A0A077Z001_TRITR Loading...

leucine--tRNA ligase

AlphaFold DB , UniProt , Accession A0A077Z001, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 297 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	32.5	Very low	40.8	Very low	238 Å²	238	120.7 Å²	120.7	100%	1.172	66%	0.66	S	S	*	*				0	106.1	0	-69.3	172.4	-170.6	0	0	106.4	V3	M1-V3 PolarHBondContact O-N 2.69Å; M1-V3 VanDerWaalsContact O-N 3.14Å
2	A	30.3	Very low	43.1	Very low	99 Å²	99	117.6 Å²	117.6	82%	0.818	64%	0.64	S	S	*	*			trans	-69.5	108	175.7	0	0	0	0	0	107	T4	A2-T4 VanDerWaalsContact C-N 3.3Å; A2-T4 PolarHBondContact O-N 2.8Å
3	V	33.5	Very low	45.6	Very low	126 Å²	126	110.2 Å²	110.2	76%	0.764	60%	0.599	S	S	*	*			trans	-64	102.9	163.8	-178.1	0	0	0	0	104.2	M1 E5	M1-V3 PolarHBondContact O-N 2.69Å; M1-V3 VanDerWaalsContact O-N 3.14Å; V3-E5 VanDerWaalsContact C-N 3.3Å; V3-E5 PolarHBondContact O-N 3.28Å
4	T	30.8	Very low	47.8	Very low	105 Å²	105	103.2 Å²	103.2	64%	0.644	57%	0.566	S	S	*	*			trans	-59.7	102.8	165.4	48.6	0	0	0	0	105.5	A2 F6	A2-T4 VanDerWaalsContact C-N 3.3Å; A2-T4 PolarHBondContact O-N 2.8Å; T4-F6 VanDerWaalsContact C-N 3.28Å; T4-F6 PolarHBondContact O-N 3.42Å
5	E	35.6	Very low	50	Low	180 Å²	180	103.9 Å²	103.9	84%	0.841	56%	0.564	S	S	*	*			trans	-59.2	98.1	170.8	-70.5	176.1	169.7	0	0	106.1	V3	V3-E5 VanDerWaalsContact C-N 3.3Å; V3-E5 PolarHBondContact O-N 3.28Å
6	F	37.1	Very low	52.1	Low	178 Å²	178	103.2 Å²	103.2	78%	0.781	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-58.3	126	165.1	-86.1	-90.4	0	0	0	105.7	T4 V8	T4-F6 VanDerWaalsContact C-N 3.28Å; T4-F6 PolarHBondContact O-N 3.42Å; F6-V8 PolarHBondContact O-N 3.42Å; F6-V8 VanDerWaalsContact O-N 3.09Å
7	P	41.5	Very low	54.1	Low	99 Å²	99	100.7 Å²	100.7	64%	0.643	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-53.8	126.3	173.7	22.1	-30.7	0	0	0	107.2	L11	P7-L11 HydrophobicContact CB-CD1 4.36Å
8	V	49.2	Very low	55.9	Low	55 Å²	55	100.1 Å²	100.1	33%	0.333	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-50.5	132	-178.1	-114.7	0	0	0	0	108.3	F6 W10 L11	F6-V8 PolarHBondContact O-N 3.42Å; F6-V8 VanDerWaalsContact O-N 3.09Å; V8-W10 PolarHBondContact O-N 3.19Å; V8-L11 HydrophobicContact CG2-CD1 4.23Å; V8-L11 PolarHBondContact O-N 3.48Å; V8-L11 VanDerWaalsContact O-N 3.09Å
9	P	51.3	Low	57.5	Low	85 Å²	85	96.4 Å²	96.4	55%	0.552	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-52.5	-20.2	-170.9	-28.2	33.4	0	0	0	115	I12	P9-I12 WeakPolarHBondContact O-CB 3.33Å; P9-I12 WeakPolarHBondContact O-CD1 3.17Å; P9-I12 VanDerWaalsContact O-CG1 3.28Å; P9-I12 WeakPolarHBondContact O-CG1 3.23Å; P9-I12 PolarHBondContact O-N 3.37Å
10	W	52.1	Low	59.1	Low	100 Å²	100	92.3 Å²	92.3	38%	0.379	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-78.2	-17.1	-174.6	-23.7	109.3	0	0	0	114.8	V8 I12 Y231	V8-W10 PolarHBondContact O-N 3.19Å; W10-I12 PolarHBondContact O-N 3.41Å; W10-Y231 HydrophobicContact CB-CD1 3.39Å; W10-Y231 HydrophobicContact CB-CD2 3.67Å; W10-Y231 HydrophobicContact CB-CE1 3.3Å; W10-Y231 HydrophobicContact CB-CE2 3.61Å; W10-Y231 HydrophobicContact CB-CG 3.56Å; W10-Y231 VanDerWaalsContact CB-CZ 3.4Å; W10-Y231 AromaticContact CD1-CE1 3.84Å; W10-Y231 HydrophobicContact CD2-CE1 4.21Å; W10-Y231 AromaticContact CG-CD1 3.98Å; W10-Y231 HydrophobicContact CG-CD1 3.98Å; W10-Y231 AromaticContact CG-CE1 3.5Å; W10-Y231 HydrophobicContact CG-CE1 3.5Å; W10-Y231 HydrophobicContact CG-CE2 4.43Å; W10-Y231 AromaticContact CG-CZ 3.76Å
11	L	55.4	Low	60.4	Low	63 Å²	63	92.5 Å²	92.5	33%	0.33	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-62.9	-22.8	171.9	-95.8	149.8	0	0	0	112.4	P7 V8 L13 E15	P7-L11 HydrophobicContact CB-CD1 4.36Å; V8-L11 HydrophobicContact CG2-CD1 4.23Å; V8-L11 PolarHBondContact O-N 3.48Å; V8-L11 VanDerWaalsContact O-N 3.09Å; L11-L13 VanDerWaalsContact C-N 3.35Å; L11-L13 PolarHBondContact O-N 3.32Å; L11-E15 WeakPolarHBondContact O-CG 3.41Å
12	I	67.7	Low	63.1	Low	83 Å²	83	88.4 Å²	88.4	43%	0.426	48%	0.478	S	S	.	.	H	α-helix	trans	-70.4	-28.8	-167.8	-60.1	175.1	0	0	0	112	P9 W10 E15 L16	P9-I12 WeakPolarHBondContact O-CB 3.33Å; P9-I12 WeakPolarHBondContact O-CD1 3.17Å; P9-I12 VanDerWaalsContact O-CG1 3.28Å; P9-I12 WeakPolarHBondContact O-CG1 3.23Å; P9-I12 PolarHBondContact O-N 3.37Å; W10-I12 PolarHBondContact O-N 3.41Å; I12-E15 PolarHBondContact O-N 3.07Å; I12-L16 HydrophobicContact CG2-CD1 3.47Å; I12-L16 VanDerWaalsContact CG2-CD1 3.47Å; I12-L16 HydrophobicContact CG2-CD2 4.31Å; I12-L16 HydrophobicContact CG2-CG 3.56Å; I12-L16 VanDerWaalsContact O-CB 3.25Å; I12-L16 WeakPolarHBondContact O-CB 3.39Å; I12-L16 WeakPolarHBondContact O-CG 3.32Å; I12-L16 PolarHBondContact O-N 3.24Å
13	L	75.5	Confident	65.8	Low	21 Å²	21	88.2 Å²	88.2	11%	0.11	46%	0.457	C	S	.	.	H	α-helix	trans	-71.2	-47.2	-168.9	-172.6	57.7	0	0	0	113.7	L11 E15 L16 Y17 I37 L237	L11-L13 VanDerWaalsContact C-N 3.35Å; L11-L13 PolarHBondContact O-N 3.32Å; L13-E15 VanDerWaalsContact C-N 3.3Å; L13-L16 PolarHBondContact O-N 3.26Å; L13-Y17 PolarHBondContact O-N 3.31Å; L13-I37 HydrophobicContact CD1-CG2 3.63Å; L13-I37 HydrophobicContact CG-CG2 4.35Å; L13-L237 HydrophobicContact CD1-CD2 3.22Å; L13-L237 HydrophobicContact CD2-CB 4.42Å; L13-L237 HydrophobicContact CD2-CD2 3.99Å; L13-L237 HydrophobicContact CG-CD2 4.23Å
14	G	76.8	Confident	68.1	Low	13 Å²	13	88.4 Å²	88.4	13%	0.134	46%	0.458	C	S	.	.	H	α-helix	trans	-64.7	-39.6	176.6	0	0	0	0	0	111.4	Y17 N18	G14-Y17 PolarHBondContact O-N 2.95Å; G14-N18 WeakPolarHBondContact O-CB 3.39Å; G14-N18 PolarHBondContact O-N 2.94Å; G14-N18 PolarHBondContact O-ND2 2.69Å
15	E	80.3	Confident	71	Confident	113 Å²	113	89.6 Å²	89.6	53%	0.528	46%	0.456	S	S	.	.	H	α-helix	trans	-62.8	-46.4	175	-68.4	176.6	179	0	0	111.6	L11 I12 L13 Y17 N18 A19	L11-E15 WeakPolarHBondContact O-CG 3.41Å; I12-E15 PolarHBondContact O-N 3.07Å; L13-E15 VanDerWaalsContact C-N 3.3Å; E15-Y17 PolarHBondContact O-N 3.08Å; E15-N18 PolarHBondContact O-N 3.48Å; E15-A19 WeakPolarHBondContact O-CB 3.46Å; E15-A19 PolarHBondContact O-N 2.96Å
16	L	84.1	Confident	73.4	Confident	93 Å²	93	85.8 Å²	85.8	49%	0.487	43%	0.434	S	S	.	.	H	α-helix	trans	-59.7	-45.2	175.8	-77.8	175.8	0	0	0	111.5	I12 L13 L20	I12-L16 HydrophobicContact CG2-CD1 3.47Å; I12-L16 VanDerWaalsContact CG2-CD1 3.47Å; I12-L16 HydrophobicContact CG2-CD2 4.31Å; I12-L16 HydrophobicContact CG2-CG 3.56Å; I12-L16 VanDerWaalsContact O-CB 3.25Å; I12-L16 WeakPolarHBondContact O-CB 3.39Å; I12-L16 WeakPolarHBondContact O-CG 3.32Å; I12-L16 PolarHBondContact O-N 3.24Å; L13-L16 PolarHBondContact O-N 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.46Å; L16-L20 PolarHBondContact O-N 2.87Å
17	Y	85.9	Confident	75.8	Confident	61 Å²	61	84.7 Å²	84.7	24%	0.239	43%	0.433	C	S	.	.	H	α-helix	trans	-63.9	-46.2	-179.3	-171	-87.5	0	0	0	111.5	L13 G14 E15 L20 R34 I37 G38	L13-Y17 PolarHBondContact O-N 3.31Å; G14-Y17 PolarHBondContact O-N 2.95Å; E15-Y17 PolarHBondContact O-N 3.08Å; Y17-L20 WeakPolarHBondContact O-CB 3.05Å; Y17-L20 PolarHBondContact O-N 3.37Å; Y17-R34 HydrophobicContact CE2-CB 4.17Å; Y17-R34 HydrophobicContact CE2-CG 4.22Å; Y17-I37 HydrophobicContact CD2-CB 4.28Å; Y17-I37 HydrophobicContact CD2-CG2 3.88Å; Y17-G38 WeakPolarHBondContact CE2-O 3.37Å
18	N	86	Confident	78.2	Confident	90 Å²	90	84.7 Å²	84.7	48%	0.481	43%	0.428	S	S	.	.	H	α-helix	trans	-71.3	-36.3	179.9	-65.8	-13.4	0	0	0	112	G14 E15 L20 D21	G14-N18 WeakPolarHBondContact O-CB 3.39Å; G14-N18 PolarHBondContact O-N 2.94Å; G14-N18 PolarHBondContact O-ND2 2.69Å; E15-N18 PolarHBondContact O-N 3.48Å; N18-L20 PolarHBondContact O-N 3.46Å; N18-D21 WeakPolarHBondContact O-CB 3.29Å; N18-D21 PolarHBondContact O-N 3.37Å
19	A	87.4	Confident	80.2	Confident	29 Å²	29	86 Å²	86	24%	0.24	43%	0.432	C	S	.	.	H	α-helix	trans	-61.1	-28.1	178.9	0	0	0	0	0	111.9	E15 D21 E22 Y23	E15-A19 WeakPolarHBondContact O-CB 3.46Å; E15-A19 PolarHBondContact O-N 2.96Å; A19-D21 PolarHBondContact O-N 2.92Å; A19-D21 VanDerWaalsContact O-N 3.08Å; A19-E22 WeakPolarHBondContact O-CB 3.04Å; A19-E22 PolarHBondContact O-N 3.42Å; A19-Y23 WeakPolarHBondContact O-CD2 3.26Å
20	L	88.2	Confident	82	Confident	15 Å²	15	82.1 Å²	82.1	8%	0.079	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22	175.7	-68.7	169.5	0	0	0	113.3	L16 Y17 N18 E22 Y23 Q33 R34 I37	L16-L20 WeakPolarHBondContact O-CG 3.46Å; L16-L20 PolarHBondContact O-N 2.87Å; Y17-L20 WeakPolarHBondContact O-CB 3.05Å; Y17-L20 PolarHBondContact O-N 3.37Å; N18-L20 PolarHBondContact O-N 3.46Å; L20-E22 VanDerWaalsContact C-N 3.32Å; L20-Y23 PolarHBondContact O-N 2.91Å; L20-Q33 HydrophobicContact CD1-CB 3.93Å; L20-Q33 HydrophobicContact CD2-CB 4.15Å; L20-R34 HydrophobicContact CB-CG 4.42Å; L20-R34 HydrophobicContact CD1-CB 4.49Å; L20-R34 HydrophobicContact CD1-CG 3.64Å; L20-R34 PolarHBondContact O-NH2 3.42Å; L20-I37 HydrophobicContact CD1-CD1 4.14Å
21	D	86.9	Confident	83.9	Confident	97 Å²	97	81.9 Å²	81.9	52%	0.519	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-26.9	175.9	-63.9	-17.1	0	0	0	112.3	N18 A19 Y23 R34	N18-D21 WeakPolarHBondContact O-CB 3.29Å; N18-D21 PolarHBondContact O-N 3.37Å; A19-D21 PolarHBondContact O-N 2.92Å; A19-D21 VanDerWaalsContact O-N 3.08Å; D21-Y23 VanDerWaalsContact C-N 3.35Å; D21-R34 IonicContact OD1-CZ 3.83Å; D21-R34 IonicContact OD1-NE 3.51Å; D21-R34 IonicContact OD1-NH2 3.35Å; D21-R34 PolarHBondContact OD1-NH2 3.17Å
22	E	89.4	Confident	85.6	Confident	151 Å²	151	83.7 Å²	83.7	71%	0.706	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-28.9	175.7	-57	-179.5	175.7	0	0	111.6	A19 L20 T24	A19-E22 WeakPolarHBondContact O-CB 3.04Å; A19-E22 PolarHBondContact O-N 3.42Å; L20-E22 VanDerWaalsContact C-N 3.32Å; E22-T24 VanDerWaalsContact C-N 3.29Å; E22-T24 PolarHBondContact O-N 3.14Å
23	Y	87.2	Confident	86.8	Confident	96 Å²	96	83.4 Å²	83.4	38%	0.376	42%	0.419	S	S	.	.			trans	-86.5	56	-177.8	-65.8	-88.3	0	0	0	113	A19 L20 D21 H25 W26	A19-Y23 WeakPolarHBondContact O-CD2 3.26Å; L20-Y23 PolarHBondContact O-N 2.91Å; D21-Y23 VanDerWaalsContact C-N 3.35Å; Y23-H25 AromaticContact CD1-CE1 3.49Å; Y23-H25 VanDerWaalsContact CD1-CE1 3.49Å; Y23-H25 WeakPolarHBondContact CD1-CE1 3.28Å; Y23-H25 PolarHBondContact O-N 3.45Å; Y23-H25 VanDerWaalsContact O-N 3.1Å; Y23-W26 HydrophobicContact CD1-CD2 4.31Å; Y23-W26 AromaticContact CD1-CE2 3.87Å; Y23-W26 HydrophobicContact CD1-CG 4.46Å; Y23-W26 HydrophobicContact CD1-CZ2 4.29Å; Y23-W26 AromaticContact CD1-NE1 3.71Å; Y23-W26 HydrophobicContact CG-CD2 4.36Å; Y23-W26 HydrophobicContact CG-CG 4.5Å; Y23-W26 WeakPolarHBondContact O-CB 3.49Å; Y23-W26 PolarHBondContact O-N 3.37Å
24	T	82.7	Confident	87.5	Confident	129 Å²	129	84.8 Å²	84.8	79%	0.791	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-59.4	-23.4	177.4	55.3	0	0	0	0	114	E22 W26	E22-T24 VanDerWaalsContact C-N 3.29Å; E22-T24 PolarHBondContact O-N 3.14Å; T24-W26 VanDerWaalsContact C-N 3.31Å; T24-W26 PolarHBondContact O-N 3.34Å
25	H	89.9	Confident	88.2	Confident	130 Å²	130	90.8 Å²	90.8	60%	0.602	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-79	-9	177.6	66.8	-80	0	0	0	114.1	Y23 M27	Y23-H25 AromaticContact CD1-CE1 3.49Å; Y23-H25 VanDerWaalsContact CD1-CE1 3.49Å; Y23-H25 WeakPolarHBondContact CD1-CE1 3.28Å; Y23-H25 PolarHBondContact O-N 3.45Å; Y23-H25 VanDerWaalsContact O-N 3.1Å; H25-M27 PolarHBondContact O-N 3.31Å
26	W	87	Confident	88.7	Confident	101 Å²	101	93.5 Å²	93.5	38%	0.383	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-78.7	11.5	-179	-83.9	24.8	0	0	0	114.5	Y23 T24 D28 I29 A30	Y23-W26 HydrophobicContact CD1-CD2 4.31Å; Y23-W26 AromaticContact CD1-CE2 3.87Å; Y23-W26 HydrophobicContact CD1-CG 4.46Å; Y23-W26 HydrophobicContact CD1-CZ2 4.29Å; Y23-W26 AromaticContact CD1-NE1 3.71Å; Y23-W26 HydrophobicContact CG-CD2 4.36Å; Y23-W26 HydrophobicContact CG-CG 4.5Å; Y23-W26 WeakPolarHBondContact O-CB 3.49Å; Y23-W26 PolarHBondContact O-N 3.37Å; T24-W26 VanDerWaalsContact C-N 3.31Å; T24-W26 PolarHBondContact O-N 3.34Å; W26-D28 PolarHBondContact O-N 3.04Å; W26-I29 HydrophobicContact CE3-CG2 4.07Å; W26-I29 VanDerWaalsContact O-CB 3.3Å; W26-I29 WeakPolarHBondContact O-CB 3.49Å; W26-I29 PolarHBondContact O-N 3Å; W26-A30 HydrophobicContact CB-CB 4.27Å
27	M	87.6	Confident	88.9	Confident	154 Å²	154	89.6 Å²	89.6	76%	0.759	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	-130.9	176.8	-62.6	-171.9	-84.5	0	0	111.5	H25 I29	H25-M27 PolarHBondContact O-N 3.31Å; M27-I29 VanDerWaalsContact C-N 3.34Å
28	D	90.8	Very high	89.1	Confident	100 Å²	100	86.8 Å²	86.8	54%	0.535	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-15.8	179.8	61.6	-25.8	0	0	0	113.9	W26 A30 D31 I32	W26-D28 PolarHBondContact O-N 3.04Å; D28-A30 PolarHBondContact O-N 2.97Å; D28-D31 PolarHBondContact O-N 2.94Å; D28-D31 VanDerWaalsContact O-N 3.11Å; D28-I32 WeakPolarHBondContact O-CG1 3.19Å; D28-I32 PolarHBondContact O-N 3.5Å
29	I	92.1	Very high	89.1	Confident	81 Å²	81	86.1 Å²	86.1	42%	0.415	42%	0.422	S	S	.	.	H	α-helix	trans	-60.2	-40.2	178.4	-61.3	165.5	0	0	0	110.1	W26 M27 D31 I32 Q33	W26-I29 HydrophobicContact CE3-CG2 4.07Å; W26-I29 VanDerWaalsContact O-CB 3.3Å; W26-I29 WeakPolarHBondContact O-CB 3.49Å; W26-I29 PolarHBondContact O-N 3Å; M27-I29 VanDerWaalsContact C-N 3.34Å; I29-D31 VanDerWaalsContact C-N 3.29Å; I29-D31 PolarHBondContact O-N 3.26Å; I29-I32 PolarHBondContact O-N 3.03Å; I29-Q33 HydrophobicContact CG2-CG 4.23Å; I29-Q33 VanDerWaalsContact O-CG 3.27Å; I29-Q33 WeakPolarHBondContact O-CG 3.19Å; I29-Q33 PolarHBondContact O-N 2.57Å
30	A	90.1	Very high	89	Confident	4 Å²	4	85.2 Å²	85.2	3%	0.033	41%	0.414	C	S	.	.	H	α-helix	trans	-59.3	-42.2	177.4	0	0	0	0	0	111.4	W26 D28 Q33 R34	W26-A30 HydrophobicContact CB-CB 4.27Å; D28-A30 PolarHBondContact O-N 2.97Å; A30-Q33 PolarHBondContact O-N 3.03Å; A30-R34 WeakPolarHBondContact O-CG 3.41Å; A30-R34 PolarHBondContact O-N 3.49Å
31	D	90.1	Very high	88.9	Confident	96 Å²	96	91.4 Å²	91.4	51%	0.513	44%	0.443	S	S	.	.	H	α-helix	trans	-71.2	-37.9	179	-67.4	-23.1	0	0	0	112.5	D28 I29 Q33 R34 H35	D28-D31 PolarHBondContact O-N 2.94Å; D28-D31 VanDerWaalsContact O-N 3.11Å; I29-D31 VanDerWaalsContact C-N 3.29Å; I29-D31 PolarHBondContact O-N 3.26Å; D31-Q33 VanDerWaalsContact C-N 3.31Å; D31-Q33 PolarHBondContact O-N 2.86Å; D31-R34 PolarHBondContact O-N 2.89Å; D31-R34 IonicContact OD1-CZ 2.88Å; D31-R34 IonicContact OD1-NH1 3.97Å; D31-R34 PolarHBondContact OD1-NH1 2.9Å; D31-H35 WeakPolarHBondContact O-CB 3.46Å; D31-H35 PolarHBondContact O-N 3.1Å
32	I	92.8	Very high	88.9	Confident	100 Å²	100	86.9 Å²	86.9	51%	0.513	42%	0.419	S	S	.	.	H	α-helix	trans	-59.4	-45.2	172.4	-66.6	167.2	0	0	0	110	D28 I29 H35 W36	D28-I32 WeakPolarHBondContact O-CG1 3.19Å; D28-I32 PolarHBondContact O-N 3.5Å; I29-I32 PolarHBondContact O-N 3.03Å; I32-H35 PolarHBondContact O-N 3.31Å; I32-W36 WeakPolarHBondContact O-CB 2.99Å; I32-W36 PolarHBondContact O-N 3.15Å
33	Q	91.5	Very high	88.8	Confident	78 Å²	78	80.9 Å²	80.9	36%	0.364	39%	0.39	S	S	.	.	H	α-helix	trans	-66.9	-44.2	178.2	-67.6	-63.5	-19.9	0	0	111.9	L20 I29 A30 D31 H35 W36 I37	L20-Q33 HydrophobicContact CD1-CB 3.93Å; L20-Q33 HydrophobicContact CD2-CB 4.15Å; I29-Q33 HydrophobicContact CG2-CG 4.23Å; I29-Q33 VanDerWaalsContact O-CG 3.27Å; I29-Q33 WeakPolarHBondContact O-CG 3.19Å; I29-Q33 PolarHBondContact O-N 2.57Å; A30-Q33 PolarHBondContact O-N 3.03Å; D31-Q33 VanDerWaalsContact C-N 3.31Å; D31-Q33 PolarHBondContact O-N 2.86Å; Q33-H35 VanDerWaalsContact C-N 3.28Å; Q33-H35 PolarHBondContact O-N 2.84Å; Q33-W36 PolarHBondContact O-N 3.31Å; Q33-W36 VanDerWaalsContact O-N 3.13Å; Q33-I37 WeakPolarHBondContact O-CB 3.31Å; Q33-I37 WeakPolarHBondContact O-CG1 3.16Å; Q33-I37 PolarHBondContact O-N 3.2Å
34	R	90.3	Very high	88.9	Confident	50 Å²	50	78.8 Å²	78.8	19%	0.189	38%	0.381	C	S	.	.	H	α-helix	trans	-56.4	-44.8	174	-75.7	-177.8	-172.4	100.5	6.2	111.2	Y17 L20 D21 A30 D31 G38	Y17-R34 HydrophobicContact CE2-CB 4.17Å; Y17-R34 HydrophobicContact CE2-CG 4.22Å; L20-R34 HydrophobicContact CB-CG 4.42Å; L20-R34 HydrophobicContact CD1-CB 4.49Å; L20-R34 HydrophobicContact CD1-CG 3.64Å; L20-R34 PolarHBondContact O-NH2 3.42Å; D21-R34 IonicContact OD1-CZ 3.83Å; D21-R34 IonicContact OD1-NE 3.51Å; D21-R34 IonicContact OD1-NH2 3.35Å; D21-R34 PolarHBondContact OD1-NH2 3.17Å; A30-R34 WeakPolarHBondContact O-CG 3.41Å; A30-R34 PolarHBondContact O-N 3.49Å; D31-R34 PolarHBondContact O-N 2.89Å; D31-R34 IonicContact OD1-CZ 2.88Å; D31-R34 IonicContact OD1-NH1 3.97Å; D31-R34 PolarHBondContact OD1-NH1 2.9Å; R34-G38 WeakPolarHBondContact O-CA 3.29Å; R34-G38 PolarHBondContact O-N 2.66Å
35	H	91.7	Very high	89.3	Confident	138 Å²	138	72.7 Å²	72.7	64%	0.639	34%	0.344	S	S	*	.	H	α-helix	trans	-67.8	-38.1	178	-169.5	79.7	0	0	0	111.8	D31 I32 Q33 K236	D31-H35 WeakPolarHBondContact O-CB 3.46Å; D31-H35 PolarHBondContact O-N 3.1Å; I32-H35 PolarHBondContact O-N 3.31Å; Q33-H35 VanDerWaalsContact C-N 3.28Å; Q33-H35 PolarHBondContact O-N 2.84Å; H35-K236 PolarHBondContact CD2-NZ 3.4Å; H35-K236 PolarHBondContact NE2-NZ 3.45Å; H35-K236 VanDerWaalsContact NE2-NZ 3.1Å; H35-K236 WeakPolarHBondContact O-CD 3.3Å; H35-K236 WeakPolarHBondContact O-CE 3.27Å; H35-K236 PolarHBondContact O-NZ 3.02Å
36	W	90.7	Very high	89.3	Confident	170 Å²	170	67.3 Å²	67.3	64%	0.644	32%	0.321	S	S	*	.	H	α-helix	trans	-64.5	-50.4	177.6	-175	-97.4	0	0	0	112.1	I32 Q33 G38	I32-W36 WeakPolarHBondContact O-CB 2.99Å; I32-W36 PolarHBondContact O-N 3.15Å; Q33-W36 PolarHBondContact O-N 3.31Å; Q33-W36 VanDerWaalsContact O-N 3.13Å; W36-G38 VanDerWaalsContact C-N 3.32Å; W36-G38 PolarHBondContact O-N 2.74Å
37	I	89.1	Confident	89.5	Confident	12 Å²	12	62.5 Å²	62.5	6%	0.062	30%	0.303	C	S	.	.	H	α-helix	trans	-61.5	-43.8	176	-66.5	166.2	0	0	0	110.1	L13 Y17 L20 Q33 S234 L237	L13-I37 HydrophobicContact CD1-CG2 3.63Å; L13-I37 HydrophobicContact CG-CG2 4.35Å; Y17-I37 HydrophobicContact CD2-CB 4.28Å; Y17-I37 HydrophobicContact CD2-CG2 3.88Å; L20-I37 HydrophobicContact CD1-CD1 4.14Å; Q33-I37 WeakPolarHBondContact O-CB 3.31Å; Q33-I37 WeakPolarHBondContact O-CG1 3.16Å; Q33-I37 PolarHBondContact O-N 3.2Å; I37-S234 VanDerWaalsContact O-CB 3.25Å; I37-S234 WeakPolarHBondContact O-CB 3.23Å; I37-S234 PolarHBondContact O-OG 3.37Å; I37-L237 PolarHBondContact O-N 2.77Å
38	G	88.9	Confident	89.6	Confident	2 Å²	2	58.5 Å²	58.5	2%	0.021	28%	0.281	C	S	.	.			trans	81.4	166.7	-174.2	0	0	0	0	0	112.8	Y17 R34 W36 C40	Y17-G38 WeakPolarHBondContact CE2-O 3.37Å; R34-G38 WeakPolarHBondContact O-CA 3.29Å; R34-G38 PolarHBondContact O-N 2.66Å; W36-G38 VanDerWaalsContact C-N 3.32Å; W36-G38 PolarHBondContact O-N 2.74Å; G38-C40 PolarHBondContact O-N 3.49Å
39	P	86.9	Confident	89.5	Confident	75 Å²	75	53.8 Å²	53.8	49%	0.487	26%	0.256	S	S	.	.			trans	-64.8	126.3	-178.4	27.7	-34.3	0	0	0	110.6	E41	P39-E41 HydrophobicContact CB-CG 4.14Å; P39-E41 PolarHBondContact O-N 3.13Å; P39-E41 VanDerWaalsContact O-N 3.15Å
40	C	85.3	Confident	89.2	Confident	10 Å²	10	50.9 Å²	50.9	7%	0.068	24%	0.242	C	C	.	.			trans	-81.8	85.8	172.5	-64.7	0	0	0	0	108.2	G38 K232 T233	G38-C40 PolarHBondContact O-N 3.49Å; C40-K232 HydrophobicContact CB-CD 4.28Å; C40-K232 HydrophobicContact CB-CG 4.11Å; C40-K232 WeakPolarHBondContact O-CE 3.43Å; C40-K232 PolarHBondContact O-NZ 2.82Å; C40-T233 WeakPolarHBondContact CA-O 3.37Å
41	E	85.4	Confident	88.7	Confident	146 Å²	146	53.5 Å²	53.5	68%	0.682	26%	0.255	S	S	*	.			trans	-113.9	-2.5	-179.4	-73.1	175.9	-169.5	0	0	113	P39	P39-E41 HydrophobicContact CB-CG 4.14Å; P39-E41 PolarHBondContact O-N 3.13Å; P39-E41 VanDerWaalsContact O-N 3.15Å
42	A	87.1	Confident	87.8	Confident	2 Å²	2	51.7 Å²	51.7	2%	0.017	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	170	-176	0	0	0	0	0	111.3	Y72 K232 T233	A42-Y72 HydrophobicContact CB-CD2 4.28Å; A42-Y72 HydrophobicContact CB-CE1 4.31Å; A42-Y72 HydrophobicContact CB-CE2 3.32Å; A42-Y72 WeakPolarHBondContact CB-OH 3.25Å; A42-K232 CarbonylContact O-C 3.47Å; A42-K232 WeakPolarHBondContact O-CA 3.34Å; A42-T233 HydrophobicContact CB-CG2 4.08Å; A42-T233 PolarHBondContact N-O 3.38Å; A42-T233 PolarHBondContact O-N 3.41Å
43	Y	88.5	Confident	86.4	Confident	24 Å²	24	50.6 Å²	50.6	9%	0.094	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144.1	-178.2	-58.2	-94	0	0	0	108.7	V73 P76 D216 L220 Y231 K232	Y43-V73 PolarHBondContact N-O 3.4Å; Y43-V73 PolarHBondContact O-N 3.07Å; Y43-V73 VanDerWaalsContact O-O 3.07Å; Y43-P76 HydrophobicContact CD2-CB 4.37Å; Y43-P76 HydrophobicContact CD2-CG 4.24Å; Y43-P76 HydrophobicContact CE1-CG 4.47Å; Y43-P76 HydrophobicContact CE2-CG 4.06Å; Y43-P76 HydrophobicContact CG-CB 4.32Å; Y43-D216 PolarHBondContact OH-OD2 2.99Å; Y43-L220 HydrophobicContact CD1-CD1 4.1Å; Y43-L220 HydrophobicContact CD1-CD2 3.85Å; Y43-L220 HydrophobicContact CD1-CG 4.39Å; Y43-L220 HydrophobicContact CE1-CD1 3.91Å; Y43-L220 HydrophobicContact CE1-CD2 4.46Å; Y43-Y231 CarbonylContact C-O 3.56Å; Y43-Y231 VanDerWaalsContact CA-O 3.31Å; Y43-Y231 WeakPolarHBondContact CA-O 3.36Å; Y43-K232 HydrophobicContact CD1-CB 4.25Å; Y43-K232 HydrophobicContact CD1-CG 4.38Å; Y43-K232 HydrophobicContact CE1-CB 4.19Å; Y43-K232 HydrophobicContact CE1-CD 4.45Å; Y43-K232 HydrophobicContact CE1-CG 4.06Å
44	R	89.2	Confident	84.4	Confident	53 Å²	53	52.9 Å²	52.9	20%	0.2	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.3	175	-154.3	166.7	-168.9	103.2	10.5	108.6	S70 I71 E133 G230 Y231 T233	R44-S70 VanDerWaalsContact CD-OG 3.3Å; R44-S70 WeakPolarHBondContact CD-OG 3.43Å; R44-S70 VanDerWaalsContact CG-OG 3.31Å; R44-S70 WeakPolarHBondContact CG-OG 3.43Å; R44-S70 PolarHBondContact NE-OG 3.01Å; R44-I71 WeakPolarHBondContact CA-O 3.43Å; R44-E133 IonicContact CZ-OE2 2.8Å; R44-E133 IonicContact NH1-OE1 3.52Å; R44-E133 IonicContact NH1-OE2 2.72Å; R44-E133 PolarHBondContact NH1-OE2 2.91Å; R44-E133 IonicContact NH2-OE2 3.5Å; R44-E133 PolarHBondContact NH2-OE2 3.4Å; R44-G230 WeakPolarHBondContact O-CA 3.39Å; R44-Y231 HydrophobicContact CB-CD2 4.43Å; R44-Y231 HydrophobicContact CB-CE1 4.29Å; R44-Y231 HydrophobicContact CB-CE2 3.87Å; R44-Y231 PolarHBondContact N-O 3.49Å; R44-Y231 PolarHBondContact O-N 2.88Å; R44-T233 HydrophobicContact CB-CG2 4.13Å
45	F	90.1	Very high	82.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.3	178.1	-65.5	-91.9	0	0	0	110.7	F47 I71 V73 P76 V79 I219 L220 A223 D229	F45-F47 HydrophobicContact CB-CD1 3.95Å; F45-F47 HydrophobicContact CB-CE1 3.5Å; F45-F47 VanDerWaalsContact CB-CE1 3.5Å; F45-F47 HydrophobicContact CB-CZ 4.47Å; F45-F47 HydrophobicContact CG-CE1 4.25Å; F45-I71 PolarHBondContact N-O 3.26Å; F45-I71 PolarHBondContact O-N 3.46Å; F45-V73 HydrophobicContact CD2-CB 4.42Å; F45-V73 HydrophobicContact CD2-CG2 3.99Å; F45-V73 HydrophobicContact CE2-CB 4.45Å; F45-V73 HydrophobicContact CE2-CG2 4.44Å; F45-P76 HydrophobicContact CE2-CB 4.47Å; F45-P76 HydrophobicContact CZ-CB 4.13Å; F45-V79 HydrophobicContact CD2-CG2 3.63Å; F45-V79 HydrophobicContact CE1-CG2 4.38Å; F45-V79 HydrophobicContact CE2-CG2 3.43Å; F45-V79 VanDerWaalsContact CE2-CG2 3.43Å; F45-V79 HydrophobicContact CG-CG2 4.2Å; F45-V79 HydrophobicContact CZ-CG2 3.84Å; F45-I219 HydrophobicContact CE1-CG2 4.34Å; F45-I219 HydrophobicContact CZ-CG2 4.14Å; F45-L220 HydrophobicContact CE1-CD2 3.97Å; F45-L220 HydrophobicContact CZ-CD2 3.83Å; F45-A223 HydrophobicContact CD1-CB 3.94Å; F45-A223 HydrophobicContact CE1-CB 3.93Å; F45-D229 CarbonylContact C-O 3.49Å; F45-D229 VanDerWaalsContact CA-O 3.24Å; F45-D229 WeakPolarHBondContact CA-O 3.13Å
46	S	90	Very high	79.8	Confident	17 Å²	17	53.1 Å²	53.1	12%	0.119	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	108	174.3	-63.8	0	0	0	0	109.3	C228 D229	S46-C228 VanDerWaalsContact O-CB 3.28Å; S46-C228 WeakPolarHBondContact O-CB 3.44Å; S46-D229 PolarHBondContact N-O 3.1Å
47	F	90.9	Very high	77.4	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	135.9	177.3	-73.5	15.1	0	0	0	109.9	F45 F68 I69 I71 V79 I85 A110 W111 N112 P113 L119 L137	F45-F47 HydrophobicContact CB-CD1 3.95Å; F45-F47 HydrophobicContact CB-CE1 3.5Å; F45-F47 VanDerWaalsContact CB-CE1 3.5Å; F45-F47 HydrophobicContact CB-CZ 4.47Å; F45-F47 HydrophobicContact CG-CE1 4.25Å; F47-F68 CarbonylContact O-C 3.02Å; F47-F68 VanDerWaalsContact O-CA 3.23Å; F47-F68 WeakPolarHBondContact O-CA 3.26Å; F47-I69 HydrophobicContact CB-CG2 3.89Å; F47-I69 PolarHBondContact N-O 3.4Å; F47-I69 PolarHBondContact O-N 3.34Å; F47-I71 HydrophobicContact CB-CD1 3.9Å; F47-I71 HydrophobicContact CD1-CD1 4.01Å; F47-I71 HydrophobicContact CD2-CD1 3.12Å; F47-I71 HydrophobicContact CE1-CD1 4.27Å; F47-I71 HydrophobicContact CE2-CD1 3.41Å; F47-I71 VanDerWaalsContact CE2-CD1 3.41Å; F47-I71 HydrophobicContact CG-CD1 3.42Å; F47-I71 VanDerWaalsContact CG-CD1 3.42Å; F47-I71 HydrophobicContact CZ-CD1 3.97Å; F47-V79 HydrophobicContact CE1-CG1 4.47Å; F47-V79 HydrophobicContact CZ-CG1 4Å; F47-I85 HydrophobicContact CD2-CD1 3.89Å; F47-I85 HydrophobicContact CE2-CD1 4.27Å; F47-A110 HydrophobicContact CB-CB 3.96Å; F47-A110 HydrophobicContact CD2-CB 4.18Å; F47-W111 WeakPolarHBondContact CB-O 3.21Å; F47-W111 WeakPolarHBondContact CG-O 3.45Å; F47-N112 HydrophobicContact CD2-CB 4.38Å; F47-N112 HydrophobicContact CE2-CB 3.93Å; F47-N112 HydrophobicContact CZ-CB 4.29Å; F47-P113 VanDerWaalsContact CD1-CD 3.43Å; F47-P113 HydrophobicContact CD1-CG 4.11Å; F47-P113 VanDerWaalsContact CE1-CD 3.46Å; F47-P113 HydrophobicContact CE1-CG 4.07Å; F47-L119 HydrophobicContact CE2-CD1 3.95Å; F47-L137 HydrophobicContact CE2-CD1 4.47Å
48	K	89.7	Confident	74.8	Confident	70 Å²	70	61 Å²	61	30%	0.304	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	133.8	179.8	-174.6	175.4	178.5	176.6	0	111	D64 F68 A110 W111	K48-D64 WeakPolarHBondContact CE-OD1 3.16Å; K48-D64 WeakPolarHBondContact CE-OD2 3.24Å; K48-D64 IonicContact NZ-OD1 3.92Å; K48-D64 IonicContact NZ-OD2 2.76Å; K48-D64 PolarHBondContact NZ-OD2 3.4Å; K48-F68 HydrophobicContact CB-CD1 4.05Å; K48-F68 HydrophobicContact CB-CE1 3.92Å; K48-F68 HydrophobicContact CG-CE1 4.22Å; K48-A110 CarbonylContact O-C 3.58Å; K48-A110 WeakPolarHBondContact O-CA 3.35Å; K48-W111 HydrophobicContact CB-CB 4.27Å; K48-W111 PolarHBondContact O-N 3.16Å
49	L	89.3	Confident	72.6	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.005	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	137.6	178.8	-67	171.5	0	0	0	111.4	Y65 D67 I69 L93 A110 I121	L49-Y65 HydrophobicContact CB-CD1 4.27Å; L49-Y65 HydrophobicContact CB-CG 4.4Å; L49-Y65 HydrophobicContact CD1-CD1 4.33Å; L49-Y65 WeakPolarHBondContact O-CB 3.27Å; L49-Y65 PolarHBondContact O-N 3.38Å; L49-D67 WeakPolarHBondContact CB-O 3.38Å; L49-D67 HydrophobicContact CD1-CB 4.12Å; L49-D67 PolarHBondContact N-O 2.83Å; L49-I69 HydrophobicContact CD1-CB 4.46Å; L49-I69 HydrophobicContact CD2-CB 3.96Å; L49-I69 HydrophobicContact CD2-CG2 3.76Å; L49-I69 HydrophobicContact CG-CB 4.29Å; L49-I69 HydrophobicContact CG-CG2 4.34Å; L49-L93 HydrophobicContact CD1-CD1 3.9Å; L49-L93 HydrophobicContact CD1-CD2 3.53Å; L49-L93 HydrophobicContact CD1-CG 4.35Å; L49-L93 HydrophobicContact CD2-CD1 4.1Å; L49-A110 HydrophobicContact CD2-CB 4.27Å; L49-I121 HydrophobicContact CD2-CD1 3.38Å
50	V	85.5	Confident	70.6	Confident	21 Å²	21	76.6 Å²	76.6	13%	0.127	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	129.6	-176.9	-177.6	0	0	0	0	108.8	G62 N109 W111	V50-G62 VanDerWaalsContact CG1-CA 3.41Å; V50-N109 PolarHBondContact N-O 2.78Å; V50-N109 PolarHBondContact O-N 2.87Å; V50-W111 HydrophobicContact CG2-CB 4.37Å
51	L	80.4	Confident	68.9	Low	59 Å²	59	82 Å²	82	31%	0.309	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	132.4	175.4	-75.6	161.7	0	0	0	110.8	I53 I63 Y65 L108	L51-I53 PolarHBondContact O-N 3.32Å; L51-I63 HydrophobicContact CB-CB 4.44Å; L51-I63 HydrophobicContact CD1-CB 4.42Å; L51-I63 HydrophobicContact CD1-CG2 4.29Å; L51-I63 PolarHBondContact N-O 3.01Å; L51-Y65 HydrophobicContact CD1-CD2 3.92Å; L51-Y65 HydrophobicContact CD2-CD2 3.95Å; L51-Y65 HydrophobicContact CD2-CE2 4.37Å; L51-Y65 HydrophobicContact CG-CD2 3.79Å; L51-L108 HydrophobicContact CD2-CD2 3.42Å; L51-L108 VanDerWaalsContact CD2-CD2 3.42Å; L51-L108 HydrophobicContact CD2-CG 4.35Å; L51-L108 HydrophobicContact CG-CD2 3.89Å
52	T	70.4	Confident	67.6	Low	57 Å²	57	76.7 Å²	76.7	35%	0.35	40%	0.404	S	S	.	.			trans	-78.9	104.6	169.4	-56.2	0	0	0	0	108.3	C54 D107 N109	T52-C54 PolarHBondContact O-N 2.89Å; T52-D107 PolarHBondContact N-O 3.32Å; T52-N109 VanDerWaalsContact OG1-CG 3.3Å; T52-N109 PolarHBondContact OG1-ND2 3.42Å; T52-N109 PolarHBondContact OG1-OD1 3.13Å
53	I	62.5	Low	66.6	Low	77 Å²	77	81.3 Å²	81.3	40%	0.395	43%	0.427	S	S	.	.			trans	-81.3	116.4	171	-42.9	173.2	0	0	0	107.4	L51 S55 I63	L51-I53 PolarHBondContact O-N 3.32Å; I53-S55 WeakPolarHBondContact CG2-OG 3.43Å; I53-S55 PolarHBondContact O-N 3.49Å; I53-I63 HydrophobicContact CD1-CD1 3.44Å; I53-I63 VanDerWaalsContact CD1-CD1 3.44Å; I53-I63 HydrophobicContact CD1-CG1 3.69Å; I53-I63 HydrophobicContact CG1-CD1 4.03Å; I53-I63 HydrophobicContact CG1-CG1 4.43Å
54	C	50.3	Low	65.9	Low	126 Å²	126	83.9 Å²	83.9	85%	0.851	44%	0.443	S	S	*	.			trans	-71.5	16.8	173.2	-86.9	0	0	0	0	114	T52	T52-C54 PolarHBondContact O-N 2.89Å
55	S	41.3	Very low	65.1	Low	58 Å²	58	86.2 Å²	86.2	41%	0.406	45%	0.452	S	S	.	.	S	Bend	trans	-90	142.4	177.8	68.2	0	0	0	0	110.5	I53 L57	I53-S55 WeakPolarHBondContact CG2-OG 3.43Å; I53-S55 PolarHBondContact O-N 3.49Å; S55-L57 PolarHBondContact O-N 3.1Å
56	S	44.1	Very low	64.5	Low	136 Å²	136	88.5 Å²	88.5	95%	0.951	48%	0.475	S	S	*	.	S	Bend	trans	-63.4	15.4	-173.6	-1.2	0	0	0	0	115.4
57	L	40	Very low	64.2	Low	143 Å²	143	92 Å²	92	75%	0.749	49%	0.493	S	S	*	.	S	Bend	trans	-104.5	103.1	-177.3	-77.2	147.4	0	0	0	108.5	S55	S55-L57 PolarHBondContact O-N 3.1Å
58	R	35.3	Very low	64.1	Low	205 Å²	205	97.3 Å²	97.3	77%	0.774	52%	0.516	S	S	*	.			trans	38.7	103	168.5	-60.9	-176.8	-169.1	177.3	3.8	114.8	E60 D61	R58-E60 PolarHBondContact O-N 2.79Å; R58-D61 PolarHBondContact O-N 3.26Å
59	K	41.6	Very low	64.1	Low	226 Å²	226	94.1 Å²	94.1	98%	0.983	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	2.8	175.6	-82.8	-178.8	171.2	-179.6	0	117.4
60	E	46.1	Very low	64.1	Low	177 Å²	177	96 Å²	96	83%	0.827	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-16.6	-169.5	-64.8	-177.8	170	0	0	113.7	R58	R58-E60 PolarHBondContact O-N 2.79Å
61	D	49.5	Very low	64.3	Low	124 Å²	124	95 Å²	95	66%	0.663	51%	0.509	S	S	*	.			trans	-109	72	-178.3	-63.9	-35.6	0	0	0	111.3	R58	R58-D61 PolarHBondContact O-N 3.26Å
62	G	58.2	Low	64.6	Low	35 Å²	35	93 Å²	93	36%	0.361	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-71.4	144.6	169.5	0	0	0	0	0	111.4	V50 D64	V50-G62 VanDerWaalsContact CG1-CA 3.41Å; G62-D64 PolarHBondContact O-N 3.42Å
63	I	66.7	Low	65.4	Low	99 Å²	99	90.5 Å²	90.5	51%	0.508	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	127.1	174.9	-70.8	153.5	0	0	0	108.4	L51 I53 Y65	L51-I63 HydrophobicContact CB-CB 4.44Å; L51-I63 HydrophobicContact CD1-CB 4.42Å; L51-I63 HydrophobicContact CD1-CG2 4.29Å; L51-I63 PolarHBondContact N-O 3.01Å; I53-I63 HydrophobicContact CD1-CD1 3.44Å; I53-I63 VanDerWaalsContact CD1-CD1 3.44Å; I53-I63 HydrophobicContact CD1-CG1 3.69Å; I53-I63 HydrophobicContact CG1-CD1 4.03Å; I53-I63 HydrophobicContact CG1-CG1 4.43Å; I63-Y65 PolarHBondContact O-N 3.36Å
64	D	72.5	Confident	66.5	Low	78 Å²	78	93.3 Å²	93.3	42%	0.417	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	119	171.2	-176.2	6	0	0	0	110.2	K48 G62 G66	K48-D64 WeakPolarHBondContact CE-OD1 3.16Å; K48-D64 WeakPolarHBondContact CE-OD2 3.24Å; K48-D64 IonicContact NZ-OD1 3.92Å; K48-D64 IonicContact NZ-OD2 2.76Å; K48-D64 PolarHBondContact NZ-OD2 3.4Å; G62-D64 PolarHBondContact O-N 3.42Å; D64-G66 PolarHBondContact O-N 3.38Å; D64-G66 PolarHBondContact OD1-N 2.69Å
65	Y	73.5	Confident	68.2	Low	102 Å²	102	94 Å²	94	40%	0.4	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	-17.1	177.5	-169.3	-98.1	0	0	0	111.6	L49 L51 I63 D67 L108	L49-Y65 HydrophobicContact CB-CD1 4.27Å; L49-Y65 HydrophobicContact CB-CG 4.4Å; L49-Y65 HydrophobicContact CD1-CD1 4.33Å; L49-Y65 WeakPolarHBondContact O-CB 3.27Å; L49-Y65 PolarHBondContact O-N 3.38Å; L51-Y65 HydrophobicContact CD1-CD2 3.92Å; L51-Y65 HydrophobicContact CD2-CD2 3.95Å; L51-Y65 HydrophobicContact CD2-CE2 4.37Å; L51-Y65 HydrophobicContact CG-CD2 3.79Å; I63-Y65 PolarHBondContact O-N 3.36Å; Y65-D67 HydrophobicContact CD1-CB 3.88Å; Y65-D67 HydrophobicContact CE1-CB 4.21Å; Y65-D67 WeakPolarHBondContact CE1-OD2 3.37Å; Y65-D67 PolarHBondContact O-N 3.42Å; Y65-L108 HydrophobicContact CD2-CD2 3.75Å; Y65-L108 HydrophobicContact CE2-CD2 4.2Å; Y65-L108 HydrophobicContact CG-CD2 4.05Å
66	G	76.7	Confident	70.4	Confident	47 Å²	47	91.4 Å²	91.4	49%	0.485	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	82.9	-9.4	178.6	0	0	0	0	0	114.8	D64	D64-G66 PolarHBondContact O-N 3.38Å; D64-G66 PolarHBondContact OD1-N 2.69Å
67	D	84.7	Confident	72.3	Confident	90 Å²	90	87 Å²	87	48%	0.481	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	164.5	176.2	-66.6	-31.8	0	0	0	112.4	L49 Y65	L49-D67 WeakPolarHBondContact CB-O 3.38Å; L49-D67 HydrophobicContact CD1-CB 4.12Å; L49-D67 PolarHBondContact N-O 2.83Å; Y65-D67 HydrophobicContact CD1-CB 3.88Å; Y65-D67 HydrophobicContact CE1-CB 4.21Å; Y65-D67 WeakPolarHBondContact CE1-OD2 3.37Å; Y65-D67 PolarHBondContact O-N 3.42Å
68	F	87.6	Confident	74.4	Confident	113 Å²	113	82 Å²	82	50%	0.496	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	145	176.5	-60.4	-95.6	0	0	0	110.4	F47 K48	F47-F68 CarbonylContact O-C 3.02Å; F47-F68 VanDerWaalsContact O-CA 3.23Å; F47-F68 WeakPolarHBondContact O-CA 3.26Å; K48-F68 HydrophobicContact CB-CD1 4.05Å; K48-F68 HydrophobicContact CB-CE1 3.92Å; K48-F68 HydrophobicContact CG-CE1 4.22Å
69	I	89.3	Confident	76.9	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.015	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128.2	166.1	-172.2	172.8	0	0	0	109.2	F47 L49 I71 I85 V87 L93 A110 A135	F47-I69 HydrophobicContact CB-CG2 3.89Å; F47-I69 PolarHBondContact N-O 3.4Å; F47-I69 PolarHBondContact O-N 3.34Å; L49-I69 HydrophobicContact CD1-CB 4.46Å; L49-I69 HydrophobicContact CD2-CB 3.96Å; L49-I69 HydrophobicContact CD2-CG2 3.76Å; L49-I69 HydrophobicContact CG-CB 4.29Å; L49-I69 HydrophobicContact CG-CG2 4.34Å; I69-I71 HydrophobicContact CG1-CG1 4.42Å; I69-I71 HydrophobicContact CG2-CD1 4.22Å; I69-I71 HydrophobicContact CG2-CG1 4.23Å; I69-I85 HydrophobicContact CD1-CG2 4.08Å; I69-V87 HydrophobicContact CD1-CG1 3.7Å; I69-L93 HydrophobicContact CB-CD1 4.42Å; I69-L93 HydrophobicContact CD1-CD1 3.79Å; I69-L93 HydrophobicContact CG1-CD1 4.32Å; I69-A110 HydrophobicContact CG2-CB 3.83Å; I69-A135 HydrophobicContact CD1-CB 3.87Å; I69-A135 HydrophobicContact CG1-CB 4.09Å
70	S	89.4	Confident	78.8	Confident	39 Å²	39	62.3 Å²	62.3	27%	0.273	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.4	179	-165	0	0	0	0	109.9	R44	R44-S70 VanDerWaalsContact CD-OG 3.3Å; R44-S70 WeakPolarHBondContact CD-OG 3.43Å; R44-S70 VanDerWaalsContact CG-OG 3.31Å; R44-S70 WeakPolarHBondContact CG-OG 3.43Å; R44-S70 PolarHBondContact NE-OG 3.01Å
71	I	89.8	Confident	80.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.7	-171.7	-58	169.5	0	0	0	109.6	R44 F45 F47 I69 V73 I85 L137	R44-I71 WeakPolarHBondContact CA-O 3.43Å; F45-I71 PolarHBondContact N-O 3.26Å; F45-I71 PolarHBondContact O-N 3.46Å; F47-I71 HydrophobicContact CB-CD1 3.9Å; F47-I71 HydrophobicContact CD1-CD1 4.01Å; F47-I71 HydrophobicContact CD2-CD1 3.12Å; F47-I71 HydrophobicContact CE1-CD1 4.27Å; F47-I71 HydrophobicContact CE2-CD1 3.41Å; F47-I71 VanDerWaalsContact CE2-CD1 3.41Å; F47-I71 HydrophobicContact CG-CD1 3.42Å; F47-I71 VanDerWaalsContact CG-CD1 3.42Å; F47-I71 HydrophobicContact CZ-CD1 3.97Å; I69-I71 HydrophobicContact CG1-CG1 4.42Å; I69-I71 HydrophobicContact CG2-CD1 4.22Å; I69-I71 HydrophobicContact CG2-CG1 4.23Å; I71-V73 HydrophobicContact CG2-CG2 3.99Å; I71-I85 HydrophobicContact CD1-CD1 3.47Å; I71-I85 VanDerWaalsContact CD1-CD1 3.47Å; I71-I85 HydrophobicContact CD1-CG1 3.9Å; I71-I85 HydrophobicContact CD1-CG2 4.47Å; I71-L137 HydrophobicContact CG2-CB 3.79Å
72	Y	87.1	Confident	81.9	Confident	17 Å²	17	49.7 Å²	49.7	7%	0.067	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.3	173.4	-179.9	-90.1	0	0	0	110.7	A42 R74 E133 A135 L136 T233	A42-Y72 HydrophobicContact CB-CD2 4.28Å; A42-Y72 HydrophobicContact CB-CE1 4.31Å; A42-Y72 HydrophobicContact CB-CE2 3.32Å; A42-Y72 WeakPolarHBondContact CB-OH 3.25Å; Y72-R74 HydrophobicContact CE1-CG 3.93Å; Y72-E133 HydrophobicContact CD1-CG 3.91Å; Y72-E133 HydrophobicContact CD2-CG 4.08Å; Y72-E133 HydrophobicContact CG-CG 3.66Å; Y72-A135 PolarHBondContact N-O 3.15Å; Y72-L136 HydrophobicContact CD1-CD2 4.08Å; Y72-T233 HydrophobicContact CD2-CG2 4.35Å; Y72-T233 HydrophobicContact CE2-CG2 4.23Å
73	V	88	Confident	83.1	Confident	6 Å²	6	54.6 Å²	54.6	4%	0.036	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	133	179.8	-167.6	0	0	0	0	109.6	Y43 F45 I71 K75 D78 V79 L137	Y43-V73 PolarHBondContact N-O 3.4Å; Y43-V73 PolarHBondContact O-N 3.07Å; Y43-V73 VanDerWaalsContact O-O 3.07Å; F45-V73 HydrophobicContact CD2-CB 4.42Å; F45-V73 HydrophobicContact CD2-CG2 3.99Å; F45-V73 HydrophobicContact CE2-CB 4.45Å; F45-V73 HydrophobicContact CE2-CG2 4.44Å; I71-V73 HydrophobicContact CG2-CG2 3.99Å; V73-K75 WeakPolarHBondContact CG1-O 3.02Å; V73-D78 HydrophobicContact CG1-CB 3.67Å; V73-V79 HydrophobicContact CG1-CG2 4.36Å; V73-V79 HydrophobicContact CG2-CG2 4.07Å; V73-L137 HydrophobicContact CG2-CB 4.2Å; V73-L137 HydrophobicContact CG2-CD2 4.39Å
74	R	84.3	Confident	84.1	Confident	135 Å²	135	49.9 Å²	49.9	51%	0.509	25%	0.251	S	S	.	.	S	Bend	trans	-75.8	-41.6	178.3	-66.7	-178.5	-178.2	170.8	1.7	112.2	Y72 D131	Y72-R74 HydrophobicContact CE1-CG 3.93Å; R74-D131 IonicContact NH2-OD2 3.01Å; R74-D131 PolarHBondContact NH2-OD2 3.14Å
75	K	86.1	Confident	84.9	Confident	141 Å²	141	46.2 Å²	46.2	61%	0.613	23%	0.231	S	C	*	.	S	Bend	trans	-121.5	129.7	177.2	-63.8	178.2	-179.8	177.9	0	109.7	V73 A77 D78	V73-K75 WeakPolarHBondContact CG1-O 3.02Å; K75-A77 PolarHBondContact O-N 2.94Å; K75-A77 VanDerWaalsContact O-N 3.15Å; K75-D78 VanDerWaalsContact O-CB 3.25Å; K75-D78 WeakPolarHBondContact O-CB 3.42Å; K75-D78 PolarHBondContact O-N 3.22Å
76	P	87.2	Confident	85.6	Confident	4 Å²	4	41.4 Å²	41.4	3%	0.026	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.7	-176.5	28.4	-32.8	0	0	0	111.3	Y43 F45 D78 V79 D216 I219	Y43-P76 HydrophobicContact CD2-CB 4.37Å; Y43-P76 HydrophobicContact CD2-CG 4.24Å; Y43-P76 HydrophobicContact CE1-CG 4.47Å; Y43-P76 HydrophobicContact CE2-CG 4.06Å; Y43-P76 HydrophobicContact CG-CB 4.32Å; F45-P76 HydrophobicContact CE2-CB 4.47Å; F45-P76 HydrophobicContact CZ-CB 4.13Å; P76-D78 PolarHBondContact O-N 3.14Å; P76-V79 VanDerWaalsContact O-CB 3.22Å; P76-V79 WeakPolarHBondContact O-CB 3.44Å; P76-V79 WeakPolarHBondContact O-CG2 3.17Å; P76-V79 PolarHBondContact O-N 3.22Å; P76-D216 HydrophobicContact CG-CB 3.72Å; P76-D216 WeakPolarHBondContact CG-OD1 3.37Å; P76-I219 HydrophobicContact CB-CB 4.28Å; P76-I219 HydrophobicContact CB-CD1 4.04Å; P76-I219 HydrophobicContact CB-CG2 4Å; P76-I219 HydrophobicContact CG-CD1 4.27Å
77	A	84.6	Confident	86.2	Confident	42 Å²	42	39.1 Å²	39.1	35%	0.347	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.8	172	0	0	0	0	0	113.7	K75 V79 L80	K75-A77 PolarHBondContact O-N 2.94Å; K75-A77 VanDerWaalsContact O-N 3.15Å; A77-V79 PolarHBondContact O-N 3.17Å; A77-L80 WeakPolarHBondContact O-CB 3.46Å; A77-L80 PolarHBondContact O-N 3.49Å; A77-L80 VanDerWaalsContact O-N 3.08Å
78	D	84.6	Confident	86.3	Confident	40 Å²	40	36.6 Å²	36.6	21%	0.214	17%	0.173	C	C	.	.	H	α-helix	trans	-65.4	-27	177.5	-65.1	-22	0	0	0	111.3	V73 K75 P76 L80 S81 G82 L137 A139	V73-D78 HydrophobicContact CG1-CB 3.67Å; K75-D78 VanDerWaalsContact O-CB 3.25Å; K75-D78 WeakPolarHBondContact O-CB 3.42Å; K75-D78 PolarHBondContact O-N 3.22Å; P76-D78 PolarHBondContact O-N 3.14Å; D78-L80 PolarHBondContact O-N 3.5Å; D78-S81 CarbonylContact O-C 3.52Å; D78-S81 PolarHBondContact O-N 3.15Å; D78-S81 PolarHBondContact O-OG 3.24Å; D78-G82 PolarHBondContact O-N 3.4Å; D78-L137 WeakPolarHBondContact O-CD2 3.49Å; D78-A139 HydrophobicContact CB-CB 3.96Å
79	V	86.5	Confident	86.1	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.1	-35.1	172.8	178.5	0	0	0	0	111.6	F45 F47 V73 P76 A77 S81 N112 V114 L137	F45-V79 HydrophobicContact CD2-CG2 3.63Å; F45-V79 HydrophobicContact CE1-CG2 4.38Å; F45-V79 HydrophobicContact CE2-CG2 3.43Å; F45-V79 VanDerWaalsContact CE2-CG2 3.43Å; F45-V79 HydrophobicContact CG-CG2 4.2Å; F45-V79 HydrophobicContact CZ-CG2 3.84Å; F47-V79 HydrophobicContact CE1-CG1 4.47Å; F47-V79 HydrophobicContact CZ-CG1 4Å; V73-V79 HydrophobicContact CG1-CG2 4.36Å; V73-V79 HydrophobicContact CG2-CG2 4.07Å; P76-V79 VanDerWaalsContact O-CB 3.22Å; P76-V79 WeakPolarHBondContact O-CB 3.44Å; P76-V79 WeakPolarHBondContact O-CG2 3.17Å; P76-V79 PolarHBondContact O-N 3.22Å; A77-V79 PolarHBondContact O-N 3.17Å; V79-S81 VanDerWaalsContact C-N 3.35Å; V79-N112 WeakPolarHBondContact CG1-OD1 3.46Å; V79-N112 PolarHBondContact O-ND2 3.25Å; V79-V114 HydrophobicContact CG1-CB 4.02Å; V79-V114 HydrophobicContact CG1-CG2 3.76Å; V79-L137 VanDerWaalsContact CA-CD2 3.49Å; V79-L137 HydrophobicContact CB-CD2 4.44Å; V79-L137 HydrophobicContact CG2-CD2 4.32Å
80	L	83.3	Confident	85.8	Confident	17 Å²	17	39.1 Å²	39.1	9%	0.089	19%	0.189	C	C	.	.	H	α-helix	trans	-77.4	-22.7	-179.6	-59.4	164.6	0	0	0	113	A77 D78 V114 T115 K211 L214 I219	A77-L80 WeakPolarHBondContact O-CB 3.46Å; A77-L80 PolarHBondContact O-N 3.49Å; A77-L80 VanDerWaalsContact O-N 3.08Å; D78-L80 PolarHBondContact O-N 3.5Å; L80-V114 HydrophobicContact CD2-CB 4.3Å; L80-V114 HydrophobicContact CD2-CG1 3.38Å; L80-V114 HydrophobicContact CG-CG1 4.43Å; L80-T115 HydrophobicContact CD2-CG2 4.21Å; L80-K211 HydrophobicContact CB-CB 4.37Å; L80-K211 HydrophobicContact CB-CD 3.62Å; L80-K211 HydrophobicContact CB-CG 3.7Å; L80-K211 HydrophobicContact CD1-CB 3.88Å; L80-K211 HydrophobicContact CD1-CG 3.76Å; L80-K211 HydrophobicContact CD2-CG 4.4Å; L80-K211 HydrophobicContact CG-CG 4.16Å; L80-K211 VanDerWaalsContact O-CE 3.31Å; L80-K211 WeakPolarHBondContact O-CE 3.15Å; L80-K211 PolarHBondContact O-NZ 3Å; L80-L214 HydrophobicContact CD1-CD2 4.35Å; L80-I219 HydrophobicContact CD1-CD1 3.95Å; L80-I219 HydrophobicContact CD1-CG1 4.27Å
81	S	79.3	Confident	85.7	Confident	25 Å²	25	38.9 Å²	38.9	18%	0.175	18%	0.184	C	C	.	.	H	α-helix	trans	-107.1	-3	-178.4	79.7	0	0	0	0	113.7	D78 V79 R83 S140	D78-S81 CarbonylContact O-C 3.52Å; D78-S81 PolarHBondContact O-N 3.15Å; D78-S81 PolarHBondContact O-OG 3.24Å; V79-S81 VanDerWaalsContact C-N 3.35Å; S81-R83 PolarHBondContact O-N 3.35Å; S81-S140 PolarHBondContact O-N 3.39Å; S81-S140 PolarHBondContact O-OG 3.29Å
82	G	81.5	Confident	85.4	Confident	10 Å²	10	45.6 Å²	45.6	10%	0.103	22%	0.218	C	C	.	.			trans	-60.5	130.4	179.4	0	0	0	0	0	111.9	D78 L119 V138	D78-G82 PolarHBondContact O-N 3.4Å; G82-L119 WeakPolarHBondContact O-CD2 3.4Å; G82-V138 WeakPolarHBondContact CA-O 3.23Å
83	R	82.3	Confident	85.3	Confident	138 Å²	138	46.2 Å²	46.2	52%	0.521	22%	0.223	S	C	.	.			trans	-117.3	-24.4	179.4	-67.4	-173.6	178.9	136.2	0.6	113.8	S81 V138 S140 L153	S81-R83 PolarHBondContact O-N 3.35Å; R83-V138 PolarHBondContact N-O 3.42Å; R83-S140 PolarHBondContact NE-OG 3.36Å; R83-S140 PolarHBondContact NH1-OG 2.84Å; R83-S140 PolarHBondContact NH2-OG 3.03Å; R83-L153 HydrophobicContact CB-CD1 4.12Å
84	L	86.9	Confident	84.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	143.5	-172.6	179.4	70.4	0	0	0	108.7	I86 F105 P120 F122 V138 L153	L84-I86 HydrophobicContact CD2-CG2 4.02Å; L84-I86 HydrophobicContact CG-CG2 4.29Å; L84-F105 HydrophobicContact CD1-CE1 3.64Å; L84-F105 HydrophobicContact CD1-CZ 4.35Å; L84-P120 HydrophobicContact CD1-CB 4.3Å; L84-P120 HydrophobicContact CD1-CG 3.86Å; L84-P120 WeakPolarHBondContact CD1-O 3.33Å; L84-F122 HydrophobicContact CD1-CB 3.87Å; L84-F122 HydrophobicContact CD2-CB 4.3Å; L84-F122 HydrophobicContact CG-CB 4.33Å; L84-V138 HydrophobicContact CB-CB 4.08Å; L84-V138 HydrophobicContact CB-CG2 4.36Å; L84-V138 HydrophobicContact CD2-CG2 4.43Å; L84-V138 WeakPolarHBondContact O-CB 3.28Å; L84-V138 PolarHBondContact O-N 3.36Å; L84-L153 HydrophobicContact CB-CD1 4.19Å
85	I	89.4	Confident	84.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.9	168.5	-65.6	158.2	0	0	0	107.6	F47 I69 I71 V87 A110 L119 P120 I121 F122 L136 L137	F47-I85 HydrophobicContact CD2-CD1 3.89Å; F47-I85 HydrophobicContact CE2-CD1 4.27Å; I69-I85 HydrophobicContact CD1-CG2 4.08Å; I71-I85 HydrophobicContact CD1-CD1 3.47Å; I71-I85 VanDerWaalsContact CD1-CD1 3.47Å; I71-I85 HydrophobicContact CD1-CG1 3.9Å; I71-I85 HydrophobicContact CD1-CG2 4.47Å; I85-V87 HydrophobicContact CG2-CG1 4.36Å; I85-A110 HydrophobicContact CD1-CB 3.37Å; I85-L119 HydrophobicContact CD1-CB 3.98Å; I85-L119 HydrophobicContact CD1-CD1 4.1Å; I85-L119 HydrophobicContact CG1-CB 4.41Å; I85-L119 HydrophobicContact CG1-CD1 4.28Å; I85-P120 PolarHBondContact N-O 3.05Å; I85-I121 HydrophobicContact CB-CG1 4.48Å; I85-I121 CarbonylContact O-C 3.52Å; I85-I121 WeakPolarHBondContact O-CA 3.46Å; I85-F122 PolarHBondContact O-N 2.96Å; I85-L136 WeakPolarHBondContact CA-O 3.22Å; I85-L137 HydrophobicContact CG1-CD1 3.78Å
86	I	88.3	Confident	82.7	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137.3	173.7	59.6	172.8	0	0	0	109.6	L84 F122 A124 C128 F129 A135 L136 V138	L84-I86 HydrophobicContact CD2-CG2 4.02Å; L84-I86 HydrophobicContact CG-CG2 4.29Å; I86-F122 CarbonylContact C-O 3.57Å; I86-F122 VanDerWaalsContact CA-O 3.25Å; I86-F122 WeakPolarHBondContact CA-O 3.48Å; I86-F122 HydrophobicContact CG2-CD1 4.24Å; I86-A124 HydrophobicContact CB-CB 4Å; I86-A124 HydrophobicContact CG2-CB 4.19Å; I86-C128 HydrophobicContact CD1-CB 4.17Å; I86-F129 HydrophobicContact CB-CZ 4.26Å; I86-F129 HydrophobicContact CD1-CE1 4.32Å; I86-F129 HydrophobicContact CD1-CZ 4.13Å; I86-F129 HydrophobicContact CG1-CE1 4.16Å; I86-F129 HydrophobicContact CG1-CZ 4Å; I86-A135 WeakPolarHBondContact O-CA 3.38Å; I86-L136 HydrophobicContact CD1-CB 4.17Å; I86-L136 HydrophobicContact CD1-CD1 4.37Å; I86-L136 HydrophobicContact CG1-CB 3.81Å; I86-L136 PolarHBondContact N-O 2.92Å; I86-L136 PolarHBondContact O-N 3.18Å; I86-V138 HydrophobicContact CB-CG2 4.49Å; I86-V138 HydrophobicContact CD1-CG2 4.23Å; I86-V138 HydrophobicContact CG1-CG2 4.1Å; I86-V138 HydrophobicContact CG2-CG2 3.74Å
87	V	89.7	Confident	81.2	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148.7	175.8	-63.7	0	0	0	0	110.7	I69 I85 H91 L106 I121 F122 V123 A124 D134 A135	I69-V87 HydrophobicContact CD1-CG1 3.7Å; I85-V87 HydrophobicContact CG2-CG1 4.36Å; V87-H91 HydrophobicContact CB-CB 4.12Å; V87-L106 HydrophobicContact CG2-CD1 4.36Å; V87-I121 HydrophobicContact CB-CG2 4.46Å; V87-I121 HydrophobicContact CG1-CG2 3.73Å; V87-I121 HydrophobicContact CG2-CG2 3.88Å; V87-F122 PolarHBondContact N-O 2.91Å; V87-V123 HydrophobicContact CG2-CB 4.45Å; V87-V123 HydrophobicContact CG2-CG2 3.91Å; V87-V123 WeakPolarHBondContact O-CA 3.25Å; V87-A124 PolarHBondContact O-N 3.43Å; V87-D134 CarbonylContact C-O 3.49Å; V87-D134 VanDerWaalsContact CA-O 3.29Å; V87-D134 WeakPolarHBondContact CA-O 3.4Å; V87-A135 HydrophobicContact CG1-CB 4.09Å
88	R	86.7	Confident	79.8	Confident	36 Å²	36	52.6 Å²	52.6	14%	0.136	27%	0.273	C	S	.	.			trans	-64.9	154.1	174.8	-75.7	-175.4	-179.4	-92.3	8.8	111.4	Q90 H91 D126 F129 D131 E133 D134	R88-Q90 PolarHBondContact O-N 3.08Å; R88-H91 WeakPolarHBondContact O-CB 3.23Å; R88-H91 PolarHBondContact O-N 3.31Å; R88-H91 VanDerWaalsContact O-N 3.07Å; R88-D126 IonicContact CZ-OD1 3.03Å; R88-D126 IonicContact NH1-OD1 2.78Å; R88-D126 PolarHBondContact NH1-OD1 3.06Å; R88-F129 HydrophobicContact CB-CE2 4.32Å; R88-F129 HydrophobicContact CB-CZ 4.45Å; R88-F129 HydrophobicContact CG-CD1 3.92Å; R88-F129 HydrophobicContact CG-CD2 3.56Å; R88-F129 HydrophobicContact CG-CE1 3.94Å; R88-F129 HydrophobicContact CG-CE2 3.57Å; R88-F129 HydrophobicContact CG-CG 3.76Å; R88-F129 HydrophobicContact CG-CZ 3.79Å; R88-F129 PolarHBondContact NH2-O 3.31Å; R88-D131 PolarHBondContact NH2-O 3.4Å; R88-E133 PolarHBondContact NE-O 3.27Å; R88-D134 PolarHBondContact N-O 3Å; R88-D134 IonicContact NE-OD1 3.95Å
89	P	83.7	Confident	78.4	Confident	37 Å²	37	51.6 Å²	51.6	24%	0.24	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-30.2	176	-22.1	35.3	0	0	0	113.4	H91 N94 V123 A124 D126	P89-H91 VanDerWaalsContact C-N 3.31Å; P89-N94 PolarHBondContact O-ND2 3.45Å; P89-V123 HydrophobicContact CB-CG1 4.25Å; P89-V123 HydrophobicContact CG-CG1 4.32Å; P89-A124 WeakPolarHBondContact CD-O 3.29Å; P89-A124 VanDerWaalsContact CG-O 3.27Å; P89-A124 WeakPolarHBondContact CG-O 3.46Å; P89-D126 WeakPolarHBondContact CD-OD1 3.31Å
90	Q	83.2	Confident	76.7	Confident	132 Å²	132	57.1 Å²	57.1	62%	0.617	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	0.5	177.7	-50.1	87	12.4	0	0	113.8	R88 D126	R88-Q90 PolarHBondContact O-N 3.08Å; Q90-D126 PolarHBondContact NE2-OD2 3.38Å; Q90-D126 PolarHBondContact OE1-OD1 2.8Å
91	H	87.1	Confident	75.3	Confident	34 Å²	34	63.2 Å²	63.2	16%	0.157	34%	0.337	C	S	.	.	S	Bend	trans	-63.7	145.3	-177.9	-172.1	-106.7	0	0	0	111.4	V87 R88 P89 L93 N94	V87-H91 HydrophobicContact CB-CB 4.12Å; R88-H91 WeakPolarHBondContact O-CB 3.23Å; R88-H91 PolarHBondContact O-N 3.31Å; R88-H91 VanDerWaalsContact O-N 3.07Å; P89-H91 VanDerWaalsContact C-N 3.31Å; H91-L93 VanDerWaalsContact CE1-CG 3.47Å; H91-L93 WeakPolarHBondContact CE1-CG 3.42Å; H91-L93 PolarHBondContact ND1-N 3.04Å; H91-L93 PolarHBondContact O-N 3.49Å; H91-L93 VanDerWaalsContact O-N 3.08Å; H91-N94 WeakPolarHBondContact O-CB 3.44Å; H91-N94 PolarHBondContact O-N 2.82Å
92	I	84.4	Confident	74.3	Confident	141 Å²	141	63.3 Å²	63.3	72%	0.723	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-55.5	-33.9	-175.1	-60	168.7	0	0	0	111.3	N94 V95	I92-N94 PolarHBondContact O-N 3.18Å; I92-N94 VanDerWaalsContact O-N 3.14Å; I92-V95 WeakPolarHBondContact O-CG2 3.04Å; I92-V95 PolarHBondContact O-N 2.83Å
93	L	83.4	Confident	74	Confident	30 Å²	30	68.2 Å²	68.2	16%	0.157	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-65.1	-17.1	178.5	-61.8	176.5	0	0	0	114.2	L49 I69 H91 V95 L106 L108 I121	L49-L93 HydrophobicContact CD1-CD1 3.9Å; L49-L93 HydrophobicContact CD1-CD2 3.53Å; L49-L93 HydrophobicContact CD1-CG 4.35Å; L49-L93 HydrophobicContact CD2-CD1 4.1Å; I69-L93 HydrophobicContact CB-CD1 4.42Å; I69-L93 HydrophobicContact CD1-CD1 3.79Å; I69-L93 HydrophobicContact CG1-CD1 4.32Å; H91-L93 VanDerWaalsContact CE1-CG 3.47Å; H91-L93 WeakPolarHBondContact CE1-CG 3.42Å; H91-L93 PolarHBondContact ND1-N 3.04Å; H91-L93 PolarHBondContact O-N 3.49Å; H91-L93 VanDerWaalsContact O-N 3.08Å; L93-V95 PolarHBondContact O-N 3.37Å; L93-L106 HydrophobicContact CB-CD1 3.91Å; L93-L108 HydrophobicContact CD2-CD1 4.27Å; L93-I121 HydrophobicContact CD1-CD1 4.32Å
94	N	81.2	Confident	73.8	Confident	27 Å²	27	63 Å²	63	14%	0.144	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-86.8	32.4	174.2	-165.8	24.7	0	0	0	112.5	P89 H91 I92 K96 G97	P89-N94 PolarHBondContact O-ND2 3.45Å; H91-N94 WeakPolarHBondContact O-CB 3.44Å; H91-N94 PolarHBondContact O-N 2.82Å; I92-N94 PolarHBondContact O-N 3.18Å; I92-N94 VanDerWaalsContact O-N 3.14Å; N94-K96 PolarHBondContact O-N 2.8Å; N94-K96 VanDerWaalsContact O-N 3.08Å; N94-G97 PolarHBondContact O-N 2.96Å
95	V	66.4	Low	73.5	Confident	117 Å²	117	66.7 Å²	66.7	71%	0.709	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-37.2	-175.8	-172	0	0	0	0	113	I92 L93 G97	I92-V95 WeakPolarHBondContact O-CG2 3.04Å; I92-V95 PolarHBondContact O-N 2.83Å; L93-V95 PolarHBondContact O-N 3.37Å; V95-G97 PolarHBondContact O-N 3.14Å
96	K	56.7	Low	73.2	Confident	177 Å²	177	67.2 Å²	67.2	77%	0.77	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	0.4	-170.3	-71.1	-176.8	-179.7	176.8	0	114.3	N94 L98	N94-K96 PolarHBondContact O-N 2.8Å; N94-K96 VanDerWaalsContact O-N 3.08Å; K96-L98 HydrophobicContact CB-CD1 3.83Å; K96-L98 HydrophobicContact CB-CG 3.69Å; K96-L98 HydrophobicContact CD-CD1 4.18Å; K96-L98 PolarHBondContact O-N 3.4Å; K96-L98 VanDerWaalsContact O-N 3.09Å
97	G	56.3	Low	72.8	Confident	44 Å²	44	72 Å²	72	45%	0.454	39%	0.39	S	S	.	.			trans	53.5	31.3	-174	0	0	0	0	0	112.3	N94 V95 S99	N94-G97 PolarHBondContact O-N 2.96Å; V95-G97 PolarHBondContact O-N 3.14Å; G97-S99 CarbonylContact O-C 3.59Å; G97-S99 PolarHBondContact O-N 3.25Å
98	L	54.1	Low	72.6	Confident	98 Å²	98	72.8 Å²	72.8	51%	0.513	39%	0.394	S	S	.	.			trans	-57.7	-14.9	-172.9	-83.9	156.1	0	0	0	113	K96 P100	K96-L98 HydrophobicContact CB-CD1 3.83Å; K96-L98 HydrophobicContact CB-CG 3.69Å; K96-L98 HydrophobicContact CD-CD1 4.18Å; K96-L98 PolarHBondContact O-N 3.4Å; K96-L98 VanDerWaalsContact O-N 3.09Å; L98-P100 VanDerWaalsContact C-CD 3.44Å; L98-P100 WeakPolarHBondContact O-CD 3.5Å
99	S	55.1	Low	72.7	Confident	18 Å²	18	72.7 Å²	72.7	13%	0.126	40%	0.396	C	S	.	.			trans	-110.4	82.6	173.4	-178.3	0	0	0	0	112	G97 N101 G102 Y103	G97-S99 CarbonylContact O-C 3.59Å; G97-S99 PolarHBondContact O-N 3.25Å; S99-N101 PolarHBondContact O-N 2.95Å; S99-G102 PolarHBondContact O-N 3.01Å; S99-G102 PolarHBondContact OG-N 3.21Å; S99-G102 VanDerWaalsContact OG-N 3.11Å; S99-Y103 VanDerWaalsContact OG-C 3.26Å; S99-Y103 WeakPolarHBondContact OG-CA 3.33Å; S99-Y103 PolarHBondContact OG-N 2.9Å
100	P	51.3	Low	73	Confident	116 Å²	116	71 Å²	71	75%	0.753	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.7	171.3	23.2	-31.3	0	0	0	112.8	L98	L98-P100 VanDerWaalsContact C-CD 3.44Å; L98-P100 WeakPolarHBondContact O-CD 3.5Å
101	N	54.6	Low	73.2	Confident	145 Å²	145	68.7 Å²	68.7	78%	0.775	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	14.3	-178.5	-62.7	-13.7	0	0	0	113.7	S99 Y103	S99-N101 PolarHBondContact O-N 2.95Å; N101-Y103 PolarHBondContact O-N 3.21Å
102	G	59.1	Low	73.3	Confident	27 Å²	27	67.1 Å²	67.1	28%	0.278	36%	0.363	S	S	.	.	S	Bend	trans	87.4	-20.5	170.3	0	0	0	0	0	117.6	S99	S99-G102 PolarHBondContact O-N 3.01Å; S99-G102 PolarHBondContact OG-N 3.21Å; S99-G102 VanDerWaalsContact OG-N 3.11Å
103	Y	74.7	Confident	73.3	Confident	114 Å²	114	60.4 Å²	60.4	45%	0.447	33%	0.329	S	S	.	.			trans	-140.5	124.7	177.9	-40.4	-64.3	0	0	0	113.4	S99 N101 V123 A125	S99-Y103 VanDerWaalsContact OG-C 3.26Å; S99-Y103 WeakPolarHBondContact OG-CA 3.33Å; S99-Y103 PolarHBondContact OG-N 2.9Å; N101-Y103 PolarHBondContact O-N 3.21Å; Y103-V123 WeakPolarHBondContact CA-O 3.38Å; Y103-A125 HydrophobicContact CD1-CB 4.37Å; Y103-A125 HydrophobicContact CE1-CB 3.35Å; Y103-A125 WeakPolarHBondContact OH-CB 3.17Å
104	A	77.9	Confident	73.3	Confident	29 Å²	29	60 Å²	60	24%	0.24	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	159.5	174.5	0	0	0	0	0	112.1	V123	A104-V123 PolarHBondContact O-N 3.38Å
105	F	80.7	Confident	73.3	Confident	77 Å²	77	60.3 Å²	60.3	34%	0.338	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	142.3	163.5	-73.1	-87.6	0	0	0	110	L84 P120 I121 F122 Y152	L84-F105 HydrophobicContact CD1-CE1 3.64Å; L84-F105 HydrophobicContact CD1-CZ 4.35Å; F105-P120 HydrophobicContact CD1-CB 3.98Å; F105-P120 HydrophobicContact CE1-CB 3.99Å; F105-P120 HydrophobicContact CE1-CG 4.35Å; F105-I121 WeakPolarHBondContact CA-O 3.34Å; F105-F122 HydrophobicContact CD1-CB 4.1Å; F105-F122 HydrophobicContact CD1-CD2 4.14Å; F105-F122 AromaticContact CD2-CD2 3.79Å; F105-F122 HydrophobicContact CD2-CD2 3.79Å; F105-F122 HydrophobicContact CD2-CE2 4.27Å; F105-F122 HydrophobicContact CE1-CB 3.98Å; F105-F122 HydrophobicContact CE1-CD2 4.06Å; F105-F122 HydrophobicContact CE1-CG 4.44Å; F105-F122 AromaticContact CE2-CD2 3.66Å; F105-F122 HydrophobicContact CE2-CD2 3.66Å; F105-F122 HydrophobicContact CE2-CE2 4.05Å; F105-F122 HydrophobicContact CG-CD2 4.02Å; F105-F122 HydrophobicContact CZ-CB 4.45Å; F105-F122 AromaticContact CZ-CD2 3.81Å; F105-F122 HydrophobicContact CZ-CD2 3.81Å; F105-F122 HydrophobicContact CZ-CG 4.45Å; F105-Y152 HydrophobicContact CE2-CD1 4.08Å; F105-Y152 AromaticContact CE2-CG 3.91Å; F105-Y152 HydrophobicContact CE2-CG 3.91Å; F105-Y152 HydrophobicContact CZ-CG 4.34Å
106	L	82.2	Confident	74.1	Confident	11 Å²	11	58.4 Å²	58.4	6%	0.058	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	153.4	168.7	-59.1	-179.9	0	0	0	109.1	V87 L93 L108 I121 V123	V87-L106 HydrophobicContact CG2-CD1 4.36Å; L93-L106 HydrophobicContact CB-CD1 3.91Å; L106-L108 HydrophobicContact CB-CB 4.21Å; L106-L108 PolarHBondContact O-N 2.96Å; L106-I121 HydrophobicContact CB-CB 4.48Å; L106-I121 HydrophobicContact CD1-CB 4.33Å; L106-I121 HydrophobicContact CD1-CG2 3.78Å; L106-I121 HydrophobicContact CG-CG2 4.42Å; L106-I121 PolarHBondContact N-O 3.48Å; L106-V123 HydrophobicContact CD1-CG2 4.39Å; L106-V123 HydrophobicContact CD2-CG2 3.75Å; L106-V123 HydrophobicContact CG-CG2 4.01Å
107	D	80.6	Confident	75.4	Confident	103 Å²	103	56.8 Å²	56.8	55%	0.551	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	20	169.2	-59.3	-38.7	0	0	0	112.3	T52	T52-D107 PolarHBondContact N-O 3.32Å
108	L	85.4	Confident	76.8	Confident	15 Å²	15	57.3 Å²	57.3	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134	-178	-69	168.6	0	0	0	108.8	L51 Y65 L93 L106 I121	L51-L108 HydrophobicContact CD2-CD2 3.42Å; L51-L108 VanDerWaalsContact CD2-CD2 3.42Å; L51-L108 HydrophobicContact CD2-CG 4.35Å; L51-L108 HydrophobicContact CG-CD2 3.89Å; Y65-L108 HydrophobicContact CD2-CD2 3.75Å; Y65-L108 HydrophobicContact CE2-CD2 4.2Å; Y65-L108 HydrophobicContact CG-CD2 4.05Å; L93-L108 HydrophobicContact CD2-CD1 4.27Å; L106-L108 HydrophobicContact CB-CB 4.21Å; L106-L108 PolarHBondContact O-N 2.96Å; L108-I121 HydrophobicContact CB-CD1 4.13Å; L108-I121 WeakPolarHBondContact O-CG1 3.47Å; L108-I121 PolarHBondContact O-N 2.83Å
109	N	87.9	Confident	78.4	Confident	35 Å²	35	53 Å²	53	19%	0.187	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	158.3	166.8	-60.8	-27.8	0	0	0	109.2	V50 T52 S118 L119 P120	V50-N109 PolarHBondContact N-O 2.78Å; V50-N109 PolarHBondContact O-N 2.87Å; T52-N109 VanDerWaalsContact OG1-CG 3.3Å; T52-N109 PolarHBondContact OG1-ND2 3.42Å; T52-N109 PolarHBondContact OG1-OD1 3.13Å; N109-S118 WeakPolarHBondContact CB-OG 3.33Å; N109-S118 PolarHBondContact ND2-OG 3.03Å; N109-L119 CarbonylContact C-O 3.59Å; N109-L119 VanDerWaalsContact CA-O 3.23Å; N109-L119 WeakPolarHBondContact CA-O 3.38Å; N109-L119 WeakPolarHBondContact CB-O 3.21Å; N109-P120 WeakPolarHBondContact OD1-CA 3.27Å
110	A	89.8	Confident	79.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	132.1	171.7	0	0	0	0	0	109.9	F47 K48 L49 I69 I85 N112 L119 I121	F47-A110 HydrophobicContact CB-CB 3.96Å; F47-A110 HydrophobicContact CD2-CB 4.18Å; K48-A110 CarbonylContact O-C 3.58Å; K48-A110 WeakPolarHBondContact O-CA 3.35Å; L49-A110 HydrophobicContact CD2-CB 4.27Å; I69-A110 HydrophobicContact CG2-CB 3.83Å; I85-A110 HydrophobicContact CD1-CB 3.37Å; A110-N112 PolarHBondContact O-N 3.09Å; A110-L119 PolarHBondContact N-O 3.06Å; A110-L119 PolarHBondContact O-N 3.15Å; A110-I121 HydrophobicContact CB-CD1 4.18Å; A110-I121 HydrophobicContact CB-CG1 4.35Å
111	W	89.1	Confident	81.7	Confident	85 Å²	85	48.1 Å²	48.1	32%	0.322	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	118.7	175.1	-174.4	-109.7	0	0	0	110.4	F47 K48 V50 P113 Q116	F47-W111 WeakPolarHBondContact CB-O 3.21Å; F47-W111 WeakPolarHBondContact CG-O 3.45Å; K48-W111 HydrophobicContact CB-CB 4.27Å; K48-W111 PolarHBondContact O-N 3.16Å; V50-W111 HydrophobicContact CG2-CB 4.37Å; W111-P113 WeakPolarHBondContact O-CD 3.32Å; W111-Q116 HydrophobicContact CH2-CB 4.09Å; W111-Q116 WeakPolarHBondContact CH2-O 3.45Å; W111-Q116 HydrophobicContact CZ2-CB 3.68Å; W111-Q116 HydrophobicContact CZ2-CG 4.39Å
112	N	88.6	Confident	83.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	113.4	171.2	-176.5	-27.4	0	0	0	109.4	F47 V79 A110 V114 T115 Q116 R117 L119	F47-N112 HydrophobicContact CD2-CB 4.38Å; F47-N112 HydrophobicContact CE2-CB 3.93Å; F47-N112 HydrophobicContact CZ-CB 4.29Å; V79-N112 WeakPolarHBondContact CG1-OD1 3.46Å; V79-N112 PolarHBondContact O-ND2 3.25Å; A110-N112 PolarHBondContact O-N 3.09Å; N112-V114 VanDerWaalsContact C-N 3.27Å; N112-V114 PolarHBondContact O-N 3.01Å; N112-V114 PolarHBondContact OD1-N 2.82Å; N112-T115 WeakPolarHBondContact CB-OG1 3.37Å; N112-T115 PolarHBondContact ND2-OG1 2.95Å; N112-T115 PolarHBondContact OD1-N 3.29Å; N112-Q116 VanDerWaalsContact O-CA 3.27Å; N112-Q116 WeakPolarHBondContact O-CA 3.4Å; N112-Q116 PolarHBondContact O-N 3.26Å; N112-R117 WeakPolarHBondContact CB-O 3.34Å; N112-R117 PolarHBondContact N-O 2.94Å; N112-L119 HydrophobicContact CB-CD1 4.07Å; N112-L119 HydrophobicContact CB-CG 4.31Å
113	P	84	Confident	84.5	Confident	1 Å²	1	40 Å²	40	1%	0.006	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.9	-176.7	26.9	-33.9	0	0	0	113.3	F47 W111 Q116 A223 H226 C228	F47-P113 VanDerWaalsContact CD1-CD 3.43Å; F47-P113 HydrophobicContact CD1-CG 4.11Å; F47-P113 VanDerWaalsContact CE1-CD 3.46Å; F47-P113 HydrophobicContact CE1-CG 4.07Å; W111-P113 WeakPolarHBondContact O-CD 3.32Å; P113-Q116 PolarHBondContact O-NE2 2.83Å; P113-A223 HydrophobicContact CG-CB 4.39Å; P113-H226 HydrophobicContact CB-CB 3.87Å; P113-H226 PolarHBondContact O-CD2 2.94Å; P113-C228 HydrophobicContact CB-CB 3.56Å; P113-C228 HydrophobicContact CG-CB 3.6Å
114	V	82.8	Confident	84.9	Confident	22 Å²	22	34.6 Å²	34.6	13%	0.133	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-44.7	-175.7	-170.4	0	0	0	0	110.5	V79 L80 N112 I219 A223	V79-V114 HydrophobicContact CG1-CB 4.02Å; V79-V114 HydrophobicContact CG1-CG2 3.76Å; L80-V114 HydrophobicContact CD2-CB 4.3Å; L80-V114 HydrophobicContact CD2-CG1 3.38Å; L80-V114 HydrophobicContact CG-CG1 4.43Å; N112-V114 VanDerWaalsContact C-N 3.27Å; N112-V114 PolarHBondContact O-N 3.01Å; N112-V114 PolarHBondContact OD1-N 2.82Å; V114-I219 HydrophobicContact CG1-CG2 4.5Å; V114-I219 HydrophobicContact CG2-CG2 4.25Å; V114-A223 HydrophobicContact CG2-CB 4.23Å
115	T	82.9	Confident	85	Confident	33 Å²	33	33.6 Å²	33.6	20%	0.202	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-11	-179.2	66.4	0	0	0	0	113.9	L80 N112 R117	L80-T115 HydrophobicContact CD2-CG2 4.21Å; N112-T115 WeakPolarHBondContact CB-OG1 3.37Å; N112-T115 PolarHBondContact ND2-OG1 2.95Å; N112-T115 PolarHBondContact OD1-N 3.29Å; T115-R117 VanDerWaalsContact C-N 3.27Å; T115-R117 PolarHBondContact O-N 3.23Å
116	Q	82.2	Confident	85	Confident	77 Å²	77	32.9 Å²	32.9	36%	0.36	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	44.5	-172.4	-54.3	-66.8	-23.6	0	0	111.8	W111 N112 P113 H226	W111-Q116 HydrophobicContact CH2-CB 4.09Å; W111-Q116 WeakPolarHBondContact CH2-O 3.45Å; W111-Q116 HydrophobicContact CZ2-CB 3.68Å; W111-Q116 HydrophobicContact CZ2-CG 4.39Å; N112-Q116 VanDerWaalsContact O-CA 3.27Å; N112-Q116 WeakPolarHBondContact O-CA 3.4Å; N112-Q116 PolarHBondContact O-N 3.26Å; P113-Q116 PolarHBondContact O-NE2 2.83Å; Q116-H226 PolarHBondContact NE2-CD2 3.39Å; Q116-H226 VanDerWaalsContact NE2-CD2 3.25Å; Q116-H226 PolarHBondContact NE2-CE1 3.35Å; Q116-H226 VanDerWaalsContact NE2-CG 3.28Å; Q116-H226 PolarHBondContact NE2-ND1 2.86Å; Q116-H226 VanDerWaalsContact NE2-ND1 3.16Å; Q116-H226 PolarHBondContact NE2-NE2 3.33Å; Q116-H226 VanDerWaalsContact NE2-NE2 3.13Å
117	R	83.9	Confident	84.9	Confident	143 Å²	143	37.1 Å²	37.1	54%	0.54	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142.1	-179.9	-69.4	-179	178.4	-165.4	-6	110	N112 T115	N112-R117 WeakPolarHBondContact CB-O 3.34Å; N112-R117 PolarHBondContact N-O 2.94Å; T115-R117 VanDerWaalsContact C-N 3.27Å; T115-R117 PolarHBondContact O-N 3.23Å
118	S	85.1	Confident	84.6	Confident	55 Å²	55	33.1 Å²	33.1	39%	0.385	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	120.3	170.3	-158.8	0	0	0	0	109.1	N109	N109-S118 WeakPolarHBondContact CB-OG 3.33Å; N109-S118 PolarHBondContact ND2-OG 3.03Å
119	L	88.1	Confident	84.4	Confident	6 Å²	6	33 Å²	33	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.7	179.2	-63.2	179.6	0	0	0	110	F47 G82 I85 N109 A110 N112 L137	F47-L119 HydrophobicContact CE2-CD1 3.95Å; G82-L119 WeakPolarHBondContact O-CD2 3.4Å; I85-L119 HydrophobicContact CD1-CB 3.98Å; I85-L119 HydrophobicContact CD1-CD1 4.1Å; I85-L119 HydrophobicContact CG1-CB 4.41Å; I85-L119 HydrophobicContact CG1-CD1 4.28Å; N109-L119 CarbonylContact C-O 3.59Å; N109-L119 VanDerWaalsContact CA-O 3.23Å; N109-L119 WeakPolarHBondContact CA-O 3.38Å; N109-L119 WeakPolarHBondContact CB-O 3.21Å; A110-L119 PolarHBondContact N-O 3.06Å; A110-L119 PolarHBondContact O-N 3.15Å; N112-L119 HydrophobicContact CB-CD1 4.07Å; N112-L119 HydrophobicContact CB-CG 4.31Å; L119-L137 HydrophobicContact CD1-CD1 3.68Å
120	P	87.9	Confident	83.7	Confident	32 Å²	32	38 Å²	38	21%	0.208	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	149.2	175.1	27.1	-32	0	0	0	111.3	L84 I85 F105 N109 L153	L84-P120 HydrophobicContact CD1-CB 4.3Å; L84-P120 HydrophobicContact CD1-CG 3.86Å; L84-P120 WeakPolarHBondContact CD1-O 3.33Å; I85-P120 PolarHBondContact N-O 3.05Å; F105-P120 HydrophobicContact CD1-CB 3.98Å; F105-P120 HydrophobicContact CE1-CB 3.99Å; F105-P120 HydrophobicContact CE1-CG 4.35Å; N109-P120 WeakPolarHBondContact OD1-CA 3.27Å; P120-L153 HydrophobicContact CG-CD2 4.36Å
121	I	88.6	Confident	82.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	127.1	176.4	-53.2	176	0	0	0	109.2	L49 I85 V87 L93 F105 L106 L108 A110	L49-I121 HydrophobicContact CD2-CD1 3.38Å; I85-I121 HydrophobicContact CB-CG1 4.48Å; I85-I121 CarbonylContact O-C 3.52Å; I85-I121 WeakPolarHBondContact O-CA 3.46Å; V87-I121 HydrophobicContact CB-CG2 4.46Å; V87-I121 HydrophobicContact CG1-CG2 3.73Å; V87-I121 HydrophobicContact CG2-CG2 3.88Å; L93-I121 HydrophobicContact CD1-CD1 4.32Å; F105-I121 WeakPolarHBondContact CA-O 3.34Å; L106-I121 HydrophobicContact CB-CB 4.48Å; L106-I121 HydrophobicContact CD1-CB 4.33Å; L106-I121 HydrophobicContact CD1-CG2 3.78Å; L106-I121 HydrophobicContact CG-CG2 4.42Å; L106-I121 PolarHBondContact N-O 3.48Å; L108-I121 HydrophobicContact CB-CD1 4.13Å; L108-I121 WeakPolarHBondContact O-CG1 3.47Å; L108-I121 PolarHBondContact O-N 2.83Å; A110-I121 HydrophobicContact CB-CD1 4.18Å; A110-I121 HydrophobicContact CB-CG1 4.35Å
122	F	86.2	Confident	82.2	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.009	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	133.2	-178.5	179.4	-98.3	0	0	0	111.4	L84 I85 I86 V87 F105 A124 Y148 Y152	L84-F122 HydrophobicContact CD1-CB 3.87Å; L84-F122 HydrophobicContact CD2-CB 4.3Å; L84-F122 HydrophobicContact CG-CB 4.33Å; I85-F122 PolarHBondContact O-N 2.96Å; I86-F122 CarbonylContact C-O 3.57Å; I86-F122 VanDerWaalsContact CA-O 3.25Å; I86-F122 WeakPolarHBondContact CA-O 3.48Å; I86-F122 HydrophobicContact CG2-CD1 4.24Å; V87-F122 PolarHBondContact N-O 2.91Å; F105-F122 HydrophobicContact CD1-CB 4.1Å; F105-F122 HydrophobicContact CD1-CD2 4.14Å; F105-F122 AromaticContact CD2-CD2 3.79Å; F105-F122 HydrophobicContact CD2-CD2 3.79Å; F105-F122 HydrophobicContact CD2-CE2 4.27Å; F105-F122 HydrophobicContact CE1-CB 3.98Å; F105-F122 HydrophobicContact CE1-CD2 4.06Å; F105-F122 HydrophobicContact CE1-CG 4.44Å; F105-F122 AromaticContact CE2-CD2 3.66Å; F105-F122 HydrophobicContact CE2-CD2 3.66Å; F105-F122 HydrophobicContact CE2-CE2 4.05Å; F105-F122 HydrophobicContact CG-CD2 4.02Å; F105-F122 HydrophobicContact CZ-CB 4.45Å; F105-F122 AromaticContact CZ-CD2 3.81Å; F105-F122 HydrophobicContact CZ-CD2 3.81Å; F105-F122 HydrophobicContact CZ-CG 4.45Å; F122-A124 HydrophobicContact CD1-CB 4.02Å; F122-A124 HydrophobicContact CE1-CB 4.07Å; F122-A124 PolarHBondContact O-N 2.79Å; F122-Y148 AromaticContact CE1-CD1 3.93Å; F122-Y148 HydrophobicContact CE1-CD1 3.93Å; F122-Y148 HydrophobicContact CZ-CD1 4.41Å; F122-Y152 HydrophobicContact CE2-CD2 4.11Å; F122-Y152 HydrophobicContact CE2-CE2 4.1Å; F122-Y152 HydrophobicContact CE2-CG 4.48Å; F122-Y152 HydrophobicContact CZ-CD2 4.09Å; F122-Y152 AromaticContact CZ-CE2 3.81Å; F122-Y152 HydrophobicContact CZ-CE2 3.81Å
123	V	86.7	Confident	81.9	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	113.1	173.3	-174.7	0	0	0	0	108.5	V87 P89 Y103 A104 L106	V87-V123 HydrophobicContact CG2-CB 4.45Å; V87-V123 HydrophobicContact CG2-CG2 3.91Å; V87-V123 WeakPolarHBondContact O-CA 3.25Å; P89-V123 HydrophobicContact CB-CG1 4.25Å; P89-V123 HydrophobicContact CG-CG1 4.32Å; Y103-V123 WeakPolarHBondContact CA-O 3.38Å; A104-V123 PolarHBondContact O-N 3.38Å; L106-V123 HydrophobicContact CD1-CG2 4.39Å; L106-V123 HydrophobicContact CD2-CG2 3.75Å; L106-V123 HydrophobicContact CG-CG2 4.01Å
124	A	82.7	Confident	81.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.242	C	C	.	.			trans	-106.2	167.5	-178.3	0	0	0	0	0	111.8	I86 V87 P89 F122 C128 F129	I86-A124 HydrophobicContact CB-CB 4Å; I86-A124 HydrophobicContact CG2-CB 4.19Å; V87-A124 PolarHBondContact O-N 3.43Å; P89-A124 WeakPolarHBondContact CD-O 3.29Å; P89-A124 VanDerWaalsContact CG-O 3.27Å; P89-A124 WeakPolarHBondContact CG-O 3.46Å; F122-A124 HydrophobicContact CD1-CB 4.02Å; F122-A124 HydrophobicContact CE1-CB 4.07Å; F122-A124 PolarHBondContact O-N 2.79Å; A124-C128 HydrophobicContact CB-CB 4.31Å; A124-F129 HydrophobicContact CB-CE2 4.17Å
125	A	79.9	Confident	82.2	Confident	7 Å²	7	42.4 Å²	42.4	6%	0.058	24%	0.236	C	C	.	.			trans	-65.4	148.9	174.7	0	0	0	0	0	111.4	Y103 S127 C128 F129	Y103-A125 HydrophobicContact CD1-CB 4.37Å; Y103-A125 HydrophobicContact CE1-CB 3.35Å; Y103-A125 WeakPolarHBondContact OH-CB 3.17Å; A125-S127 WeakPolarHBondContact CB-OG 3.42Å; A125-S127 PolarHBondContact O-N 2.82Å; A125-C128 WeakPolarHBondContact O-CB 3.38Å; A125-C128 PolarHBondContact O-N 2.86Å; A125-C128 PolarHBondContact O-SG 3.06Å; A125-C128 VanDerWaalsContact O-SG 3.32Å; A125-F129 WeakPolarHBondContact O-CD2 3.46Å
126	D	81.4	Confident	82.5	Confident	63 Å²	63	42.5 Å²	42.5	34%	0.337	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-56.3	-25.5	172.4	-79.9	-36.3	0	0	0	113.1	R88 P89 Q90 C128 F129	R88-D126 IonicContact CZ-OD1 3.03Å; R88-D126 IonicContact NH1-OD1 2.78Å; R88-D126 PolarHBondContact NH1-OD1 3.06Å; P89-D126 WeakPolarHBondContact CD-OD1 3.31Å; Q90-D126 PolarHBondContact NE2-OD2 3.38Å; Q90-D126 PolarHBondContact OE1-OD1 2.8Å; D126-C128 PolarHBondContact O-N 3.27Å; D126-F129 PolarHBondContact O-N 2.84Å
127	S	78.5	Confident	82.7	Confident	100 Å²	100	39.5 Å²	39.5	70%	0.699	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-65.5	-17	175.6	58.8	0	0	0	0	114.5	A125 F129	A125-S127 WeakPolarHBondContact CB-OG 3.42Å; A125-S127 PolarHBondContact O-N 2.82Å; S127-F129 VanDerWaalsContact C-N 3.25Å
128	C	75.8	Confident	82.8	Confident	19 Å²	19	32.9 Å²	32.9	13%	0.128	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-76.5	-18.4	176.9	-53.9	0	0	0	0	112.2	I86 A124 A125 D126 Y148	I86-C128 HydrophobicContact CD1-CB 4.17Å; A124-C128 HydrophobicContact CB-CB 4.31Å; A125-C128 WeakPolarHBondContact O-CB 3.38Å; A125-C128 PolarHBondContact O-N 2.86Å; A125-C128 PolarHBondContact O-SG 3.06Å; A125-C128 VanDerWaalsContact O-SG 3.32Å; D126-C128 PolarHBondContact O-N 3.27Å; C128-Y148 WeakPolarHBondContact SG-CE2 2.92Å; C128-Y148 PolarHBondContact SG-OH 3.19Å
129	F	79.5	Confident	82.5	Confident	12 Å²	12	30.6 Å²	30.6	5%	0.053	18%	0.181	C	C	.	.			trans	-105.9	104.5	-173	-59.3	-95	0	0	0	109	I86 R88 A124 A125 D126 S127 D131 E133 L136	I86-F129 HydrophobicContact CB-CZ 4.26Å; I86-F129 HydrophobicContact CD1-CE1 4.32Å; I86-F129 HydrophobicContact CD1-CZ 4.13Å; I86-F129 HydrophobicContact CG1-CE1 4.16Å; I86-F129 HydrophobicContact CG1-CZ 4Å; R88-F129 HydrophobicContact CB-CE2 4.32Å; R88-F129 HydrophobicContact CB-CZ 4.45Å; R88-F129 HydrophobicContact CG-CD1 3.92Å; R88-F129 HydrophobicContact CG-CD2 3.56Å; R88-F129 HydrophobicContact CG-CE1 3.94Å; R88-F129 HydrophobicContact CG-CE2 3.57Å; R88-F129 HydrophobicContact CG-CG 3.76Å; R88-F129 HydrophobicContact CG-CZ 3.79Å; R88-F129 PolarHBondContact NH2-O 3.31Å; A124-F129 HydrophobicContact CB-CE2 4.17Å; A125-F129 WeakPolarHBondContact O-CD2 3.46Å; D126-F129 PolarHBondContact O-N 2.84Å; S127-F129 VanDerWaalsContact C-N 3.25Å; F129-D131 PolarHBondContact O-N 3.02Å; F129-E133 WeakPolarHBondContact CD1-O 3.24Å; F129-L136 HydrophobicContact CD1-CD1 3.47Å; F129-L136 VanDerWaalsContact CD1-CD1 3.47Å; F129-L136 HydrophobicContact CD1-CG 3.9Å; F129-L136 HydrophobicContact CE1-CB 4.39Å; F129-L136 HydrophobicContact CE1-CD1 3.89Å; F129-L136 HydrophobicContact CE1-CG 3.98Å; F129-L136 HydrophobicContact CG-CD1 4.3Å
130	L	74	Confident	81.6	Confident	139 Å²	139	31.8 Å²	31.8	73%	0.728	19%	0.19	S	C	*	.	S	Bend	trans	-68.9	-26.6	174.9	-67.4	167.9	0	0	0	112.2
131	D	74.2	Confident	80.7	Confident	18 Å²	18	36.4 Å²	36.4	10%	0.096	21%	0.213	C	C	.	.	S	Bend	trans	-120.4	168.3	-164.1	-54.8	-24.3	0	0	0	109.8	R74 R88 F129 E133 R235	R74-D131 IonicContact NH2-OD2 3.01Å; R74-D131 PolarHBondContact NH2-OD2 3.14Å; R88-D131 PolarHBondContact NH2-O 3.4Å; F129-D131 PolarHBondContact O-N 3.02Å; D131-E133 HydrophobicContact CB-CG 4.37Å; D131-E133 PolarHBondContact O-N 2.78Å; D131-R235 IonicContact OD1-CZ 3.53Å; D131-R235 IonicContact OD1-NH1 2.62Å; D131-R235 PolarHBondContact OD1-NH1 3.05Å; D131-R235 IonicContact OD1-NH2 2.95Å; D131-R235 PolarHBondContact OD1-NH2 3.32Å; D131-R235 IonicContact OD2-CZ 2.64Å; D131-R235 IonicContact OD2-NH1 3.95Å; D131-R235 PolarHBondContact OD2-NH1 3.03Å; D131-R235 IonicContact OD2-NH2 3.55Å
132	S	74.2	Confident	79.7	Confident	85 Å²	85	39.1 Å²	39.1	59%	0.594	23%	0.227	S	C	*	.	S	Bend	trans	-71.1	16.7	179.2	54.4	0	0	0	0	114.3
133	E	81.4	Confident	78.9	Confident	18 Å²	18	43.6 Å²	43.6	8%	0.084	26%	0.257	C	S	.	.			trans	-84.7	139.4	179.4	-57.2	-59.1	153.5	0	0	109.7	R44 Y72 R88 F129 D131 L136	R44-E133 IonicContact CZ-OE2 2.8Å; R44-E133 IonicContact NH1-OE1 3.52Å; R44-E133 IonicContact NH1-OE2 2.72Å; R44-E133 PolarHBondContact NH1-OE2 2.91Å; R44-E133 IonicContact NH2-OE2 3.5Å; R44-E133 PolarHBondContact NH2-OE2 3.4Å; Y72-E133 HydrophobicContact CD1-CG 3.91Å; Y72-E133 HydrophobicContact CD2-CG 4.08Å; Y72-E133 HydrophobicContact CG-CG 3.66Å; R88-E133 PolarHBondContact NE-O 3.27Å; F129-E133 WeakPolarHBondContact CD1-O 3.24Å; D131-E133 HydrophobicContact CB-CG 4.37Å; D131-E133 PolarHBondContact O-N 2.78Å; E133-L136 HydrophobicContact CB-CD2 4.09Å
134	D	84.9	Confident	77.6	Confident	79 Å²	79	47.1 Å²	47.1	42%	0.422	28%	0.281	S	S	.	.	S	Bend	trans	-93.9	-18.6	-179	-58.6	-37.4	0	0	0	113	V87 R88	V87-D134 CarbonylContact C-O 3.49Å; V87-D134 VanDerWaalsContact CA-O 3.29Å; V87-D134 WeakPolarHBondContact CA-O 3.4Å; R88-D134 PolarHBondContact N-O 3Å; R88-D134 IonicContact NE-OD1 3.95Å
135	A	88.7	Confident	76.4	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.017	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128.4	-178.9	0	0	0	0	0	111.3	I69 Y72 I86 V87	I69-A135 HydrophobicContact CD1-CB 3.87Å; I69-A135 HydrophobicContact CG1-CB 4.09Å; Y72-A135 PolarHBondContact N-O 3.15Å; I86-A135 WeakPolarHBondContact O-CA 3.38Å; V87-A135 HydrophobicContact CG1-CB 4.09Å
136	L	87.6	Confident	75.4	Confident	34 Å²	34	50.1 Å²	50.1	18%	0.178	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.8	-179.5	-66.4	171.3	0	0	0	111	Y72 I85 I86 F129 E133	Y72-L136 HydrophobicContact CD1-CD2 4.08Å; I85-L136 WeakPolarHBondContact CA-O 3.22Å; I86-L136 HydrophobicContact CD1-CB 4.17Å; I86-L136 HydrophobicContact CD1-CD1 4.37Å; I86-L136 HydrophobicContact CG1-CB 3.81Å; I86-L136 PolarHBondContact N-O 2.92Å; I86-L136 PolarHBondContact O-N 3.18Å; F129-L136 HydrophobicContact CD1-CD1 3.47Å; F129-L136 VanDerWaalsContact CD1-CD1 3.47Å; F129-L136 HydrophobicContact CD1-CG 3.9Å; F129-L136 HydrophobicContact CE1-CB 4.39Å; F129-L136 HydrophobicContact CE1-CD1 3.89Å; F129-L136 HydrophobicContact CE1-CG 3.98Å; F129-L136 HydrophobicContact CG-CD1 4.3Å; E133-L136 HydrophobicContact CB-CD2 4.09Å
137	L	88.4	Confident	74.6	Confident	15 Å²	15	53.2 Å²	53.2	8%	0.079	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	122.7	170.2	-170.4	67	0	0	0	110.3	F47 I71 V73 D78 V79 I85 L119 A139	F47-L137 HydrophobicContact CE2-CD1 4.47Å; I71-L137 HydrophobicContact CG2-CB 3.79Å; V73-L137 HydrophobicContact CG2-CB 4.2Å; V73-L137 HydrophobicContact CG2-CD2 4.39Å; D78-L137 WeakPolarHBondContact O-CD2 3.49Å; V79-L137 VanDerWaalsContact CA-CD2 3.49Å; V79-L137 HydrophobicContact CB-CD2 4.44Å; V79-L137 HydrophobicContact CG2-CD2 4.32Å; I85-L137 HydrophobicContact CG1-CD1 3.78Å; L119-L137 HydrophobicContact CD1-CD1 3.68Å; L137-A139 PolarHBondContact O-N 3.03Å
138	V	84.6	Confident	73.8	Confident	4 Å²	4	50 Å²	50	2%	0.024	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	100.6	172.7	176.9	0	0	0	0	109	G82 R83 L84 I86 C145 A149	G82-V138 WeakPolarHBondContact CA-O 3.23Å; R83-V138 PolarHBondContact N-O 3.42Å; L84-V138 HydrophobicContact CB-CB 4.08Å; L84-V138 HydrophobicContact CB-CG2 4.36Å; L84-V138 HydrophobicContact CD2-CG2 4.43Å; L84-V138 WeakPolarHBondContact O-CB 3.28Å; L84-V138 PolarHBondContact O-N 3.36Å; I86-V138 HydrophobicContact CB-CG2 4.49Å; I86-V138 HydrophobicContact CD1-CG2 4.23Å; I86-V138 HydrophobicContact CG1-CG2 4.1Å; I86-V138 HydrophobicContact CG2-CG2 3.74Å; V138-C145 HydrophobicContact CB-CB 3.94Å; V138-C145 HydrophobicContact CG1-CB 3.28Å; V138-C145 HydrophobicContact CG2-CB 3.56Å; V138-A149 HydrophobicContact CG1-CB 4.45Å
139	A	78.3	Confident	73	Confident	6 Å²	6	50 Å²	50	5%	0.05	28%	0.279	C	S	.	.			trans	-67.3	157.4	167.6	0	0	0	0	0	110.7	D78 L137 D141 D142	D78-A139 HydrophobicContact CB-CB 3.96Å; L137-A139 PolarHBondContact O-N 3.03Å; A139-D141 PolarHBondContact O-N 3.45Å; A139-D141 VanDerWaalsContact O-N 3.15Å; A139-D142 PolarHBondContact O-N 3.2Å
140	S	69.9	Low	72.3	Confident	31 Å²	31	56 Å²	56	22%	0.217	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.9	176.9	-64.4	0	0	0	0	113	S81 R83 Q146	S81-S140 PolarHBondContact O-N 3.39Å; S81-S140 PolarHBondContact O-OG 3.29Å; R83-S140 PolarHBondContact NE-OG 3.36Å; R83-S140 PolarHBondContact NH1-OG 2.84Å; R83-S140 PolarHBondContact NH2-OG 3.03Å; S140-Q146 PolarHBondContact O-NE2 2.81Å
141	D	69.1	Low	71.6	Confident	129 Å²	129	54.3 Å²	54.3	69%	0.69	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-9.9	-170.8	-62.5	-19.7	0	0	0	113.9	A139 P143	A139-D141 PolarHBondContact O-N 3.45Å; A139-D141 VanDerWaalsContact O-N 3.15Å; D141-P143 VanDerWaalsContact O-CD 3.29Å; D141-P143 WeakPolarHBondContact O-CD 3.38Å
142	D	68.5	Low	70.8	Confident	57 Å²	57	58.7 Å²	58.7	31%	0.305	31%	0.31	S	S	.	.			trans	-79.8	112.7	-175.2	-176.2	3.2	0	0	0	112.5	A139 S144 C145 Q146	A139-D142 PolarHBondContact O-N 3.2Å; D142-S144 PolarHBondContact O-N 3.19Å; D142-S144 PolarHBondContact OD1-N 2.95Å; D142-C145 HydrophobicContact CB-CB 4.4Å; D142-C145 PolarHBondContact O-N 3.37Å; D142-C145 PolarHBondContact OD2-SG 3.36Å; D142-Q146 WeakPolarHBondContact O-CG 3.39Å; D142-Q146 PolarHBondContact O-N 3.01Å
143	P	68.4	Low	70	Confident	97 Å²	97	57.3 Å²	57.3	63%	0.63	30%	0.295	S	S	*	.	H	α-helix	trans	-65.7	-33.4	-174.6	26.3	-35.4	0	0	0	114	D141 C145 Q146	D141-P143 VanDerWaalsContact O-CD 3.29Å; D141-P143 WeakPolarHBondContact O-CD 3.38Å; P143-C145 PolarHBondContact O-N 3.18Å; P143-Q146 PolarHBondContact O-N 3.32Å
144	S	60.2	Low	68.4	Low	74 Å²	74	61.1 Å²	61.1	52%	0.517	32%	0.32	S	S	.	.	H	α-helix	trans	-63.6	-36.9	-179.1	-61	0	0	0	0	110.9	D142	D142-S144 PolarHBondContact O-N 3.19Å; D142-S144 PolarHBondContact OD1-N 2.95Å
145	C	56.8	Low	66.3	Low	6 Å²	6	64.7 Å²	64.7	4%	0.041	34%	0.339	C	S	.	.	H	α-helix	trans	-91.5	-20.8	-176.1	-60.6	0	0	0	0	112.9	V138 D142 P143 K147 Y148 A149	V138-C145 HydrophobicContact CB-CB 3.94Å; V138-C145 HydrophobicContact CG1-CB 3.28Å; V138-C145 HydrophobicContact CG2-CB 3.56Å; D142-C145 HydrophobicContact CB-CB 4.4Å; D142-C145 PolarHBondContact O-N 3.37Å; D142-C145 PolarHBondContact OD2-SG 3.36Å; P143-C145 PolarHBondContact O-N 3.18Å; C145-K147 PolarHBondContact O-N 3.11Å; C145-K147 VanDerWaalsContact O-N 3.14Å; C145-Y148 PolarHBondContact O-N 3.25Å; C145-Y148 VanDerWaalsContact O-N 3.07Å; C145-A149 PolarHBondContact O-N 3.24Å
146	Q	58.2	Low	63.9	Low	64 Å²	64	71.7 Å²	71.7	30%	0.299	37%	0.372	S	S	.	.	H	α-helix	trans	-54.9	-30.4	173.6	-84.8	-178	29.1	0	0	113	S140 D142 P143 K150	S140-Q146 PolarHBondContact O-NE2 2.81Å; D142-Q146 WeakPolarHBondContact O-CG 3.39Å; D142-Q146 PolarHBondContact O-N 3.01Å; P143-Q146 PolarHBondContact O-N 3.32Å; Q146-K150 WeakPolarHBondContact O-CB 2.78Å; Q146-K150 WeakPolarHBondContact O-CG 3.17Å; Q146-K150 PolarHBondContact O-N 2.95Å
147	K	66	Low	61.3	Low	129 Å²	129	75.9 Å²	75.9	56%	0.561	40%	0.4	S	S	*	.	H	α-helix	trans	-60.2	-48	176	-174.1	-179.8	177.2	-176	0	111.4	C145 Q151	C145-K147 PolarHBondContact O-N 3.11Å; C145-K147 VanDerWaalsContact O-N 3.14Å; K147-Q151 WeakPolarHBondContact O-CB 3.34Å; K147-Q151 VanDerWaalsContact O-CG 3.23Å; K147-Q151 WeakPolarHBondContact O-CG 3.2Å; K147-Q151 PolarHBondContact O-N 2.98Å; K147-Q151 VanDerWaalsContact O-N 3.14Å
148	Y	61.5	Low	58.4	Low	32 Å²	32	79.2 Å²	79.2	13%	0.125	44%	0.439	C	S	.	.	H	α-helix	trans	-74.8	-43.1	-179.6	-61.7	-79.2	0	0	0	111.6	F122 C128 C145 K150 Q151 Y152	F122-Y148 AromaticContact CE1-CD1 3.93Å; F122-Y148 HydrophobicContact CE1-CD1 3.93Å; F122-Y148 HydrophobicContact CZ-CD1 4.41Å; C128-Y148 WeakPolarHBondContact SG-CE2 2.92Å; C128-Y148 PolarHBondContact SG-OH 3.19Å; C145-Y148 PolarHBondContact O-N 3.25Å; C145-Y148 VanDerWaalsContact O-N 3.07Å; Y148-K150 VanDerWaalsContact C-N 3.34Å; Y148-K150 PolarHBondContact O-N 3.43Å; Y148-Q151 PolarHBondContact O-N 2.83Å; Y148-Y152 WeakPolarHBondContact O-CD2 3.34Å; Y148-Y152 PolarHBondContact O-N 2.89Å
149	A	59.6	Low	55.9	Low	18 Å²	18	82.5 Å²	82.5	15%	0.149	47%	0.467	C	S	.	.	H	α-helix	trans	-58.1	-45.6	175.2	0	0	0	0	0	111.6	V138 C145 Q151 Y152 L153	V138-A149 HydrophobicContact CG1-CB 4.45Å; C145-A149 PolarHBondContact O-N 3.24Å; A149-Q151 PolarHBondContact O-N 2.85Å; A149-Y152 PolarHBondContact O-N 2.84Å; A149-L153 HydrophobicContact CB-CD1 3.97Å; A149-L153 WeakPolarHBondContact O-CA 2.69Å; A149-L153 WeakPolarHBondContact O-CB 3.47Å; A149-L153 PolarHBondContact O-N 2.78Å
150	K	63.3	Low	53.6	Low	138 Å²	138	85.5 Å²	85.5	60%	0.6	48%	0.484	S	S	*	.	H	α-helix	trans	-69.3	-32.1	178.2	-73.6	175	-176.7	169.9	0	113.3	Q146 Y148 Y152 T154	Q146-K150 WeakPolarHBondContact O-CB 2.78Å; Q146-K150 WeakPolarHBondContact O-CG 3.17Å; Q146-K150 PolarHBondContact O-N 2.95Å; Y148-K150 VanDerWaalsContact C-N 3.34Å; Y148-K150 PolarHBondContact O-N 3.43Å; K150-Y152 VanDerWaalsContact C-N 3.33Å; K150-T154 WeakPolarHBondContact O-CG2 3.4Å
151	Q	59.8	Low	52.2	Low	105 Å²	105	88.5 Å²	88.5	49%	0.491	51%	0.505	S	S	.	.	H	α-helix	trans	-71.3	-29.9	180	-81.1	177.3	-21.8	0	0	112.6	K147 Y148 A149	K147-Q151 WeakPolarHBondContact O-CB 3.34Å; K147-Q151 VanDerWaalsContact O-CG 3.23Å; K147-Q151 WeakPolarHBondContact O-CG 3.2Å; K147-Q151 PolarHBondContact O-N 2.98Å; K147-Q151 VanDerWaalsContact O-N 3.14Å; Y148-Q151 PolarHBondContact O-N 2.83Å; A149-Q151 PolarHBondContact O-N 2.85Å
152	Y	57.2	Low	50.7	Low	109 Å²	109	89.2 Å²	89.2	43%	0.427	51%	0.509	S	S	.	.	H	α-helix	trans	-126	-16.6	-167.9	-62.3	-74.2	0	0	0	115.7	F105 F122 Y148 A149 K150	F105-Y152 HydrophobicContact CE2-CD1 4.08Å; F105-Y152 AromaticContact CE2-CG 3.91Å; F105-Y152 HydrophobicContact CE2-CG 3.91Å; F105-Y152 HydrophobicContact CZ-CG 4.34Å; F122-Y152 HydrophobicContact CE2-CD2 4.11Å; F122-Y152 HydrophobicContact CE2-CE2 4.1Å; F122-Y152 HydrophobicContact CE2-CG 4.48Å; F122-Y152 HydrophobicContact CZ-CD2 4.09Å; F122-Y152 AromaticContact CZ-CE2 3.81Å; F122-Y152 HydrophobicContact CZ-CE2 3.81Å; Y148-Y152 WeakPolarHBondContact O-CD2 3.34Å; Y148-Y152 PolarHBondContact O-N 2.89Å; A149-Y152 PolarHBondContact O-N 2.84Å; K150-Y152 VanDerWaalsContact C-N 3.33Å
153	L	58.4	Low	49.2	Very low	56 Å²	56	92.9 Å²	92.9	29%	0.293	53%	0.528	S	S	.	.			trans	-98.7	26.1	174.6	-61.3	167.9	0	0	0	112.9	R83 L84 P120 A149 N155	R83-L153 HydrophobicContact CB-CD1 4.12Å; L84-L153 HydrophobicContact CB-CD1 4.19Å; P120-L153 HydrophobicContact CG-CD2 4.36Å; A149-L153 HydrophobicContact CB-CD1 3.97Å; A149-L153 WeakPolarHBondContact O-CA 2.69Å; A149-L153 WeakPolarHBondContact O-CB 3.47Å; A149-L153 PolarHBondContact O-N 2.78Å; L153-N155 PolarHBondContact O-N 3.33Å
154	T	47.1	Very low	47.7	Very low	99 Å²	99	93.1 Å²	93.1	61%	0.607	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-1.1	-176.2	53.3	0	0	0	0	115.4	K150	K150-T154 WeakPolarHBondContact O-CG2 3.4Å
155	N	41.8	Very low	46.8	Very low	153 Å²	153	98.4 Å²	98.4	82%	0.818	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	12.8	-173.3	-67.7	-14.7	0	0	0	115	L153	L153-N155 PolarHBondContact O-N 3.33Å
156	E	37.5	Very low	46.4	Very low	150 Å²	150	102 Å²	102	70%	0.701	56%	0.563	S	S	*	*	S	Bend	trans	-101.8	135.9	161.5	-72.8	-152.1	160.4	0	0	111.2	G158	E156-G158 PolarHBondContact O-N 2.87Å
157	P	33.1	Very low	45.5	Very low	121 Å²	121	105.8 Å²	105.8	79%	0.786	58%	0.579	S	S	*	*			trans	-62.1	115.5	-174.3	24	-31.3	0	0	0	110.3	A159	P157-A159 PolarHBondContact O-N 3.46Å
158	G	28	Very low	44.4	Very low	86 Å²	86	100.7 Å²	100.7	89%	0.887	56%	0.562	S	S	*	*			trans	-58.7	101.3	158.3	0	0	0	0	0	109.3	E156	E156-G158 PolarHBondContact O-N 2.87Å
159	A	30.3	Very low	43.8	Very low	73 Å²	73	107.9 Å²	107.9	60%	0.603	59%	0.594	S	S	*	*			trans	-147.7	107.3	162.5	0	0	0	0	0	103.6	P157	P157-A159 PolarHBondContact O-N 3.46Å
160	T	30.3	Very low	43.4	Very low	68 Å²	68	112.4 Å²	112.4	42%	0.417	62%	0.62	S	S	.	*				-174.6	59.8	72.4	42.6	0	0	0	0	110	F164	T160-F164 HydrophobicContact CG2-CD2 4.34Å
161	S	40.4	Very low	42.7	Very low	95 Å²	95	110.8 Å²	110.8	66%	0.664	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-10.7	-177.6	56.9	0	0	0	0	115.9
162	N	38.7	Very low	42.3	Very low	143 Å²	143	111.6 Å²	111.6	77%	0.765	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	-23.4	-178.4	-73	-15.5	0	0	0	115.7
163	L	35.9	Very low	42.1	Very low	135 Å²	135	110.6 Å²	110.6	71%	0.707	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-22.4	179.2	-123	130.1	0	0	0	113.3
164	F	36.9	Very low	41.6	Very low	101 Å²	101	114.2 Å²	114.2	44%	0.443	64%	0.638	S	S	.	*	H	α-helix	trans	-86.5	-18.6	-175.1	-108.8	-90.3	0	0	0	115.3	T160 A166 F167 G168	T160-F164 HydrophobicContact CG2-CD2 4.34Å; F164-A166 PolarHBondContact O-N 2.86Å; F164-F167 PolarHBondContact O-N 2.95Å; F164-G168 PolarHBondContact O-N 2.8Å; F164-G168 VanDerWaalsContact O-N 3.08Å
165	K	42.4	Very low	42	Very low	186 Å²	186	113.6 Å²	113.6	81%	0.809	63%	0.625	S	S	*	*	H	α-helix	trans	-66.5	-19.6	175.2	-75.6	-177	178.6	175.9	0	112.7
166	A	47.5	Very low	42.5	Very low	80 Å²	80	110 Å²	110	66%	0.661	61%	0.612	S	S	*	*	H	α-helix	trans	-90.2	-36.8	176	0	0	0	0	0	113.4	F164	F164-A166 PolarHBondContact O-N 2.86Å
167	F	39.8	Very low	43.3	Very low	145 Å²	145	110.4 Å²	110.4	64%	0.636	61%	0.607	S	S	*	*	H	α-helix	trans	-88.9	-20.9	-176.4	-90.6	-86.4	0	0	0	115	F164 K169 V170	F164-F167 PolarHBondContact O-N 2.95Å; F167-K169 VanDerWaalsContact C-N 3.3Å; F167-K169 PolarHBondContact O-N 3.03Å; F167-V170 PolarHBondContact O-N 2.84Å
168	G	42.8	Very low	44.1	Very low	21 Å²	21	109.3 Å²	109.3	22%	0.216	59%	0.588	C	S	.	*	H	α-helix	trans	-60.9	-28.5	-173.3	0	0	0	0	0	115.6	F164 I172	F164-G168 PolarHBondContact O-N 2.8Å; F164-G168 VanDerWaalsContact O-N 3.08Å; G168-I172 VanDerWaalsContact O-CD1 3.23Å; G168-I172 WeakPolarHBondContact O-CD1 3.4Å; G168-I172 WeakPolarHBondContact O-CG1 3.47Å; G168-I172 PolarHBondContact O-N 2.85Å
169	K	48.5	Very low	45.2	Very low	184 Å²	184	109.9 Å²	109.9	80%	0.8	57%	0.566	S	S	*	*	H	α-helix	trans	-75.3	-33.7	-176.9	-76.9	-174.4	176.5	-178.9	0	114	F167	F167-K169 VanDerWaalsContact C-N 3.3Å; F167-K169 PolarHBondContact O-N 3.03Å
170	V	52.6	Low	46.4	Very low	113 Å²	113	113.2 Å²	113.2	69%	0.685	57%	0.569	S	S	*	*	H	α-helix	trans	-77.4	-39.4	179.4	-177.6	0	0	0	0	110.6	F167 S173 W174	F167-V170 PolarHBondContact O-N 2.84Å; V170-S173 PolarHBondContact O-N 3.04Å; V170-W174 PolarHBondContact O-N 2.89Å
171	F	47	Very low	47.3	Very low	103 Å²	103	114.5 Å²	114.5	45%	0.452	57%	0.574	S	S	.	*	H	α-helix	trans	-71.1	-35.3	-177.1	-162.3	-96.6	0	0	0	113.3	S173 W174 Y175 L201	F171-S173 PolarHBondContact O-N 2.87Å; F171-W174 HydrophobicContact CE2-CE3 4.2Å; F171-W174 HydrophobicContact CE2-CZ3 4.28Å; F171-W174 HydrophobicContact CZ-CZ3 4.48Å; F171-W174 PolarHBondContact O-N 3.4Å; F171-Y175 VanDerWaalsContact O-CB 3.32Å; F171-Y175 WeakPolarHBondContact O-CB 3.39Å; F171-Y175 PolarHBondContact O-N 3.23Å; F171-L201 HydrophobicContact CZ-CD2 4.28Å
172	I	52.4	Low	47.6	Very low	122 Å²	122	115.6 Å²	115.6	63%	0.626	57%	0.572	S	S	*	*	H	α-helix	trans	-66.7	-37.3	178.3	-66.7	165.8	0	0	0	111.3	G168 S176	G168-I172 VanDerWaalsContact O-CD1 3.23Å; G168-I172 WeakPolarHBondContact O-CD1 3.4Å; G168-I172 WeakPolarHBondContact O-CG1 3.47Å; G168-I172 PolarHBondContact O-N 2.85Å; I172-S176 WeakPolarHBondContact O-CB 3.3Å; I172-S176 PolarHBondContact O-N 2.64Å
173	S	51.9	Low	48	Very low	88 Å²	88	114.4 Å²	114.4	62%	0.615	57%	0.569	S	S	*	*	H	α-helix	trans	-65.8	-41.4	176.3	-169.1	0	0	0	0	111.9	V170 F171 W177	V170-S173 PolarHBondContact O-N 3.04Å; F171-S173 PolarHBondContact O-N 2.87Å; S173-W177 PolarHBondContact O-N 3.23Å
174	W	48.8	Very low	48.5	Very low	133 Å²	133	115.8 Å²	115.8	50%	0.504	57%	0.572	S	S	.	*	H	α-helix	trans	-71.3	-41	178.3	-175.1	76.1	0	0	0	112.3	V170 F171 W177 Y178	V170-W174 PolarHBondContact O-N 2.89Å; F171-W174 HydrophobicContact CE2-CE3 4.2Å; F171-W174 HydrophobicContact CE2-CZ3 4.28Å; F171-W174 HydrophobicContact CZ-CZ3 4.48Å; F171-W174 PolarHBondContact O-N 3.4Å; W174-W177 PolarHBondContact O-N 3.47Å; W174-Y178 PolarHBondContact O-N 3.05Å
175	Y	55.1	Low	48.5	Very low	85 Å²	85	118.4 Å²	118.4	33%	0.333	59%	0.591	S	S	.	*	H	α-helix	trans	-67.5	-35.4	177.2	-174.5	-98.8	0	0	0	112.6	F171 W177 Y178 K179	F171-Y175 VanDerWaalsContact O-CB 3.32Å; F171-Y175 WeakPolarHBondContact O-CB 3.39Å; F171-Y175 PolarHBondContact O-N 3.23Å; Y175-W177 VanDerWaalsContact C-N 3.3Å; Y175-W177 PolarHBondContact O-N 2.78Å; Y175-Y178 PolarHBondContact O-N 2.62Å; Y175-K179 HydrophobicContact CE1-CD 4.34Å; Y175-K179 WeakPolarHBondContact O-CB 3.31Å; Y175-K179 PolarHBondContact O-N 3.03Å
176	S	53.2	Low	48.1	Very low	78 Å²	78	118.6 Å²	118.6	55%	0.545	59%	0.592	S	S	.	*	H	α-helix	trans	-60.4	-40.3	173.1	-176.4	0	0	0	0	112	I172	I172-S176 WeakPolarHBondContact O-CB 3.3Å; I172-S176 PolarHBondContact O-N 2.64Å
177	W	53.8	Low	47.5	Very low	159 Å²	159	125 Å²	125	60%	0.602	60%	0.599	S	S	*	*	H	α-helix	trans	-70.3	-44.6	176.6	-173.5	79.1	0	0	0	111.2	S173 W174 Y175 K179 Q180	S173-W177 PolarHBondContact O-N 3.23Å; W174-W177 PolarHBondContact O-N 3.47Å; Y175-W177 VanDerWaalsContact C-N 3.3Å; Y175-W177 PolarHBondContact O-N 2.78Å; W177-K179 VanDerWaalsContact C-N 3.32Å; W177-K179 PolarHBondContact O-N 2.92Å; W177-Q180 WeakPolarHBondContact O-CB 3.41Å; W177-Q180 PolarHBondContact O-N 2.75Å; W177-Q180 VanDerWaalsContact O-N 3.14Å
178	Y	49.3	Very low	47.5	Very low	97 Å²	97	124.2 Å²	124.2	38%	0.38	61%	0.608	S	S	.	*	H	α-helix	trans	-63.2	-32.9	177.5	-173.3	-100.8	0	0	0	113.7	W174 Y175 Q180 D181 L182	W174-Y178 PolarHBondContact O-N 3.05Å; Y175-Y178 PolarHBondContact O-N 2.62Å; Y178-Q180 PolarHBondContact O-N 3.45Å; Y178-D181 PolarHBondContact O-N 2.88Å; Y178-L182 HydrophobicContact CD1-CD1 4.05Å; Y178-L182 HydrophobicContact CE1-CD1 3.65Å; Y178-L182 HydrophobicContact CE1-CG 4.26Å
179	K	52.2	Low	47.5	Very low	98 Å²	98	130.7 Å²	130.7	43%	0.426	64%	0.636	S	S	.	*	H	α-helix	trans	-67.8	-24.5	177.6	-156.5	-179.2	-173.1	-174.2	0	112.4	Y175 W177	Y175-K179 HydrophobicContact CE1-CD 4.34Å; Y175-K179 WeakPolarHBondContact O-CB 3.31Å; Y175-K179 PolarHBondContact O-N 3.03Å; W177-K179 VanDerWaalsContact C-N 3.32Å; W177-K179 PolarHBondContact O-N 2.92Å
180	Q	54.9	Low	46.8	Very low	143 Å²	143	130 Å²	130	67%	0.668	63%	0.633	S	S	*	*	H	α-helix	trans	-78	-27.9	-179.6	-158.4	165.1	-3	0	0	112.3	W177 Y178 T183	W177-Q180 WeakPolarHBondContact O-CB 3.41Å; W177-Q180 PolarHBondContact O-N 2.75Å; W177-Q180 VanDerWaalsContact O-N 3.14Å; Y178-Q180 PolarHBondContact O-N 3.45Å; Q180-T183 PolarHBondContact O-OG1 3.47Å
181	D	48.4	Very low	46.2	Very low	95 Å²	95	132 Å²	132	51%	0.508	64%	0.64	S	S	.	*	H	α-helix	trans	-81.6	-24.5	177.9	-84.6	-10.4	0	0	0	113.6	Y178 T183 E184	Y178-D181 PolarHBondContact O-N 2.88Å; D181-T183 VanDerWaalsContact C-N 3.25Å; D181-T183 PolarHBondContact O-N 2.82Å; D181-E184 PolarHBondContact O-N 3.29Å
182	L	46.8	Very low	45.6	Very low	119 Å²	119	135.1 Å²	135.1	62%	0.623	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-17.8	-179.7	-81.6	166.6	0	0	0	113.9	Y178 E184	Y178-L182 HydrophobicContact CD1-CD1 4.05Å; Y178-L182 HydrophobicContact CE1-CD1 3.65Å; Y178-L182 HydrophobicContact CE1-CG 4.26Å; L182-E184 VanDerWaalsContact C-N 3.33Å
183	T	48.9	Very low	44.7	Very low	117 Å²	117	136.1 Å²	136.1	72%	0.718	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-13.9	-179.8	47.2	0	0	0	0	113.6	Q180 D181	Q180-T183 PolarHBondContact O-OG1 3.47Å; D181-T183 VanDerWaalsContact C-N 3.25Å; D181-T183 PolarHBondContact O-N 2.82Å
184	E	45.8	Very low	44	Very low	164 Å²	164	141 Å²	141	77%	0.766	67%	0.67	S	S	*	*	S	Bend	trans	-104	108.2	174.9	-69.4	-170.9	172.2	0	0	110.2	D181 L182 K186	D181-E184 PolarHBondContact O-N 3.29Å; L182-E184 VanDerWaalsContact C-N 3.33Å; E184-K186 PolarHBondContact O-N 2.98Å
185	N	35.6	Very low	43.8	Very low	157 Å²	157	139 Å²	139	84%	0.84	69%	0.69	S	S	*	*			trans	-41.9	111.6	175.4	-87.6	-36.2	0	0	0	112.9
186	K	35.2	Very low	43.4	Very low	189 Å²	189	139.1 Å²	139.1	82%	0.822	70%	0.7	S	S	*	*	S	Bend		170.2	108.2	128.8	-89.6	155.9	-167.8	-180	0	111.7	E184	E184-K186 PolarHBondContact O-N 2.98Å
187	R	35.1	Very low	42.8	Very low	216 Å²	216	140.8 Å²	140.8	82%	0.815	71%	0.708	S	S	*	*			trans	71.9	121.6	154.2	-50.4	177.8	-178.4	-164.3	-0.6	116.7	I189	R187-I189 PolarHBondContact O-N 2.94Å; R187-I189 VanDerWaalsContact O-N 3.07Å
188	P	39.7	Very low	42.1	Very low	127 Å²	127	137.7 Å²	137.7	83%	0.825	72%	0.717	S	S	*	*			trans	-71.7	106.9	164.3	29.4	-29.3	0	0	0	108.4
189	I	42.7	Very low	42.1	Very low	157 Å²	157	139 Å²	139	81%	0.805	73%	0.729	S	S	*	*			trans	-68.6	129.1	171.6	-72.4	164.5	0	0	0	108.7	R187 L191	R187-I189 PolarHBondContact O-N 2.94Å; R187-I189 VanDerWaalsContact O-N 3.07Å; I189-L191 PolarHBondContact O-N 3.07Å
190	F	33.9	Very low	41.6	Very low	169 Å²	169	140.1 Å²	140.1	74%	0.741	74%	0.744	S	S	*	*			trans	-30.7	117.2	168.4	-112.4	-119.5	0	0	0	114.8	F192	F190-F192 HydrophobicContact CD1-CB 3.69Å; F190-F192 AromaticContact CD1-CD2 3.86Å; F190-F192 HydrophobicContact CD1-CD2 3.86Å; F190-F192 HydrophobicContact CD1-CG 4.21Å; F190-F192 HydrophobicContact CE1-CB 4.03Å; F190-F192 AromaticContact CE1-CD2 3.61Å; F190-F192 HydrophobicContact CE1-CD2 3.61Å; F190-F192 HydrophobicContact CE1-CE2 4.39Å; F190-F192 HydrophobicContact CE1-CG 4.11Å; F190-F192 HydrophobicContact CZ-CD2 4.32Å
191	L	39	Very low	41.1	Very low	156 Å²	156	138.8 Å²	138.8	82%	0.817	74%	0.741	S	S	*	*			trans	-97.2	80.1	157.4	-107.3	151.3	0	0	0	107.9	I189	I189-L191 PolarHBondContact O-N 3.07Å
192	F	34.3	Very low	41.2	Very low	168 Å²	168	136.5 Å²	136.5	74%	0.737	73%	0.729	S	S	*	*			trans	-131.6	61.3	169.3	-103.8	-79.2	0	0	0	109	F190	F190-F192 HydrophobicContact CD1-CB 3.69Å; F190-F192 AromaticContact CD1-CD2 3.86Å; F190-F192 HydrophobicContact CD1-CD2 3.86Å; F190-F192 HydrophobicContact CD1-CG 4.21Å; F190-F192 HydrophobicContact CE1-CB 4.03Å; F190-F192 AromaticContact CE1-CD2 3.61Å; F190-F192 HydrophobicContact CE1-CD2 3.61Å; F190-F192 HydrophobicContact CE1-CE2 4.39Å; F190-F192 HydrophobicContact CE1-CG 4.11Å; F190-F192 HydrophobicContact CZ-CD2 4.32Å
193	L	34.3	Very low	41.5	Very low	144 Å²	144	136.3 Å²	136.3	75%	0.754	73%	0.727	S	S	*	*			trans	-148.7	141.5	163.5	-73.2	178.4	0	0	0	106.9
194	F	37.8	Very low	41.7	Very low	190 Å²	190	134.1 Å²	134.1	83%	0.833	71%	0.714	S	S	*	*	S	Bend	trans	77.5	101.3	-163	-49.5	-73.5	0	0	0	112.4	V196	F194-V196 HydrophobicContact CB-CG2 4.2Å; F194-V196 PolarHBondContact O-N 3.27Å
195	G	43	Very low	42.1	Very low	90 Å²	90	128.1 Å²	128.1	93%	0.928	69%	0.692	S	S	*	*			trans	-64.5	60.6	177.1	0	0	0	0	0	113.5
196	V	48.2	Very low	42.8	Very low	89 Å²	89	125 Å²	125	54%	0.539	68%	0.676	S	S	.	*			trans	-81.6	118.5	171	-174.6	0	0	0	0	106.3	F194 A198 I199	F194-V196 HydrophobicContact CB-CG2 4.2Å; F194-V196 PolarHBondContact O-N 3.27Å; V196-A198 PolarHBondContact O-N 2.82Å; V196-I199 HydrophobicContact CG1-CD1 3.72Å; V196-I199 HydrophobicContact CG1-CG1 3.83Å
197	P	40.4	Very low	43.9	Very low	112 Å²	112	119.3 Å²	119.3	73%	0.727	65%	0.654	S	S	*	*			trans	-58.6	132	175.1	25.5	-31.7	0	0	0	107.7	I199	P197-I199 PolarHBondContact O-N 3.09Å
198	A	38.9	Very low	45	Very low	95 Å²	95	112.8 Å²	112.8	79%	0.785	64%	0.635	S	S	*	*			trans	-26.4	96.2	-178.4	0	0	0	0	0	111.7	V196 T200	V196-A198 PolarHBondContact O-N 2.82Å; A198-T200 VanDerWaalsContact C-N 3.33Å; A198-T200 PolarHBondContact O-N 3.34Å
199	I	48.9	Very low	45.9	Very low	123 Å²	123	108.9 Å²	108.9	63%	0.631	61%	0.613	S	S	*	*			trans	-63.6	110.7	166	-62.5	165.7	0	0	0	102.2	V196 P197 L201	V196-I199 HydrophobicContact CG1-CD1 3.72Å; V196-I199 HydrophobicContact CG1-CG1 3.83Å; P197-I199 PolarHBondContact O-N 3.09Å; I199-L201 PolarHBondContact O-N 3.15Å
200	T	42.6	Very low	46.7	Very low	122 Å²	122	104.9 Å²	104.9	75%	0.748	60%	0.596	S	S	*	*			trans	-58.7	84.1	156.8	43.6	0	0	0	0	104.9	A198 D202	A198-T200 VanDerWaalsContact C-N 3.33Å; A198-T200 PolarHBondContact O-N 3.34Å; T200-D202 PolarHBondContact O-N 3.3Å
201	L	44.5	Very low	48	Very low	116 Å²	116	99.3 Å²	99.3	61%	0.607	57%	0.572	S	S	*	*			trans	-44.8	115.1	162.8	-86	163.9	0	0	0	103.5	F171 I199 I203	F171-L201 HydrophobicContact CZ-CD2 4.28Å; I199-L201 PolarHBondContact O-N 3.15Å; L201-I203 VanDerWaalsContact C-N 3.26Å; L201-I203 WeakPolarHBondContact O-CG1 3.33Å; L201-I203 PolarHBondContact O-N 3.35Å
202	D	48.7	Very low	49	Very low	46 Å²	46	101 Å²	101	25%	0.246	57%	0.573	C	S	.	*			trans	-55.1	96.9	-167.6	-174.7	-4.6	0	0	0	107.8	T200 T204 A205 L206	T200-D202 PolarHBondContact O-N 3.3Å; D202-T204 PolarHBondContact O-N 3.35Å; D202-T204 WeakPolarHBondContact OD1-CB 3.48Å; D202-T204 PolarHBondContact OD1-N 3.23Å; D202-T204 PolarHBondContact OD1-OG1 3.19Å; D202-T204 PolarHBondContact OD2-OG1 2.76Å; D202-A205 HydrophobicContact CB-CB 3.87Å; D202-A205 PolarHBondContact O-N 3.08Å; D202-A205 PolarHBondContact OD1-N 3.14Å; D202-L206 PolarHBondContact O-N 2.98Å
203	I	55	Low	50.5	Low	115 Å²	115	98 Å²	98	59%	0.59	56%	0.561	S	S	*	*	H	α-helix	trans	-57.8	-28.1	-174.6	-64	173.2	0	0	0	107.1	L201 N207	L201-I203 VanDerWaalsContact C-N 3.26Å; L201-I203 WeakPolarHBondContact O-CG1 3.33Å; L201-I203 PolarHBondContact O-N 3.35Å; I203-N207 WeakPolarHBondContact CG2-ND2 3.32Å; I203-N207 WeakPolarHBondContact O-CA 2.84Å; I203-N207 WeakPolarHBondContact O-CB 3.38Å; I203-N207 PolarHBondContact O-N 3.41Å; I203-N207 PolarHBondContact O-ND2 3.08Å; I203-N207 VanDerWaalsContact O-ND2 3.13Å; I203-N207 PolarHBondContact O-OD1 3.26Å
204	T	52.7	Low	52.4	Low	71 Å²	71	93.9 Å²	93.9	44%	0.436	54%	0.539	S	S	.	.	H	α-helix	trans	-71.8	-39.7	176.1	80.3	0	0	0	0	112.9	D202 N207 N208	D202-T204 PolarHBondContact O-N 3.35Å; D202-T204 WeakPolarHBondContact OD1-CB 3.48Å; D202-T204 PolarHBondContact OD1-N 3.23Å; D202-T204 PolarHBondContact OD1-OG1 3.19Å; D202-T204 PolarHBondContact OD2-OG1 2.76Å; T204-N207 PolarHBondContact O-N 3.38Å; T204-N208 VanDerWaalsContact O-CB 3.26Å; T204-N208 WeakPolarHBondContact O-CB 3.37Å; T204-N208 PolarHBondContact O-N 2.79Å; T204-N208 PolarHBondContact O-ND2 3.37Å; T204-N208 VanDerWaalsContact O-ND2 3.1Å; T204-N208 PolarHBondContact O-OD1 3.09Å
205	A	53.6	Low	54.5	Low	38 Å²	38	88.2 Å²	88.2	31%	0.314	52%	0.52	S	S	.	.	H	α-helix	trans	-71.4	-41.3	176.7	0	0	0	0	0	111.7	D202 N208 A209	D202-A205 HydrophobicContact CB-CB 3.87Å; D202-A205 PolarHBondContact O-N 3.08Å; D202-A205 PolarHBondContact OD1-N 3.14Å; A205-N208 PolarHBondContact O-N 2.88Å; A205-A209 WeakPolarHBondContact O-CB 3.43Å; A205-A209 PolarHBondContact O-N 3.5Å
206	L	50.4	Low	56.5	Low	93 Å²	93	87.4 Å²	87.4	49%	0.487	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-47	172.1	-167.5	80.7	0	0	0	110.1	D202 N208 A209 V210	D202-L206 PolarHBondContact O-N 2.98Å; L206-N208 VanDerWaalsContact C-N 3.3Å; L206-N208 PolarHBondContact O-N 3.32Å; L206-A209 PolarHBondContact O-N 2.88Å; L206-A209 VanDerWaalsContact O-N 3.15Å; L206-V210 WeakPolarHBondContact O-CB 3.25Å; L206-V210 VanDerWaalsContact O-CG2 3.28Å; L206-V210 WeakPolarHBondContact O-CG2 3.48Å; L206-V210 PolarHBondContact O-N 2.58Å
207	N	57.5	Low	58.2	Low	69 Å²	69	89.8 Å²	89.8	37%	0.369	50%	0.5	S	S	.	.	H	α-helix	trans	-59.5	-41.9	174.7	-73.6	-15	0	0	0	110.7	I203 T204 A209 V210 K211	I203-N207 WeakPolarHBondContact CG2-ND2 3.32Å; I203-N207 WeakPolarHBondContact O-CA 2.84Å; I203-N207 WeakPolarHBondContact O-CB 3.38Å; I203-N207 PolarHBondContact O-N 3.41Å; I203-N207 PolarHBondContact O-ND2 3.08Å; I203-N207 VanDerWaalsContact O-ND2 3.13Å; I203-N207 PolarHBondContact O-OD1 3.26Å; T204-N207 PolarHBondContact O-N 3.38Å; N207-A209 VanDerWaalsContact C-N 3.34Å; N207-A209 PolarHBondContact O-N 3.49Å; N207-V210 PolarHBondContact O-N 2.72Å; N207-K211 VanDerWaalsContact O-CB 3.29Å; N207-K211 WeakPolarHBondContact O-CB 3.48Å; N207-K211 WeakPolarHBondContact O-CG 3.41Å; N207-K211 PolarHBondContact O-N 2.76Å
208	N	59.9	Low	60.2	Low	79 Å²	79	89 Å²	89	42%	0.422	49%	0.486	S	S	.	.	H	α-helix	trans	-67.2	-33.1	177.5	-68.4	-22.3	0	0	0	113.1	T204 A205 L206 K211 K212	T204-N208 VanDerWaalsContact O-CB 3.26Å; T204-N208 WeakPolarHBondContact O-CB 3.37Å; T204-N208 PolarHBondContact O-N 2.79Å; T204-N208 PolarHBondContact O-ND2 3.37Å; T204-N208 VanDerWaalsContact O-ND2 3.1Å; T204-N208 PolarHBondContact O-OD1 3.09Å; A205-N208 PolarHBondContact O-N 2.88Å; L206-N208 VanDerWaalsContact C-N 3.3Å; L206-N208 PolarHBondContact O-N 3.32Å; N208-K211 PolarHBondContact OD1-NZ 2.8Å; N208-K212 PolarHBondContact O-N 3.27Å
209	A	57.8	Low	62.4	Low	44 Å²	44	84.4 Å²	84.4	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-70.7	-40.3	172.8	0	0	0	0	0	112	A205 L206 N207 K212	A205-A209 WeakPolarHBondContact O-CB 3.43Å; A205-A209 PolarHBondContact O-N 3.5Å; L206-A209 PolarHBondContact O-N 2.88Å; L206-A209 VanDerWaalsContact O-N 3.15Å; N207-A209 VanDerWaalsContact C-N 3.34Å; N207-A209 PolarHBondContact O-N 3.49Å; A209-K212 PolarHBondContact O-N 3.47Å
210	V	60	Low	64.2	Low	73 Å²	73	79.8 Å²	79.8	44%	0.442	43%	0.425	S	S	.	.	H	α-helix	trans	-67.6	-39.6	174.4	173.7	0	0	0	0	110.8	L206 N207 K212 Q213 L214	L206-V210 WeakPolarHBondContact O-CB 3.25Å; L206-V210 VanDerWaalsContact O-CG2 3.28Å; L206-V210 WeakPolarHBondContact O-CG2 3.48Å; L206-V210 PolarHBondContact O-N 2.58Å; N207-V210 PolarHBondContact O-N 2.72Å; V210-K212 PolarHBondContact O-N 3.07Å; V210-Q213 WeakPolarHBondContact O-CA 3.08Å; V210-Q213 PolarHBondContact O-N 3.08Å; V210-L214 PolarHBondContact O-N 3.49Å; V210-L214 VanDerWaalsContact O-N 3.1Å
211	K	59.9	Low	66.1	Low	52 Å²	52	77.8 Å²	77.8	23%	0.226	41%	0.41	C	S	.	.	H	α-helix	trans	-57.1	-36.1	175.2	-75.8	172.7	-169.2	-178	0	112.2	L80 N207 N208 Q213	L80-K211 HydrophobicContact CB-CB 4.37Å; L80-K211 HydrophobicContact CB-CD 3.62Å; L80-K211 HydrophobicContact CB-CG 3.7Å; L80-K211 HydrophobicContact CD1-CB 3.88Å; L80-K211 HydrophobicContact CD1-CG 3.76Å; L80-K211 HydrophobicContact CD2-CG 4.4Å; L80-K211 HydrophobicContact CG-CG 4.16Å; L80-K211 VanDerWaalsContact O-CE 3.31Å; L80-K211 WeakPolarHBondContact O-CE 3.15Å; L80-K211 PolarHBondContact O-NZ 3Å; N207-K211 VanDerWaalsContact O-CB 3.29Å; N207-K211 WeakPolarHBondContact O-CB 3.48Å; N207-K211 WeakPolarHBondContact O-CG 3.41Å; N207-K211 PolarHBondContact O-N 2.76Å; N208-K211 PolarHBondContact OD1-NZ 2.8Å; K211-Q213 VanDerWaalsContact C-N 3.27Å; K211-Q213 PolarHBondContact O-N 3.44Å
212	K	60.4	Low	67.9	Low	193 Å²	193	73.7 Å²	73.7	84%	0.839	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-16.7	175.1	-76.8	-173.7	176.5	-175.4	0	113.8	N208 A209 V210	N208-K212 PolarHBondContact O-N 3.27Å; A209-K212 PolarHBondContact O-N 3.47Å; V210-K212 PolarHBondContact O-N 3.07Å
213	Q	65.8	Low	69.5	Low	105 Å²	105	71.5 Å²	71.5	49%	0.491	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-13.5	179.8	-69.7	179.9	11.7	0	0	112.9	V210 K211 T215	V210-Q213 WeakPolarHBondContact O-CA 3.08Å; V210-Q213 PolarHBondContact O-N 3.08Å; K211-Q213 VanDerWaalsContact C-N 3.27Å; K211-Q213 PolarHBondContact O-N 3.44Å; Q213-T215 PolarHBondContact O-N 3.2Å
214	L	74.1	Confident	70.8	Confident	56 Å²	56	70.3 Å²	70.3	29%	0.293	37%	0.371	S	S	.	.	S	Bend	trans	-73.7	124.9	179.6	-157	68.5	0	0	0	109.5	L80 V210 Q218 I219	L80-L214 HydrophobicContact CD1-CD2 4.35Å; V210-L214 PolarHBondContact O-N 3.49Å; V210-L214 VanDerWaalsContact O-N 3.1Å; L214-Q218 HydrophobicContact CD1-CB 3.61Å; L214-Q218 HydrophobicContact CD1-CG 4.24Å; L214-Q218 HydrophobicContact CD2-CB 4.44Å; L214-Q218 HydrophobicContact CG-CB 3.7Å; L214-I219 HydrophobicContact CB-CG1 4.39Å; L214-I219 HydrophobicContact CD2-CD1 4.49Å; L214-I219 HydrophobicContact CD2-CG1 3.52Å; L214-I219 HydrophobicContact CG-CG1 3.98Å
215	T	81.9	Confident	72.1	Confident	71 Å²	71	74.4 Å²	74.4	44%	0.436	39%	0.387	S	S	.	.			trans	-68.6	151.8	175.7	56.8	0	0	0	0	110.6	Q213 E217 Q218 I219	Q213-T215 PolarHBondContact O-N 3.2Å; T215-E217 PolarHBondContact O-N 3.4Å; T215-Q218 WeakPolarHBondContact O-CB 3.28Å; T215-Q218 PolarHBondContact O-N 3.41Å; T215-Q218 WeakPolarHBondContact OG1-CB 3.25Å; T215-Q218 WeakPolarHBondContact OG1-CG 3.36Å; T215-Q218 PolarHBondContact OG1-N 3.45Å; T215-Q218 PolarHBondContact OG1-OE1 2.77Å; T215-I219 PolarHBondContact O-N 3.47Å; T215-I219 VanDerWaalsContact O-N 3.14Å
216	D	84.4	Confident	73.1	Confident	73 Å²	73	76.8 Å²	76.8	39%	0.39	39%	0.392	S	S	.	.	H	α-helix	trans	-54.1	-39.7	178	-66.6	-8.2	0	0	0	111.5	Y43 P76 I219 L220	Y43-D216 PolarHBondContact OH-OD2 2.99Å; P76-D216 HydrophobicContact CG-CB 3.72Å; P76-D216 WeakPolarHBondContact CG-OD1 3.37Å; D216-I219 WeakPolarHBondContact O-CB 3.41Å; D216-I219 PolarHBondContact O-N 3.49Å; D216-L220 WeakPolarHBondContact O-CG 3.15Å; D216-L220 PolarHBondContact O-N 2.85Å
217	E	83.7	Confident	74.1	Confident	140 Å²	140	83.2 Å²	83.2	65%	0.654	41%	0.41	S	S	*	.	H	α-helix	trans	-63.3	-41.3	176.5	-64.7	-177.7	176.6	0	0	112.5	T215 I219 L220 N221	T215-E217 PolarHBondContact O-N 3.4Å; E217-I219 VanDerWaalsContact C-N 3.29Å; E217-I219 PolarHBondContact O-N 3.09Å; E217-L220 PolarHBondContact O-N 2.92Å; E217-N221 WeakPolarHBondContact O-CB 3.39Å; E217-N221 PolarHBondContact O-N 3.41Å; E217-N221 PolarHBondContact O-ND2 2.95Å
218	Q	84.4	Confident	74.9	Confident	94 Å²	94	80.2 Å²	80.2	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-64.4	-34.8	176.3	-76.3	167.4	-38.6	0	0	112.1	L214 T215 S222	L214-Q218 HydrophobicContact CD1-CB 3.61Å; L214-Q218 HydrophobicContact CD1-CG 4.24Å; L214-Q218 HydrophobicContact CD2-CB 4.44Å; L214-Q218 HydrophobicContact CG-CB 3.7Å; T215-Q218 WeakPolarHBondContact O-CB 3.28Å; T215-Q218 PolarHBondContact O-N 3.41Å; T215-Q218 WeakPolarHBondContact OG1-CB 3.25Å; T215-Q218 WeakPolarHBondContact OG1-CG 3.36Å; T215-Q218 PolarHBondContact OG1-N 3.45Å; T215-Q218 PolarHBondContact OG1-OE1 2.77Å; Q218-S222 VanDerWaalsContact O-CB 3.26Å; Q218-S222 WeakPolarHBondContact O-CB 3.37Å; Q218-S222 PolarHBondContact O-N 2.78Å
219	I	85	Confident	75.7	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-66.2	-45	175.1	-63.3	168.4	0	0	0	110.3	F45 P76 L80 V114 L214 T215 D216 E217 S222 A223	F45-I219 HydrophobicContact CE1-CG2 4.34Å; F45-I219 HydrophobicContact CZ-CG2 4.14Å; P76-I219 HydrophobicContact CB-CB 4.28Å; P76-I219 HydrophobicContact CB-CD1 4.04Å; P76-I219 HydrophobicContact CB-CG2 4Å; P76-I219 HydrophobicContact CG-CD1 4.27Å; L80-I219 HydrophobicContact CD1-CD1 3.95Å; L80-I219 HydrophobicContact CD1-CG1 4.27Å; V114-I219 HydrophobicContact CG1-CG2 4.5Å; V114-I219 HydrophobicContact CG2-CG2 4.25Å; L214-I219 HydrophobicContact CB-CG1 4.39Å; L214-I219 HydrophobicContact CD2-CD1 4.49Å; L214-I219 HydrophobicContact CD2-CG1 3.52Å; L214-I219 HydrophobicContact CG-CG1 3.98Å; T215-I219 PolarHBondContact O-N 3.47Å; T215-I219 VanDerWaalsContact O-N 3.14Å; D216-I219 WeakPolarHBondContact O-CB 3.41Å; D216-I219 PolarHBondContact O-N 3.49Å; E217-I219 VanDerWaalsContact C-N 3.29Å; E217-I219 PolarHBondContact O-N 3.09Å; I219-S222 PolarHBondContact O-N 2.79Å; I219-A223 PolarHBondContact O-N 3.09Å
220	L	84.9	Confident	76.9	Confident	25 Å²	25	76.6 Å²	76.6	13%	0.131	37%	0.369	C	S	.	.	H	α-helix	trans	-64.6	-46.3	178.3	-66.3	172.9	0	0	0	111.8	Y43 F45 D216 E217 S222 A223 Q224	Y43-L220 HydrophobicContact CD1-CD1 4.1Å; Y43-L220 HydrophobicContact CD1-CD2 3.85Å; Y43-L220 HydrophobicContact CD1-CG 4.39Å; Y43-L220 HydrophobicContact CE1-CD1 3.91Å; Y43-L220 HydrophobicContact CE1-CD2 4.46Å; F45-L220 HydrophobicContact CE1-CD2 3.97Å; F45-L220 HydrophobicContact CZ-CD2 3.83Å; D216-L220 WeakPolarHBondContact O-CG 3.15Å; D216-L220 PolarHBondContact O-N 2.85Å; E217-L220 PolarHBondContact O-N 2.92Å; L220-S222 VanDerWaalsContact C-N 3.29Å; L220-S222 PolarHBondContact O-N 3.1Å; L220-A223 WeakPolarHBondContact O-CB 3.42Å; L220-A223 PolarHBondContact O-N 2.99Å; L220-A223 VanDerWaalsContact O-N 3.15Å; L220-Q224 WeakPolarHBondContact O-CG 3.35Å; L220-Q224 PolarHBondContact O-N 3.14Å
221	N	83.6	Confident	78.1	Confident	80 Å²	80	74.7 Å²	74.7	43%	0.428	35%	0.354	S	S	.	.	H	α-helix	trans	-61.9	-39.6	177.5	-68.9	-17.1	0	0	0	111.2	E217 Q224 M225	E217-N221 WeakPolarHBondContact O-CB 3.39Å; E217-N221 PolarHBondContact O-N 3.41Å; E217-N221 PolarHBondContact O-ND2 2.95Å; N221-Q224 PolarHBondContact O-N 3.4Å; N221-M225 WeakPolarHBondContact O-CG 3.35Å; N221-M225 PolarHBondContact O-N 3.46Å
222	S	82	Confident	79.4	Confident	31 Å²	31	75.9 Å²	75.9	22%	0.217	36%	0.359	C	S	.	.	H	α-helix	trans	-62.2	-43.5	174.5	176.3	0	0	0	0	111.8	Q218 I219 L220 M225 H226	Q218-S222 VanDerWaalsContact O-CB 3.26Å; Q218-S222 WeakPolarHBondContact O-CB 3.37Å; Q218-S222 PolarHBondContact O-N 2.78Å; I219-S222 PolarHBondContact O-N 2.79Å; L220-S222 VanDerWaalsContact C-N 3.29Å; L220-S222 PolarHBondContact O-N 3.1Å; S222-M225 PolarHBondContact O-N 2.73Å; S222-H226 PolarHBondContact O-CD2 3.11Å; S222-H226 PolarHBondContact O-N 3.24Å
223	A	82.9	Confident	80.6	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.6	-48.9	176.3	0	0	0	0	0	111.4	F45 P113 V114 I219 L220 M225 H226 C228	F45-A223 HydrophobicContact CD1-CB 3.94Å; F45-A223 HydrophobicContact CE1-CB 3.93Å; P113-A223 HydrophobicContact CG-CB 4.39Å; V114-A223 HydrophobicContact CG2-CB 4.23Å; I219-A223 PolarHBondContact O-N 3.09Å; L220-A223 WeakPolarHBondContact O-CB 3.42Å; L220-A223 PolarHBondContact O-N 2.99Å; L220-A223 VanDerWaalsContact O-N 3.15Å; A223-M225 VanDerWaalsContact C-N 3.34Å; A223-M225 PolarHBondContact O-N 3.13Å; A223-H226 PolarHBondContact O-N 2.89Å; A223-C228 CarbonylContact C-O 3.57Å; A223-C228 PolarHBondContact O-N 3.36Å
224	Q	82.3	Confident	81.6	Confident	89 Å²	89	62.9 Å²	62.9	42%	0.416	30%	0.303	S	S	.	.	H	α-helix	trans	-58.2	-42.3	179.9	-70.9	176.8	-0.3	0	0	112.6	L220 N221 H226 R227 C228	L220-Q224 WeakPolarHBondContact O-CG 3.35Å; L220-Q224 PolarHBondContact O-N 3.14Å; N221-Q224 PolarHBondContact O-N 3.4Å; Q224-H226 PolarHBondContact O-N 2.86Å; Q224-R227 PolarHBondContact O-N 2.86Å; Q224-C228 WeakPolarHBondContact CA-O 3.49Å; Q224-C228 PolarHBondContact N-O 3.38Å
225	M	79.7	Confident	82	Confident	158 Å²	158	66.2 Å²	66.2	78%	0.778	31%	0.312	S	S	*	.	H	α-helix	trans	-60.2	-28.2	177.2	-74.1	-178.4	-178.7	0	0	113.2	N221 S222 A223 R227	N221-M225 WeakPolarHBondContact O-CG 3.35Å; N221-M225 PolarHBondContact O-N 3.46Å; S222-M225 PolarHBondContact O-N 2.73Å; A223-M225 VanDerWaalsContact C-N 3.34Å; A223-M225 PolarHBondContact O-N 3.13Å; M225-R227 VanDerWaalsContact C-N 3.3Å; M225-R227 PolarHBondContact O-N 2.92Å
226	H	75	Confident	82.1	Confident	87 Å²	87	67.4 Å²	67.4	40%	0.403	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	23.2	-178.4	-67.1	-57	0	0	0	113.8	P113 Q116 S222 A223 Q224 C228	P113-H226 HydrophobicContact CB-CB 3.87Å; P113-H226 PolarHBondContact O-CD2 2.94Å; Q116-H226 PolarHBondContact NE2-CD2 3.39Å; Q116-H226 VanDerWaalsContact NE2-CD2 3.25Å; Q116-H226 PolarHBondContact NE2-CE1 3.35Å; Q116-H226 VanDerWaalsContact NE2-CG 3.28Å; Q116-H226 PolarHBondContact NE2-ND1 2.86Å; Q116-H226 VanDerWaalsContact NE2-ND1 3.16Å; Q116-H226 PolarHBondContact NE2-NE2 3.33Å; Q116-H226 VanDerWaalsContact NE2-NE2 3.13Å; S222-H226 PolarHBondContact O-CD2 3.11Å; S222-H226 PolarHBondContact O-N 3.24Å; A223-H226 PolarHBondContact O-N 2.89Å; Q224-H226 PolarHBondContact O-N 2.86Å; H226-C228 PolarHBondContact O-N 3.3Å
227	R	71.5	Confident	82.1	Confident	229 Å²	229	67 Å²	67	86%	0.864	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	27.7	-177.2	-56.2	-178.2	179.7	167.4	-0.1	113.3	Q224 M225	Q224-R227 PolarHBondContact O-N 2.86Å; M225-R227 VanDerWaalsContact C-N 3.3Å; M225-R227 PolarHBondContact O-N 2.92Å
228	C	73.7	Confident	82.1	Confident	5 Å²	5	68.8 Å²	68.8	3%	0.034	31%	0.314	C	S	.	.			trans	-120.7	135.5	176	-68.4	0	0	0	0	107.8	S46 P113 A223 Q224 H226	S46-C228 VanDerWaalsContact O-CB 3.28Å; S46-C228 WeakPolarHBondContact O-CB 3.44Å; P113-C228 HydrophobicContact CB-CB 3.56Å; P113-C228 HydrophobicContact CG-CB 3.6Å; A223-C228 CarbonylContact C-O 3.57Å; A223-C228 PolarHBondContact O-N 3.36Å; Q224-C228 WeakPolarHBondContact CA-O 3.49Å; Q224-C228 PolarHBondContact N-O 3.38Å; H226-C228 PolarHBondContact O-N 3.3Å
229	D	77.2	Confident	82	Confident	46 Å²	46	71 Å²	71	25%	0.246	33%	0.329	C	S	.	.			trans	-81.3	130	-178.9	-60.2	-38.6	0	0	0	109.7	F45 S46 Y231	F45-D229 CarbonylContact C-O 3.49Å; F45-D229 VanDerWaalsContact CA-O 3.24Å; F45-D229 WeakPolarHBondContact CA-O 3.13Å; S46-D229 PolarHBondContact N-O 3.1Å; D229-Y231 HydrophobicContact CB-CD1 4.28Å; D229-Y231 HydrophobicContact CB-CE1 4.45Å
230	G	83.3	Confident	82	Confident	2 Å²	2	81 Å²	81	2%	0.021	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	119.2	166.4	0	0	0	0	0	108.1	R44	R44-G230 WeakPolarHBondContact O-CA 3.39Å
231	Y	84.1	Confident	82.1	Confident	33 Å²	33	84.3 Å²	84.3	13%	0.129	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	157	-179.6	59.2	-90	0	0	0	112.1	W10 Y43 R44 D229	W10-Y231 HydrophobicContact CB-CD1 3.39Å; W10-Y231 HydrophobicContact CB-CD2 3.67Å; W10-Y231 HydrophobicContact CB-CE1 3.3Å; W10-Y231 HydrophobicContact CB-CE2 3.61Å; W10-Y231 HydrophobicContact CB-CG 3.56Å; W10-Y231 VanDerWaalsContact CB-CZ 3.4Å; W10-Y231 AromaticContact CD1-CE1 3.84Å; W10-Y231 HydrophobicContact CD2-CE1 4.21Å; W10-Y231 AromaticContact CG-CD1 3.98Å; W10-Y231 HydrophobicContact CG-CD1 3.98Å; W10-Y231 AromaticContact CG-CE1 3.5Å; W10-Y231 HydrophobicContact CG-CE1 3.5Å; W10-Y231 HydrophobicContact CG-CE2 4.43Å; W10-Y231 AromaticContact CG-CZ 3.76Å; Y43-Y231 CarbonylContact C-O 3.56Å; Y43-Y231 VanDerWaalsContact CA-O 3.31Å; Y43-Y231 WeakPolarHBondContact CA-O 3.36Å; R44-Y231 HydrophobicContact CB-CD2 4.43Å; R44-Y231 HydrophobicContact CB-CE1 4.29Å; R44-Y231 HydrophobicContact CB-CE2 3.87Å; R44-Y231 PolarHBondContact N-O 3.49Å; R44-Y231 PolarHBondContact O-N 2.88Å; D229-Y231 HydrophobicContact CB-CD1 4.28Å; D229-Y231 HydrophobicContact CB-CE1 4.45Å
232	K	86.7	Confident	82.4	Confident	77 Å²	77	84.8 Å²	84.8	34%	0.335	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	134	177.8	-165.2	175	174.7	178.5	0	109.5	C40 A42 Y43	C40-K232 HydrophobicContact CB-CD 4.28Å; C40-K232 HydrophobicContact CB-CG 4.11Å; C40-K232 WeakPolarHBondContact O-CE 3.43Å; C40-K232 PolarHBondContact O-NZ 2.82Å; A42-K232 CarbonylContact O-C 3.47Å; A42-K232 WeakPolarHBondContact O-CA 3.34Å; Y43-K232 HydrophobicContact CD1-CB 4.25Å; Y43-K232 HydrophobicContact CD1-CG 4.38Å; Y43-K232 HydrophobicContact CE1-CB 4.19Å; Y43-K232 HydrophobicContact CE1-CD 4.45Å; Y43-K232 HydrophobicContact CE1-CG 4.06Å
233	T	86.8	Confident	82.7	Confident	18 Å²	18	86.7 Å²	86.7	11%	0.11	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	158.1	-175.5	-165.6	0	0	0	0	112.7	C40 A42 R44 Y72	C40-T233 WeakPolarHBondContact CA-O 3.37Å; A42-T233 HydrophobicContact CB-CG2 4.08Å; A42-T233 PolarHBondContact N-O 3.38Å; A42-T233 PolarHBondContact O-N 3.41Å; R44-T233 HydrophobicContact CB-CG2 4.13Å; Y72-T233 HydrophobicContact CD2-CG2 4.35Å; Y72-T233 HydrophobicContact CE2-CG2 4.23Å
234	S	86.5	Confident	82.8	Confident	6 Å²	6	93.6 Å²	93.6	4%	0.042	43%	0.433	C	S	.	.			trans	-100.1	144.9	169.4	173.5	0	0	0	0	109.7	I37 K236	I37-S234 VanDerWaalsContact O-CB 3.25Å; I37-S234 WeakPolarHBondContact O-CB 3.23Å; I37-S234 PolarHBondContact O-OG 3.37Å; S234-K236 VanDerWaalsContact C-N 3.31Å; S234-K236 PolarHBondContact OG-N 3.2Å; S234-K236 VanDerWaalsContact OG-N 3.09Å
235	R	82.7	Confident	83.1	Confident	127 Å²	127	98.5 Å²	98.5	48%	0.479	46%	0.456	S	S	.	.	S	Bend	trans	-74.3	-23.5	172.5	-177.8	178.3	162.5	165.3	2.6	112.7	D131	D131-R235 IonicContact OD1-CZ 3.53Å; D131-R235 IonicContact OD1-NH1 2.62Å; D131-R235 PolarHBondContact OD1-NH1 3.05Å; D131-R235 IonicContact OD1-NH2 2.95Å; D131-R235 PolarHBondContact OD1-NH2 3.32Å; D131-R235 IonicContact OD2-CZ 2.64Å; D131-R235 IonicContact OD2-NH1 3.95Å; D131-R235 PolarHBondContact OD2-NH1 3.03Å; D131-R235 IonicContact OD2-NH2 3.55Å
236	K	84.5	Confident	83.2	Confident	96 Å²	96	100.3 Å²	100.3	42%	0.417	45%	0.454	S	S	.	.	S	Bend	trans	-87.5	-39.6	-172.8	-174.6	176.3	179.8	175.9	0	112.1	H35 S234	H35-K236 PolarHBondContact CD2-NZ 3.4Å; H35-K236 PolarHBondContact NE2-NZ 3.45Å; H35-K236 VanDerWaalsContact NE2-NZ 3.1Å; H35-K236 WeakPolarHBondContact O-CD 3.3Å; H35-K236 WeakPolarHBondContact O-CE 3.27Å; H35-K236 PolarHBondContact O-NZ 3.02Å; S234-K236 VanDerWaalsContact C-N 3.31Å; S234-K236 PolarHBondContact OG-N 3.2Å; S234-K236 VanDerWaalsContact OG-N 3.09Å
237	L	84.1	Confident	83	Confident	65 Å²	65	101.8 Å²	101.8	34%	0.34	46%	0.464	S	S	.	.			trans	-72.5	133.6	-178	-167.2	70.2	0	0	0	110.3	L13 I37	L13-L237 HydrophobicContact CD1-CD2 3.22Å; L13-L237 HydrophobicContact CD2-CB 4.42Å; L13-L237 HydrophobicContact CD2-CD2 3.99Å; L13-L237 HydrophobicContact CG-CD2 4.23Å; I37-L237 PolarHBondContact O-N 2.77Å
238	K	82.8	Confident	83.4	Confident	176 Å²	176	100 Å²	100	77%	0.765	46%	0.457	S	S	*	.			trans	-111.9	157.4	174.4	-63.8	-177.4	178.2	-176.4	0	109.6
239	D	81.9	Confident	83.7	Confident	140 Å²	140	102.4 Å²	102.4	75%	0.749	48%	0.483	S	S	*	.			trans	-55.5	142.3	174.4	-68.8	-20.7	0	0	0	111.6	V241	D239-V241 PolarHBondContact O-N 3.06Å; D239-V241 VanDerWaalsContact O-N 3.14Å
240	W	85.2	Confident	83.9	Confident	212 Å²	212	106.7 Å²	106.7	80%	0.803	51%	0.511	S	S	*	.			trans	-75.9	107.6	-179.3	-176.4	25.5	0	0	0	110.3	V242	W240-V242 HydrophobicContact CD2-CG2 3.69Å; W240-V242 HydrophobicContact CE3-CG2 3.82Å; W240-V242 HydrophobicContact CG-CG2 4.07Å; W240-V242 HydrophobicContact CZ2-CG2 4.44Å; W240-V242 HydrophobicContact CZ3-CG2 4.25Å; W240-V242 PolarHBondContact O-N 3.14Å
241	V	88.3	Confident	83.7	Confident	93 Å²	93	109.2 Å²	109.2	56%	0.564	53%	0.527	S	S	*	.			trans	-70.4	105.9	169.6	-174.9	0	0	0	0	108	D239 R244	D239-V241 PolarHBondContact O-N 3.06Å; D239-V241 VanDerWaalsContact O-N 3.14Å; V241-R244 VanDerWaalsContact O-CZ 3.26Å; V241-R244 PolarHBondContact O-NH1 2.85Å; V241-R244 PolarHBondContact O-NH2 2.84Å
242	V	88.7	Confident	83.7	Confident	90 Å²	90	111.9 Å²	111.9	55%	0.545	54%	0.543	S	S	.	.			trans	-89.5	-28.7	177.6	-176	0	0	0	0	111.7	W240	W240-V242 HydrophobicContact CD2-CG2 3.69Å; W240-V242 HydrophobicContact CE3-CG2 3.82Å; W240-V242 HydrophobicContact CG-CG2 4.07Å; W240-V242 HydrophobicContact CZ2-CG2 4.44Å; W240-V242 HydrophobicContact CZ3-CG2 4.25Å; W240-V242 PolarHBondContact O-N 3.14Å
243	S	88.3	Confident	83.5	Confident	72 Å²	72	110.6 Å²	110.6	50%	0.503	54%	0.542	S	S	.	.			trans	-65.5	136.2	-176	59.8	0	0	0	0	112.3
244	R	85.6	Confident	83.3	Confident	144 Å²	144	112.8 Å²	112.8	54%	0.543	55%	0.553	S	S	.	*			trans	-134.6	135.3	178.9	-62.7	-67.4	178.1	-87.6	-4.4	109.7	V241 R246	V241-R244 VanDerWaalsContact O-CZ 3.26Å; V241-R244 PolarHBondContact O-NH1 2.85Å; V241-R244 PolarHBondContact O-NH2 2.84Å; R244-R246 HydrophobicContact CB-CG 4.5Å; R244-R246 PolarHBondContact O-N 2.7Å
245	Q	87.5	Confident	82.9	Confident	192 Å²	192	113.9 Å²	113.9	90%	0.897	56%	0.559	S	S	*	*			trans	-84.3	57.1	173.4	-61.9	176	11.4	0	0	110.1
246	R	82	Confident	82.8	Confident	197 Å²	197	113.1 Å²	113.1	74%	0.743	56%	0.561	S	S	*	*			trans	-128.6	140.6	-179.5	-65.2	-173.5	-179.4	-179.4	0.5	109.3	R244	R244-R246 HydrophobicContact CB-CG 4.5Å; R244-R246 PolarHBondContact O-N 2.7Å
247	L	71.7	Confident	82.6	Confident	117 Å²	117	109.7 Å²	109.7	61%	0.613	55%	0.549	S	S	*	.	S	Bend	trans	-67	-40.5	175	179.7	65.9	0	0	0	111.3	G249 Q286	L247-G249 PolarHBondContact O-N 3.43Å; L247-Q286 VanDerWaalsContact CD1-OE1 3.25Å
248	W	79.8	Confident	82.7	Confident	191 Å²	191	112.8 Å²	112.8	72%	0.723	57%	0.573	S	S	*	*	S	Bend	trans	-84.3	104.3	-179.7	-170.6	-110	0	0	0	110.6	Y277	W248-Y277 AromaticContact CE3-CE1 3.81Å; W248-Y277 HydrophobicContact CE3-CE1 3.81Å; W248-Y277 HydrophobicContact CE3-CE2 4.21Å; W248-Y277 AromaticContact CE3-CZ 3.49Å; W248-Y277 VanDerWaalsContact CE3-CZ 3.49Å; W248-Y277 VanDerWaalsContact CE3-OH 3.25Å; W248-Y277 AromaticContact CH2-CE2 3.68Å; W248-Y277 HydrophobicContact CH2-CE2 3.68Å; W248-Y277 AromaticContact CH2-CZ 3.5Å; W248-Y277 VanDerWaalsContact CH2-CZ 3.5Å; W248-Y277 WeakPolarHBondContact CH2-OH 3.34Å; W248-Y277 WeakPolarHBondContact CZ2-OH 3.43Å; W248-Y277 HydrophobicContact CZ3-CD2 4.31Å; W248-Y277 AromaticContact CZ3-CE1 3.74Å; W248-Y277 HydrophobicContact CZ3-CE1 3.74Å; W248-Y277 AromaticContact CZ3-CE2 3.29Å; W248-Y277 HydrophobicContact CZ3-CE2 3.29Å; W248-Y277 AromaticContact CZ3-CZ 2.97Å; W248-Y277 WeakPolarHBondContact CZ3-OH 3.35Å
249	G	80.3	Confident	82.9	Confident	56 Å²	56	115.5 Å²	115.5	58%	0.577	58%	0.578	S	S	*	*	S	Bend	trans	168	172.5	176.8	0	0	0	0	0	112.1	L247 P251	L247-G249 PolarHBondContact O-N 3.43Å; G249-P251 WeakPolarHBondContact O-CD 3.32Å
250	T	81.5	Confident	82.9	Confident	136 Å²	136	112.7 Å²	112.7	83%	0.834	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-70	125.2	173.8	-51.6	0	0	0	0	109.1
251	P	79.5	Confident	82.7	Confident	55 Å²	55	104.1 Å²	104.1	36%	0.357	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-65.5	140.1	176.9	22.9	-28.1	0	0	0	110.6	G249 L273	G249-P251 WeakPolarHBondContact O-CD 3.32Å; P251-L273 HydrophobicContact CB-CB 4.02Å; P251-L273 HydrophobicContact CB-CD1 4.11Å; P251-L273 HydrophobicContact CG-CB 3.2Å; P251-L273 HydrophobicContact CG-CD1 3.94Å; P251-L273 HydrophobicContact CG-CG 4.14Å; P251-L273 WeakPolarHBondContact CG-O 3.47Å
252	I	82.5	Confident	82.4	Confident	90 Å²	90	105.2 Å²	105.2	46%	0.462	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-74	124.4	178.7	-57.8	175.2	0	0	0	107.6	I254	I252-I254 HydrophobicContact CG2-CB 4.23Å; I252-I254 HydrophobicContact CG2-CD1 3.66Å; I252-I254 HydrophobicContact CG2-CG1 3.75Å; I252-I254 PolarHBondContact O-N 3.12Å
253	P	83.6	Confident	82	Confident	49 Å²	49	104.5 Å²	104.5	32%	0.318	54%	0.542	S	S	.	.			trans	-78.8	52.2	-173.2	34.2	-38	0	0	0	112.2	S265 L270	P253-S265 PolarHBondContact O-N 2.93Å; P253-L270 HydrophobicContact CB-CD2 3.59Å; P253-L270 HydrophobicContact CG-CD2 4.43Å
254	I	82.2	Confident	81.5	Confident	64 Å²	64	107.3 Å²	107.3	33%	0.328	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.1	179.5	-64.6	176.7	0	0	0	109.1	I252 N262 L263 M264	I252-I254 HydrophobicContact CG2-CB 4.23Å; I252-I254 HydrophobicContact CG2-CD1 3.66Å; I252-I254 HydrophobicContact CG2-CG1 3.75Å; I252-I254 PolarHBondContact O-N 3.12Å; I254-N262 HydrophobicContact CG2-CB 4.18Å; I254-L263 WeakPolarHBondContact CA-O 3.49Å; I254-M264 HydrophobicContact CD1-CE 3.89Å; I254-M264 HydrophobicContact CG1-CE 3.5Å; I254-M264 VanDerWaalsContact CG1-CE 3.5Å; I254-M264 HydrophobicContact CG1-SD 4.35Å
255	V	78.1	Confident	80.7	Confident	30 Å²	30	101.6 Å²	101.6	18%	0.182	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.8	172.8	-179.8	0	0	0	0	109.1	L263 I294	V255-L263 PolarHBondContact N-O 3.43Å; V255-L263 PolarHBondContact O-N 2.93Å; V255-I294 HydrophobicContact CB-CG2 4.04Å; V255-I294 HydrophobicContact CG1-CG2 3.45Å; V255-I294 VanDerWaalsContact CG1-CG2 3.45Å; V255-I294 HydrophobicContact CG2-CG2 3.49Å; V255-I294 VanDerWaalsContact CG2-CG2 3.49Å
256	H	80.3	Confident	79.8	Confident	110 Å²	110	99.3 Å²	99.3	51%	0.509	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	104.4	174.1	-66.5	-66.5	0	0	0	110	N262 Y295	H256-N262 PolarHBondContact CE1-OD1 3.26Å; H256-N262 VanDerWaalsContact CE1-OD1 3.26Å; H256-N262 PolarHBondContact ND1-OD1 2.99Å; H256-Y295 WeakPolarHBondContact O-CE1 3.41Å; H256-Y295 PolarHBondContact O-OH 2.68Å
257	C	80.5	Confident	78.7	Confident	24 Å²	24	97.9 Å²	97.9	16%	0.162	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.4	172.6	180	0	0	0	0	110.1	R259 C260 G261 L263	C257-R259 PolarHBondContact O-N 2.86Å; C257-R259 VanDerWaalsContact O-N 3.12Å; C257-C260 HydrophobicContact CB-CB 3.93Å; C257-C260 PolarHBondContact O-N 2.79Å; C257-C260 PolarHBondContact SG-N 2.91Å; C257-C260 VanDerWaalsContact SG-N 3.43Å; C257-G261 PolarHBondContact N-O 2.94Å; C257-G261 WeakPolarHBondContact O-CA 3.38Å; C257-G261 PolarHBondContact O-N 3.36Å; C257-L263 HydrophobicContact CB-CD1 4.33Å
258	P	85.9	Confident	77.7	Confident	130 Å²	130	99.5 Å²	99.5	84%	0.844	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-25.4	177.9	-22.6	31.5	0	0	0	114.1
259	R	86.8	Confident	76.6	Confident	233 Å²	233	94.4 Å²	94.4	88%	0.879	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-40.6	-178.7	-165.5	-176	-66.3	-169.5	0.6	112.7	C257	C257-R259 PolarHBondContact O-N 2.86Å; C257-R259 VanDerWaalsContact O-N 3.12Å
260	C	82.9	Confident	75.3	Confident	81 Å²	81	95.9 Å²	95.9	55%	0.547	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-10.3	-172.5	-51.7	0	0	0	0	113.8	C257 L263	C257-C260 HydrophobicContact CB-CB 3.93Å; C257-C260 PolarHBondContact O-N 2.79Å; C257-C260 PolarHBondContact SG-N 2.91Å; C257-C260 VanDerWaalsContact SG-N 3.43Å; C260-L263 HydrophobicContact CB-CD1 3.85Å; C260-L263 HydrophobicContact CB-CD2 4.33Å; C260-L263 HydrophobicContact CB-CG 4.25Å
261	G	81.2	Confident	74.1	Confident	33 Å²	33	98 Å²	98	34%	0.34	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	80.4	-143.1	-172.9	0	0	0	0	0	112.6	C257	C257-G261 PolarHBondContact N-O 2.94Å; C257-G261 WeakPolarHBondContact O-CA 3.38Å; C257-G261 PolarHBondContact O-N 3.36Å
262	N	81.7	Confident	72.7	Confident	115 Å²	115	101.5 Å²	101.5	62%	0.615	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.3	-175.6	-58.6	-17.1	0	0	0	109.7	I254 H256	I254-N262 HydrophobicContact CG2-CB 4.18Å; H256-N262 PolarHBondContact CE1-OD1 3.26Å; H256-N262 VanDerWaalsContact CE1-OD1 3.26Å; H256-N262 PolarHBondContact ND1-OD1 2.99Å
263	L	80	Confident	71.3	Confident	75 Å²	75	99.1 Å²	99.1	39%	0.393	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	144.4	178.8	-61.6	175.4	0	0	0	109.9	I254 V255 C257 C260	I254-L263 WeakPolarHBondContact CA-O 3.49Å; V255-L263 PolarHBondContact N-O 3.43Å; V255-L263 PolarHBondContact O-N 2.93Å; C257-L263 HydrophobicContact CB-CD1 4.33Å; C260-L263 HydrophobicContact CB-CD1 3.85Å; C260-L263 HydrophobicContact CB-CD2 4.33Å; C260-L263 HydrophobicContact CB-CG 4.25Å
264	M	77.9	Confident	69.9	Low	131 Å²	131	105.6 Å²	105.6	65%	0.645	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.3	166.3	-70.1	-60.6	112.9	0	0	109.1	I254	I254-M264 HydrophobicContact CD1-CE 3.89Å; I254-M264 HydrophobicContact CG1-CE 3.5Å; I254-M264 VanDerWaalsContact CG1-CE 3.5Å; I254-M264 HydrophobicContact CG1-SD 4.35Å
265	S	69.4	Low	68.6	Low	24 Å²	24	106.5 Å²	106.5	17%	0.168	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-64.7	138.6	168.7	-178.4	0	0	0	0	109.4	P253 D269	P253-S265 PolarHBondContact O-N 2.93Å; S265-D269 WeakPolarHBondContact OG-CB 2.88Å
266	Q	68.6	Low	67.1	Low	145 Å²	145	109.7 Å²	109.7	68%	0.678	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-68.7	151.6	178.6	-66.8	-177	3	0	0	110	L268 D269	Q266-L268 PolarHBondContact O-N 3.38Å; Q266-D269 PolarHBondContact O-N 3.03Å
267	M	58	Low	65.7	Low	166 Å²	166	112.6 Å²	112.6	82%	0.818	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-55.7	-27.2	-174.9	-154.5	167.3	109.5	0	0	113.2	D269 L270	M267-D269 VanDerWaalsContact C-N 3.33Å; M267-D269 PolarHBondContact O-N 3.31Å; M267-L270 HydrophobicContact CG-CD1 4.04Å
268	L	51.4	Low	64.3	Low	152 Å²	152	114.8 Å²	114.8	80%	0.796	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-71.4	-18.8	177.9	-78.5	107.8	0	0	0	114.6	Q266	Q266-L268 PolarHBondContact O-N 3.38Å
269	D	55.5	Low	62.5	Low	84 Å²	84	118.6 Å²	118.6	45%	0.449	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-93.9	-5.8	-179.6	-67.4	-30.2	0	0	0	113	S265 Q266 M267 E271 M272	S265-D269 WeakPolarHBondContact OG-CB 2.88Å; Q266-D269 PolarHBondContact O-N 3.03Å; M267-D269 VanDerWaalsContact C-N 3.33Å; M267-D269 PolarHBondContact O-N 3.31Å; D269-E271 VanDerWaalsContact C-N 3.29Å; D269-E271 PolarHBondContact O-N 3.03Å; D269-M272 WeakPolarHBondContact O-CB 3.33Å; D269-M272 PolarHBondContact O-N 3.44Å
270	L	54.9	Low	60.7	Low	86 Å²	86	109.5 Å²	109.5	45%	0.45	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-68.3	-27.2	-171.3	-68.1	173.4	0	0	0	113.3	P253 M267 M272	P253-L270 HydrophobicContact CB-CD2 3.59Å; P253-L270 HydrophobicContact CG-CD2 4.43Å; M267-L270 HydrophobicContact CG-CD1 4.04Å; L270-M272 PolarHBondContact O-N 3.31Å
271	E	54.6	Low	59.3	Low	182 Å²	182	111.7 Å²	111.7	85%	0.85	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-70.6	-19.7	174.4	-65.8	-173.6	168.7	0	0	112.3	D269 L273	D269-E271 VanDerWaalsContact C-N 3.29Å; D269-E271 PolarHBondContact O-N 3.03Å; E271-L273 VanDerWaalsContact C-N 3.34Å; E271-L273 PolarHBondContact O-N 3.46Å
272	M	50.9	Low	58.2	Low	128 Å²	128	112 Å²	112	63%	0.631	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-83.1	-5.8	-170.3	-68.8	-73.1	-75.8	0	0	114.6	D269 L270	D269-M272 WeakPolarHBondContact O-CB 3.33Å; D269-M272 PolarHBondContact O-N 3.44Å; L270-M272 PolarHBondContact O-N 3.31Å
273	L	53.8	Low	57	Low	39 Å²	39	113.1 Å²	113.1	20%	0.204	57%	0.569	C	S	.	*	G	3₁₀ helix	trans	-99.7	-0.3	-172.3	-59.8	171.5	0	0	0	114.8	P251 E271 I275 I294	P251-L273 HydrophobicContact CB-CB 4.02Å; P251-L273 HydrophobicContact CB-CD1 4.11Å; P251-L273 HydrophobicContact CG-CB 3.2Å; P251-L273 HydrophobicContact CG-CD1 3.94Å; P251-L273 HydrophobicContact CG-CG 4.14Å; P251-L273 WeakPolarHBondContact CG-O 3.47Å; E271-L273 VanDerWaalsContact C-N 3.34Å; E271-L273 PolarHBondContact O-N 3.46Å; L273-I275 PolarHBondContact O-N 3.33Å; L273-I294 HydrophobicContact CD2-CD1 4.38Å
274	Q	53.2	Low	55.9	Low	185 Å²	185	119.9 Å²	119.9	86%	0.864	59%	0.59	S	S	*	*			trans	-72.2	76.2	160.8	-80.6	-170.5	-40.6	0	0	109	S276	Q274-S276 PolarHBondContact O-N 3.35Å
275	I	54.7	Low	54.9	Low	83 Å²	83	118.1 Å²	118.1	43%	0.426	58%	0.58	S	S	.	*			trans	-63.4	104.5	169.4	-64.5	157.5	0	0	0	105.9	L273 Y277 I278 C290	L273-I275 PolarHBondContact O-N 3.33Å; I275-Y277 PolarHBondContact O-N 3.09Å; I275-I278 HydrophobicContact CG2-CD1 4.23Å; I275-I278 HydrophobicContact CG2-CG1 4.18Å; I275-C290 HydrophobicContact CD1-CB 4.36Å; I275-C290 WeakPolarHBondContact CD1-SG 2.91Å
276	S	47.2	Very low	54.3	Low	97 Å²	97	118.3 Å²	118.3	68%	0.678	58%	0.578	S	S	*	*			trans	-44.9	129.2	166.8	50.5	0	0	0	0	107.9	Q274 I278	Q274-S276 PolarHBondContact O-N 3.35Å; S276-I278 VanDerWaalsContact C-N 3.32Å; S276-I278 WeakPolarHBondContact O-CG1 3.49Å; S276-I278 PolarHBondContact O-N 2.81Å
277	Y	51.3	Low	53.9	Low	172 Å²	172	115.2 Å²	115.2	68%	0.675	56%	0.563	S	S	*	*			trans	-41.6	90.6	-179.5	-76.2	-94.8	0	0	0	112.2	W248 I275 K279	W248-Y277 AromaticContact CE3-CE1 3.81Å; W248-Y277 HydrophobicContact CE3-CE1 3.81Å; W248-Y277 HydrophobicContact CE3-CE2 4.21Å; W248-Y277 AromaticContact CE3-CZ 3.49Å; W248-Y277 VanDerWaalsContact CE3-CZ 3.49Å; W248-Y277 VanDerWaalsContact CE3-OH 3.25Å; W248-Y277 AromaticContact CH2-CE2 3.68Å; W248-Y277 HydrophobicContact CH2-CE2 3.68Å; W248-Y277 AromaticContact CH2-CZ 3.5Å; W248-Y277 VanDerWaalsContact CH2-CZ 3.5Å; W248-Y277 WeakPolarHBondContact CH2-OH 3.34Å; W248-Y277 WeakPolarHBondContact CZ2-OH 3.43Å; W248-Y277 HydrophobicContact CZ3-CD2 4.31Å; W248-Y277 AromaticContact CZ3-CE1 3.74Å; W248-Y277 HydrophobicContact CZ3-CE1 3.74Å; W248-Y277 AromaticContact CZ3-CE2 3.29Å; W248-Y277 HydrophobicContact CZ3-CE2 3.29Å; W248-Y277 AromaticContact CZ3-CZ 2.97Å; W248-Y277 WeakPolarHBondContact CZ3-OH 3.35Å; I275-Y277 PolarHBondContact O-N 3.09Å; Y277-K279 PolarHBondContact O-N 3.08Å; Y277-K279 VanDerWaalsContact O-N 3.12Å
278	I	49.7	Very low	53.9	Low	70 Å²	70	109.8 Å²	109.8	36%	0.359	54%	0.542	S	S	.	.			trans	-75	108.8	169.8	-54.3	-176.7	0	0	0	104.4	I275 S276 T280 Q286 L289	I275-I278 HydrophobicContact CG2-CD1 4.23Å; I275-I278 HydrophobicContact CG2-CG1 4.18Å; S276-I278 VanDerWaalsContact C-N 3.32Å; S276-I278 WeakPolarHBondContact O-CG1 3.49Å; S276-I278 PolarHBondContact O-N 2.81Å; I278-T280 HydrophobicContact CG2-CG2 3.59Å; I278-T280 WeakPolarHBondContact CG2-OG1 3.15Å; I278-T280 PolarHBondContact O-N 3.16Å; I278-Q286 PolarHBondContact O-NE2 3.32Å; I278-L289 HydrophobicContact CD1-CD1 3.91Å
279	K	48.8	Very low	54.1	Low	210 Å²	210	106.8 Å²	106.8	91%	0.913	53%	0.526	S	S	*	.			trans	-65.6	46.7	170	-73.6	-177.7	174.9	177.2	0	111.5	Y277	Y277-K279 PolarHBondContact O-N 3.08Å; Y277-K279 VanDerWaalsContact O-N 3.12Å
280	T	49.8	Very low	54.1	Low	41 Å²	41	104.8 Å²	104.8	25%	0.252	52%	0.518	S	S	.	.			trans	-83.5	133.2	166.8	38.1	0	0	0	0	108.4	I278 S282 Q286	I278-T280 HydrophobicContact CG2-CG2 3.59Å; I278-T280 WeakPolarHBondContact CG2-OG1 3.15Å; I278-T280 PolarHBondContact O-N 3.16Å; T280-S282 PolarHBondContact O-N 3.37Å; T280-Q286 WeakPolarHBondContact OG1-CG 3.37Å; T280-Q286 PolarHBondContact OG1-NE2 3.08Å
281	S	53.2	Low	54.2	Low	127 Å²	127	105.6 Å²	105.6	89%	0.888	52%	0.518	S	S	*	.	S	Bend	trans	-74.3	-4.7	-170.9	51.3	0	0	0	0	113.8
282	S	57.3	Low	53.9	Low	39 Å²	39	104.3 Å²	104.3	27%	0.273	51%	0.512	S	S	.	.			trans	-129.4	127.7	-175.8	124.4	0	0	0	0	112.4	T280 R284 E285	T280-S282 PolarHBondContact O-N 3.37Å; S282-R284 PolarHBondContact O-N 3.16Å; S282-R284 VanDerWaalsContact O-N 3.08Å; S282-R284 PolarHBondContact OG-N 3.47Å; S282-E285 PolarHBondContact O-N 2.76Å; S282-E285 PolarHBondContact OG-N 3.37Å
283	Y	57.3	Low	53.7	Low	140 Å²	140	105.9 Å²	105.9	55%	0.549	52%	0.515	S	S	.	.	H	α-helix	trans	-52	-28.1	172.6	-179.8	-99.7	0	0	0	112.9	H287	Y283-H287 AromaticContact CE1-CD2 3.52Å; Y283-H287 AromaticContact CE1-NE2 3.7Å; Y283-H287 AromaticContact CZ-CD2 3.54Å; Y283-H287 AromaticContact CZ-NE2 3.45Å; Y283-H287 PolarHBondContact O-N 3.41Å; Y283-H287 PolarHBondContact OH-NE2 3.46Å; Y283-H287 VanDerWaalsContact OH-NE2 3.09Å
284	R	56.1	Low	53.6	Low	216 Å²	216	107.1 Å²	107.1	82%	0.815	52%	0.521	S	S	*	.	H	α-helix	trans	-73.7	-36	-176.3	-144.8	179	-144	172.8	5	112.6	S282 S288	S282-R284 PolarHBondContact O-N 3.16Å; S282-R284 VanDerWaalsContact O-N 3.08Å; S282-R284 PolarHBondContact OG-N 3.47Å; R284-S288 PolarHBondContact O-N 3.43Å
285	E	57.3	Low	53.3	Low	94 Å²	94	104.1 Å²	104.1	44%	0.439	50%	0.503	S	S	.	.	H	α-helix	trans	-75.2	-34.7	179.1	-71.4	175.4	174.3	0	0	111.9	S282 H287 S288 L289	S282-E285 PolarHBondContact O-N 2.76Å; S282-E285 PolarHBondContact OG-N 3.37Å; E285-H287 VanDerWaalsContact C-N 3.33Å; E285-S288 PolarHBondContact O-N 3.23Å; E285-S288 PolarHBondContact O-OG 3.3Å; E285-L289 WeakPolarHBondContact O-CG 3.25Å; E285-L289 PolarHBondContact O-N 3.48Å
286	Q	57	Low	52.7	Low	29 Å²	29	105.2 Å²	105.2	14%	0.136	52%	0.518	C	S	.	.	H	α-helix	trans	-65.4	-41.1	173.5	-66	175.2	-15	0	0	110.6	L247 I278 T280 S288 L289 C290	L247-Q286 VanDerWaalsContact CD1-OE1 3.25Å; I278-Q286 PolarHBondContact O-NE2 3.32Å; T280-Q286 WeakPolarHBondContact OG1-CG 3.37Å; T280-Q286 PolarHBondContact OG1-NE2 3.08Å; Q286-S288 PolarHBondContact O-N 3.26Å; Q286-L289 PolarHBondContact O-N 2.87Å; Q286-C290 PolarHBondContact O-N 2.89Å; Q286-C290 PolarHBondContact O-SG 3.03Å
287	H	59.5	Low	52.4	Low	79 Å²	79	109 Å²	109	37%	0.366	54%	0.542	S	S	.	.	H	α-helix	trans	-61	-38.9	175.8	-112	-93.1	0	0	0	113.3	Y283 E285 K291	Y283-H287 AromaticContact CE1-CD2 3.52Å; Y283-H287 AromaticContact CE1-NE2 3.7Å; Y283-H287 AromaticContact CZ-CD2 3.54Å; Y283-H287 AromaticContact CZ-NE2 3.45Å; Y283-H287 PolarHBondContact O-N 3.41Å; Y283-H287 PolarHBondContact OH-NE2 3.46Å; Y283-H287 VanDerWaalsContact OH-NE2 3.09Å; E285-H287 VanDerWaalsContact C-N 3.33Å; H287-K291 WeakPolarHBondContact O-CB 2.81Å; H287-K291 VanDerWaalsContact O-CG 3.25Å; H287-K291 WeakPolarHBondContact O-CG 3.49Å; H287-K291 PolarHBondContact O-N 3.36Å; H287-K291 VanDerWaalsContact O-N 3.16Å
288	S	58.3	Low	52.4	Low	52 Å²	52	105.9 Å²	105.9	36%	0.364	54%	0.536	S	S	.	.	H	α-helix	trans	-68.8	-42	178.2	62.7	0	0	0	0	111.7	R284 E285 Q286 K291 H292	R284-S288 PolarHBondContact O-N 3.43Å; E285-S288 PolarHBondContact O-N 3.23Å; E285-S288 PolarHBondContact O-OG 3.3Å; Q286-S288 PolarHBondContact O-N 3.26Å; S288-K291 PolarHBondContact O-N 3.12Å; S288-H292 PolarHBondContact O-N 3.22Å; S288-H292 VanDerWaalsContact O-N 3.12Å; S288-H292 PolarHBondContact O-ND1 3.36Å
289	L	56.5	Low	52.6	Low	89 Å²	89	107.7 Å²	107.7	47%	0.466	55%	0.545	S	S	.	.	H	α-helix	trans	-65.6	-40.5	178.2	-70.3	169.4	0	0	0	112.8	I278 E285 Q286	I278-L289 HydrophobicContact CD1-CD1 3.91Å; E285-L289 WeakPolarHBondContact O-CG 3.25Å; E285-L289 PolarHBondContact O-N 3.48Å; Q286-L289 PolarHBondContact O-N 2.87Å
290	C	55	Low	52.8	Low	42 Å²	42	102.1 Å²	102.1	28%	0.284	53%	0.525	S	S	.	.	H	α-helix	trans	-62.4	-44.8	175.1	-62.7	0	0	0	0	111.4	I275 Q286 H292 K293 I294	I275-C290 HydrophobicContact CD1-CB 4.36Å; I275-C290 WeakPolarHBondContact CD1-SG 2.91Å; Q286-C290 PolarHBondContact O-N 2.89Å; Q286-C290 PolarHBondContact O-SG 3.03Å; C290-H292 PolarHBondContact O-N 3.27Å; C290-K293 PolarHBondContact O-N 3.19Å; C290-I294 WeakPolarHBondContact O-CD1 3.44Å; C290-I294 WeakPolarHBondContact O-CG1 3.19Å
291	K	55.5	Low	52.9	Low	104 Å²	104	105.6 Å²	105.6	45%	0.452	54%	0.541	S	S	.	.	H	α-helix	trans	-60	-46.9	-179.8	-82.1	179.4	-174.9	-172.5	0	111.5	H287 S288 K293 I294 Y295	H287-K291 WeakPolarHBondContact O-CB 2.81Å; H287-K291 VanDerWaalsContact O-CG 3.25Å; H287-K291 WeakPolarHBondContact O-CG 3.49Å; H287-K291 PolarHBondContact O-N 3.36Å; H287-K291 VanDerWaalsContact O-N 3.16Å; S288-K291 PolarHBondContact O-N 3.12Å; K291-K293 VanDerWaalsContact C-N 3.31Å; K291-K293 PolarHBondContact O-N 3.23Å; K291-I294 PolarHBondContact O-N 3.49Å; K291-I294 VanDerWaalsContact O-N 3.16Å; K291-Y295 HydrophobicContact CB-CD2 4.21Å; K291-Y295 HydrophobicContact CB-CE2 3.75Å; K291-Y295 HydrophobicContact CG-CE2 4.03Å; K291-Y295 WeakPolarHBondContact O-CD2 3.48Å; K291-Y295 WeakPolarHBondContact O-CE2 3.35Å; K291-Y295 PolarHBondContact O-N 3.12Å
292	H	48.6	Very low	52.9	Low	155 Å²	155	104.3 Å²	104.3	72%	0.718	52%	0.519	S	S	*	.	H	α-helix	trans	-65.7	-29.5	-175.2	-76.4	68.9	0	0	0	114.1	S288 C290 I294	S288-H292 PolarHBondContact O-N 3.22Å; S288-H292 VanDerWaalsContact O-N 3.12Å; S288-H292 PolarHBondContact O-ND1 3.36Å; C290-H292 PolarHBondContact O-N 3.27Å; H292-I294 VanDerWaalsContact C-N 3.29Å; H292-I294 PolarHBondContact O-N 2.95Å
293	K	48.5	Very low	52.6	Low	161 Å²	161	108.7 Å²	108.7	70%	0.7	54%	0.536	S	S	*	.	H	α-helix	trans	-72.8	-20.4	176.8	-85.6	-174.3	173.3	-174.9	0	114.1	C290 K291	C290-K293 PolarHBondContact O-N 3.19Å; K291-K293 VanDerWaalsContact C-N 3.31Å; K291-K293 PolarHBondContact O-N 3.23Å
294	I	50.9	Low	52.3	Low	65 Å²	65	106.4 Å²	106.4	33%	0.333	54%	0.535	S	S	.	.	H	α-helix	trans	-98.7	-18.8	-171.5	-62.7	171	0	0	0	111.4	V255 L273 C290 K291 H292 S296	V255-I294 HydrophobicContact CB-CG2 4.04Å; V255-I294 HydrophobicContact CG1-CG2 3.45Å; V255-I294 VanDerWaalsContact CG1-CG2 3.45Å; V255-I294 HydrophobicContact CG2-CG2 3.49Å; V255-I294 VanDerWaalsContact CG2-CG2 3.49Å; L273-I294 HydrophobicContact CD2-CD1 4.38Å; C290-I294 WeakPolarHBondContact O-CD1 3.44Å; C290-I294 WeakPolarHBondContact O-CG1 3.19Å; K291-I294 PolarHBondContact O-N 3.49Å; K291-I294 VanDerWaalsContact O-N 3.16Å; H292-I294 VanDerWaalsContact C-N 3.29Å; H292-I294 PolarHBondContact O-N 2.95Å; I294-S296 PolarHBondContact O-N 2.77Å
295	Y	46.1	Very low	52	Low	121 Å²	121	98 Å²	98	48%	0.475	51%	0.513	S	S	.	.			trans	-88.1	23.5	-173.8	-71.7	-59.6	0	0	0	116.1	H256 K291 C297	H256-Y295 WeakPolarHBondContact O-CE1 3.41Å; H256-Y295 PolarHBondContact O-OH 2.68Å; K291-Y295 HydrophobicContact CB-CD2 4.21Å; K291-Y295 HydrophobicContact CB-CE2 3.75Å; K291-Y295 HydrophobicContact CG-CE2 4.03Å; K291-Y295 WeakPolarHBondContact O-CD2 3.48Å; K291-Y295 WeakPolarHBondContact O-CE2 3.35Å; K291-Y295 PolarHBondContact O-N 3.12Å; Y295-C297 PolarHBondContact O-N 2.68Å
296	S	41.9	Very low	51.6	Low	107 Å²	107	98.3 Å²	98.3	75%	0.748	52%	0.519	S	S	*	.			trans	-88	84.4	163.3	60.2	0	0	0	0	109.8	I294	I294-S296 PolarHBondContact O-N 2.77Å
297	C	41	Very low	51.1	Low	176 Å²	176	104.6 Å²	104.6	100%	1.189	55%	0.554	S	S	*	*			trans	-85.5	0	160.8	-82.4	0	0	0	0	110.4	Y295	Y295-C297 PolarHBondContact O-N 2.68Å

Retrieved 297 of 297 residues in 211.2 ms (Link to these results)

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