarHBondContact O-CG 3.43Å; E24-L28 PolarHBondContact O-N 3.45Å
25	R	71.8	Confident	72	Confident	142 Å²	142	85.5 Å²	85.5	54%	0.536	48%	0.476	S	S	.	.	H	α-helix	trans	-70	-39.6	178.6	-71.1	-69.1	-177.3	177.7	-0.1	113	L21 V22 A27 L28 D29 V35	L21-R25 WeakPolarHBondContact O-CB 3.31Å; L21-R25 WeakPolarHBondContact O-CG 3.01Å; L21-R25 PolarHBondContact O-N 3.26Å; V22-R25 PolarHBondContact O-N 2.85Å; R25-A27 VanDerWaalsContact C-N 3.31Å; R25-L28 PolarHBondContact O-N 3.41Å; R25-D29 PolarHBondContact O-N 2.89Å; R25-V35 HydrophobicContact CB-CG1 4.41Å
26	C	71.2	Confident	71.3	Confident	25 Å²	25	87.7 Å²	87.7	17%	0.169	49%	0.485	C	S	.	.	H	α-helix	trans	-69.5	-30.8	177.4	-66.1	0	0	0	0	112	V22 S23 L28 D29 Q36	V22-C26 VanDerWaalsContact O-CB 3.3Å; V22-C26 WeakPolarHBondContact O-CB 3.35Å; V22-C26 PolarHBondContact O-N 3.27Å; V22-C26 PolarHBondContact O-SG 2.9Å; S23-C26 PolarHBondContact O-N 2.88Å; C26-L28 VanDerWaalsContact C-N 3.31Å; C26-D29 CarbonylContact O-C 3.54Å; C26-Q36 WeakPolarHBondContact SG-CG 3.35Å
27	A	71.7	Confident	71	Confident	84 Å²	84	82.1 Å²	82.1	69%	0.694	47%	0.47	S	S	*	.	H	α-helix	trans	-68.2	-31	173.4	0	0	0	0	0	112.5	S23 E24 R25	S23-A27 WeakPolarHBondContact O-CB 3.26Å; S23-A27 PolarHBondContact O-N 3.07Å; E24-A27 PolarHBondContact O-N 3.23Å; R25-A27 VanDerWaalsContact C-N 3.31Å
28	L	71.7	Confident	70.5	Confident	139 Å²	139	83 Å²	83	73%	0.728	47%	0.47	S	S	*	.	H	α-helix	trans	-78.5	-34.9	179.3	-71	171.5	0	0	0	113.3	E24 R25 C26	E24-L28 WeakPolarHBondContact O-CG 3.43Å; E24-L28 PolarHBondContact O-N 3.45Å; R25-L28 PolarHBondContact O-N 3.41Å; C26-L28 VanDerWaalsContact C-N 3.31Å
29	D	67.2	Low	70.2	Confident	71 Å²	71	80.5 Å²	80.5	38%	0.38	46%	0.457	S	S	.	.			trans	-149.5	100.2	178	-172.2	-4.3	0	0	0	110.8	R25 C26 A31 L32	R25-D29 PolarHBondContact O-N 2.89Å; C26-D29 CarbonylContact O-C 3.54Å; D29-A31 PolarHBondContact O-N 2.94Å; D29-A31 VanDerWaalsContact O-N 3.16Å; D29-A31 WeakPolarHBondContact OD1-CA 3.47Å; D29-A31 WeakPolarHBondContact OD1-CB 3.45Å; D29-A31 PolarHBondContact OD1-N 3.32Å; D29-L32 HydrophobicContact CB-CD1 3.75Å; D29-L32 HydrophobicContact CB-CG 3.92Å; D29-L32 WeakPolarHBondContact O-CB 3.47Å; D29-L32 PolarHBondContact O-N 3.07Å; D29-L32 VanDerWaalsContact O-N 3.15Å
30	P	64.1	Low	70	Confident	100 Å²	100	82.7 Å²	82.7	65%	0.649	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-19.1	175.8	-20.4	31.3	0	0	0	113.3	L32	P30-L32 PolarHBondContact O-N 3.44Å
31	A	66.6	Low	69.8	Low	83 Å²	83	83.2 Å²	83.2	69%	0.686	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-1.9	179.2	0	0	0	0	0	113	D29 E33	D29-A31 PolarHBondContact O-N 2.94Å; D29-A31 VanDerWaalsContact O-N 3.16Å; D29-A31 WeakPolarHBondContact OD1-CA 3.47Å; D29-A31 WeakPolarHBondContact OD1-CB 3.45Å; D29-A31 PolarHBondContact OD1-N 3.32Å; A31-E33 PolarHBondContact O-N 3.38Å
32	L	66.2	Low	69.6	Low	58 Å²	58	82 Å²	82	30%	0.304	47%	0.465	S	S	.	.			trans	-77.2	52.6	171.4	-71.1	168.5	0	0	0	112	D29 P30 N34 V35 Q36	D29-L32 HydrophobicContact CB-CD1 3.75Å; D29-L32 HydrophobicContact CB-CG 3.92Å; D29-L32 WeakPolarHBondContact O-CB 3.47Å; D29-L32 PolarHBondContact O-N 3.07Å; D29-L32 VanDerWaalsContact O-N 3.15Å; P30-L32 PolarHBondContact O-N 3.44Å; L32-N34 PolarHBondContact O-N 2.79Å; L32-N34 VanDerWaalsContact O-N 3.14Å; L32-V35 HydrophobicContact CB-CB 3.87Å; L32-V35 HydrophobicContact CB-CG2 3.79Å; L32-V35 HydrophobicContact CD1-CG2 4.17Å; L32-V35 HydrophobicContact CD2-CG2 3.79Å; L32-V35 HydrophobicContact CG-CG2 4.15Å; L32-V35 WeakPolarHBondContact O-CA 3.47Å; L32-V35 WeakPolarHBondContact O-CB 3.36Å; L32-V35 PolarHBondContact O-N 3.34Å; L32-Q36 PolarHBondContact O-N 2.89Å
33	E	64.6	Low	69.6	Low	150 Å²	150	84 Å²	84	70%	0.701	47%	0.472	S	S	*	.	H	α-helix	trans	-52.8	-34.9	174.2	-169.2	177.1	-173.8	0	0	111.3	A31 V35 Q36 G37	A31-E33 PolarHBondContact O-N 3.38Å; E33-V35 PolarHBondContact O-N 3.42Å; E33-Q36 PolarHBondContact O-N 3.23Å; E33-G37 PolarHBondContact O-N 3.4Å
34	N	66.2	Low	69.7	Low	137 Å²	137	85.7 Å²	85.7	73%	0.733	47%	0.471	S	S	*	.	H	α-helix	trans	-65.9	-34.6	174.8	-68.7	-23.9	0	0	0	113.3	L32 T38	L32-N34 PolarHBondContact O-N 2.79Å; L32-N34 VanDerWaalsContact O-N 3.14Å; N34-T38 WeakPolarHBondContact O-CB 3.49Å; N34-T38 PolarHBondContact O-N 3.44Å; N34-T38 PolarHBondContact O-OG1 3.03Å
35	V	65.9	Low	69.8	Low	50 Å²	50	86.5 Å²	86.5	30%	0.303	48%	0.475	S	S	.	.	H	α-helix	trans	-75.2	-38.2	177.1	178.9	0	0	0	0	110	R25 L32 E33 T38 A39	R25-V35 HydrophobicContact CB-CG1 4.41Å; L32-V35 HydrophobicContact CB-CB 3.87Å; L32-V35 HydrophobicContact CB-CG2 3.79Å; L32-V35 HydrophobicContact CD1-CG2 4.17Å; L32-V35 HydrophobicContact CD2-CG2 3.79Å; L32-V35 HydrophobicContact CG-CG2 4.15Å; L32-V35 WeakPolarHBondContact O-CA 3.47Å; L32-V35 WeakPolarHBondContact O-CB 3.36Å; L32-V35 PolarHBondContact O-N 3.34Å; E33-V35 PolarHBondContact O-N 3.42Å; V35-T38 PolarHBondContact O-N 2.94Å; V35-A39 WeakPolarHBondContact O-CB 3.47Å; V35-A39 PolarHBondContact O-N 3.49Å
36	Q	65.1	Low	69.9	Low	81 Å²	81	80.2 Å²	80.2	38%	0.379	45%	0.453	S	S	.	.	H	α-helix	trans	-61.4	-46.5	172.5	-70.7	178.8	0.2	0	0	111.5	C26 L32 E33 A39 V40	C26-Q36 WeakPolarHBondContact SG-CG 3.35Å; L32-Q36 PolarHBondContact O-N 2.89Å; E33-Q36 PolarHBondContact O-N 3.23Å; Q36-A39 WeakPolarHBondContact O-CB 3.4Å; Q36-A39 PolarHBondContact O-N 3.43Å; Q36-V40 VanDerWaalsContact O-CG2 3.31Å; Q36-V40 WeakPolarHBondContact O-CG2 3.45Å; Q36-V40 PolarHBondContact O-N 2.99Å
37	G	69.1	Low	70.1	Confident	36 Å²	36	81.4 Å²	81.4	37%	0.371	46%	0.464	S	S	.	.	H	α-helix	trans	-61.1	-46.7	177.4	0	0	0	0	0	112.8	E33 A39 V40 Q41	E33-G37 PolarHBondContact O-N 3.4Å; G37-A39 VanDerWaalsContact C-N 3.31Å; G37-A39 PolarHBondContact O-N 3.21Å; G37-V40 PolarHBondContact O-N 2.87Å; G37-Q41 WeakPolarHBondContact O-CG 3.5Å; G37-Q41 PolarHBondContact O-N 2.86Å; G37-Q41 VanDerWaalsContact O-N 3.14Å
38	T	69.5	Low	70.2	Confident	80 Å²	80	82.6 Å²	82.6	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-63.8	-39.3	177.3	-52.4	0	0	0	0	111.4	N34 V35 Q41 L42	N34-T38 WeakPolarHBondContact O-CB 3.49Å; N34-T38 PolarHBondContact O-N 3.44Å; N34-T38 PolarHBondContact O-OG1 3.03Å; V35-T38 PolarHBondContact O-N 2.94Å; T38-Q41 PolarHBondContact O-N 3.27Å; T38-L42 HydrophobicContact CG2-CD1 4.39Å; T38-L42 WeakPolarHBondContact O-CG 3.47Å; T38-L42 PolarHBondContact O-N 3.43Å; T38-L42 VanDerWaalsContact O-N 3.07Å
39	A	69.3	Low	70.4	Confident	5 Å²	5	78.5 Å²	78.5	4%	0.041	43%	0.434	C	S	.	.	H	α-helix	trans	-61.9	-50.2	176.9	0	0	0	0	0	112.2	V22 V35 Q36 G37 Q41 L42 F43	V22-A39 HydrophobicContact CB-CB 3.88Å; V22-A39 HydrophobicContact CG1-CB 3.31Å; V22-A39 HydrophobicContact CG2-CB 3.27Å; V35-A39 WeakPolarHBondContact O-CB 3.47Å; V35-A39 PolarHBondContact O-N 3.49Å; Q36-A39 WeakPolarHBondContact O-CB 3.4Å; Q36-A39 PolarHBondContact O-N 3.43Å; G37-A39 VanDerWaalsContact C-N 3.31Å; G37-A39 PolarHBondContact O-N 3.21Å; A39-Q41 VanDerWaalsContact C-N 3.26Å; A39-Q41 PolarHBondContact O-N 3.49Å; A39-L42 WeakPolarHBondContact O-CB 3.39Å; A39-L42 PolarHBondContact O-N 3.05Å; A39-L42 VanDerWaalsContact O-N 3.08Å; A39-F43 HydrophobicContact CB-CD2 4.31Å; A39-F43 HydrophobicContact CB-CE2 4.27Å; A39-F43 WeakPolarHBondContact O-CD2 3.17Å; A39-F43 PolarHBondContact O-N 3.4Å
40	V	71.9	Confident	70.8	Confident	75 Å²	75	76.4 Å²	76.4	46%	0.455	42%	0.423	S	S	.	.	H	α-helix	trans	-57	-42.9	179	171.9	0	0	0	0	110.5	Q36 G37 L42 F43 E44	Q36-V40 VanDerWaalsContact O-CG2 3.31Å; Q36-V40 WeakPolarHBondContact O-CG2 3.45Å; Q36-V40 PolarHBondContact O-N 2.99Å; G37-V40 PolarHBondContact O-N 2.87Å; V40-L42 PolarHBondContact O-N 3.5Å; V40-F43 WeakPolarHBondContact O-CB 3.18Å; V40-F43 PolarHBondContact O-N 3.12Å; V40-E44 HydrophobicContact CG1-CG 4.35Å; V40-E44 WeakPolarHBondContact O-CB 3.47Å; V40-E44 WeakPolarHBondContact O-CG 3.49Å; V40-E44 PolarHBondContact O-N 3.06Å
41	Q	73.3	Confident	71.2	Confident	131 Å²	131	77.6 Å²	77.6	61%	0.612	42%	0.419	S	S	*	.	H	α-helix	trans	-60.3	-44.8	175.2	-72.5	178.4	-2.5	0	0	112.5	G37 T38 A39 F43 E44 E45	G37-Q41 WeakPolarHBondContact O-CG 3.5Å; G37-Q41 PolarHBondContact O-N 2.86Å; G37-Q41 VanDerWaalsContact O-N 3.14Å; T38-Q41 PolarHBondContact O-N 3.27Å; A39-Q41 VanDerWaalsContact C-N 3.26Å; A39-Q41 PolarHBondContact O-N 3.49Å; Q41-F43 VanDerWaalsContact C-N 3.31Å; Q41-F43 PolarHBondContact O-N 3.07Å; Q41-E44 PolarHBondContact O-N 3.08Å; Q41-E45 WeakPolarHBondContact O-CB 3.46Å; Q41-E45 PolarHBondContact O-N 3.46Å
42	L	72.4	Confident	71.8	Confident	69 Å²	69	78.3 Å²	78.3	36%	0.361	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-36.5	176.5	-70.5	171.1	0	0	0	112.3	L18 T38 A39 V40 C46	L18-L42 HydrophobicContact CD1-CB 4.38Å; L18-L42 HydrophobicContact CD2-CD1 4.31Å; T38-L42 HydrophobicContact CG2-CD1 4.39Å; T38-L42 WeakPolarHBondContact O-CG 3.47Å; T38-L42 PolarHBondContact O-N 3.43Å; T38-L42 VanDerWaalsContact O-N 3.07Å; A39-L42 WeakPolarHBondContact O-CB 3.39Å; A39-L42 PolarHBondContact O-N 3.05Å; A39-L42 VanDerWaalsContact O-N 3.08Å; V40-L42 PolarHBondContact O-N 3.5Å; L42-C46 WeakPolarHBondContact O-CB 3.31Å; L42-C46 PolarHBondContact O-N 2.95Å
43	F	75.9	Confident	72.1	Confident	66 Å²	66	77 Å²	77	29%	0.289	40%	0.4	S	S	.	.	H	α-helix	trans	-64.6	-46.1	174.3	-80.9	-69.4	0	0	0	112	L15 A19 A39 V40 Q41 C46 A47	L15-F43 HydrophobicContact CD1-CD1 3.32Å; L15-F43 HydrophobicContact CD1-CE1 3.94Å; L15-F43 HydrophobicContact CD1-CG 4.28Å; L15-F43 HydrophobicContact CG-CD1 4.08Å; L15-F43 HydrophobicContact CG-CE1 4.31Å; A19-F43 HydrophobicContact CB-CE1 3.46Å; A19-F43 VanDerWaalsContact CB-CE1 3.46Å; A19-F43 HydrophobicContact CB-CZ 3.34Å; A39-F43 HydrophobicContact CB-CD2 4.31Å; A39-F43 HydrophobicContact CB-CE2 4.27Å; A39-F43 WeakPolarHBondContact O-CD2 3.17Å; A39-F43 PolarHBondContact O-N 3.4Å; V40-F43 WeakPolarHBondContact O-CB 3.18Å; V40-F43 PolarHBondContact O-N 3.12Å; Q41-F43 VanDerWaalsContact C-N 3.31Å; Q41-F43 PolarHBondContact O-N 3.07Å; F43-C46 PolarHBondContact O-N 3.3Å; F43-A47 VanDerWaalsContact O-CB 3.24Å; F43-A47 WeakPolarHBondContact O-CB 3.38Å; F43-A47 PolarHBondContact O-N 2.87Å
44	E	74.9	Confident	72.5	Confident	118 Å²	118	72.6 Å²	72.6	55%	0.551	39%	0.385	S	S	*	.	H	α-helix	trans	-61.8	-47.5	177.6	-73.9	176.5	169.6	0	0	110.9	V40 Q41 C46 A47 E48	V40-E44 HydrophobicContact CG1-CG 4.35Å; V40-E44 WeakPolarHBondContact O-CB 3.47Å; V40-E44 WeakPolarHBondContact O-CG 3.49Å; V40-E44 PolarHBondContact O-N 3.06Å; Q41-E44 PolarHBondContact O-N 3.08Å; E44-C46 VanDerWaalsContact C-N 3.34Å; E44-C46 PolarHBondContact O-N 3.34Å; E44-A47 PolarHBondContact O-N 3.14Å; E44-E48 WeakPolarHBondContact O-CG 3.2Å; E44-E48 PolarHBondContact O-N 3.47Å
45	E	76.4	Confident	72.7	Confident	117 Å²	117	69 Å²	69	55%	0.547	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-42.9	178.3	-172.9	-178.6	177	0	0	111.9	Q41 E48 N49	Q41-E45 WeakPolarHBondContact O-CB 3.46Å; Q41-E45 PolarHBondContact O-N 3.46Å; E45-E48 PolarHBondContact O-N 3.41Å; E45-N49 VanDerWaalsContact O-CG 3.3Å; E45-N49 PolarHBondContact O-N 3.45Å; E45-N49 PolarHBondContact O-ND2 2.88Å
46	C	75.1	Confident	72.7	Confident	10 Å²	10	72.7 Å²	72.7	7%	0.068	38%	0.384	C	S	.	.	H	α-helix	trans	-70.8	-39.7	178.3	-169.7	0	0	0	0	112.1	Q11 L15 L42 F43 E44 E48 N49 I50	Q11-C46 PolarHBondContact O-SG 2.85Å; L15-C46 HydrophobicContact CD1-CB 3.58Å; L42-C46 WeakPolarHBondContact O-CB 3.31Å; L42-C46 PolarHBondContact O-N 2.95Å; F43-C46 PolarHBondContact O-N 3.3Å; E44-C46 VanDerWaalsContact C-N 3.34Å; E44-C46 PolarHBondContact O-N 3.34Å; C46-E48 VanDerWaalsContact C-N 3.32Å; C46-E48 PolarHBondContact O-N 3.33Å; C46-N49 PolarHBondContact O-N 2.88Å; C46-N49 VanDerWaalsContact O-N 3.16Å; C46-I50 WeakPolarHBondContact O-CG1 3.42Å; C46-I50 PolarHBondContact O-N 3.3Å
47	A	74.1	Confident	72.3	Confident	49 Å²	49	73.3 Å²	73.3	41%	0.405	39%	0.39	S	S	.	.	H	α-helix	trans	-62	-40.1	174.3	0	0	0	0	0	111.6	F43 E44 I50 H51	F43-A47 VanDerWaalsContact O-CB 3.24Å; F43-A47 WeakPolarHBondContact O-CB 3.38Å; F43-A47 PolarHBondContact O-N 2.87Å; E44-A47 PolarHBondContact O-N 3.14Å; A47-I50 PolarHBondContact O-N 2.94Å; A47-H51 VanDerWaalsContact O-CB 3.3Å; A47-H51 WeakPolarHBondContact O-CB 3.18Å; A47-H51 PolarHBondContact O-N 3.36Å
48	E	75.3	Confident	71.6	Confident	110 Å²	110	78 Å²	78	51%	0.514	41%	0.406	S	S	.	.	H	α-helix	trans	-61.4	-41.9	172.1	-77.3	-171.7	-171.5	0	0	112.2	E44 E45 C46 H51 K52	E44-E48 WeakPolarHBondContact O-CG 3.2Å; E44-E48 PolarHBondContact O-N 3.47Å; E45-E48 PolarHBondContact O-N 3.41Å; C46-E48 VanDerWaalsContact C-N 3.32Å; C46-E48 PolarHBondContact O-N 3.33Å; E48-H51 PolarHBondContact O-N 2.93Å; E48-K52 WeakPolarHBondContact O-CB 3.38Å; E48-K52 VanDerWaalsContact O-CG 3.28Å; E48-K52 WeakPolarHBondContact O-CG 3.48Å; E48-K52 PolarHBondContact O-N 3.44Å; E48-K52 IonicContact OE2-NZ 3.8Å
49	N	75.8	Confident	70.7	Confident	52 Å²	52	83 Å²	83	28%	0.278	42%	0.423	S	S	.	.	H	α-helix	trans	-65.8	-42.5	177.6	-72.8	-26.1	0	0	0	111.8	E45 C46 H51 K52 I53	E45-N49 VanDerWaalsContact O-CG 3.3Å; E45-N49 PolarHBondContact O-N 3.45Å; E45-N49 PolarHBondContact O-ND2 2.88Å; C46-N49 PolarHBondContact O-N 2.88Å; C46-N49 VanDerWaalsContact O-N 3.16Å; N49-H51 VanDerWaalsContact C-N 3.34Å; N49-K52 PolarHBondContact O-N 3.49Å; N49-I53 VanDerWaalsContact O-CG1 3.27Å; N49-I53 WeakPolarHBondContact O-CG1 3.47Å; N49-I53 PolarHBondContact O-N 3.33Å
50	I	74.8	Confident	69.7	Low	28 Å²	28	92 Å²	92	14%	0.144	47%	0.465	C	S	.	.	H	α-helix	trans	-59.8	-46.3	172.5	-71.7	163	0	0	0	110.3	L8 Q11 L12 L15 C46 A47 K52 I53 C54	L8-I50 HydrophobicContact CD1-CB 4.37Å; L8-I50 HydrophobicContact CD1-CG1 4.29Å; L8-I50 HydrophobicContact CD1-CG2 3.84Å; Q11-I50 HydrophobicContact CB-CG1 4.1Å; L12-I50 HydrophobicContact CD2-CD1 3.63Å; L12-I50 HydrophobicContact CD2-CG1 4.5Å; L12-I50 HydrophobicContact CG-CD1 4.12Å; L15-I50 HydrophobicContact CD2-CD1 3.91Å; C46-I50 WeakPolarHBondContact O-CG1 3.42Å; C46-I50 PolarHBondContact O-N 3.3Å; A47-I50 PolarHBondContact O-N 2.94Å; I50-K52 VanDerWaalsContact C-N 3.34Å; I50-K52 PolarHBondContact O-N 2.86Å; I50-I53 PolarHBondContact O-N 3.15Å; I50-C54 WeakPolarHBondContact O-CB 3.3Å; I50-C54 PolarHBondContact O-N 3.27Å; I50-C54 PolarHBondContact O-SG 2.94Å
51	H	73.7	Confident	68.5	Low	124 Å²	124	90.9 Å²	90.9	57%	0.574	47%	0.469	S	S	*	.	H	α-helix	trans	-61.8	-40	177.9	-174.1	-99.6	0	0	0	112	A47 E48 N49 C54 N55	A47-H51 VanDerWaalsContact O-CB 3.3Å; A47-H51 WeakPolarHBondContact O-CB 3.18Å; A47-H51 PolarHBondContact O-N 3.36Å; E48-H51 PolarHBondContact O-N 2.93Å; N49-H51 VanDerWaalsContact C-N 3.34Å; H51-C54 PolarHBondContact O-N 3.36Å; H51-N55 PolarHBondContact CD2-ND2 3.47Å; H51-N55 PolarHBondContact CE1-ND2 3.24Å; H51-N55 VanDerWaalsContact CG-ND2 3.33Å; H51-N55 PolarHBondContact ND1-ND2 2.87Å; H51-N55 VanDerWaalsContact ND1-ND2 3.13Å; H51-N55 PolarHBondContact NE2-ND2 2.92Å; H51-N55 WeakPolarHBondContact O-CB 3.35Å; H51-N55 PolarHBondContact O-N 2.96Å; H51-N55 PolarHBondContact O-ND2 2.76Å
52	K	77.7	Confident	67.3	Low	99 Å²	99	90.7 Å²	90.7	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-45.5	173	-73.6	167.1	-170	158.7	0	111.3	E48 N49 I50 C54 N55 N56	E48-K52 WeakPolarHBondContact O-CB 3.38Å; E48-K52 VanDerWaalsContact O-CG 3.28Å; E48-K52 WeakPolarHBondContact O-CG 3.48Å; E48-K52 PolarHBondContact O-N 3.44Å; E48-K52 IonicContact OE2-NZ 3.8Å; N49-K52 PolarHBondContact O-N 3.49Å; I50-K52 VanDerWaalsContact C-N 3.34Å; I50-K52 PolarHBondContact O-N 2.86Å; K52-C54 VanDerWaalsContact C-N 3.32Å; K52-C54 PolarHBondContact O-N 3.1Å; K52-N55 PolarHBondContact O-N 2.84Å; K52-N56 WeakPolarHBondContact O-CB 3.32Å; K52-N56 PolarHBondContact O-N 3Å; K52-N56 PolarHBondContact O-ND2 3.37Å
53	I	73.1	Confident	66	Low	31 Å²	31	95.2 Å²	95.2	16%	0.159	50%	0.502	C	S	.	.	H	α-helix	trans	-61.8	-42.4	177.7	-66.5	162.1	0	0	0	110.7	E7 L8 Q11 N49 I50 N57	E7-I53 HydrophobicContact CG-CD1 3.91Å; L8-I53 HydrophobicContact CB-CG2 4.14Å; L8-I53 HydrophobicContact CD1-CB 4.42Å; L8-I53 HydrophobicContact CD1-CG2 4.15Å; Q11-I53 HydrophobicContact CG-CD1 4.01Å; N49-I53 VanDerWaalsContact O-CG1 3.27Å; N49-I53 WeakPolarHBondContact O-CG1 3.47Å; N49-I53 PolarHBondContact O-N 3.33Å; I50-I53 PolarHBondContact O-N 3.15Å; I53-N57 PolarHBondContact O-ND2 3.45Å
54	C	73	Confident	64.5	Low	57 Å²	57	97.5 Å²	97.5	39%	0.385	53%	0.527	S	S	.	.	H	α-helix	trans	-67.3	-42.7	178.8	-69	0	0	0	0	112.4	I50 H51 K52	I50-C54 WeakPolarHBondContact O-CB 3.3Å; I50-C54 PolarHBondContact O-N 3.27Å; I50-C54 PolarHBondContact O-SG 2.94Å; H51-C54 PolarHBondContact O-N 3.36Å; K52-C54 VanDerWaalsContact C-N 3.32Å; K52-C54 PolarHBondContact O-N 3.1Å
55	N	71.2	Confident	63.1	Low	60 Å²	60	98.3 Å²	98.3	32%	0.321	54%	0.539	S	S	.	.	H	α-helix	trans	-87.9	-21.1	-175.4	-69.6	-50.1	0	0	0	114.9	H51 K52 N57 L58	H51-N55 PolarHBondContact CD2-ND2 3.47Å; H51-N55 PolarHBondContact CE1-ND2 3.24Å; H51-N55 VanDerWaalsContact CG-ND2 3.33Å; H51-N55 PolarHBondContact ND1-ND2 2.87Å; H51-N55 VanDerWaalsContact ND1-ND2 3.13Å; H51-N55 PolarHBondContact NE2-ND2 2.92Å; H51-N55 WeakPolarHBondContact O-CB 3.35Å; H51-N55 PolarHBondContact O-N 2.96Å; H51-N55 PolarHBondContact O-ND2 2.76Å; K52-N55 PolarHBondContact O-N 2.84Å; N55-N57 PolarHBondContact O-N 3.04Å; N55-N57 VanDerWaalsContact O-N 3.16Å; N55-L58 WeakPolarHBondContact O-CB 3.46Å; N55-L58 PolarHBondContact O-N 3.14Å
56	N	65.2	Low	61.5	Low	129 Å²	129	95.4 Å²	95.4	69%	0.69	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-12.5	170.8	-73.6	-17.1	0	0	0	112.1	K52	K52-N56 WeakPolarHBondContact O-CB 3.32Å; K52-N56 PolarHBondContact O-N 3Å; K52-N56 PolarHBondContact O-ND2 3.37Å
57	N	55.6	Low	60.2	Low	94 Å²	94	105 Å²	105	50%	0.503	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.4	0.2	168.9	-59.5	-56.7	0	0	0	113.3	N4 I53 N55	N4-N57 PolarHBondContact ND2-OD1 3.12Å; I53-N57 PolarHBondContact O-ND2 3.45Å; N55-N57 PolarHBondContact O-N 3.04Å; N55-N57 VanDerWaalsContact O-N 3.16Å
58	L	54.5	Low	58.9	Low	134 Å²	134	106 Å²	106	70%	0.702	60%	0.596	S	S	*	*	S	Bend	trans	-96.9	-9.1	-176.4	-127.4	100.6	0	0	0	114.3	N55	N55-L58 WeakPolarHBondContact O-CB 3.46Å; N55-L58 PolarHBondContact O-N 3.14Å
59	E	51.3	Low	57.6	Low	184 Å²	184	109.3 Å²	109.3	86%	0.86	61%	0.612	S	S	*	*	S	Bend	trans	-93.7	5.2	-177.1	-80.8	-156.8	143.8	0	0	116.1
60	E	48.1	Very low	56.5	Low	195 Å²	195	114.7 Å²	114.7	91%	0.911	64%	0.641	S	S	*	*			trans	-106.9	29.4	173.8	-69.7	-166.8	164.2	0	0	114.1
61	G	46.5	Very low	55.5	Low	52 Å²	52	122.2 Å²	122.2	54%	0.536	68%	0.675	S	S	.	*	S	Bend	trans	-88.6	129.4	160.4	0	0	0	0	0	109.6	L63	G61-L63 PolarHBondContact O-N 2.93Å; G61-L63 VanDerWaalsContact O-N 3.12Å
62	P	48	Very low	54.4	Low	126 Å²	126	125.2 Å²	125.2	82%	0.818	69%	0.69	S	S	*	*			trans	-57.6	125.4	178.8	23.8	-31.8	0	0	0	109.2	S64	P62-S64 PolarHBondContact O-N 3.41Å
63	L	46.8	Very low	52.9	Low	164 Å²	164	126.5 Å²	126.5	86%	0.859	71%	0.708	S	S	*	*			trans	-55.1	91.9	162.4	-75.2	164.8	0	0	0	107.3	G61 T65	G61-L63 PolarHBondContact O-N 2.93Å; G61-L63 VanDerWaalsContact O-N 3.12Å; L63-T65 PolarHBondContact O-N 3.38Å
64	S	43.9	Very low	51.8	Low	115 Å²	115	130 Å²	130	80%	0.804	74%	0.736	S	S	*	*			trans	-70.2	83.1	172.3	-171.9	0	0	0	0	107.4	P62 G66	P62-S64 PolarHBondContact O-N 3.41Å; S64-G66 PolarHBondContact O-N 3.3Å
65	T	44.3	Very low	50.9	Low	134 Å²	134	132.4 Å²	132.4	82%	0.822	75%	0.753	S	S	*	*			trans	-74.8	60.8	164.1	46	0	0	0	0	108	L63	L63-T65 PolarHBondContact O-N 3.38Å
66	G	43.3	Very low	49.8	Very low	56 Å²	56	137.4 Å²	137.4	58%	0.577	78%	0.779	S	S	*	*			trans	-109.2	57	178.7	0	0	0	0	0	111	S64 G68	S64-G66 PolarHBondContact O-N 3.3Å; G66-G68 PolarHBondContact O-N 3.28Å
67	F	47.5	Very low	49.3	Very low	213 Å²	213	138.2 Å²	138.2	93%	0.934	79%	0.789	S	S	*	*			trans	-70.8	74.5	156.6	-87.9	-89.3	0	0	0	107.5
68	G	47.3	Very low	49.1	Very low	68 Å²	68	137.6 Å²	137.6	70%	0.701	79%	0.792	S	S	*	*			trans	-87	99.8	166.1	0	0	0	0	0	107.9	G66 N70	G66-G68 PolarHBondContact O-N 3.28Å; G68-N70 PolarHBondContact O-N 3.42Å
69	E	48.9	Very low	48.8	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	80%	0.8	S	S	*	*			trans	-58.6	113.3	166.5	-55.4	173.1	146.3	0	0	108
70	N	52.1	Low	49.1	Very low	165 Å²	165	140.1 Å²	140.1	88%	0.882	80%	0.796	S	S	*	*			trans	-158.9	125.5	151.4	-90	-54.8	0	0	0	109.8	G68	G68-N70 PolarHBondContact O-N 3.42Å
71	E	52.7	Low	49.4	Very low	187 Å²	187	135.5 Å²	135.5	87%	0.874	79%	0.792	S	S	*	*			trans	-63	131.5	179.1	-63.1	168	99.9	0	0	111.8
72	E	51.5	Low	49.8	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.874	80%	0.798	S	S	*	*				177	139.3	115	-105.6	-171.9	108.5	0	0	110.2
73	P	46	Very low	50.3	Low	126 Å²	126	136.4 Å²	136.4	82%	0.818	80%	0.795	S	S	*	*			trans	-100.1	125.9	-174	35.9	-27.3	0	0	0	112.4
74	S	50	Low	50.7	Low	105 Å²	105	134.7 Å²	134.7	73%	0.734	79%	0.791	S	S	*	*			trans	-160.6	100.9	161.8	58.2	0	0	0	0	108.3
75	S	54.5	Low	51.1	Low	107 Å²	107	137 Å²	137	75%	0.748	79%	0.793	S	S	*	*				100	120.5	84.7	66.3	0	0	0	0	111.4
76	D	48.6	Very low	51.9	Low	164 Å²	164	135.5 Å²	135.5	88%	0.877	78%	0.784	S	S	*	*			trans	56.1	92.9	162	-84.5	-28.3	0	0	0	119.5
77	V	54.4	Low	52.3	Low	147 Å²	147	138.9 Å²	138.9	89%	0.891	80%	0.796	S	S	*	*			trans	-141.1	122.6	140.8	-162.6	0	0	0	0	110.9
78	S	50.2	Low	52.9	Low	80 Å²	80	134.5 Å²	134.5	56%	0.559	79%	0.787	S	S	*	*			trans	-10.7	124.5	170.3	-160	0	0	0	0	119.1	H80	S78-H80 PolarHBondContact O-N 3.43Å; S78-H80 PolarHBondContact OG-CD2 3.03Å; S78-H80 PolarHBondContact OG-NE2 3.09Å; S78-H80 VanDerWaalsContact OG-NE2 3.17Å
79	K	49.7	Very low	53	Low	204 Å²	204	142.2 Å²	142.2	89%	0.887	80%	0.795	S	S	*	*			trans	-73.8	85.6	168.8	-63.7	176.8	-177.7	178.7	0	110.5
80	H	57	Low	53	Low	167 Å²	167	142.3 Å²	142.3	77%	0.773	80%	0.798	S	S	*	*			trans	-102.4	81	157.7	-67.3	-61.6	0	0	0	108.5	S78 A82	S78-H80 PolarHBondContact O-N 3.43Å; S78-H80 PolarHBondContact OG-CD2 3.03Å; S78-H80 PolarHBondContact OG-NE2 3.09Å; S78-H80 VanDerWaalsContact OG-NE2 3.17Å; H80-A82 PolarHBondContact O-N 2.87Å
81	A	53.5	Low	53	Low	99 Å²	99	141.7 Å²	141.7	82%	0.818	79%	0.789	S	S	*	*			trans	-65.3	114.9	165.1	0	0	0	0	0	107.5
82	A	55.3	Low	52.9	Low	80 Å²	80	142.1 Å²	142.1	66%	0.661	79%	0.788	S	S	*	*			trans	-56.9	141.4	170.9	0	0	0	0	0	109.4	H80 V84	H80-A82 PolarHBondContact O-N 2.87Å; A82-V84 PolarHBondContact O-N 3.27Å; A82-V84 VanDerWaalsContact O-N 3.12Å
83	P	58.6	Low	53.2	Low	117 Å²	117	143 Å²	143	76%	0.76	78%	0.784	S	S	*	*			trans	-61.6	119.6	179.5	23.5	-30.6	0	0	0	109.4	L85	P83-L85 PolarHBondContact O-N 2.85Å
84	V	55.9	Low	53.7	Low	127 Å²	127	141.4 Å²	141.4	77%	0.77	77%	0.774	S	S	*	*			trans	-66.8	105.3	170.8	177.8	0	0	0	0	107	A82 T86	A82-V84 PolarHBondContact O-N 3.27Å; A82-V84 VanDerWaalsContact O-N 3.12Å; V84-T86 HydrophobicContact CG1-CG2 4.35Å; V84-T86 PolarHBondContact O-N 2.98Å
85	L	52.8	Low	54	Low	164 Å²	164	141 Å²	141	86%	0.859	78%	0.777	S	S	*	*			trans	-68.2	97.8	170.4	-66.6	173	0	0	0	107.7	P83	P83-L85 PolarHBondContact O-N 2.85Å
86	T	60.8	Low	53.8	Low	103 Å²	103	144.2 Å²	144.2	63%	0.632	78%	0.784	S	S	*	*			trans	-77	139.1	164.7	47.2	0	0	0	0	108	V84 T88	V84-T86 HydrophobicContact CG1-CG2 4.35Å; V84-T86 PolarHBondContact O-N 2.98Å; T86-T88 PolarHBondContact O-N 3.2Å
87	P	50.2	Low	53.8	Low	127 Å²	127	138.5 Å²	138.5	83%	0.825	77%	0.765	S	S	*	*			trans	-63.4	103.8	177.5	22	-29.4	0	0	0	109.2	R89	P87-R89 PolarHBondContact O-N 3.27Å; P87-R89 VanDerWaalsContact O-N 3.17Å
88	T	60.4	Low	53.6	Low	120 Å²	120	141.2 Å²	141.2	74%	0.736	77%	0.768	S	S	*	*			trans	-64.6	113.7	173.3	-50.1	0	0	0	0	107.9	T86 M90	T86-T88 PolarHBondContact O-N 3.2Å; T88-M90 PolarHBondContact O-N 3.23Å; T88-M90 VanDerWaalsContact O-N 3.07Å
89	R	49.8	Very low	53.6	Low	230 Å²	230	146.3 Å²	146.3	87%	0.868	78%	0.78	S	S	*	*			trans	-62.5	109.6	166.4	-74.6	-177	169.5	-176.5	-4.2	107.7	P87 E91	P87-R89 PolarHBondContact O-N 3.27Å; P87-R89 VanDerWaalsContact O-N 3.17Å; R89-E91 PolarHBondContact O-N 3.25Å
90	M	48.7	Very low	53.1	Low	183 Å²	183	140 Å²	140	90%	0.901	77%	0.773	S	S	*	*			trans	-74.7	105	166.8	-73.7	-162.8	-77.9	0	0	107.8	T88 F92	T88-M90 PolarHBondContact O-N 3.23Å; T88-M90 VanDerWaalsContact O-N 3.07Å; M90-F92 PolarHBondContact O-N 3.15Å
91	E	53.3	Low	52.5	Low	152 Å²	152	137.9 Å²	137.9	71%	0.71	77%	0.771	S	S	*	*			trans	-75.8	113.2	165.8	-71.3	-175	177.2	0	0	108.2	R89 R93	R89-E91 PolarHBondContact O-N 3.25Å; E91-R93 PolarHBondContact O-N 3.48Å; E91-R93 VanDerWaalsContact O-N 3.12Å
92	F	50.1	Low	52.3	Low	195 Å²	195	138.5 Å²	138.5	86%	0.855	77%	0.767	S	S	*	*			trans	-71.2	105.5	171.9	-141	-90.6	0	0	0	108.1	M90 P94	M90-F92 PolarHBondContact O-N 3.15Å; F92-P94 WeakPolarHBondContact O-CD 2.9Å
93	R	58.3	Low	51.5	Low	205 Å²	205	141 Å²	141	77%	0.774	77%	0.774	S	S	*	*			trans	-97.2	105.2	166.6	-71.5	-172.9	176.4	-166.3	-1.5	107.1	E91 A95	E91-R93 PolarHBondContact O-N 3.48Å; E91-R93 VanDerWaalsContact O-N 3.12Å; R93-A95 PolarHBondContact O-N 3.15Å; R93-A95 VanDerWaalsContact O-N 3.1Å
94	P	55	Low	50.8	Low	94 Å²	94	139.5 Å²	139.5	61%	0.61	77%	0.771	S	S	*	*			trans	-57.2	123.2	167.3	22.8	-29	0	0	0	106.8	F92 L96	F92-P94 WeakPolarHBondContact O-CD 2.9Å; P94-L96 VanDerWaalsContact C-N 3.29Å; P94-L96 PolarHBondContact O-N 3.38Å
95	A	56.7	Low	50.1	Low	97 Å²	97	142.9 Å²	142.9	80%	0.802	78%	0.776	S	S	*	*			trans	-62	99.6	171.2	0	0	0	0	0	106.5	R93 G97	R93-A95 PolarHBondContact O-N 3.15Å; R93-A95 VanDerWaalsContact O-N 3.1Å; A95-G97 PolarHBondContact O-N 3.27Å
96	L	51.2	Low	49.5	Very low	173 Å²	173	143.9 Å²	143.9	91%	0.906	78%	0.776	S	S	*	*			trans	-69.6	63.5	162.8	-74.9	165	0	0	0	107.4	P94	P94-L96 VanDerWaalsContact C-N 3.29Å; P94-L96 PolarHBondContact O-N 3.38Å
97	G	47.8	Very low	48.6	Very low	45 Å²	45	148 Å²	148	46%	0.464	79%	0.788	S	S	.	*			trans	-75.2	131.7	157.8	0	0	0	0	0	106.8	A95 F99	A95-G97 PolarHBondContact O-N 3.27Å; G97-F99 PolarHBondContact O-N 3.22Å
98	E	49.4	Very low	47.9	Very low	203 Å²	203	150.7 Å²	150.7	95%	0.949	79%	0.792	S	S	*	*			trans	-59.5	79.6	175.7	-69.5	175	144.8	0	0	110.7	G100	E98-G100 VanDerWaalsContact C-N 3.33Å; E98-G100 PolarHBondContact O-N 2.97Å; E98-G100 VanDerWaalsContact O-N 3.08Å
99	F	50.7	Low	46.9	Very low	188 Å²	188	149.5 Å²	149.5	83%	0.825	79%	0.794	S	S	*	*			trans	-77.7	93.1	163.8	-82.6	-85.1	0	0	0	107.2	G97 V101	G97-F99 PolarHBondContact O-N 3.22Å; F99-V101 VanDerWaalsContact C-N 3.35Å; F99-V101 PolarHBondContact O-N 3.25Å
100	G	40.3	Very low	46.3	Very low	72 Å²	72	147.3 Å²	147.3	74%	0.742	79%	0.791	S	S	*	*			trans	-57.6	99.4	164.4	0	0	0	0	0	108.8	E98 P102	E98-G100 VanDerWaalsContact C-N 3.33Å; E98-G100 PolarHBondContact O-N 2.97Å; E98-G100 VanDerWaalsContact O-N 3.08Å; G100-P102 WeakPolarHBondContact O-CD 3.43Å
101	V	44.5	Very low	45.9	Very low	121 Å²	121	150 Å²	150	73%	0.733	79%	0.791	S	S	*	*			trans	-65.7	115.6	174.2	-178.8	0	0	0	0	107.5	F99 V103	F99-V101 VanDerWaalsContact C-N 3.35Å; F99-V101 PolarHBondContact O-N 3.25Å; V101-V103 PolarHBondContact O-N 3.16Å; V101-V103 VanDerWaalsContact O-N 3.13Å
102	P	47.8	Very low	45.1	Very low	113 Å²	113	153.4 Å²	153.4	73%	0.734	80%	0.798	S	S	*	*			trans	-65.9	118.1	169.9	26.1	-29.1	0	0	0	107.5	G100 A104	G100-P102 WeakPolarHBondContact O-CD 3.43Å; P102-A104 PolarHBondContact O-N 2.99Å
103	V	38.9	Very low	44.6	Very low	131 Å²	131	151.6 Å²	151.6	79%	0.794	80%	0.797	S	S	*	*			trans	-66.4	89.3	170.8	-178.3	0	0	0	0	107.3	V101 K105	V101-V103 PolarHBondContact O-N 3.16Å; V101-V103 VanDerWaalsContact O-N 3.13Å; V103-K105 PolarHBondContact O-N 3.49Å
104	A	43.5	Very low	43.5	Very low	86 Å²	86	150.3 Å²	150.3	71%	0.711	81%	0.806	S	S	*	*			trans	-67.5	99.7	169.4	0	0	0	0	0	108.1	P102 E106	P102-A104 PolarHBondContact O-N 2.99Å; A104-E106 VanDerWaalsContact C-N 3.28Å; A104-E106 PolarHBondContact O-N 3.48Å; A104-E106 VanDerWaalsContact O-N 3.11Å
105	K	41.8	Very low	42.5	Very low	198 Å²	198	150.5 Å²	150.5	86%	0.861	81%	0.809	S	S	*	*			trans	-71.7	88.1	159.1	-74.1	178.6	177.3	173.6	0	106.8	V103	V103-K105 PolarHBondContact O-N 3.49Å
106	E	41.1	Very low	41.8	Very low	185 Å²	185	153.6 Å²	153.6	86%	0.864	81%	0.811	S	S	*	*			trans	-139	136.3	169.5	-112.1	174.7	-171.2	0	0	114	A104	A104-E106 VanDerWaalsContact C-N 3.28Å; A104-E106 PolarHBondContact O-N 3.48Å; A104-E106 VanDerWaalsContact O-N 3.11Å
107	E	41.6	Very low	41.2	Very low	191 Å²	191	154.9 Å²	154.9	89%	0.893	81%	0.81	S	S	*	*			trans	-68.5	125.4	-167.1	-142.7	171.9	163.6	0	0	110.3	A109	E107-A109 PolarHBondContact O-N 3.45Å
108	M	34.7	Very low	40.5	Very low	183 Å²	183	163.9 Å²	163.9	90%	0.901	83%	0.83	S	S	*	*			trans	-68.1	96.7	176.8	-75.6	-170.7	-115.8	0	0	111.2	F110	M108-F110 PolarHBondContact O-N 2.8Å
109	A	39.7	Very low	40	Very low	94 Å²	94	158.6 Å²	158.6	78%	0.777	82%	0.815	S	S	*	*			trans	-92	89.6	162.2	0	0	0	0	0	109.8	E107 R111	E107-A109 PolarHBondContact O-N 3.45Å; A109-R111 PolarHBondContact O-N 2.9Å; A109-R111 VanDerWaalsContact O-N 3.14Å
110	F	36.4	Very low	39.4	Very low	185 Å²	185	153.5 Å²	153.5	81%	0.811	80%	0.803	S	S	*	*			trans	-61.5	108.5	169.5	-126.4	-94.9	0	0	0	109.5	M108	M108-F110 PolarHBondContact O-N 2.8Å
111	R	42.1	Very low	39.4	Very low	239 Å²	239	157.9 Å²	157.9	90%	0.902	81%	0.809	S	S	*	*			trans	-120.6	111.3	159.8	-79.2	-159.8	175.8	-169.2	2	110.1	A109	A109-R111 PolarHBondContact O-N 2.9Å; A109-R111 VanDerWaalsContact O-N 3.14Å
112	R	36.5	Very low	39.4	Very low	223 Å²	223	160.2 Å²	160.2	84%	0.842	82%	0.817	S	S	*	*			trans	-51.1	127.9	163	-73.7	175.5	169.1	110.6	-1.1	109.1
113	D	38.4	Very low	38.9	Very low	157 Å²	157	164.2 Å²	164.2	84%	0.84	83%	0.826	S	S	*	*			trans	-173.1	81.2	138.2	-88.6	-29.1	0	0	0	108.4
114	N	36.1	Very low	39.1	Very low	179 Å²	179	167.5 Å²	167.5	96%	0.957	83%	0.833	S	S	*	*			trans	-115	83.2	164.5	-113.5	8	0	0	0	107.5
115	S	34.6	Very low	38.9	Very low	98 Å²	98	168.5 Å²	168.5	69%	0.685	84%	0.84	S	S	*	*			trans	-112.6	133	159.5	81.4	0	0	0	0	106.7
116	L	40	Very low	38.8	Very low	161 Å²	161	163.8 Å²	163.8	84%	0.843	84%	0.838	S	S	*	*			trans	96	63.5	175.1	-51.5	164.2	0	0	0	116.1
117	F	38.4	Very low	38.7	Very low	201 Å²	201	161.7 Å²	161.7	88%	0.882	84%	0.838	S	S	*	*			trans	-141.6	93.7	133.6	-122	-89.7	0	0	0	108.7	S119	F117-S119 PolarHBondContact O-N 3.16Å
118	R	34.4	Very low	38.7	Very low	234 Å²	234	160.2 Å²	160.2	88%	0.883	84%	0.835	S	S	*	*			trans	-85.4	97	175.8	-140.6	-163.7	-172.9	-148	0.9	106.6
119	S	39.6	Very low	38.8	Very low	92 Å²	92	156.1 Å²	156.1	64%	0.643	83%	0.825	S	S	*	*			trans	-121.9	83.3	163.9	-55.5	0	0	0	0	106.7	F117	F117-S119 PolarHBondContact O-N 3.16Å
120	S	37.2	Very low	38.8	Very low	81 Å²	81	160 Å²	160	57%	0.566	83%	0.827	S	S	*	*			trans	-53.4	138.4	156.7	-61	0	0	0	0	108
121	D	40.9	Very low	38.9	Very low	164 Å²	164	156.8 Å²	156.8	88%	0.877	83%	0.827	S	S	*	*	S	Bend	trans	121	18.1	169.4	-53.2	-18.6	0	0	0	116.8
122	L	43.1	Very low	39	Very low	169 Å²	169	151 Å²	151	89%	0.885	82%	0.818	S	S	*	*			trans	-132.9	26.1	173.2	-110.6	149.1	0	0	0	114.6
123	E	38.9	Very low	39	Very low	198 Å²	198	147.1 Å²	147.1	93%	0.925	82%	0.82	S	S	*	*			trans	-110.6	69.3	170.9	-71.5	-166.1	138.9	0	0	110.6
124	E	41.4	Very low	39.4	Very low	200 Å²	200	145.6 Å²	145.6	94%	0.935	82%	0.816	S	S	*	*	S	Bend	trans	-153.9	9.8	166.1	-131.6	-178	161.6	0	0	116.8
125	A	40.3	Very low	40.1	Very low	106 Å²	106	146.3 Å²	146.3	88%	0.876	81%	0.811	S	S	*	*	S	Bend	trans	-123.2	5.6	-171.2	0	0	0	0	0	117.4
126	A	40.3	Very low	40.8	Very low	99 Å²	99	147.9 Å²	147.9	82%	0.818	82%	0.819	S	S	*	*			trans	-129.7	54.7	-176.7	0	0	0	0	0	113.3
127	V	37.9	Very low	41.1	Very low	141 Å²	141	151.9 Å²	151.9	86%	0.855	82%	0.822	S	S	*	*			trans	-134.8	67.9	167.9	-168.2	0	0	0	0	110.1
128	L	41.6	Very low	41.4	Very low	160 Å²	160	151 Å²	151	84%	0.838	82%	0.821	S	S	*	*			trans	-147.4	99.4	162.2	-79.1	175.2	0	0	0	106.8
129	S	36.7	Very low	41.9	Very low	97 Å²	97	151.4 Å²	151.4	68%	0.678	82%	0.823	S	S	*	*				56	112.8	109.2	61.2	0	0	0	0	112.7
130	E	40.1	Very low	42.1	Very low	176 Å²	176	153.4 Å²	153.4	82%	0.822	83%	0.83	S	S	*	*				-162.5	146.9	61.3	-89.2	176.1	110.2	0	0	110.9	V132	E130-V132 PolarHBondContact O-N 2.73Å; E130-V132 VanDerWaalsContact O-N 3.15Å
131	S	39.3	Very low	42.6	Very low	117 Å²	117	154.3 Å²	154.3	82%	0.818	84%	0.837	S	S	*	*			trans	-66.1	102.2	168	49.7	0	0	0	0	111.3
132	V	42.9	Very low	43.1	Very low	118 Å²	118	151.8 Å²	151.8	72%	0.715	83%	0.829	S	S	*	*			trans	-93.1	108.9	164.2	-179.4	0	0	0	0	108.8	E130 T134	E130-V132 PolarHBondContact O-N 2.73Å; E130-V132 VanDerWaalsContact O-N 3.15Å; V132-T134 HydrophobicContact CG1-CG2 4.26Å; V132-T134 PolarHBondContact O-N 2.8Å
133	T	36.5	Very low	43.1	Very low	142 Å²	142	151.7 Å²	151.7	87%	0.871	83%	0.83	S	S	*	*			trans	-80.1	98.1	170.6	11.8	0	0	0	0	108.8
134	T	46.4	Very low	43.7	Very low	125 Å²	125	148 Å²	148	77%	0.767	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-101.2	123.3	165.6	28.5	0	0	0	0	110.2	V132	V132-T134 HydrophobicContact CG1-CG2 4.26Å; V132-T134 PolarHBondContact O-N 2.8Å
135	K	51.4	Low	44.3	Very low	194 Å²	194	146.9 Å²	146.9	84%	0.843	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-53.5	150.5	-177.3	-71.1	175.9	175.7	175.8	0	112.8	R137	K135-R137 PolarHBondContact O-N 3.14Å
136	P	49.1	Very low	45.1	Very low	131 Å²	131	147.9 Å²	147.9	85%	0.851	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-63	122.9	170	26.2	-31.2	0	0	0	109.9	E138	P136-E138 PolarHBondContact O-N 3.05Å
137	R	47.1	Very low	45.6	Very low	244 Å²	244	151.8 Å²	151.8	92%	0.921	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-72.3	120.1	172.4	-172.9	172.1	174.7	163.2	-3.4	108.4	K135	K135-R137 PolarHBondContact O-N 3.14Å
138	E	44.8	Very low	46.2	Very low	182 Å²	182	153 Å²	153	85%	0.85	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-51.6	133.5	175.2	-118.2	173.4	127.3	0	0	111.3	P136 V140	P136-E138 PolarHBondContact O-N 3.05Å; E138-V140 PolarHBondContact O-N 3.1Å
139	R	44.4	Very low	46.8	Very low	244 Å²	244	152.6 Å²	152.6	92%	0.921	81%	0.813	S	S	*	*			trans	-66.2	113.1	170.9	-74.2	-178.5	-179.6	168.6	-0.7	108.6
140	V	44.8	Very low	47.4	Very low	133 Å²	133	153.4 Å²	153.4	81%	0.806	82%	0.816	S	S	*	*			trans	-85.1	115.5	161	176.9	0	0	0	0	106.9	E138 P142	E138-V140 PolarHBondContact O-N 3.1Å; V140-P142 WeakPolarHBondContact O-CD 3.39Å
141	S	46	Very low	47.3	Very low	101 Å²	101	150.9 Å²	150.9	71%	0.706	82%	0.817	S	S	*	*			trans	-66.9	129.8	168	-52.7	0	0	0	0	109.7
142	P	51.2	Low	47.4	Very low	110 Å²	110	150.3 Å²	150.3	71%	0.714	82%	0.819	S	S	*	*			trans	-98.8	94.8	156.1	30.4	-17.7	0	0	0	108.2	V140 T144	V140-P142 WeakPolarHBondContact O-CD 3.39Å; P142-T144 PolarHBondContact O-N 3.3Å; P142-T144 VanDerWaalsContact O-N 3.16Å
143	D	44.4	Very low	47.4	Very low	168 Å²	168	150 Å²	150	90%	0.898	82%	0.822	S	S	*	*			trans	-71.5	89.6	150.9	-93.6	-35.5	0	0	0	106.2
144	T	52.2	Low	47.4	Very low	120 Å²	120	147 Å²	147	74%	0.736	82%	0.819	S	S	*	*			trans	-135.8	117.7	166.5	-38.9	0	0	0	0	107.4	P142	P142-T144 PolarHBondContact O-N 3.3Å; P142-T144 VanDerWaalsContact O-N 3.16Å
145	E	53.1	Low	47	Very low	177 Å²	177	146.5 Å²	146.5	83%	0.827	82%	0.821	S	S	*	*			trans	-54.4	142.5	176.4	-65	-170.1	121.8	0	0	110.6	E147	E145-E147 PolarHBondContact O-N 2.9Å; E145-E147 VanDerWaalsContact O-N 3.14Å
146	P	56.9	Low	46.6	Very low	126 Å²	126	146.3 Å²	146.3	82%	0.818	82%	0.823	S	S	*	*			trans	-69.3	111.4	176.2	27.9	-30.8	0	0	0	109	D148	P146-D148 PolarHBondContact O-N 3.39Å
147	E	51.5	Low	46.4	Very low	182 Å²	182	146.6 Å²	146.6	85%	0.85	82%	0.822	S	S	*	*			trans	-64.9	129.9	161.5	-74.2	-159.9	117.3	0	0	108.7	E145 I149	E145-E147 PolarHBondContact O-N 2.9Å; E145-E147 VanDerWaalsContact O-N 3.14Å; E147-I149 PolarHBondContact O-N 3.3Å
148	D	50.1	Low	46.3	Very low	165 Å²	165	139.8 Å²	139.8	88%	0.882	82%	0.818	S	S	*	*			trans	-51.7	107.3	177	-73.7	-55.8	0	0	0	111.1	P146	P146-D148 PolarHBondContact O-N 3.39Å
149	I	53.3	Low	46.5	Very low	152 Å²	152	139.4 Å²	139.4	78%	0.779	82%	0.817	S	S	*	*			trans	-75.4	124.1	168.2	-56.3	173.9	0	0	0	106.9	E147 C151	E147-I149 PolarHBondContact O-N 3.3Å; I149-C151 PolarHBondContact O-N 3.08Å; I149-C151 VanDerWaalsContact O-N 3.09Å
150	P	49.4	Very low	46.7	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	80%	0.804	S	S	*	*			trans	-65.1	115.6	178.8	25	-31.1	0	0	0	109.7	A152	P150-A152 PolarHBondContact O-N 2.91Å
151	C	39.3	Very low	47	Very low	122 Å²	122	134.1 Å²	134.1	82%	0.824	80%	0.802	S	S	*	*			trans	-56.9	106.5	164.8	-76	0	0	0	0	108.7	I149 S153	I149-C151 PolarHBondContact O-N 3.08Å; I149-C151 VanDerWaalsContact O-N 3.09Å; C151-S153 PolarHBondContact O-N 3.09Å
152	A	41.6	Very low	47.3	Very low	105 Å²	105	132.6 Å²	132.6	87%	0.868	80%	0.796	S	S	*	*			trans	-71.6	85.2	168.7	0	0	0	0	0	108.8	P150 G154	P150-A152 PolarHBondContact O-N 2.91Å; A152-G154 PolarHBondContact O-N 3.47Å
153	S	41.1	Very low	47.5	Very low	112 Å²	112	132.2 Å²	132.2	78%	0.783	79%	0.787	S	S	*	*			trans	-65.7	116.9	164.2	45.1	0	0	0	0	109.7	C151	C151-S153 PolarHBondContact O-N 3.09Å
154	G	36.3	Very low	47.9	Very low	78 Å²	78	126.6 Å²	126.6	80%	0.804	77%	0.769	S	S	*	*			trans	50.4	106.2	148	0	0	0	0	0	118.1	A152	A152-G154 PolarHBondContact O-N 3.47Å
155	S	38.2	Very low	47.8	Very low	116 Å²	116	130.4 Å²	130.4	81%	0.811	78%	0.775	S	S	*	*			trans	-133.8	106.8	143.4	63.4	0	0	0	0	109.5	T157	S155-T157 PolarHBondContact O-N 3.48Å
156	E	43.6	Very low	48.1	Very low	189 Å²	189	124.1 Å²	124.1	88%	0.883	75%	0.751	S	S	*	*			trans	-55.2	114.5	166.2	-60.1	166.5	123.1	0	0	109.1
157	T	45.3	Very low	48	Very low	137 Å²	137	124.9 Å²	124.9	84%	0.84	76%	0.755	S	S	*	*			trans	153.2	67.3	158.7	37.9	0	0	0	0	109.2	S155 E159	S155-T157 PolarHBondContact O-N 3.48Å; T157-E159 PolarHBondContact O-N 2.89Å
158	A	45.4	Very low	48.9	Very low	101 Å²	101	119.5 Å²	119.5	84%	0.835	74%	0.738	S	S	*	*			trans	-79.4	105.2	167.8	0	0	0	0	0	108.3
159	E	49.1	Very low	49.7	Very low	175 Å²	175	114.3 Å²	114.3	82%	0.818	72%	0.724	S	S	*	*			trans	-57.9	141.3	163.5	-82.4	-169.5	129.5	0	0	109.3	T157 Q161	T157-E159 PolarHBondContact O-N 2.89Å; E159-Q161 PolarHBondContact O-N 3.37Å; E159-Q161 VanDerWaalsContact O-N 3.1Å
160	P	48	Very low	50.4	Low	100 Å²	100	113.2 Å²	113.2	65%	0.649	72%	0.715	S	S	*	*			trans	-64.1	115.9	179.1	25.8	-32.1	0	0	0	109.6	A162	P160-A162 PolarHBondContact O-N 3Å; P160-A162 VanDerWaalsContact O-N 3.15Å
161	Q	50.4	Low	51.2	Low	165 Å²	165	113.5 Å²	113.5	77%	0.771	71%	0.709	S	S	*	*			trans	-74.6	101.6	169.3	-72.7	-177.4	13.1	0	0	108.4	E159 I163	E159-Q161 PolarHBondContact O-N 3.37Å; E159-Q161 VanDerWaalsContact O-N 3.1Å; Q161-I163 PolarHBondContact O-N 3.32Å
162	A	53.9	Low	52.2	Low	70 Å²	70	112.4 Å²	112.4	58%	0.579	69%	0.694	S	S	*	*			trans	-64.5	118.1	174.8	0	0	0	0	0	110.3	P160 G164 I171	P160-A162 PolarHBondContact O-N 3Å; P160-A162 VanDerWaalsContact O-N 3.15Å; A162-G164 PolarHBondContact O-N 3.26Å; A162-I171 HydrophobicContact CB-CG2 4.37Å
163	I	54.3	Low	53.6	Low	102 Å²	102	114.6 Å²	114.6	52%	0.523	69%	0.687	S	S	.	*			trans	-89.5	85.9	175.8	-59.6	-170.3	0	0	0	108.6	Q161 L174	Q161-I163 PolarHBondContact O-N 3.32Å; I163-L174 HydrophobicContact CD1-CD1 3.29Å; I163-L174 HydrophobicContact CD1-CD2 3.88Å; I163-L174 HydrophobicContact CD1-CG 3.59Å; I163-L174 HydrophobicContact CG1-CD1 4.05Å; I163-L174 HydrophobicContact CG1-CG 4.17Å
164	G	52.3	Low	55.3	Low	50 Å²	50	115.3 Å²	115.3	52%	0.515	68%	0.681	S	S	.	*			trans	76.4	157.7	166.4	0	0	0	0	0	115.6	A162	A162-G164 PolarHBondContact O-N 3.26Å
165	F	51.3	Low	57.3	Low	199 Å²	199	118 Å²	118	87%	0.873	67%	0.673	S	S	*	*	B	Isolated β-bridge	trans	-88.3	118.4	173.8	-81.6	-89.9	0	0	0	109.5
166	C	58.7	Low	59.3	Low	46 Å²	46	121.6 Å²	121.6	31%	0.311	68%	0.677	S	S	.	*			trans	-72.1	136.5	166.9	-161.4	0	0	0	0	108.7	S168 G169 H170	C166-S168 PolarHBondContact O-N 3.13Å; C166-S168 PolarHBondContact SG-OG 3.09Å; C166-G169 PolarHBondContact O-N 3.36Å; C166-H170 HydrophobicContact CB-CB 4.42Å; C166-H170 WeakPolarHBondContact CB-O 3.22Å
167	P	55.5	Low	61.1	Low	141 Å²	141	115.7 Å²	115.7	92%	0.916	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-13.2	178	20.7	-31	0	0	0	113.9	G169	P167-G169 VanDerWaalsContact C-N 3.3Å
168	S	70.6	Confident	62.7	Low	69 Å²	69	117.2 Å²	117.2	48%	0.483	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-4.7	170	59.6	0	0	0	0	114.5	C166 H170	C166-S168 PolarHBondContact O-N 3.13Å; C166-S168 PolarHBondContact SG-OG 3.09Å; S168-H170 VanDerWaalsContact C-N 3.27Å; S168-H170 PolarHBondContact O-N 2.92Å; S168-H170 PolarHBondContact OG-CD2 3.4Å; S168-H170 VanDerWaalsContact OG-CD2 3.23Å
169	G	66.6	Low	64.5	Low	57 Å²	57	116.5 Å²	116.5	59%	0.588	65%	0.649	S	S	*	*			trans	77.6	7.2	-174.9	0	0	0	0	0	114.3	C166 P167	C166-G169 PolarHBondContact O-N 3.36Å; P167-G169 VanDerWaalsContact C-N 3.3Å
170	H	67.1	Low	66.3	Low	128 Å²	128	113.2 Å²	113.2	59%	0.593	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-76.2	132.3	173.7	-60.6	-25.4	0	0	0	110.6	C166 S168	C166-H170 HydrophobicContact CB-CB 4.42Å; C166-H170 WeakPolarHBondContact CB-O 3.22Å; S168-H170 VanDerWaalsContact C-N 3.27Å; S168-H170 PolarHBondContact O-N 2.92Å; S168-H170 PolarHBondContact OG-CD2 3.4Å; S168-H170 VanDerWaalsContact OG-CD2 3.23Å
171	I	65.9	Low	68.1	Low	122 Å²	122	112.1 Å²	112.1	63%	0.626	64%	0.644	S	S	*	*	B	Isolated β-bridge	trans	-83	123.3	170.4	-60.4	173.3	0	0	0	106.3	A162 E173	A162-I171 HydrophobicContact CB-CG2 4.37Å; I171-E173 HydrophobicContact CG2-CG 4.46Å
172	L	61.7	Low	69.6	Low	98 Å²	98	106.1 Å²	106.1	51%	0.513	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-89.3	124.5	173.2	-64.1	173	0	0	0	108.5
173	E	70.4	Confident	71.1	Confident	151 Å²	151	106 Å²	106	71%	0.706	61%	0.614	S	S	*	*			trans	-105.2	135.4	175.2	-65.6	-174.1	170.2	0	0	109.6	I171	I171-E173 HydrophobicContact CG2-CG 4.46Å
174	L	76	Confident	72.3	Confident	127 Å²	127	107.1 Å²	107.1	67%	0.665	62%	0.62	S	S	*	*			trans	-80.8	130	171.3	-80.2	178.6	0	0	0	109.9	I163	I163-L174 HydrophobicContact CD1-CD1 3.29Å; I163-L174 HydrophobicContact CD1-CD2 3.88Å; I163-L174 HydrophobicContact CD1-CG 3.59Å; I163-L174 HydrophobicContact CG1-CD1 4.05Å; I163-L174 HydrophobicContact CG1-CG 4.17Å
175	Q	78.7	Confident	73.6	Confident	135 Å²	135	107.4 Å²	107.4	63%	0.631	62%	0.618	S	S	*	*			trans	-106.5	120.5	169	-169.3	168.3	29.3	0	0	109.4	L177	Q175-L177 PolarHBondContact O-N 2.74Å
176	E	80.3	Confident	74.8	Confident	191 Å²	191	99.9 Å²	99.9	89%	0.893	59%	0.587	S	S	*	*			trans	-69.2	129.4	173.5	-71.4	-175.6	173.2	0	0	110.2
177	L	82.3	Confident	75.8	Confident	65 Å²	65	99.9 Å²	99.9	34%	0.34	59%	0.59	S	S	.	*			trans	-111.7	156.3	176.3	-63.4	175	0	0	0	110.3	Q175 G179 C183 N186 A187	Q175-L177 PolarHBondContact O-N 2.74Å; L177-G179 PolarHBondContact O-N 3.29Å; L177-C183 WeakPolarHBondContact CD1-O 3.22Å; L177-N186 HydrophobicContact CD1-CB 4.01Å; L177-N186 HydrophobicContact CD2-CB 4.2Å; L177-A187 HydrophobicContact CD1-CB 3.66Å
178	F	78.4	Confident	76.7	Confident	170 Å²	170	99.2 Å²	99.2	75%	0.746	58%	0.575	S	S	*	*			trans	-63.8	135	177.1	-69	-77.4	0	0	0	111.7	D180	F178-D180 PolarHBondContact O-N 3.47Å; F178-D180 VanDerWaalsContact O-N 3.07Å
179	G	83.2	Confident	76.3	Confident	86 Å²	86	102.6 Å²	102.6	89%	0.887	58%	0.583	S	S	*	*			trans	-82.5	48.6	178.3	0	0	0	0	0	113.6	L177	L177-G179 PolarHBondContact O-N 3.29Å
180	D	87.5	Confident	75.9	Confident	106 Å²	106	102.3 Å²	102.3	57%	0.567	57%	0.57	S	S	*	*	S	Bend	trans	-95.6	8.1	-178.1	65.2	-0.9	0	0	0	113.6	F178 S182	F178-D180 PolarHBondContact O-N 3.47Å; F178-D180 VanDerWaalsContact O-N 3.07Å; D180-S182 VanDerWaalsContact C-N 3.31Å; D180-S182 WeakPolarHBondContact OD1-CB 3.49Å; D180-S182 PolarHBondContact OD1-N 3.31Å; D180-S182 PolarHBondContact OD1-OG 3.27Å; D180-S182 PolarHBondContact OD2-OG 3.09Å; D180-S182 VanDerWaalsContact OD2-OG 3.12Å
181	G	84.2	Confident	75.3	Confident	77 Å²	77	104.5 Å²	104.5	79%	0.794	58%	0.58	S	S	*	*	S	Bend	trans	84	-0.3	-175.4	0	0	0	0	0	114.3
182	S	83.5	Confident	74.5	Confident	38 Å²	38	105.5 Å²	105.5	27%	0.266	59%	0.587	S	S	.	*			trans	-104	12.4	176	73.1	0	0	0	0	113.6	D180 L184 A185 N186	D180-S182 VanDerWaalsContact C-N 3.31Å; D180-S182 WeakPolarHBondContact OD1-CB 3.49Å; D180-S182 PolarHBondContact OD1-N 3.31Å; D180-S182 PolarHBondContact OD1-OG 3.27Å; D180-S182 PolarHBondContact OD2-OG 3.09Å; D180-S182 VanDerWaalsContact OD2-OG 3.12Å; S182-L184 PolarHBondContact O-N 3.14Å; S182-L184 VanDerWaalsContact O-N 3.09Å; S182-A185 PolarHBondContact O-N 2.9Å; S182-N186 PolarHBondContact O-N 2.96Å; S182-N186 PolarHBondContact OG-ND2 3.47Å
183	C	84.8	Confident	73.9	Confident	69 Å²	69	106.6 Å²	106.6	47%	0.466	59%	0.592	S	S	.	*	H	α-helix	trans	-55.3	-33.5	-174.7	62.4	0	0	0	0	114	L177 A187	L177-C183 WeakPolarHBondContact CD1-O 3.22Å; C183-A187 WeakPolarHBondContact O-CB 3.36Å; C183-A187 PolarHBondContact O-N 2.91Å
184	L	79.4	Confident	72.7	Confident	124 Å²	124	106.9 Å²	106.9	65%	0.649	59%	0.593	S	S	*	*	H	α-helix	trans	-66.5	-46.2	175.3	-174.7	65.8	0	0	0	111.7	S182 N186 A187 E188	S182-L184 PolarHBondContact O-N 3.14Å; S182-L184 VanDerWaalsContact O-N 3.09Å; L184-N186 VanDerWaalsContact C-N 3.35Å; L184-A187 PolarHBondContact O-N 3.11Å; L184-E188 WeakPolarHBondContact O-CG 3.45Å; L184-E188 PolarHBondContact O-N 2.82Å; L184-E188 VanDerWaalsContact O-N 3.09Å
185	A	80.1	Confident	71.1	Confident	56 Å²	56	107.3 Å²	107.3	46%	0.463	60%	0.601	S	S	.	*	H	α-helix	trans	-65.5	-39.8	177.7	0	0	0	0	0	111.5	S182 E188 E189	S182-A185 PolarHBondContact O-N 2.9Å; A185-E188 PolarHBondContact O-N 3.36Å; A185-E189 PolarHBondContact O-N 2.92Å
186	N	76.6	Confident	69.3	Low	41 Å²	41	105 Å²	105	22%	0.219	60%	0.6	C	S	.	*	H	α-helix	trans	-68.6	-34.5	178	-65.2	-18.5	0	0	0	112.1	L177 S182 L184 T190	L177-N186 HydrophobicContact CD1-CB 4.01Å; L177-N186 HydrophobicContact CD2-CB 4.2Å; S182-N186 PolarHBondContact O-N 2.96Å; S182-N186 PolarHBondContact OG-ND2 3.47Å; L184-N186 VanDerWaalsContact C-N 3.35Å; N186-T190 PolarHBondContact O-N 3.09Å; N186-T190 PolarHBondContact O-OG1 3.07Å
187	A	78.7	Confident	67.5	Low	47 Å²	47	102 Å²	102	39%	0.388	60%	0.595	S	S	.	*	H	α-helix	trans	-69.7	-37.2	175.8	0	0	0	0	0	112.2	L177 C183 L184 T190	L177-A187 HydrophobicContact CD1-CB 3.66Å; C183-A187 WeakPolarHBondContact O-CB 3.36Å; C183-A187 PolarHBondContact O-N 2.91Å; L184-A187 PolarHBondContact O-N 3.11Å; A187-T190 WeakPolarHBondContact CA-OG1 3.45Å; A187-T190 PolarHBondContact O-OG1 2.57Å
188	E	73.9	Confident	65.3	Low	126 Å²	126	104.6 Å²	104.6	59%	0.589	62%	0.618	S	S	*	*	H	α-helix	trans	-71.4	-33.1	175.9	-73.6	-178.7	174.6	0	0	112.4	L184 A185 T190 E191	L184-E188 WeakPolarHBondContact O-CG 3.45Å; L184-E188 PolarHBondContact O-N 2.82Å; L184-E188 VanDerWaalsContact O-N 3.09Å; A185-E188 PolarHBondContact O-N 3.36Å; E188-T190 VanDerWaalsContact C-N 3.35Å; E188-E191 PolarHBondContact O-N 3.16Å
189	E	63.8	Low	63.3	Low	140 Å²	140	109.3 Å²	109.3	65%	0.654	64%	0.643	S	S	*	*	H	α-helix	trans	-68.5	-31.7	175.9	-82.4	-168.6	160.4	0	0	113.2	A185 E191 N192	A185-E189 PolarHBondContact O-N 2.92Å; E189-E191 PolarHBondContact O-N 2.93Å; E189-N192 PolarHBondContact O-N 3.49Å
190	T	57.3	Low	62.3	Low	52 Å²	52	110.5 Å²	110.5	32%	0.319	63%	0.631	S	S	.	*	H	α-helix	trans	-67	-19.3	177.4	32.1	0	0	0	0	114.2	N186 A187 E188 N192 I193	N186-T190 PolarHBondContact O-N 3.09Å; N186-T190 PolarHBondContact O-OG1 3.07Å; A187-T190 WeakPolarHBondContact CA-OG1 3.45Å; A187-T190 PolarHBondContact O-OG1 2.57Å; E188-T190 VanDerWaalsContact C-N 3.35Å; T190-N192 PolarHBondContact O-N 3.05Å; T190-I193 PolarHBondContact O-N 3.42Å
191	E	55.2	Low	61	Low	173 Å²	173	110.7 Å²	110.7	81%	0.808	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-12.7	178.1	-134.6	-177.7	-173.7	0	0	113.1	E188 E189	E188-E191 PolarHBondContact O-N 3.16Å; E189-E191 PolarHBondContact O-N 2.93Å
192	N	48.7	Very low	59.7	Low	144 Å²	144	112.6 Å²	112.6	77%	0.77	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	2.2	-179.3	-71.5	-54.9	0	0	0	114.5	E189 T190	E189-N192 PolarHBondContact O-N 3.49Å; T190-N192 PolarHBondContact O-N 3.05Å
193	I	49.6	Very low	58.3	Low	120 Å²	120	117 Å²	117	62%	0.615	65%	0.646	S	S	*	*	S	Bend	trans	-105.8	100	-177.9	-55.2	175.6	0	0	0	109.1	T190	T190-I193 PolarHBondContact O-N 3.42Å
194	E	44.3	Very low	56.6	Low	157 Å²	157	120 Å²	120	73%	0.734	66%	0.658	S	S	*	*			trans	72.5	67.9	157.3	-60.1	-174.2	152.9	0	0	118.5	S196	E194-S196 PolarHBondContact O-N 3.14Å; E194-S196 VanDerWaalsContact O-N 3.09Å
195	V	42.6	Very low	55.1	Low	136 Å²	136	119.7 Å²	119.7	82%	0.824	66%	0.658	S	S	*	*			trans	-75.1	69.4	134.1	-172.8	0	0	0	0	107.8	T197	V195-T197 VanDerWaalsContact C-N 3.29Å; V195-T197 HydrophobicContact CG1-CG2 4.22Å; V195-T197 PolarHBondContact O-N 3Å; V195-T197 VanDerWaalsContact O-N 3.14Å
196	S	40.1	Very low	53.3	Low	88 Å²	88	124.3 Å²	124.3	62%	0.615	67%	0.672	S	S	*	*			trans	-80.2	86.7	164.8	-74	0	0	0	0	107.3	E194 S198	E194-S196 PolarHBondContact O-N 3.14Å; E194-S196 VanDerWaalsContact O-N 3.09Å; S196-S198 PolarHBondContact O-N 3.12Å
197	T	43.2	Very low	51.6	Low	126 Å²	126	130.7 Å²	130.7	77%	0.773	71%	0.707	S	S	*	*			trans	-49.6	122.9	168.5	40.5	0	0	0	0	110.3	V195	V195-T197 VanDerWaalsContact C-N 3.29Å; V195-T197 HydrophobicContact CG1-CG2 4.22Å; V195-T197 PolarHBondContact O-N 3Å; V195-T197 VanDerWaalsContact O-N 3.14Å
198	S	36	Very low	49.3	Very low	120 Å²	120	137.7 Å²	137.7	84%	0.839	73%	0.734	S	S	*	*			trans	-62.9	132.9	170.8	-36.4	0	0	0	0	110.9	S196	S196-S198 PolarHBondContact O-N 3.12Å
199	E	36.9	Very low	47.1	Very low	270 Å²	270	138.7 Å²	138.7	100%	1.262	75%	0.747	S	S	*	*			trans	-91.8	0	143.4	-84.8	-170.5	114.7	0	0	109.1

Retrieved 199 of 199 residues in 47.9 ms (Link to these results)

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