A0A077ZI55_TRITR Loading...

Phage pRha domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZI55, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 257 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	60.4	Low	58.9	Low	195 Å²	195	128.2 Å²	128.2	96%	0.961	63%	0.628	S	S	*	*				0	-50.9	0	-147.4	164.9	163.5	0	0	112.6	R3 H4 Q5	M1-R3 PolarHBondContact O-N 3.31Å; M1-H4 PolarHBondContact O-N 3.18Å; M1-Q5 PolarHBondContact O-N 3.4Å
2	V	59.3	Low	59.8	Low	108 Å²	108	127.2 Å²	127.2	66%	0.655	63%	0.625	S	S	*	*	H	α-helix	trans	-56	-46.3	-178.3	-175.9	0	0	0	0	114.6	H4 Q5 Q6	V2-H4 VanDerWaalsContact C-N 3.3Å; V2-H4 PolarHBondContact O-N 2.99Å; V2-Q5 PolarHBondContact O-N 3.25Å; V2-Q6 PolarHBondContact O-N 3.47Å
3	R	56.3	Low	60	Low	218 Å²	218	125.2 Å²	125.2	82%	0.823	62%	0.617	S	S	*	*	H	α-helix	trans	-59.5	-36.5	178	-73.4	-172.2	-174	-174.6	2.2	113.2	M1 V7	M1-R3 PolarHBondContact O-N 3.31Å; R3-V7 VanDerWaalsContact O-CG2 3.27Å; R3-V7 WeakPolarHBondContact O-CG2 3.27Å; R3-V7 PolarHBondContact O-N 3.3Å; R3-V7 VanDerWaalsContact O-N 3.09Å
4	H	59.2	Low	60.3	Low	148 Å²	148	124.8 Å²	124.8	69%	0.685	61%	0.611	S	S	*	*	H	α-helix	trans	-70.9	-38.8	178.7	-100.9	-50.8	0	0	0	112.6	M1 V2 R8	M1-H4 PolarHBondContact O-N 3.18Å; V2-H4 VanDerWaalsContact C-N 3.3Å; V2-H4 PolarHBondContact O-N 2.99Å; H4-R8 PolarHBondContact O-N 3.09Å; H4-R8 VanDerWaalsContact O-N 3.17Å
5	Q	51.1	Low	60.8	Low	123 Å²	123	122.6 Å²	122.6	58%	0.575	60%	0.599	S	S	*	*	H	α-helix	trans	-65.3	-42.1	173.6	-87.2	174.5	-39.7	0	0	111.6	M1 V2 V7 R8 M9	M1-Q5 PolarHBondContact O-N 3.4Å; V2-Q5 PolarHBondContact O-N 3.25Å; Q5-V7 PolarHBondContact O-N 3.17Å; Q5-R8 PolarHBondContact O-N 2.95Å; Q5-M9 WeakPolarHBondContact O-CB 3.39Å; Q5-M9 PolarHBondContact O-N 3.33Å
6	Q	51.5	Low	61.1	Low	127 Å²	127	123.2 Å²	123.2	59%	0.593	60%	0.597	S	S	*	*	H	α-helix	trans	-64.5	-39.6	179.6	-161.4	173.2	8.4	0	0	112.5	V2 M9 C10	V2-Q6 PolarHBondContact O-N 3.47Å; Q6-M9 PolarHBondContact O-N 3.01Å; Q6-C10 WeakPolarHBondContact O-CB 3.42Å; Q6-C10 PolarHBondContact O-N 3.49Å
7	V	60.5	Low	61.5	Low	85 Å²	85	120.9 Å²	120.9	52%	0.515	59%	0.588	S	S	.	*	H	α-helix	trans	-65.5	-43.8	175.3	172.8	0	0	0	0	111.6	R3 Q5 C10 G11	R3-V7 VanDerWaalsContact O-CG2 3.27Å; R3-V7 WeakPolarHBondContact O-CG2 3.27Å; R3-V7 PolarHBondContact O-N 3.3Å; R3-V7 VanDerWaalsContact O-N 3.09Å; Q5-V7 PolarHBondContact O-N 3.17Å; V7-C10 PolarHBondContact O-N 3.47Å; V7-G11 PolarHBondContact O-N 3.05Å
8	R	63.3	Low	61.8	Low	193 Å²	193	119.5 Å²	119.5	73%	0.728	58%	0.575	S	S	*	*	H	α-helix	trans	-62	-44.5	176.1	-77.9	-172.7	177.4	-169.8	0.1	112	H4 Q5 C10 G11 I12	H4-R8 PolarHBondContact O-N 3.09Å; H4-R8 VanDerWaalsContact O-N 3.17Å; Q5-R8 PolarHBondContact O-N 2.95Å; R8-C10 VanDerWaalsContact C-N 3.34Å; R8-C10 PolarHBondContact O-N 3.4Å; R8-G11 PolarHBondContact O-N 3.2Å; R8-I12 WeakPolarHBondContact O-CG1 3.35Å; R8-I12 PolarHBondContact O-N 3.23Å
9	M	57.8	Low	62.2	Low	112 Å²	112	119.1 Å²	119.1	55%	0.552	57%	0.57	S	S	*	*	H	α-helix	trans	-63.6	-40.6	179.5	-152.4	-170.3	-32.4	0	0	111.7	Q5 Q6 G11 I12 L13	Q5-M9 WeakPolarHBondContact O-CB 3.39Å; Q5-M9 PolarHBondContact O-N 3.33Å; Q6-M9 PolarHBondContact O-N 3.01Å; M9-G11 PolarHBondContact O-N 3.37Å; M9-I12 PolarHBondContact O-N 3.06Å; M9-L13 HydrophobicContact CG-CD1 4.33Å; M9-L13 PolarHBondContact O-N 3.49Å
10	C	60.7	Low	62.5	Low	63 Å²	63	117.1 Å²	117.1	43%	0.426	56%	0.56	S	S	.	*	H	α-helix	trans	-62.3	-40.2	174.7	-175.1	0	0	0	0	112.2	Q6 V7 R8 K14	Q6-C10 WeakPolarHBondContact O-CB 3.42Å; Q6-C10 PolarHBondContact O-N 3.49Å; V7-C10 PolarHBondContact O-N 3.47Å; R8-C10 VanDerWaalsContact C-N 3.34Å; R8-C10 PolarHBondContact O-N 3.4Å; C10-K14 WeakPolarHBondContact O-CB 3.27Å; C10-K14 VanDerWaalsContact O-CG 3.27Å; C10-K14 WeakPolarHBondContact O-CG 3.46Å; C10-K14 PolarHBondContact O-N 3.43Å
11	G	68	Low	62.7	Low	38 Å²	38	115.5 Å²	115.5	39%	0.392	55%	0.553	S	S	.	*	H	α-helix	trans	-62	-48.8	174.7	0	0	0	0	0	112.6	V7 R8 M9 L13 K14 E15	V7-G11 PolarHBondContact O-N 3.05Å; R8-G11 PolarHBondContact O-N 3.2Å; M9-G11 PolarHBondContact O-N 3.37Å; G11-L13 PolarHBondContact O-N 2.88Å; G11-K14 PolarHBondContact O-N 3Å; G11-E15 PolarHBondContact O-N 2.94Å
12	I	69.1	Low	63.1	Low	116 Å²	116	109 Å²	109	60%	0.595	53%	0.531	S	S	*	.	H	α-helix	trans	-61.1	-45.5	179.3	-64.9	165	0	0	0	111.1	R8 M9 K14 E15 F16	R8-I12 WeakPolarHBondContact O-CG1 3.35Å; R8-I12 PolarHBondContact O-N 3.23Å; M9-I12 PolarHBondContact O-N 3.06Å; I12-K14 VanDerWaalsContact C-N 3.33Å; I12-K14 PolarHBondContact O-N 3.04Å; I12-E15 PolarHBondContact O-N 3.15Å; I12-F16 WeakPolarHBondContact O-CB 2.95Å; I12-F16 PolarHBondContact O-N 3.29Å
13	L	62.8	Low	63.5	Low	101 Å²	101	105.4 Å²	105.4	53%	0.529	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-40.8	177.8	-106.7	117.4	0	0	0	112.2	M9 G11 F16 I17	M9-L13 HydrophobicContact CG-CD1 4.33Å; M9-L13 PolarHBondContact O-N 3.49Å; G11-L13 PolarHBondContact O-N 2.88Å; L13-F16 PolarHBondContact O-N 3.06Å; L13-I17 HydrophobicContact CD2-CD1 4.48Å; L13-I17 WeakPolarHBondContact O-CB 3.09Å; L13-I17 WeakPolarHBondContact O-CG1 3.49Å; L13-I17 PolarHBondContact O-N 3.44Å
14	K	64.9	Low	64	Low	120 Å²	120	95.4 Å²	95.4	52%	0.522	47%	0.471	S	S	.	.	H	α-helix	trans	-64.9	-43.7	177.4	-77.2	178.6	176.5	-166.8	0	112.1	C10 G11 I12 F16 I17 R18	C10-K14 WeakPolarHBondContact O-CB 3.27Å; C10-K14 VanDerWaalsContact O-CG 3.27Å; C10-K14 WeakPolarHBondContact O-CG 3.46Å; C10-K14 PolarHBondContact O-N 3.43Å; G11-K14 PolarHBondContact O-N 3Å; I12-K14 VanDerWaalsContact C-N 3.33Å; I12-K14 PolarHBondContact O-N 3.04Å; K14-F16 VanDerWaalsContact C-N 3.33Å; K14-I17 PolarHBondContact O-N 3.23Å; K14-R18 WeakPolarHBondContact O-CB 3.44Å; K14-R18 PolarHBondContact O-N 3.36Å
15	E	67.6	Low	64.2	Low	92 Å²	92	90.6 Å²	90.6	43%	0.43	45%	0.453	S	S	.	.	H	α-helix	trans	-64.5	-40.4	178.1	-161	-169.7	151.7	0	0	111.2	G11 I12 R18 K19	G11-E15 PolarHBondContact O-N 2.94Å; I12-E15 PolarHBondContact O-N 3.15Å; E15-R18 PolarHBondContact O-N 2.97Å; E15-K19 WeakPolarHBondContact O-CB 3.22Å; E15-K19 WeakPolarHBondContact O-CG 2.82Å; E15-K19 PolarHBondContact O-N 2.71Å; E15-K19 WeakPolarHBondContact OE1-CE 3.5Å; E15-K19 IonicContact OE1-NZ 2.71Å; E15-K19 PolarHBondContact OE1-NZ 3.33Å
16	F	65.5	Low	65	Low	132 Å²	132	85.3 Å²	85.3	58%	0.579	43%	0.43	S	S	*	.	H	α-helix	trans	-61.2	-52.1	173.9	-173.5	-95.9	0	0	0	111.3	I12 L13 K14 R18 K19 E20	I12-F16 WeakPolarHBondContact O-CB 2.95Å; I12-F16 PolarHBondContact O-N 3.29Å; L13-F16 PolarHBondContact O-N 3.06Å; K14-F16 VanDerWaalsContact C-N 3.33Å; F16-R18 VanDerWaalsContact C-N 3.28Å; F16-R18 PolarHBondContact O-N 3.45Å; F16-K19 PolarHBondContact O-N 2.99Å; F16-E20 WeakPolarHBondContact O-CB 3.32Å; F16-E20 PolarHBondContact O-N 3.05Å
17	I	67.6	Low	65.8	Low	84 Å²	84	81.5 Å²	81.5	43%	0.431	41%	0.413	S	S	.	.	H	α-helix	trans	-58.9	-41	177.3	-69.3	166.2	0	0	0	110.9	L13 K14 E20 M21	L13-I17 HydrophobicContact CD2-CD1 4.48Å; L13-I17 WeakPolarHBondContact O-CB 3.09Å; L13-I17 WeakPolarHBondContact O-CG1 3.49Å; L13-I17 PolarHBondContact O-N 3.44Å; K14-I17 PolarHBondContact O-N 3.23Å; I17-E20 PolarHBondContact O-N 2.99Å; I17-M21 HydrophobicContact CG2-CG 4.1Å; I17-M21 HydrophobicContact CG2-SD 3.79Å; I17-M21 WeakPolarHBondContact O-CB 3.4Å; I17-M21 WeakPolarHBondContact O-CG 3.39Å; I17-M21 PolarHBondContact O-N 3.4Å
18	R	67.3	Low	66	Low	96 Å²	96	81.4 Å²	81.4	36%	0.362	41%	0.406	S	S	.	.	H	α-helix	trans	-64.8	-46.9	179.1	-177.8	178.2	171.9	-166.5	-8.6	111.7	K14 E15 F16 E20 M21 A22 E38 E74	K14-R18 WeakPolarHBondContact O-CB 3.44Å; K14-R18 PolarHBondContact O-N 3.36Å; E15-R18 PolarHBondContact O-N 2.97Å; F16-R18 VanDerWaalsContact C-N 3.28Å; F16-R18 PolarHBondContact O-N 3.45Å; R18-E20 VanDerWaalsContact C-N 3.31Å; R18-E20 PolarHBondContact O-N 3.27Å; R18-M21 PolarHBondContact O-N 2.9Å; R18-A22 VanDerWaalsContact O-CB 3.31Å; R18-A22 WeakPolarHBondContact O-CB 3.38Å; R18-A22 PolarHBondContact O-N 3.35Å; R18-E38 IonicContact NH2-OE1 2.99Å; R18-E38 PolarHBondContact NH2-OE1 2.93Å; R18-E74 WeakPolarHBondContact CD-OE1 3.38Å; R18-E74 IonicContact CZ-OE1 3.36Å; R18-E74 IonicContact NE-OE1 3.85Å; R18-E74 IonicContact NH1-OE1 2.91Å; R18-E74 PolarHBondContact NH1-OE1 3.34Å
19	K	69	Low	66.3	Low	112 Å²	112	77.2 Å²	77.2	49%	0.487	40%	0.398	S	S	.	.	H	α-helix	trans	-57.9	-46.9	175.4	-79.1	172.7	172.5	163	0	110.2	E15 F16 M21 A22 V23	E15-K19 WeakPolarHBondContact O-CB 3.22Å; E15-K19 WeakPolarHBondContact O-CG 2.82Å; E15-K19 PolarHBondContact O-N 2.71Å; E15-K19 WeakPolarHBondContact OE1-CE 3.5Å; E15-K19 IonicContact OE1-NZ 2.71Å; E15-K19 PolarHBondContact OE1-NZ 3.33Å; F16-K19 PolarHBondContact O-N 2.99Å; K19-M21 PolarHBondContact O-N 3.27Å; K19-A22 PolarHBondContact O-N 3.23Å; K19-V23 WeakPolarHBondContact O-CB 3.21Å; K19-V23 VanDerWaalsContact O-CG2 3.25Å; K19-V23 WeakPolarHBondContact O-CG2 3.41Å; K19-V23 PolarHBondContact O-N 3.23Å
20	E	68.4	Low	66.7	Low	79 Å²	79	78.5 Å²	78.5	37%	0.369	41%	0.407	S	S	.	.	H	α-helix	trans	-61.7	-45.2	178	-150.1	74.5	174.6	0	0	112.2	F16 I17 R18 V23 N24	F16-E20 WeakPolarHBondContact O-CB 3.32Å; F16-E20 PolarHBondContact O-N 3.05Å; I17-E20 PolarHBondContact O-N 2.99Å; R18-E20 VanDerWaalsContact C-N 3.31Å; R18-E20 PolarHBondContact O-N 3.27Å; E20-V23 PolarHBondContact O-N 3.1Å; E20-N24 WeakPolarHBondContact O-CB 3.25Å; E20-N24 PolarHBondContact O-N 3.26Å; E20-N24 PolarHBondContact O-ND2 3.03Å; E20-N24 VanDerWaalsContact O-ND2 3.07Å
21	M	66.8	Low	67.5	Low	84 Å²	84	80.9 Å²	80.9	41%	0.414	41%	0.41	S	S	.	.	H	α-helix	trans	-67.5	-37.4	179.2	-73.6	-174.9	90.7	0	0	112.6	I17 R18 K19 T25	I17-M21 HydrophobicContact CG2-CG 4.1Å; I17-M21 HydrophobicContact CG2-SD 3.79Å; I17-M21 WeakPolarHBondContact O-CB 3.4Å; I17-M21 WeakPolarHBondContact O-CG 3.39Å; I17-M21 PolarHBondContact O-N 3.4Å; R18-M21 PolarHBondContact O-N 2.9Å; K19-M21 PolarHBondContact O-N 3.27Å; M21-T25 WeakPolarHBondContact O-CB 3.44Å; M21-T25 PolarHBondContact O-N 3.35Å; M21-T25 PolarHBondContact O-OG1 3.43Å
22	A	67.8	Low	68.4	Low	59 Å²	59	79.9 Å²	79.9	49%	0.488	40%	0.396	S	S	.	.	H	α-helix	trans	-66.3	-45.5	176.2	0	0	0	0	0	110.8	R18 K19 T25 A26	R18-A22 VanDerWaalsContact O-CB 3.31Å; R18-A22 WeakPolarHBondContact O-CB 3.38Å; R18-A22 PolarHBondContact O-N 3.35Å; K19-A22 PolarHBondContact O-N 3.23Å; A22-T25 PolarHBondContact O-N 3.05Å; A22-A26 WeakPolarHBondContact O-CB 3.46Å; A22-A26 PolarHBondContact O-N 3.44Å
23	V	67.7	Low	69.4	Low	31 Å²	31	76.8 Å²	76.8	19%	0.188	39%	0.385	C	S	.	.	H	α-helix	trans	-59.6	-50.7	174.2	169.2	0	0	0	0	110.4	K19 E20 T25 A26 I27	K19-V23 WeakPolarHBondContact O-CB 3.21Å; K19-V23 VanDerWaalsContact O-CG2 3.25Å; K19-V23 WeakPolarHBondContact O-CG2 3.41Å; K19-V23 PolarHBondContact O-N 3.23Å; E20-V23 PolarHBondContact O-N 3.1Å; V23-T25 VanDerWaalsContact C-N 3.27Å; V23-T25 PolarHBondContact O-N 3.16Å; V23-A26 PolarHBondContact O-N 3.42Å; V23-A26 VanDerWaalsContact O-N 3.1Å; V23-I27 HydrophobicContact CG1-CD1 3.6Å; V23-I27 HydrophobicContact CG1-CG1 4.35Å; V23-I27 VanDerWaalsContact O-CG1 3.24Å; V23-I27 WeakPolarHBondContact O-CG1 3.5Å; V23-I27 PolarHBondContact O-N 2.93Å
24	N	67.2	Low	70.8	Confident	8 Å²	8	72 Å²	72	4%	0.043	36%	0.36	C	S	.	.	H	α-helix	trans	-57.9	-40.5	177.6	-73.5	-31.5	0	0	0	112.1	E20 I27 F28 M127 L138	E20-N24 WeakPolarHBondContact O-CB 3.25Å; E20-N24 PolarHBondContact O-N 3.26Å; E20-N24 PolarHBondContact O-ND2 3.03Å; E20-N24 VanDerWaalsContact O-ND2 3.07Å; N24-I27 PolarHBondContact O-N 3.18Å; N24-F28 WeakPolarHBondContact O-CD2 3.31Å; N24-F28 PolarHBondContact O-N 3.26Å; N24-F28 VanDerWaalsContact O-N 3.15Å; N24-M127 WeakPolarHBondContact OD1-CE 3.49Å; N24-L138 WeakPolarHBondContact ND2-CD1 3.44Å
25	T	64.7	Low	72.2	Confident	48 Å²	48	66.9 Å²	66.9	29%	0.294	34%	0.339	S	S	.	.	H	α-helix	trans	-68.4	-39.5	177.9	-53.1	0	0	0	0	111.8	M21 A22 V23 I27 N29 R142	M21-T25 WeakPolarHBondContact O-CB 3.44Å; M21-T25 PolarHBondContact O-N 3.35Å; M21-T25 PolarHBondContact O-OG1 3.43Å; A22-T25 PolarHBondContact O-N 3.05Å; V23-T25 VanDerWaalsContact C-N 3.27Å; V23-T25 PolarHBondContact O-N 3.16Å; T25-I27 VanDerWaalsContact C-N 3.34Å; T25-N29 WeakPolarHBondContact O-CB 3.35Å; T25-N29 PolarHBondContact O-N 2.93Å; T25-N29 VanDerWaalsContact O-N 3.07Å; T25-R142 PolarHBondContact OG1-NH2 3.12Å; T25-R142 VanDerWaalsContact OG1-NH2 3.12Å
26	A	67.3	Low	73.4	Confident	11 Å²	11	62.5 Å²	62.5	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-65.7	-38.2	176.2	0	0	0	0	0	111.7	A22 V23 N29 D30 K31 V123	A22-A26 WeakPolarHBondContact O-CB 3.46Å; A22-A26 PolarHBondContact O-N 3.44Å; V23-A26 PolarHBondContact O-N 3.42Å; V23-A26 VanDerWaalsContact O-N 3.1Å; A26-N29 PolarHBondContact O-N 3.08Å; A26-D30 VanDerWaalsContact O-CA 3.22Å; A26-D30 WeakPolarHBondContact O-CA 3.4Å; A26-D30 PolarHBondContact O-N 3.04Å; A26-K31 WeakPolarHBondContact CA-O 3.27Å; A26-K31 WeakPolarHBondContact CB-O 3.04Å; A26-K31 PolarHBondContact O-N 3.38Å; A26-K31 VanDerWaalsContact O-N 3.16Å; A26-V123 HydrophobicContact CB-CG2 3.71Å
27	I	67.4	Low	74.7	Confident	48 Å²	48	57.4 Å²	57.4	25%	0.246	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-44.8	178	-69.2	168.9	0	0	0	111.4	V23 N24 T25 M127	V23-I27 HydrophobicContact CG1-CD1 3.6Å; V23-I27 HydrophobicContact CG1-CG1 4.35Å; V23-I27 VanDerWaalsContact O-CG1 3.24Å; V23-I27 WeakPolarHBondContact O-CG1 3.5Å; V23-I27 PolarHBondContact O-N 2.93Å; N24-I27 PolarHBondContact O-N 3.18Å; T25-I27 VanDerWaalsContact C-N 3.34Å; I27-M127 HydrophobicContact CD1-CE 3.24Å; I27-M127 HydrophobicContact CD1-CG 4.18Å; I27-M127 HydrophobicContact CD1-SD 3.72Å; I27-M127 HydrophobicContact CG2-SD 4.15Å
28	F	65.9	Low	75.9	Confident	82 Å²	82	55.7 Å²	55.7	36%	0.36	29%	0.288	S	S	.	.	H	α-helix	trans	-74.4	-27.9	179	-75.9	-65.9	0	0	0	114.1	N24 A135 M136 E139	N24-F28 WeakPolarHBondContact O-CD2 3.31Å; N24-F28 PolarHBondContact O-N 3.26Å; N24-F28 VanDerWaalsContact O-N 3.15Å; F28-A135 VanDerWaalsContact CE2-C 3.45Å; F28-A135 HydrophobicContact CE2-CB 3.54Å; F28-A135 WeakPolarHBondContact CE2-O 3.33Å; F28-A135 VanDerWaalsContact CZ-C 3.4Å; F28-A135 HydrophobicContact CZ-CB 3.69Å; F28-A135 WeakPolarHBondContact CZ-O 3.35Å; F28-M136 HydrophobicContact CZ-CG 4.26Å; F28-E139 HydrophobicContact CD2-CB 4.37Å; F28-E139 HydrophobicContact CE2-CB 4.1Å; F28-E139 HydrophobicContact CZ-CB 4.31Å
29	N	68.2	Low	77.1	Confident	105 Å²	105	51.1 Å²	51.1	56%	0.561	27%	0.271	S	S	*	.	H	α-helix	trans	-100.2	-0.7	-178	-67.7	-17.4	0	0	0	113.6	T25 A26 K31	T25-N29 WeakPolarHBondContact O-CB 3.35Å; T25-N29 PolarHBondContact O-N 2.93Å; T25-N29 VanDerWaalsContact O-N 3.07Å; A26-N29 PolarHBondContact O-N 3.08Å; N29-K31 HydrophobicContact CB-CB 4.4Å; N29-K31 VanDerWaalsContact O-CG 3.26Å; N29-K31 WeakPolarHBondContact O-CG 3.49Å; N29-K31 PolarHBondContact O-N 2.71Å; N29-K31 VanDerWaalsContact O-N 3.12Å
30	D	66.6	Low	78.2	Confident	139 Å²	139	46 Å²	46	74%	0.743	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.8	33.5	-172.9	-153.6	20.9	0	0	0	113.3	A26	A26-D30 VanDerWaalsContact O-CA 3.22Å; A26-D30 WeakPolarHBondContact O-CA 3.4Å; A26-D30 PolarHBondContact O-N 3.04Å
31	K	78	Confident	79.3	Confident	113 Å²	113	47.9 Å²	47.9	49%	0.491	26%	0.259	S	S	.	.			trans	-136.3	107.6	-170.4	-77.6	174.4	-172.2	-176.9	0	111	A26 N29	A26-K31 WeakPolarHBondContact CA-O 3.27Å; A26-K31 WeakPolarHBondContact CB-O 3.04Å; A26-K31 PolarHBondContact O-N 3.38Å; A26-K31 VanDerWaalsContact O-N 3.16Å; N29-K31 HydrophobicContact CB-CB 4.4Å; N29-K31 VanDerWaalsContact O-CG 3.26Å; N29-K31 WeakPolarHBondContact O-CG 3.49Å; N29-K31 PolarHBondContact O-N 2.71Å; N29-K31 VanDerWaalsContact O-N 3.12Å
32	V	86.9	Confident	80.4	Confident	17 Å²	17	45.7 Å²	45.7	10%	0.103	25%	0.248	C	C	.	.			trans	-67.5	142.4	163.3	177.1	0	0	0	0	109.5	G90 W116 L119 E120 V123	V32-G90 PolarHBondContact O-N 2.88Å; V32-W116 HydrophobicContact CB-CE3 4.26Å; V32-W116 HydrophobicContact CB-CZ3 3.85Å; V32-W116 HydrophobicContact CG1-CE3 3.58Å; V32-W116 HydrophobicContact CG1-CH2 4.42Å; V32-W116 HydrophobicContact CG1-CZ3 3.42Å; V32-W116 VanDerWaalsContact CG1-CZ3 3.42Å; V32-L119 HydrophobicContact CB-CB 4.44Å; V32-L119 HydrophobicContact CG1-CB 3.26Å; V32-L119 HydrophobicContact CG1-CD1 3.64Å; V32-L119 HydrophobicContact CG1-CG 4Å; V32-L119 HydrophobicContact CG2-CB 4.32Å; V32-E120 HydrophobicContact CG2-CG 4.23Å; V32-V123 HydrophobicContact CG2-CB 4.39Å; V32-V123 HydrophobicContact CG2-CG2 3.69Å
33	S	90.7	Very high	81.4	Confident	51 Å²	51	43.2 Å²	43.2	36%	0.357	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	155.9	175.8	67.8	0	0	0	0	113.1	F88	S33-F88 CarbonylContact C-O 3.54Å; S33-F88 WeakPolarHBondContact CA-O 3.38Å; S33-F88 WeakPolarHBondContact CB-O 3.22Å
34	M	91.2	Very high	82.4	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	135.4	171.9	-167.7	-178.4	-49.8	0	0	109.7	E38 I39 F88 L112 R115 W116 L119	M34-E38 WeakPolarHBondContact CA-OE2 3.37Å; M34-E38 HydrophobicContact CG-CB 4Å; M34-I39 HydrophobicContact CG-CG1 4.03Å; M34-I39 HydrophobicContact SD-CG1 3.64Å; M34-F88 PolarHBondContact N-O 3.11Å; M34-F88 WeakPolarHBondContact O-CB 3.44Å; M34-F88 PolarHBondContact O-N 3.37Å; M34-L112 HydrophobicContact SD-CD1 4.43Å; M34-L112 HydrophobicContact SD-CG 4.45Å; M34-R115 HydrophobicContact CE-CB 3.94Å; M34-R115 HydrophobicContact CE-CG 3.37Å; M34-R115 HydrophobicContact SD-CG 4.25Å; M34-W116 HydrophobicContact CB-CH2 4.5Å; M34-W116 HydrophobicContact CB-CZ2 3.94Å; M34-W116 HydrophobicContact CE-CD2 4.15Å; M34-W116 HydrophobicContact CE-CG 4.03Å; M34-W116 HydrophobicContact CE-CZ2 4.44Å; M34-L119 HydrophobicContact CE-CD1 4.06Å
35	T	93.7	Very high	83.4	Confident	12 Å²	12	46.3 Å²	46.3	7%	0.074	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	154.4	-179.4	68.8	0	0	0	0	111.9	V37 E38 I39 V71 Y86 I87	T35-V37 PolarHBondContact O-N 3.11Å; T35-V37 VanDerWaalsContact O-N 3.14Å; T35-E38 PolarHBondContact N-OE2 2.81Å; T35-E38 PolarHBondContact O-N 2.92Å; T35-E38 VanDerWaalsContact O-N 3.1Å; T35-E38 VanDerWaalsContact OG1-CG 3.31Å; T35-E38 WeakPolarHBondContact OG1-CG 3.45Å; T35-E38 PolarHBondContact OG1-N 3.4Å; T35-E38 PolarHBondContact OG1-OE2 3.16Å; T35-I39 WeakPolarHBondContact O-CG1 3.45Å; T35-I39 PolarHBondContact O-N 3.19Å; T35-V71 HydrophobicContact CG2-CG2 4.35Å; T35-Y86 CarbonylContact C-O 3.43Å; T35-Y86 WeakPolarHBondContact CA-O 3.33Å; T35-I87 HydrophobicContact CG2-CG1 4.5Å
36	S	94.4	Very high	84.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-25.4	172	53.8	0	0	0	0	114.1	A40 H47 A85 Y86	S36-A40 WeakPolarHBondContact O-CB 3.36Å; S36-A40 PolarHBondContact O-N 3.48Å; S36-H47 PolarHBondContact O-CD2 3.26Å; S36-H47 PolarHBondContact OG-NE2 3.27Å; S36-A85 WeakPolarHBondContact OG-CA 3.47Å; S36-A85 WeakPolarHBondContact OG-CB 3.31Å; S36-Y86 PolarHBondContact N-O 3.22Å; S36-Y86 PolarHBondContact OG-N 3.33Å
37	V	92.8	Very high	85.7	Confident	26 Å²	26	52.4 Å²	52.4	16%	0.158	29%	0.285	C	S	.	.	H	α-helix	trans	-71.5	-48.1	174.5	177	0	0	0	0	109.9	T35 I39 A40 E41 A85	T35-V37 PolarHBondContact O-N 3.11Å; T35-V37 VanDerWaalsContact O-N 3.14Å; V37-I39 VanDerWaalsContact C-N 3.29Å; V37-I39 PolarHBondContact O-N 3.23Å; V37-A40 WeakPolarHBondContact O-CB 3.29Å; V37-A40 PolarHBondContact O-N 3.11Å; V37-A40 VanDerWaalsContact O-N 3.08Å; V37-E41 WeakPolarHBondContact O-CG 3.37Å; V37-E41 PolarHBondContact O-N 3.02Å; V37-A85 HydrophobicContact CG2-CB 3.85Å
38	E	91.1	Very high	86.9	Confident	48 Å²	48	52 Å²	52	22%	0.224	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-39.1	175.4	-70.7	161.9	168	0	0	111.5	R18 M34 T35 E41 L42	R18-E38 IonicContact NH2-OE1 2.99Å; R18-E38 PolarHBondContact NH2-OE1 2.93Å; M34-E38 WeakPolarHBondContact CA-OE2 3.37Å; M34-E38 HydrophobicContact CG-CB 4Å; T35-E38 PolarHBondContact N-OE2 2.81Å; T35-E38 PolarHBondContact O-N 2.92Å; T35-E38 VanDerWaalsContact O-N 3.1Å; T35-E38 VanDerWaalsContact OG1-CG 3.31Å; T35-E38 WeakPolarHBondContact OG1-CG 3.45Å; T35-E38 PolarHBondContact OG1-N 3.4Å; T35-E38 PolarHBondContact OG1-OE2 3.16Å; E38-E41 PolarHBondContact O-N 2.91Å; E38-L42 WeakPolarHBondContact O-CB 3.28Å; E38-L42 PolarHBondContact O-N 3.44Å
39	I	92.6	Very high	88.1	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-47.2	173.1	-66.8	170.1	0	0	0	110.4	M34 T35 V37 E41 L42 V43 V50 F88 V101 L112	M34-I39 HydrophobicContact CG-CG1 4.03Å; M34-I39 HydrophobicContact SD-CG1 3.64Å; T35-I39 WeakPolarHBondContact O-CG1 3.45Å; T35-I39 PolarHBondContact O-N 3.19Å; V37-I39 VanDerWaalsContact C-N 3.29Å; V37-I39 PolarHBondContact O-N 3.23Å; I39-E41 VanDerWaalsContact C-N 3.33Å; I39-E41 PolarHBondContact O-N 3.43Å; I39-L42 PolarHBondContact O-N 3.49Å; I39-V43 WeakPolarHBondContact O-CG1 3.43Å; I39-V43 VanDerWaalsContact O-CG2 3.31Å; I39-V43 WeakPolarHBondContact O-CG2 3.43Å; I39-V43 PolarHBondContact O-N 2.85Å; I39-V50 HydrophobicContact CB-CG1 4.47Å; I39-V50 HydrophobicContact CG2-CG1 4.07Å; I39-F88 HydrophobicContact CD1-CD2 3.54Å; I39-F88 HydrophobicContact CD1-CE2 3.46Å; I39-F88 VanDerWaalsContact CD1-CE2 3.46Å; I39-F88 HydrophobicContact CD1-CG 4.41Å; I39-F88 HydrophobicContact CD1-CZ 4.26Å; I39-V101 HydrophobicContact CG2-CG2 3.59Å; I39-L112 HydrophobicContact CG1-CD1 4.2Å; I39-L112 HydrophobicContact CG2-CD1 4.37Å
40	A	92.4	Very high	89.3	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.033	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-43.1	179.9	0	0	0	0	0	111.9	S36 V37 G44 S45 H47 V50	S36-A40 WeakPolarHBondContact O-CB 3.36Å; S36-A40 PolarHBondContact O-N 3.48Å; V37-A40 WeakPolarHBondContact O-CB 3.29Å; V37-A40 PolarHBondContact O-N 3.11Å; V37-A40 VanDerWaalsContact O-N 3.08Å; A40-G44 PolarHBondContact O-N 3.39Å; A40-S45 PolarHBondContact O-N 3.32Å; A40-H47 HydrophobicContact CB-CB 4.1Å; A40-V50 HydrophobicContact CB-CB 4.44Å; A40-V50 HydrophobicContact CB-CG2 3.73Å
41	E	91	Very high	90.6	Very high	119 Å²	119	44.3 Å²	44.3	56%	0.556	25%	0.249	S	C	*	.	H	α-helix	trans	-63.1	-45.9	175	-70.9	174	179.6	0	0	111.8	V37 E38 I39 V43 G44	V37-E41 WeakPolarHBondContact O-CG 3.37Å; V37-E41 PolarHBondContact O-N 3.02Å; E38-E41 PolarHBondContact O-N 2.91Å; I39-E41 VanDerWaalsContact C-N 3.33Å; I39-E41 PolarHBondContact O-N 3.43Å; E41-V43 VanDerWaalsContact C-N 3.32Å; E41-V43 PolarHBondContact O-N 3.33Å; E41-G44 PolarHBondContact O-N 3.07Å
42	L	90.3	Very high	91.4	Very high	38 Å²	38	42.3 Å²	42.3	20%	0.199	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-36.4	-177.6	-175.2	147.6	0	0	0	112.9	E38 I39 R111 L112 R115	E38-L42 WeakPolarHBondContact O-CB 3.28Å; E38-L42 PolarHBondContact O-N 3.44Å; I39-L42 PolarHBondContact O-N 3.49Å; L42-R111 HydrophobicContact CD2-CB 3.68Å; L42-R111 HydrophobicContact CG-CB 4.31Å; L42-L112 HydrophobicContact CD2-CB 4.02Å; L42-R115 HydrophobicContact CD1-CB 3.51Å; L42-R115 HydrophobicContact CD1-CG 3.74Å
43	V	89.4	Confident	91.7	Very high	6 Å²	6	42.5 Å²	42.5	4%	0.036	25%	0.245	C	C	.	.	H	α-helix	trans	-94.4	-1.8	178.6	-50.4	0	0	0	0	113.5	I39 E41 S45 V101 F108	I39-V43 WeakPolarHBondContact O-CG1 3.43Å; I39-V43 VanDerWaalsContact O-CG2 3.31Å; I39-V43 WeakPolarHBondContact O-CG2 3.43Å; I39-V43 PolarHBondContact O-N 2.85Å; E41-V43 VanDerWaalsContact C-N 3.32Å; E41-V43 PolarHBondContact O-N 3.33Å; V43-S45 VanDerWaalsContact C-N 3.31Å; V43-S45 PolarHBondContact O-N 3.39Å; V43-V101 HydrophobicContact CG1-CB 4.43Å; V43-V101 HydrophobicContact CG1-CG1 3.81Å; V43-V101 HydrophobicContact CG1-CG2 3.71Å; V43-F108 HydrophobicContact CB-CB 4.06Å; V43-F108 HydrophobicContact CB-CD1 4.41Å; V43-F108 HydrophobicContact CB-CG 4.1Å; V43-F108 HydrophobicContact CG1-CB 3.79Å; V43-F108 HydrophobicContact CG1-CG 4.37Å
44	G	87.6	Confident	92	Very high	73 Å²	73	40.1 Å²	40.1	75%	0.753	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	29.4	-177.6	0	0	0	0	0	114.4	A40 E41	A40-G44 PolarHBondContact O-N 3.39Å; E41-G44 PolarHBondContact O-N 3.07Å
45	S	88.3	Confident	92.2	Very high	31 Å²	31	43.6 Å²	43.6	22%	0.217	24%	0.244	C	C	.	.			trans	-105.5	161.2	-180	-169.6	0	0	0	0	111.9	A40 V43	A40-S45 PolarHBondContact O-N 3.32Å; V43-S45 VanDerWaalsContact C-N 3.31Å; V43-S45 PolarHBondContact O-N 3.39Å
46	Q	90	Very high	92.3	Very high	145 Å²	145	50.4 Å²	50.4	68%	0.678	27%	0.269	S	S	*	.			trans	-70.5	133	170.9	-66.4	-175.9	2.2	0	0	109.9	G48 N49 V50	Q46-G48 PolarHBondContact O-N 2.93Å; Q46-G48 VanDerWaalsContact O-N 3.11Å; Q46-N49 WeakPolarHBondContact O-CB 3.31Å; Q46-N49 PolarHBondContact O-N 3.39Å; Q46-V50 PolarHBondContact O-N 3.45Å
47	H	91.5	Very high	92.4	Very high	43 Å²	43	51 Å²	51	20%	0.199	27%	0.271	C	S	.	.	H	α-helix	trans	-53	-35.6	178.8	177.3	-117	0	0	0	113.3	S36 A40 N49 V50 R51 N84	S36-H47 PolarHBondContact O-CD2 3.26Å; S36-H47 PolarHBondContact OG-NE2 3.27Å; A40-H47 HydrophobicContact CB-CB 4.1Å; H47-N49 VanDerWaalsContact C-N 3.33Å; H47-N49 PolarHBondContact O-N 2.91Å; H47-V50 PolarHBondContact O-N 2.88Å; H47-R51 WeakPolarHBondContact O-CB 3.4Å; H47-R51 PolarHBondContact O-N 3.46Å; H47-N84 PolarHBondContact CE1-O 3.23Å
48	G	91.9	Very high	92.6	Very high	39 Å²	39	50.8 Å²	50.8	40%	0.402	27%	0.273	S	S	.	.	H	α-helix	trans	-58.6	-40	174.4	0	0	0	0	0	113.7	Q46 R51 I52	Q46-G48 PolarHBondContact O-N 2.93Å; Q46-G48 VanDerWaalsContact O-N 3.11Å; G48-R51 PolarHBondContact O-N 2.93Å; G48-I52 VanDerWaalsContact O-CG1 3.27Å; G48-I52 WeakPolarHBondContact O-CG1 3.49Å; G48-I52 PolarHBondContact O-N 3.04Å
49	N	91.8	Very high	92.8	Very high	75 Å²	75	57.7 Å²	57.7	40%	0.401	30%	0.302	S	S	.	.	H	α-helix	trans	-67.7	-42.5	177.6	-68.3	-19.5	0	0	0	111.2	Q46 H47 R51 I52 S53	Q46-N49 WeakPolarHBondContact O-CB 3.31Å; Q46-N49 PolarHBondContact O-N 3.39Å; H47-N49 VanDerWaalsContact C-N 3.33Å; H47-N49 PolarHBondContact O-N 2.91Å; N49-R51 VanDerWaalsContact C-N 3.34Å; N49-R51 PolarHBondContact O-N 3.46Å; N49-I52 PolarHBondContact O-N 3.5Å; N49-S53 PolarHBondContact O-N 2.88Å; N49-S53 PolarHBondContact O-OG 3.32Å
50	V	93.4	Very high	92.9	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-60	-47.3	175.9	179.8	0	0	0	0	110.3	I39 A40 Q46 H47 I52 S53 I54 V100 L104	I39-V50 HydrophobicContact CB-CG1 4.47Å; I39-V50 HydrophobicContact CG2-CG1 4.07Å; A40-V50 HydrophobicContact CB-CB 4.44Å; A40-V50 HydrophobicContact CB-CG2 3.73Å; Q46-V50 PolarHBondContact O-N 3.45Å; H47-V50 PolarHBondContact O-N 2.88Å; V50-I52 PolarHBondContact O-N 3.14Å; V50-S53 PolarHBondContact O-N 3.23Å; V50-I54 HydrophobicContact CG1-CD1 3.89Å; V50-I54 HydrophobicContact CG1-CG1 4.49Å; V50-I54 VanDerWaalsContact O-CG1 3.28Å; V50-I54 WeakPolarHBondContact O-CG1 3.28Å; V50-I54 PolarHBondContact O-N 2.94Å; V50-V100 HydrophobicContact CG1-CG1 4.31Å; V50-L104 HydrophobicContact CB-CD1 4.44Å; V50-L104 HydrophobicContact CG2-CD1 4.15Å
51	R	94.5	Very high	92.9	Very high	89 Å²	89	69.7 Å²	69.7	34%	0.336	37%	0.367	S	S	.	.	H	α-helix	trans	-58.6	-49.2	178.5	-170.1	-170.9	163.9	164.6	-3.9	112.6	H47 G48 N49 S53 I54 E55 Y86	H47-R51 WeakPolarHBondContact O-CB 3.4Å; H47-R51 PolarHBondContact O-N 3.46Å; G48-R51 PolarHBondContact O-N 2.93Å; N49-R51 VanDerWaalsContact C-N 3.34Å; N49-R51 PolarHBondContact O-N 3.46Å; R51-S53 VanDerWaalsContact C-N 3.27Å; R51-S53 PolarHBondContact O-N 3.35Å; R51-I54 WeakPolarHBondContact O-CB 3.42Å; R51-I54 PolarHBondContact O-N 3.45Å; R51-E55 IonicContact CZ-OE1 3.71Å; R51-E55 IonicContact NE-OE1 2.75Å; R51-E55 PolarHBondContact NE-OE1 3.12Å; R51-E55 IonicContact NH2-OE1 3.92Å; R51-E55 PolarHBondContact NH2-OE1 3.27Å; R51-E55 WeakPolarHBondContact O-CG 3.32Å; R51-E55 PolarHBondContact O-N 2.75Å; R51-Y86 HydrophobicContact CG-CD2 4.18Å; R51-Y86 HydrophobicContact CG-CE2 3.62Å
52	I	94.1	Very high	93.1	Very high	72 Å²	72	66.6 Å²	66.6	37%	0.369	36%	0.356	S	S	.	.	H	α-helix	trans	-59.7	-41.1	178.9	-70	165.8	0	0	0	110.6	G48 N49 V50 E55 R56	G48-I52 VanDerWaalsContact O-CG1 3.27Å; G48-I52 WeakPolarHBondContact O-CG1 3.49Å; G48-I52 PolarHBondContact O-N 3.04Å; N49-I52 PolarHBondContact O-N 3.5Å; V50-I52 PolarHBondContact O-N 3.14Å; I52-E55 PolarHBondContact O-N 3.01Å; I52-R56 HydrophobicContact CG2-CG 4.39Å; I52-R56 WeakPolarHBondContact O-CB 3.24Å; I52-R56 VanDerWaalsContact O-CG 3.28Å; I52-R56 WeakPolarHBondContact O-CG 3.25Å; I52-R56 PolarHBondContact O-N 3.43Å
53	S	93.7	Very high	93.3	Very high	21 Å²	21	65.2 Å²	65.2	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-40.1	177.7	-72.9	0	0	0	0	112.8	N49 V50 R51 R56 L57 L104	N49-S53 PolarHBondContact O-N 2.88Å; N49-S53 PolarHBondContact O-OG 3.32Å; V50-S53 PolarHBondContact O-N 3.23Å; R51-S53 VanDerWaalsContact C-N 3.27Å; R51-S53 PolarHBondContact O-N 3.35Å; S53-R56 PolarHBondContact O-N 3.04Å; S53-L57 WeakPolarHBondContact O-CB 3.28Å; S53-L57 VanDerWaalsContact O-CG 3.3Å; S53-L57 WeakPolarHBondContact O-CG 3.41Å; S53-L57 PolarHBondContact O-N 3.42Å; S53-L104 WeakPolarHBondContact OG-CD2 3.48Å
54	I	95.8	Very high	93.5	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-58.6	-50.9	173.8	-66.8	166.2	0	0	0	110.1	V50 R51 R56 L57 A58 I63 L65 P66 Y86 F88 V100	V50-I54 HydrophobicContact CG1-CD1 3.89Å; V50-I54 HydrophobicContact CG1-CG1 4.49Å; V50-I54 VanDerWaalsContact O-CG1 3.28Å; V50-I54 WeakPolarHBondContact O-CG1 3.28Å; V50-I54 PolarHBondContact O-N 2.94Å; R51-I54 WeakPolarHBondContact O-CB 3.42Å; R51-I54 PolarHBondContact O-N 3.45Å; I54-R56 VanDerWaalsContact C-N 3.33Å; I54-R56 PolarHBondContact O-N 3.48Å; I54-L57 PolarHBondContact O-N 2.87Å; I54-A58 VanDerWaalsContact O-CB 3.32Å; I54-A58 WeakPolarHBondContact O-CB 3.4Å; I54-A58 PolarHBondContact O-N 3.24Å; I54-I63 HydrophobicContact CG2-CD1 4.11Å; I54-L65 HydrophobicContact CG2-CD1 4.3Å; I54-P66 HydrophobicContact CG2-CG 4.28Å; I54-Y86 HydrophobicContact CB-CD2 4.1Å; I54-Y86 HydrophobicContact CB-CE2 4.19Å; I54-Y86 HydrophobicContact CD1-CD2 3.7Å; I54-Y86 HydrophobicContact CD1-CG 4.25Å; I54-Y86 HydrophobicContact CG2-CD1 4.49Å; I54-Y86 HydrophobicContact CG2-CD2 3.73Å; I54-Y86 HydrophobicContact CG2-CE2 3.85Å; I54-Y86 HydrophobicContact CG2-CG 4.06Å; I54-F88 HydrophobicContact CD1-CE2 3.78Å; I54-F88 HydrophobicContact CD1-CZ 3.68Å; I54-F88 HydrophobicContact CG1-CZ 3.93Å; I54-V100 HydrophobicContact CG1-CG1 3.95Å; I54-V100 HydrophobicContact CG1-CG2 3.86Å
55	E	96.4	Very high	93.9	Very high	74 Å²	74	72.5 Å²	72.5	35%	0.346	37%	0.365	S	S	.	.	H	α-helix	trans	-60.5	-41.2	179.7	-69.8	172.6	-173.3	0	0	111.7	R51 I52 K59 Y86	R51-E55 IonicContact CZ-OE1 3.71Å; R51-E55 IonicContact NE-OE1 2.75Å; R51-E55 PolarHBondContact NE-OE1 3.12Å; R51-E55 IonicContact NH2-OE1 3.92Å; R51-E55 PolarHBondContact NH2-OE1 3.27Å; R51-E55 WeakPolarHBondContact O-CG 3.32Å; R51-E55 PolarHBondContact O-N 2.75Å; I52-E55 PolarHBondContact O-N 3.01Å; E55-K59 WeakPolarHBondContact O-CB 3.45Å; E55-K59 PolarHBondContact O-N 3.35Å; E55-Y86 HydrophobicContact CG-CE2 4.18Å; E55-Y86 VanDerWaalsContact CG-OH 3.25Å; E55-Y86 WeakPolarHBondContact CG-OH 3.41Å; E55-Y86 PolarHBondContact OE1-OH 3.01Å
56	R	95.8	Very high	94.2	Very high	156 Å²	156	72 Å²	72	59%	0.589	36%	0.361	S	S	*	.	H	α-helix	trans	-66.3	-44.7	176.7	-75	175.1	-176.9	177.1	3.1	112.8	I52 S53 I54 K59 R60	I52-R56 HydrophobicContact CG2-CG 4.39Å; I52-R56 WeakPolarHBondContact O-CB 3.24Å; I52-R56 VanDerWaalsContact O-CG 3.28Å; I52-R56 WeakPolarHBondContact O-CG 3.25Å; I52-R56 PolarHBondContact O-N 3.43Å; S53-R56 PolarHBondContact O-N 3.04Å; I54-R56 VanDerWaalsContact C-N 3.33Å; I54-R56 PolarHBondContact O-N 3.48Å; R56-K59 PolarHBondContact O-N 2.64Å; R56-R60 WeakPolarHBondContact O-CG 3.49Å; R56-R60 PolarHBondContact O-N 3.46Å; R56-R60 VanDerWaalsContact O-N 3.09Å
57	L	95.8	Very high	94.3	Very high	11 Å²	11	68 Å²	68	6%	0.058	35%	0.353	C	S	.	.	H	α-helix	trans	-67.7	-39.5	-179.9	-73.4	168.9	0	0	0	111.3	S53 I54 R60 G61 V62 I63 I99 V100 Q103	S53-L57 WeakPolarHBondContact O-CB 3.28Å; S53-L57 VanDerWaalsContact O-CG 3.3Å; S53-L57 WeakPolarHBondContact O-CG 3.41Å; S53-L57 PolarHBondContact O-N 3.42Å; I54-L57 PolarHBondContact O-N 2.87Å; L57-R60 PolarHBondContact O-N 3.38Å; L57-G61 PolarHBondContact O-N 2.77Å; L57-V62 HydrophobicContact CB-CB 4.46Å; L57-V62 HydrophobicContact CD2-CB 4.08Å; L57-V62 HydrophobicContact CD2-CG1 4.17Å; L57-V62 HydrophobicContact CD2-CG2 4.23Å; L57-V62 PolarHBondContact O-N 3.1Å; L57-I63 HydrophobicContact CB-CD1 3.72Å; L57-I63 HydrophobicContact CB-CG1 3.72Å; L57-I63 HydrophobicContact CB-CG2 4.39Å; L57-I63 HydrophobicContact CD1-CD1 4.48Å; L57-I99 HydrophobicContact CD1-CG2 4.35Å; L57-V100 HydrophobicContact CD1-CB 4.32Å; L57-V100 HydrophobicContact CD1-CG2 3.79Å; L57-Q103 HydrophobicContact CD1-CG 4.47Å; L57-Q103 HydrophobicContact CD2-CG 4.18Å
58	A	96.3	Very high	94.5	Very high	23 Å²	23	69.6 Å²	69.6	19%	0.19	36%	0.361	C	S	.	.	H	α-helix	trans	-63.7	-44	174	0	0	0	0	0	111.4	I54 R60 G61 I63 L65	I54-A58 VanDerWaalsContact O-CB 3.32Å; I54-A58 WeakPolarHBondContact O-CB 3.4Å; I54-A58 PolarHBondContact O-N 3.24Å; A58-R60 PolarHBondContact O-N 2.8Å; A58-G61 PolarHBondContact O-N 3.2Å; A58-I63 WeakPolarHBondContact CA-O 3.28Å; A58-I63 HydrophobicContact CB-CG1 4.13Å; A58-L65 HydrophobicContact CB-CB 3.91Å; A58-L65 HydrophobicContact CB-CD1 3.78Å; A58-L65 HydrophobicContact CB-CG 4.44Å
59	K	95.8	Very high	94.4	Very high	193 Å²	193	72.4 Å²	72.4	84%	0.839	36%	0.364	S	S	*	.	H	α-helix	trans	-60.8	-31.8	175.6	-173.9	176.3	-178.5	178.6	0	113	E55 R56 G61	E55-K59 WeakPolarHBondContact O-CB 3.45Å; E55-K59 PolarHBondContact O-N 3.35Å; R56-K59 PolarHBondContact O-N 2.64Å; K59-G61 VanDerWaalsContact C-N 3.28Å
60	R	95.2	Very high	94.3	Very high	190 Å²	190	76.5 Å²	76.5	72%	0.717	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-5.1	175.2	-71	177.1	179.7	-175.7	-0.2	113.5	R56 L57 A58 V62	R56-R60 WeakPolarHBondContact O-CG 3.49Å; R56-R60 PolarHBondContact O-N 3.46Å; R56-R60 VanDerWaalsContact O-N 3.09Å; L57-R60 PolarHBondContact O-N 3.38Å; A58-R60 PolarHBondContact O-N 2.8Å; R60-V62 VanDerWaalsContact C-N 3.26Å; R60-V62 HydrophobicContact CB-CG2 3.82Å; R60-V62 PolarHBondContact O-N 3.14Å
61	G	93	Very high	93.8	Very high	65 Å²	65	77.7 Å²	77.7	67%	0.67	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	16.3	-175.7	0	0	0	0	0	114.3	L57 A58 K59	L57-G61 PolarHBondContact O-N 2.77Å; A58-G61 PolarHBondContact O-N 3.2Å; K59-G61 VanDerWaalsContact C-N 3.28Å
62	V	94.5	Very high	93.1	Very high	55 Å²	55	77.8 Å²	77.8	33%	0.333	39%	0.39	S	S	.	.	S	Bend	trans	-77.7	-37.5	-179.5	-175.5	0	0	0	0	110.9	L57 R60 R95 I99	L57-V62 HydrophobicContact CB-CB 4.46Å; L57-V62 HydrophobicContact CD2-CB 4.08Å; L57-V62 HydrophobicContact CD2-CG1 4.17Å; L57-V62 HydrophobicContact CD2-CG2 4.23Å; L57-V62 PolarHBondContact O-N 3.1Å; R60-V62 VanDerWaalsContact C-N 3.26Å; R60-V62 HydrophobicContact CB-CG2 3.82Å; R60-V62 PolarHBondContact O-N 3.14Å; V62-R95 PolarHBondContact O-NH1 2.81Å; V62-R95 PolarHBondContact O-NH2 3.4Å; V62-I99 HydrophobicContact CG1-CG2 3.79Å
63	I	95	Very high	91.9	Very high	9 Å²	9	76.9 Å²	76.9	5%	0.046	39%	0.386	C	S	.	.	S	Bend	trans	-126.2	159.1	176.9	68	175.7	0	0	0	109.8	I54 L57 A58 D96 I99 V100	I54-I63 HydrophobicContact CG2-CD1 4.11Å; L57-I63 HydrophobicContact CB-CD1 3.72Å; L57-I63 HydrophobicContact CB-CG1 3.72Å; L57-I63 HydrophobicContact CB-CG2 4.39Å; L57-I63 HydrophobicContact CD1-CD1 4.48Å; A58-I63 WeakPolarHBondContact CA-O 3.28Å; A58-I63 HydrophobicContact CB-CG1 4.13Å; I63-D96 HydrophobicContact CB-CB 3.89Å; I63-D96 VanDerWaalsContact CB-CG 3.5Å; I63-D96 HydrophobicContact CG2-CB 3.87Å; I63-I99 HydrophobicContact CG2-CB 4.05Å; I63-I99 HydrophobicContact CG2-CD1 4.25Å; I63-I99 HydrophobicContact CG2-CG2 3.88Å; I63-V100 HydrophobicContact CD1-CG2 3.73Å
64	Q	93.6	Very high	90.3	Very high	135 Å²	135	80.7 Å²	80.7	63%	0.631	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-77.3	139.3	166.3	-173.2	173.7	6.7	0	0	109	P66 D96	Q64-P66 WeakPolarHBondContact O-CD 3.38Å; Q64-D96 PolarHBondContact N-OD2 2.87Å
65	L	95.2	Very high	88.5	Confident	97 Å²	97	88.3 Å²	88.3	51%	0.508	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-66	116.7	174.9	-172.8	66.2	0	0	0	109.1	I54 A58 Y86	I54-L65 HydrophobicContact CG2-CD1 4.3Å; A58-L65 HydrophobicContact CB-CB 3.91Å; A58-L65 HydrophobicContact CB-CD1 3.78Å; A58-L65 HydrophobicContact CB-CG 4.44Å; L65-Y86 HydrophobicContact CD1-CE1 3.78Å; L65-Y86 HydrophobicContact CG-CE1 4.25Å
66	P	94	Very high	86.6	Confident	20 Å²	20	86.1 Å²	86.1	13%	0.13	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-71.9	161.6	-178.6	-12.1	27.7	0	0	0	111.5	I54 Q64 Y86 I87 F88	I54-P66 HydrophobicContact CG2-CG 4.28Å; Q64-P66 WeakPolarHBondContact O-CD 3.38Å; P66-Y86 HydrophobicContact CB-CD1 4.32Å; P66-Y86 VanDerWaalsContact O-CD1 3.28Å; P66-Y86 WeakPolarHBondContact O-CD1 3.28Å; P66-I87 WeakPolarHBondContact CB-O 3.12Å; P66-F88 HydrophobicContact CG-CD1 3.93Å; P66-F88 HydrophobicContact CG-CE1 3.56Å; P66-F88 HydrophobicContact CG-CE2 4.31Å; P66-F88 HydrophobicContact CG-CG 4.47Å; P66-F88 HydrophobicContact CG-CZ 3.76Å
67	A	94	Very high	84.9	Confident	61 Å²	61	87.3 Å²	87.3	50%	0.504	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	139.2	175.1	0	0	0	0	0	110.5	Y86 I87	A67-Y86 CarbonylContact O-C 3.57Å; A67-Y86 WeakPolarHBondContact O-CA 3.32Å; A67-I87 PolarHBondContact O-N 3.21Å
68	M	94.3	Very high	83	Confident	76 Å²	76	90 Å²	90	37%	0.374	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.5	175.9	-173.3	178.7	-69.2	0	0	109.9	N84 A85 Y86	M68-N84 HydrophobicContact CG-CB 4.04Å; M68-N84 HydrophobicContact SD-CB 3.76Å; M68-A85 WeakPolarHBondContact CA-O 3.35Å; M68-Y86 HydrophobicContact CB-CD1 4.26Å; M68-Y86 HydrophobicContact CB-CE1 4.23Å; M68-Y86 HydrophobicContact CE-CD1 4.31Å; M68-Y86 HydrophobicContact CE-CE1 3.56Å; M68-Y86 HydrophobicContact CE-CE2 4Å; M68-Y86 VanDerWaalsContact CE-OH 3.32Å; M68-Y86 WeakPolarHBondContact CE-OH 3.3Å
69	Q	91.2	Very high	81.3	Confident	99 Å²	99	97.9 Å²	97.9	46%	0.463	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	157.1	175.7	-59.5	-172.1	14.4	0	0	110.9	V71 A85 I87	Q69-V71 PolarHBondContact O-N 3.44Å; Q69-A85 PolarHBondContact N-O 3.48Å; Q69-A85 PolarHBondContact O-N 2.85Å; Q69-I87 HydrophobicContact CB-CD1 3.83Å; Q69-I87 HydrophobicContact CB-CG1 4.3Å; Q69-I87 HydrophobicContact CG-CD1 3.64Å; Q69-I87 HydrophobicContact CG-CG1 4.19Å; Q69-I87 VanDerWaalsContact OE1-CD1 3.26Å
70	K	88.7	Confident	79.9	Confident	160 Å²	160	95.3 Å²	95.3	70%	0.696	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	115.6	172.8	-77.8	-176.8	178.4	-175.9	0	109.2	F82 N84	K70-F82 HydrophobicContact CB-CB 4.46Å; K70-N84 VanDerWaalsContact CG-OD1 3.24Å; K70-N84 WeakPolarHBondContact CG-OD1 3.42Å
71	V	83.8	Confident	79	Confident	26 Å²	26	88.7 Å²	88.7	16%	0.158	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	139.6	177.3	-177.5	0	0	0	0	108.9	T35 Q69 N73 F82 T83 A85	T35-V71 HydrophobicContact CG2-CG2 4.35Å; Q69-V71 PolarHBondContact O-N 3.44Å; V71-N73 PolarHBondContact O-N 3.47Å; V71-F82 CarbonylContact O-C 3.53Å; V71-F82 WeakPolarHBondContact O-CA 3.34Å; V71-T83 PolarHBondContact N-O 2.82Å; V71-T83 PolarHBondContact O-N 3.36Å; V71-A85 HydrophobicContact CB-CB 4.23Å; V71-A85 HydrophobicContact CG2-CB 3.73Å
72	E	78.8	Confident	78.4	Confident	91 Å²	91	91.5 Å²	91.5	43%	0.425	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	121.4	176.3	-165.2	174.9	177.1	0	0	110.4	K81 F82	E72-K81 CarbonylContact C-O 3.22Å; E72-K81 HydrophobicContact CG-CB 3.77Å; E72-K81 HydrophobicContact CG-CD 4.48Å; E72-K81 WeakPolarHBondContact OE1-CD 3.33Å; E72-F82 HydrophobicContact CB-CD1 4.24Å; E72-F82 HydrophobicContact CB-CE1 4.05Å; E72-F82 HydrophobicContact CG-CE1 4.26Å
73	N	69.2	Low	78	Confident	52 Å²	52	90.6 Å²	90.6	28%	0.278	45%	0.453	S	S	.	.			trans	-85.5	101	171.1	-174.4	-6.6	0	0	0	109.5	V71 Q75 S76 K81	V71-N73 PolarHBondContact O-N 3.47Å; N73-Q75 PolarHBondContact O-N 3.07Å; N73-Q75 PolarHBondContact OD1-N 3.5Å; N73-S76 PolarHBondContact O-N 3.07Å; N73-S76 PolarHBondContact O-OG 3.35Å; N73-K81 WeakPolarHBondContact CA-O 3.28Å; N73-K81 VanDerWaalsContact CB-O 3.25Å; N73-K81 WeakPolarHBondContact CB-O 3.44Å; N73-K81 PolarHBondContact N-O 2.95Å
74	E	60	Low	77.8	Confident	102 Å²	102	93.4 Å²	93.4	48%	0.477	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-16.8	-173.5	-60.5	179.3	-171	0	0	113.6	R18 S76	R18-E74 WeakPolarHBondContact CD-OE1 3.38Å; R18-E74 IonicContact CZ-OE1 3.36Å; R18-E74 IonicContact NE-OE1 3.85Å; R18-E74 IonicContact NH1-OE1 2.91Å; R18-E74 PolarHBondContact NH1-OE1 3.34Å; E74-S76 PolarHBondContact O-N 2.86Å
75	Q	58.6	Low	77.8	Confident	160 Å²	160	87 Å²	87	75%	0.748	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.4	178.1	-62	-173.2	-10.8	0	0	112.9	N73	N73-Q75 PolarHBondContact O-N 3.07Å; N73-Q75 PolarHBondContact OD1-N 3.5Å
76	S	55.6	Low	77.8	Confident	28 Å²	28	82.9 Å²	82.9	20%	0.196	42%	0.416	C	S	.	.			trans	-103.9	125.3	179.7	76.9	0	0	0	0	111.8	N73 E74 K81	N73-S76 PolarHBondContact O-N 3.07Å; N73-S76 PolarHBondContact O-OG 3.35Å; E74-S76 PolarHBondContact O-N 2.86Å; S76-K81 VanDerWaalsContact O-CD 3.22Å; S76-K81 WeakPolarHBondContact O-CD 3.25Å; S76-K81 WeakPolarHBondContact O-CE 3.44Å; S76-K81 WeakPolarHBondContact O-CG 3.32Å; S76-K81 VanDerWaalsContact OG-CA 3.32Å; S76-K81 WeakPolarHBondContact OG-CA 3.2Å
77	F	59.3	Low	77.8	Confident	181 Å²	181	82.8 Å²	82.8	79%	0.794	41%	0.414	S	S	*	.			trans	-83	-2.3	167.7	-71.3	-85.9	0	0	0	112.7
78	S	57.2	Low	77.8	Confident	67 Å²	67	79.9 Å²	79.9	47%	0.469	39%	0.39	S	S	.	.	S	Bend	trans	-69	163.6	-179.3	179.6	0	0	0	0	112.7	N80 K81	S78-N80 PolarHBondContact O-N 3.35Å; S78-N80 PolarHBondContact OG-N 3.33Å; S78-K81 WeakPolarHBondContact O-CE 3.49Å; S78-K81 WeakPolarHBondContact O-CG 3.43Å
79	Q	60.5	Low	77.7	Confident	189 Å²	189	80.5 Å²	80.5	88%	0.883	39%	0.392	S	S	*	.	S	Bend	trans	-66.3	-19.2	167.1	-73.4	176.4	-15.6	0	0	112.3	K81	Q79-K81 PolarHBondContact O-N 2.93Å
80	N	65.4	Low	77.7	Confident	139 Å²	139	76.9 Å²	76.9	74%	0.743	38%	0.381	S	S	*	.			trans	-82.4	42.3	176.2	-74.9	-8.6	0	0	0	113.1	S78 F82	S78-N80 PolarHBondContact O-N 3.35Å; S78-N80 PolarHBondContact OG-N 3.33Å; N80-F82 PolarHBondContact O-N 3.48Å
81	K	77.2	Confident	77.7	Confident	50 Å²	50	75.7 Å²	75.7	22%	0.217	38%	0.378	C	S	.	.			trans	-72.1	-16.5	-179.4	-47.2	-163.9	178.8	-172.4	0	113.4	E72 N73 S76 S78 Q79	E72-K81 CarbonylContact C-O 3.22Å; E72-K81 HydrophobicContact CG-CB 3.77Å; E72-K81 HydrophobicContact CG-CD 4.48Å; E72-K81 WeakPolarHBondContact OE1-CD 3.33Å; N73-K81 WeakPolarHBondContact CA-O 3.28Å; N73-K81 VanDerWaalsContact CB-O 3.25Å; N73-K81 WeakPolarHBondContact CB-O 3.44Å; N73-K81 PolarHBondContact N-O 2.95Å; S76-K81 VanDerWaalsContact O-CD 3.22Å; S76-K81 WeakPolarHBondContact O-CD 3.25Å; S76-K81 WeakPolarHBondContact O-CE 3.44Å; S76-K81 WeakPolarHBondContact O-CG 3.32Å; S76-K81 VanDerWaalsContact OG-CA 3.32Å; S76-K81 WeakPolarHBondContact OG-CA 3.2Å; S78-K81 WeakPolarHBondContact O-CE 3.49Å; S78-K81 WeakPolarHBondContact O-CG 3.43Å; Q79-K81 PolarHBondContact O-N 2.93Å
82	F	80.8	Confident	78.1	Confident	124 Å²	124	79.9 Å²	79.9	54%	0.544	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	122.7	-173.3	-60.5	-78.6	0	0	0	111.5	K70 V71 E72 N80	K70-F82 HydrophobicContact CB-CB 4.46Å; V71-F82 CarbonylContact O-C 3.53Å; V71-F82 WeakPolarHBondContact O-CA 3.34Å; E72-F82 HydrophobicContact CB-CD1 4.24Å; E72-F82 HydrophobicContact CB-CE1 4.05Å; E72-F82 HydrophobicContact CG-CE1 4.26Å; N80-F82 PolarHBondContact O-N 3.48Å
83	T	85	Confident	78.8	Confident	36 Å²	36	75.9 Å²	75.9	22%	0.221	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.3	171.5	-59.2	0	0	0	0	109.1	V71 A85	V71-T83 PolarHBondContact N-O 2.82Å; V71-T83 PolarHBondContact O-N 3.36Å; T83-A85 PolarHBondContact O-N 2.97Å
84	N	91.5	Very high	80	Confident	68 Å²	68	75.2 Å²	75.2	36%	0.364	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	118.5	171.6	-69.5	-25.8	0	0	0	109.5	H47 M68 K70	H47-N84 PolarHBondContact CE1-O 3.23Å; M68-N84 HydrophobicContact CG-CB 4.04Å; M68-N84 HydrophobicContact SD-CB 3.76Å; K70-N84 VanDerWaalsContact CG-OD1 3.24Å; K70-N84 WeakPolarHBondContact CG-OD1 3.42Å
85	A	93.5	Very high	81.6	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.4	179.8	0	0	0	0	0	110.7	S36 V37 M68 Q69 V71 T83	S36-A85 WeakPolarHBondContact OG-CA 3.47Å; S36-A85 WeakPolarHBondContact OG-CB 3.31Å; V37-A85 HydrophobicContact CG2-CB 3.85Å; M68-A85 WeakPolarHBondContact CA-O 3.35Å; Q69-A85 PolarHBondContact N-O 3.48Å; Q69-A85 PolarHBondContact O-N 2.85Å; V71-A85 HydrophobicContact CB-CB 4.23Å; V71-A85 HydrophobicContact CG2-CB 3.73Å; T83-A85 PolarHBondContact O-N 2.97Å
86	Y	95.9	Very high	83.3	Confident	12 Å²	12	68.7 Å²	68.7	5%	0.047	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	139.6	165.8	-69.8	-67.1	0	0	0	110.4	T35 S36 R51 I54 E55 L65 P66 A67 M68	T35-Y86 CarbonylContact C-O 3.43Å; T35-Y86 WeakPolarHBondContact CA-O 3.33Å; S36-Y86 PolarHBondContact N-O 3.22Å; S36-Y86 PolarHBondContact OG-N 3.33Å; R51-Y86 HydrophobicContact CG-CD2 4.18Å; R51-Y86 HydrophobicContact CG-CE2 3.62Å; I54-Y86 HydrophobicContact CB-CD2 4.1Å; I54-Y86 HydrophobicContact CB-CE2 4.19Å; I54-Y86 HydrophobicContact CD1-CD2 3.7Å; I54-Y86 HydrophobicContact CD1-CG 4.25Å; I54-Y86 HydrophobicContact CG2-CD1 4.49Å; I54-Y86 HydrophobicContact CG2-CD2 3.73Å; I54-Y86 HydrophobicContact CG2-CE2 3.85Å; I54-Y86 HydrophobicContact CG2-CG 4.06Å; E55-Y86 HydrophobicContact CG-CE2 4.18Å; E55-Y86 VanDerWaalsContact CG-OH 3.25Å; E55-Y86 WeakPolarHBondContact CG-OH 3.41Å; E55-Y86 PolarHBondContact OE1-OH 3.01Å; L65-Y86 HydrophobicContact CD1-CE1 3.78Å; L65-Y86 HydrophobicContact CG-CE1 4.25Å; P66-Y86 HydrophobicContact CB-CD1 4.32Å; P66-Y86 VanDerWaalsContact O-CD1 3.28Å; P66-Y86 WeakPolarHBondContact O-CD1 3.28Å; A67-Y86 CarbonylContact O-C 3.57Å; A67-Y86 WeakPolarHBondContact O-CA 3.32Å; M68-Y86 HydrophobicContact CB-CD1 4.26Å; M68-Y86 HydrophobicContact CB-CE1 4.23Å; M68-Y86 HydrophobicContact CE-CD1 4.31Å; M68-Y86 HydrophobicContact CE-CE1 3.56Å; M68-Y86 HydrophobicContact CE-CE2 4Å; M68-Y86 VanDerWaalsContact CE-OH 3.32Å; M68-Y86 WeakPolarHBondContact CE-OH 3.3Å
87	I	94.4	Very high	85.1	Confident	17 Å²	17	67.4 Å²	67.4	9%	0.087	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	118.9	176.2	-49.5	-164.4	0	0	0	109.6	T35 P66 A67 Q69 E89	T35-I87 HydrophobicContact CG2-CG1 4.5Å; P66-I87 WeakPolarHBondContact CB-O 3.12Å; A67-I87 PolarHBondContact O-N 3.21Å; Q69-I87 HydrophobicContact CB-CD1 3.83Å; Q69-I87 HydrophobicContact CB-CG1 4.3Å; Q69-I87 HydrophobicContact CG-CD1 3.64Å; Q69-I87 HydrophobicContact CG-CG1 4.19Å; Q69-I87 VanDerWaalsContact OE1-CD1 3.26Å; I87-E89 HydrophobicContact CB-CG 4.49Å; I87-E89 HydrophobicContact CG2-CG 3.55Å
88	F	93.9	Very high	86.7	Confident	1 Å²	1	60.9 Å²	60.9	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	119	171.6	-65.7	-92	0	0	0	108.4	S33 M34 I39 I54 P66 G93 D96 V100 W116	S33-F88 CarbonylContact C-O 3.54Å; S33-F88 WeakPolarHBondContact CA-O 3.38Å; S33-F88 WeakPolarHBondContact CB-O 3.22Å; M34-F88 PolarHBondContact N-O 3.11Å; M34-F88 WeakPolarHBondContact O-CB 3.44Å; M34-F88 PolarHBondContact O-N 3.37Å; I39-F88 HydrophobicContact CD1-CD2 3.54Å; I39-F88 HydrophobicContact CD1-CE2 3.46Å; I39-F88 VanDerWaalsContact CD1-CE2 3.46Å; I39-F88 HydrophobicContact CD1-CG 4.41Å; I39-F88 HydrophobicContact CD1-CZ 4.26Å; I54-F88 HydrophobicContact CD1-CE2 3.78Å; I54-F88 HydrophobicContact CD1-CZ 3.68Å; I54-F88 HydrophobicContact CG1-CZ 3.93Å; P66-F88 HydrophobicContact CG-CD1 3.93Å; P66-F88 HydrophobicContact CG-CE1 3.56Å; P66-F88 HydrophobicContact CG-CE2 4.31Å; P66-F88 HydrophobicContact CG-CG 4.47Å; P66-F88 HydrophobicContact CG-CZ 3.76Å; F88-G93 VanDerWaalsContact CD1-O 3.31Å; F88-G93 WeakPolarHBondContact CD1-O 3.48Å; F88-D96 HydrophobicContact CD1-CB 4.07Å; F88-D96 HydrophobicContact CE1-CB 3.95Å; F88-V100 HydrophobicContact CE1-CG2 4.4Å; F88-V100 HydrophobicContact CZ-CG2 4.18Å; F88-W116 HydrophobicContact CB-CZ2 4.16Å
89	E	92.2	Very high	88.3	Confident	88 Å²	88	59.3 Å²	59.3	41%	0.411	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.1	-177.3	-55.6	-173.1	169.5	0	0	111.9	I87 G93	I87-E89 HydrophobicContact CB-CG 4.49Å; I87-E89 HydrophobicContact CG2-CG 3.55Å; E89-G93 WeakPolarHBondContact O-CA 3.31Å; E89-G93 PolarHBondContact O-N 2.98Å
90	G	89.6	Confident	89.8	Confident	23 Å²	23	50.3 Å²	50.3	24%	0.237	25%	0.246	C	C	.	.	H	α-helix	trans	62.3	-165.5	177.1	0	0	0	0	0	114.3	V32 Q92 G93 K94	V32-G90 PolarHBondContact O-N 2.88Å; G90-Q92 VanDerWaalsContact C-N 3.32Å; G90-Q92 PolarHBondContact O-N 3.34Å; G90-G93 PolarHBondContact O-N 3.24Å; G90-K94 PolarHBondContact O-N 3.42Å
91	E	90.5	Very high	91	Very high	136 Å²	136	43.8 Å²	43.8	64%	0.636	21%	0.211	S	C	*	.	H	α-helix	trans	-59.3	-38.8	-176.5	-70.7	-61.3	140.7	0	0	113.3	K94 R95	E91-K94 PolarHBondContact O-N 2.94Å; E91-R95 WeakPolarHBondContact O-CB 3.4Å; E91-R95 PolarHBondContact O-N 2.96Å
92	Q	91.8	Very high	91.7	Very high	114 Å²	114	43.4 Å²	43.4	53%	0.533	22%	0.217	S	C	.	.	H	α-helix	trans	-67	-45.3	176.6	-72.3	-63	-22.9	0	0	111.4	G90 K94 R95 D96	G90-Q92 VanDerWaalsContact C-N 3.32Å; G90-Q92 PolarHBondContact O-N 3.34Å; Q92-K94 VanDerWaalsContact C-N 3.32Å; Q92-K94 PolarHBondContact O-N 2.79Å; Q92-R95 PolarHBondContact O-N 3.28Å; Q92-D96 WeakPolarHBondContact O-CB 3.42Å; Q92-D96 PolarHBondContact O-N 3.46Å
93	G	93	Very high	92	Very high	6 Å²	6	43.9 Å²	43.9	6%	0.062	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-41.8	175	0	0	0	0	0	112.5	F88 E89 G90 D96 S97	F88-G93 VanDerWaalsContact CD1-O 3.31Å; F88-G93 WeakPolarHBondContact CD1-O 3.48Å; E89-G93 WeakPolarHBondContact O-CA 3.31Å; E89-G93 PolarHBondContact O-N 2.98Å; G90-G93 PolarHBondContact O-N 3.24Å; G93-D96 PolarHBondContact O-N 2.96Å; G93-S97 VanDerWaalsContact O-CB 3.24Å; G93-S97 WeakPolarHBondContact O-CB 3.24Å; G93-S97 PolarHBondContact O-N 3.47Å; G93-S97 PolarHBondContact O-OG 3.23Å
94	K	93.3	Very high	91.9	Very high	39 Å²	39	44.5 Å²	44.5	17%	0.17	22%	0.223	C	C	.	.	H	α-helix	trans	-57.4	-55.1	173.9	179.6	177.6	-177.7	179.3	0	111.5	G90 E91 Q92 D96 S97 I98 W116 E120	G90-K94 PolarHBondContact O-N 3.42Å; E91-K94 PolarHBondContact O-N 2.94Å; Q92-K94 VanDerWaalsContact C-N 3.32Å; Q92-K94 PolarHBondContact O-N 2.79Å; K94-D96 PolarHBondContact O-N 3.34Å; K94-S97 PolarHBondContact O-N 3.33Å; K94-S97 PolarHBondContact O-OG 3.24Å; K94-I98 HydrophobicContact CG-CD1 4.06Å; K94-I98 WeakPolarHBondContact O-CD1 3.42Å; K94-I98 VanDerWaalsContact O-CG1 3.25Å; K94-I98 WeakPolarHBondContact O-CG1 3.28Å; K94-I98 PolarHBondContact O-N 3.41Å; K94-W116 VanDerWaalsContact CA-CE2 3.5Å; K94-W116 VanDerWaalsContact CA-CZ2 3.48Å; K94-W116 HydrophobicContact CB-CD2 3.78Å; K94-W116 HydrophobicContact CB-CE3 3.9Å; K94-W116 HydrophobicContact CB-CG 4.34Å; K94-W116 HydrophobicContact CB-CH2 4.13Å; K94-W116 HydrophobicContact CB-CZ2 4.01Å; K94-W116 HydrophobicContact CB-CZ3 4.05Å; K94-W116 HydrophobicContact CD-CB 4.24Å; K94-W116 HydrophobicContact CD-CD2 4.2Å; K94-W116 HydrophobicContact CD-CE3 4.24Å; K94-W116 HydrophobicContact CD-CG 4.19Å; K94-W116 HydrophobicContact CG-CB 4.25Å; K94-W116 HydrophobicContact CG-CD2 3.71Å; K94-W116 HydrophobicContact CG-CE3 4.11Å; K94-W116 HydrophobicContact CG-CG 3.74Å; K94-E120 WeakPolarHBondContact CD-OE1 3.24Å; K94-E120 WeakPolarHBondContact CE-OE1 3.44Å; K94-E120 IonicContact NZ-OE1 2.82Å; K94-E120 PolarHBondContact NZ-OE1 3.07Å; K94-E120 IonicContact NZ-OE2 4Å; K94-E120 PolarHBondContact NZ-OE2 2.95Å
95	R	93.9	Very high	91.5	Very high	121 Å²	121	42.8 Å²	42.8	46%	0.457	22%	0.216	S	C	.	.	H	α-helix	trans	-56.9	-48.1	177.7	179.2	-118.5	177.5	-145.3	0	112.1	V62 E91 Q92 I98 I99	V62-R95 PolarHBondContact O-NH1 2.81Å; V62-R95 PolarHBondContact O-NH2 3.4Å; E91-R95 WeakPolarHBondContact O-CB 3.4Å; E91-R95 PolarHBondContact O-N 2.96Å; Q92-R95 PolarHBondContact O-N 3.28Å; R95-I98 PolarHBondContact O-N 3.46Å; R95-I99 HydrophobicContact CG-CD1 4.26Å; R95-I99 WeakPolarHBondContact O-CG1 3.45Å; R95-I99 PolarHBondContact O-N 3.44Å; R95-I99 VanDerWaalsContact O-N 3.1Å
96	D	95.1	Very high	91.2	Very high	4 Å²	4	47 Å²	47	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-68.2	-38.8	-176.8	-74.8	-7	0	0	0	112.2	I63 Q64 F88 Q92 G93 K94 I98 I99 V100	I63-D96 HydrophobicContact CB-CB 3.89Å; I63-D96 VanDerWaalsContact CB-CG 3.5Å; I63-D96 HydrophobicContact CG2-CB 3.87Å; Q64-D96 PolarHBondContact N-OD2 2.87Å; F88-D96 HydrophobicContact CD1-CB 4.07Å; F88-D96 HydrophobicContact CE1-CB 3.95Å; Q92-D96 WeakPolarHBondContact O-CB 3.42Å; Q92-D96 PolarHBondContact O-N 3.46Å; G93-D96 PolarHBondContact O-N 2.96Å; K94-D96 PolarHBondContact O-N 3.34Å; D96-I98 PolarHBondContact O-N 2.88Å; D96-I99 PolarHBondContact O-N 2.92Å; D96-V100 VanDerWaalsContact O-CG2 3.28Å; D96-V100 WeakPolarHBondContact O-CG2 3.32Å; D96-V100 PolarHBondContact O-N 2.9Å
97	S	92.9	Very high	90.8	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-37.5	175.5	67.2	0	0	0	0	112.4	G93 K94 V100 V101 W116	G93-S97 VanDerWaalsContact O-CB 3.24Å; G93-S97 WeakPolarHBondContact O-CB 3.24Å; G93-S97 PolarHBondContact O-N 3.47Å; G93-S97 PolarHBondContact O-OG 3.23Å; K94-S97 PolarHBondContact O-N 3.33Å; K94-S97 PolarHBondContact O-OG 3.24Å; S97-V100 PolarHBondContact O-N 2.86Å; S97-V101 PolarHBondContact O-N 3.48Å; S97-W116 PolarHBondContact OG-NE1 3.09Å
98	I	92.5	Very high	90.5	Very high	45 Å²	45	56.5 Å²	56.5	23%	0.231	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-45.4	172.3	-67.8	164.6	0	0	0	110.4	K94 R95 D96 V100 V101 A102 T109 L112 V113	K94-I98 HydrophobicContact CG-CD1 4.06Å; K94-I98 WeakPolarHBondContact O-CD1 3.42Å; K94-I98 VanDerWaalsContact O-CG1 3.25Å; K94-I98 WeakPolarHBondContact O-CG1 3.28Å; K94-I98 PolarHBondContact O-N 3.41Å; R95-I98 PolarHBondContact O-N 3.46Å; D96-I98 PolarHBondContact O-N 2.88Å; I98-V100 PolarHBondContact O-N 2.94Å; I98-V101 PolarHBondContact O-N 3.03Å; I98-A102 VanDerWaalsContact O-CB 3.28Å; I98-A102 WeakPolarHBondContact O-CB 3.43Å; I98-A102 PolarHBondContact O-N 2.65Å; I98-T109 HydrophobicContact CG2-CG2 3.98Å; I98-L112 HydrophobicContact CB-CD2 4.22Å; I98-L112 HydrophobicContact CG1-CD2 3.35Å; I98-V113 HydrophobicContact CD1-CG2 4.14Å; I98-V113 HydrophobicContact CG1-CG2 4.26Å
99	I	91.7	Very high	90.2	Very high	34 Å²	34	58 Å²	58	17%	0.174	30%	0.296	C	S	.	.	H	α-helix	trans	-62.6	-42.9	178.4	-68.4	167.2	0	0	0	111.4	L57 V62 I63 R95 D96 V101 A102 Q103	L57-I99 HydrophobicContact CD1-CG2 4.35Å; V62-I99 HydrophobicContact CG1-CG2 3.79Å; I63-I99 HydrophobicContact CG2-CB 4.05Å; I63-I99 HydrophobicContact CG2-CD1 4.25Å; I63-I99 HydrophobicContact CG2-CG2 3.88Å; R95-I99 HydrophobicContact CG-CD1 4.26Å; R95-I99 WeakPolarHBondContact O-CG1 3.45Å; R95-I99 PolarHBondContact O-N 3.44Å; R95-I99 VanDerWaalsContact O-N 3.1Å; D96-I99 PolarHBondContact O-N 2.92Å; I99-V101 PolarHBondContact O-N 2.85Å; I99-A102 PolarHBondContact O-N 3.47Å; I99-Q103 WeakPolarHBondContact O-CG 3.14Å; I99-Q103 PolarHBondContact O-N 2.9Å; I99-Q103 VanDerWaalsContact O-N 3.11Å
100	V	91.9	Very high	90.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.5	-47.6	177.8	170.1	0	0	0	0	110.8	V50 I54 L57 I63 F88 D96 S97 I98 Q103 L104	V50-V100 HydrophobicContact CG1-CG1 4.31Å; I54-V100 HydrophobicContact CG1-CG1 3.95Å; I54-V100 HydrophobicContact CG1-CG2 3.86Å; L57-V100 HydrophobicContact CD1-CB 4.32Å; L57-V100 HydrophobicContact CD1-CG2 3.79Å; I63-V100 HydrophobicContact CD1-CG2 3.73Å; F88-V100 HydrophobicContact CE1-CG2 4.4Å; F88-V100 HydrophobicContact CZ-CG2 4.18Å; D96-V100 VanDerWaalsContact O-CG2 3.28Å; D96-V100 WeakPolarHBondContact O-CG2 3.32Å; D96-V100 PolarHBondContact O-N 2.9Å; S97-V100 PolarHBondContact O-N 2.86Å; I98-V100 PolarHBondContact O-N 2.94Å; V100-Q103 PolarHBondContact O-N 2.88Å; V100-L104 HydrophobicContact CG1-CD1 3.95Å; V100-L104 WeakPolarHBondContact O-CB 3.25Å; V100-L104 WeakPolarHBondContact O-CG 3.32Å; V100-L104 PolarHBondContact O-N 3.01Å
101	V	90.9	Very high	90.1	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.006	32%	0.316	C	S	.	.	H	α-helix	trans	-70	-40.3	179.1	170	0	0	0	0	112	I39 V43 S97 I98 I99 Q103 L104 C105 F108 L112	I39-V101 HydrophobicContact CG2-CG2 3.59Å; V43-V101 HydrophobicContact CG1-CB 4.43Å; V43-V101 HydrophobicContact CG1-CG1 3.81Å; V43-V101 HydrophobicContact CG1-CG2 3.71Å; S97-V101 PolarHBondContact O-N 3.48Å; I98-V101 PolarHBondContact O-N 3.03Å; I99-V101 PolarHBondContact O-N 2.85Å; V101-Q103 PolarHBondContact O-N 2.85Å; V101-L104 PolarHBondContact O-N 3.39Å; V101-L104 VanDerWaalsContact O-N 3.16Å; V101-C105 CarbonylContact O-C 3.57Å; V101-C105 VanDerWaalsContact O-C 3.22Å; V101-C105 PolarHBondContact O-N 2.86Å; V101-F108 HydrophobicContact CG1-CB 4.19Å; V101-L112 HydrophobicContact CB-CD1 4Å; V101-L112 HydrophobicContact CG2-CD1 3.29Å
102	A	91	Very high	90.1	Very high	42 Å²	42	56.3 Å²	56.3	35%	0.347	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-33.1	177.8	0	0	0	0	0	112.8	I98 I99	I98-A102 VanDerWaalsContact O-CB 3.28Å; I98-A102 WeakPolarHBondContact O-CB 3.43Å; I98-A102 PolarHBondContact O-N 2.65Å; I99-A102 PolarHBondContact O-N 3.47Å
103	Q	87	Confident	90.1	Very high	134 Å²	134	52.8 Å²	52.8	63%	0.626	27%	0.272	S	S	*	.	H	α-helix	trans	-81.3	-31.3	177.4	-72	-73.8	-27.1	0	0	113.6	L57 I99 V100 V101	L57-Q103 HydrophobicContact CD1-CG 4.47Å; L57-Q103 HydrophobicContact CD2-CG 4.18Å; I99-Q103 WeakPolarHBondContact O-CG 3.14Å; I99-Q103 PolarHBondContact O-N 2.9Å; I99-Q103 VanDerWaalsContact O-N 3.11Å; V100-Q103 PolarHBondContact O-N 2.88Å; V101-Q103 PolarHBondContact O-N 2.85Å
104	L	84	Confident	90.1	Very high	50 Å²	50	56.4 Å²	56.4	26%	0.262	29%	0.29	S	S	.	.	H	α-helix	trans	-84.9	-53	-178.2	-82	171.5	0	0	0	112.3	V50 S53 V100 V101	V50-L104 HydrophobicContact CB-CD1 4.44Å; V50-L104 HydrophobicContact CG2-CD1 4.15Å; S53-L104 WeakPolarHBondContact OG-CD2 3.48Å; V100-L104 HydrophobicContact CG1-CD1 3.95Å; V100-L104 WeakPolarHBondContact O-CB 3.25Å; V100-L104 WeakPolarHBondContact O-CG 3.32Å; V100-L104 PolarHBondContact O-N 3.01Å; V101-L104 PolarHBondContact O-N 3.39Å; V101-L104 VanDerWaalsContact O-N 3.16Å
105	C	83.4	Confident	90.1	Very high	32 Å²	32	57.8 Å²	57.8	22%	0.216	29%	0.294	C	S	.	.			trans	-150.2	76.6	-170.6	-50.4	0	0	0	0	108.7	V101 E107 F108	V101-C105 CarbonylContact O-C 3.57Å; V101-C105 VanDerWaalsContact O-C 3.22Å; V101-C105 PolarHBondContact O-N 2.86Å; C105-E107 PolarHBondContact O-N 3.42Å; C105-F108 HydrophobicContact CB-CD2 3.49Å; C105-F108 VanDerWaalsContact CB-CD2 3.49Å; C105-F108 HydrophobicContact CB-CE2 4.07Å; C105-F108 HydrophobicContact CB-CG 4.41Å; C105-F108 PolarHBondContact O-N 3.46Å
106	P	86	Confident	90	Very high	87 Å²	87	52.1 Å²	52.1	57%	0.565	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-57	-28.6	-173.2	20.6	-32.5	0	0	0	113.6	F108 T109	P106-F108 PolarHBondContact O-N 2.86Å; P106-F108 VanDerWaalsContact O-N 3.15Å; P106-T109 WeakPolarHBondContact O-CB 3.33Å; P106-T109 PolarHBondContact O-N 3.33Å; P106-T109 VanDerWaalsContact O-N 3.11Å; P106-T109 PolarHBondContact O-OG1 3.42Å
107	E	88.3	Confident	89.8	Confident	176 Å²	176	59.7 Å²	59.7	82%	0.822	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-58	-24.6	175.6	-59.5	-179.4	-167.7	0	0	113.4	C105	C105-E107 PolarHBondContact O-N 3.42Å
108	F	87.9	Confident	89.7	Confident	53 Å²	53	64.4 Å²	64.4	23%	0.232	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-97.3	0.9	-178.5	-62.3	-95.6	0	0	0	113.5	V43 V101 C105 P106 A110 R111 L112	V43-F108 HydrophobicContact CB-CB 4.06Å; V43-F108 HydrophobicContact CB-CD1 4.41Å; V43-F108 HydrophobicContact CB-CG 4.1Å; V43-F108 HydrophobicContact CG1-CB 3.79Å; V43-F108 HydrophobicContact CG1-CG 4.37Å; V101-F108 HydrophobicContact CG1-CB 4.19Å; C105-F108 HydrophobicContact CB-CD2 3.49Å; C105-F108 VanDerWaalsContact CB-CD2 3.49Å; C105-F108 HydrophobicContact CB-CE2 4.07Å; C105-F108 HydrophobicContact CB-CG 4.41Å; C105-F108 PolarHBondContact O-N 3.46Å; P106-F108 PolarHBondContact O-N 2.86Å; P106-F108 VanDerWaalsContact O-N 3.15Å; F108-A110 VanDerWaalsContact C-N 3.25Å; F108-A110 PolarHBondContact O-N 3.1Å; F108-R111 PolarHBondContact O-N 2.91Å; F108-R111 VanDerWaalsContact O-N 3.1Å; F108-L112 PolarHBondContact O-N 3.36Å
109	T	88.2	Confident	89.4	Confident	33 Å²	33	63.3 Å²	63.3	20%	0.202	32%	0.318	C	S	.	.	H	α-helix	trans	-58.1	-39.4	-178.1	-49.9	0	0	0	0	111.7	I98 P106 R111 L112 V113	I98-T109 HydrophobicContact CG2-CG2 3.98Å; P106-T109 WeakPolarHBondContact O-CB 3.33Å; P106-T109 PolarHBondContact O-N 3.33Å; P106-T109 VanDerWaalsContact O-N 3.11Å; P106-T109 PolarHBondContact O-OG1 3.42Å; T109-R111 VanDerWaalsContact C-N 3.35Å; T109-R111 PolarHBondContact O-N 2.88Å; T109-L112 PolarHBondContact O-N 3.24Å; T109-V113 WeakPolarHBondContact O-CG2 3.38Å; T109-V113 PolarHBondContact O-N 2.97Å
110	A	89.6	Confident	89.3	Confident	63 Å²	63	64 Å²	64	52%	0.521	32%	0.321	S	S	.	.	H	α-helix	trans	-58	-45.9	176.9	0	0	0	0	0	111.9	F108 L112 V113 D114	F108-A110 VanDerWaalsContact C-N 3.25Å; F108-A110 PolarHBondContact O-N 3.1Å; A110-L112 VanDerWaalsContact C-N 3.31Å; A110-L112 PolarHBondContact O-N 2.91Å; A110-V113 PolarHBondContact O-N 3.45Å; A110-D114 VanDerWaalsContact O-CG 3.28Å; A110-D114 PolarHBondContact O-N 3.31Å
111	R	90.5	Very high	89	Confident	148 Å²	148	69.9 Å²	69.9	56%	0.558	35%	0.348	S	S	*	.	H	α-helix	trans	-62.4	-38.2	179	-64.6	-172	-175.2	176.1	-0.8	112.4	L42 F108 T109 D114 R115	L42-R111 HydrophobicContact CD2-CB 3.68Å; L42-R111 HydrophobicContact CG-CB 4.31Å; F108-R111 PolarHBondContact O-N 2.91Å; F108-R111 VanDerWaalsContact O-N 3.1Å; T109-R111 VanDerWaalsContact C-N 3.35Å; T109-R111 PolarHBondContact O-N 2.88Å; R111-D114 PolarHBondContact O-N 3.38Å; R111-R115 WeakPolarHBondContact O-CB 3.49Å; R111-R115 PolarHBondContact O-N 2.99Å
112	L	89.8	Confident	88.5	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-68.6	-40.3	178.3	-175.5	147	0	0	0	110.7	M34 I39 L42 I98 V101 F108 T109 A110 R115 W116	M34-L112 HydrophobicContact SD-CD1 4.43Å; M34-L112 HydrophobicContact SD-CG 4.45Å; I39-L112 HydrophobicContact CG1-CD1 4.2Å; I39-L112 HydrophobicContact CG2-CD1 4.37Å; L42-L112 HydrophobicContact CD2-CB 4.02Å; I98-L112 HydrophobicContact CB-CD2 4.22Å; I98-L112 HydrophobicContact CG1-CD2 3.35Å; V101-L112 HydrophobicContact CB-CD1 4Å; V101-L112 HydrophobicContact CG2-CD1 3.29Å; F108-L112 PolarHBondContact O-N 3.36Å; T109-L112 PolarHBondContact O-N 3.24Å; A110-L112 VanDerWaalsContact C-N 3.31Å; A110-L112 PolarHBondContact O-N 2.91Å; L112-R115 PolarHBondContact O-N 3.43Å; L112-W116 VanDerWaalsContact CD2-CD1 3.48Å; L112-W116 VanDerWaalsContact O-CD1 3.28Å; L112-W116 PolarHBondContact O-N 3.27Å
113	V	91.5	Very high	87.9	Confident	41 Å²	41	73.2 Å²	73.2	25%	0.248	36%	0.358	C	S	.	.	H	α-helix	trans	-62.4	-45.2	174.7	172	0	0	0	0	111.1	I98 T109 A110 R115 W116 R117	I98-V113 HydrophobicContact CD1-CG2 4.14Å; I98-V113 HydrophobicContact CG1-CG2 4.26Å; T109-V113 WeakPolarHBondContact O-CG2 3.38Å; T109-V113 PolarHBondContact O-N 2.97Å; A110-V113 PolarHBondContact O-N 3.45Å; V113-R115 VanDerWaalsContact C-N 3.28Å; V113-R115 PolarHBondContact O-N 3.24Å; V113-W116 PolarHBondContact O-N 2.98Å; V113-R117 PolarHBondContact O-N 3.28Å
114	D	93.2	Very high	87.5	Confident	81 Å²	81	76.2 Å²	76.2	43%	0.433	36%	0.364	S	S	.	.	H	α-helix	trans	-60	-41.8	176.3	-68.1	-27.5	0	0	0	111	A110 R111 W116 R117 E118	A110-D114 VanDerWaalsContact O-CG 3.28Å; A110-D114 PolarHBondContact O-N 3.31Å; R111-D114 PolarHBondContact O-N 3.38Å; D114-W116 PolarHBondContact O-N 3.41Å; D114-R117 WeakPolarHBondContact O-CB 3.26Å; D114-R117 PolarHBondContact O-N 3.2Å; D114-R117 VanDerWaalsContact O-N 3.14Å; D114-E118 WeakPolarHBondContact O-CG 3.32Å; D114-E118 PolarHBondContact O-N 3.34Å
115	R	92.6	Very high	87.2	Confident	69 Å²	69	80.7 Å²	80.7	26%	0.26	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-41.3	176.5	-178.6	61.7	-177.9	162.3	2.3	113	M34 L42 R111 L112 V113 E118 L119	M34-R115 HydrophobicContact CE-CB 3.94Å; M34-R115 HydrophobicContact CE-CG 3.37Å; M34-R115 HydrophobicContact SD-CG 4.25Å; L42-R115 HydrophobicContact CD1-CB 3.51Å; L42-R115 HydrophobicContact CD1-CG 3.74Å; R111-R115 WeakPolarHBondContact O-CB 3.49Å; R111-R115 PolarHBondContact O-N 2.99Å; L112-R115 PolarHBondContact O-N 3.43Å; V113-R115 VanDerWaalsContact C-N 3.28Å; V113-R115 PolarHBondContact O-N 3.24Å; R115-E118 IonicContact NH1-OE2 2.65Å; R115-E118 PolarHBondContact NH1-OE2 3.12Å; R115-E118 PolarHBondContact O-N 2.97Å; R115-L119 HydrophobicContact CG-CD1 4.36Å; R115-L119 VanDerWaalsContact O-CG 3.29Å; R115-L119 WeakPolarHBondContact O-CG 3.38Å; R115-L119 PolarHBondContact O-N 3.4Å; R115-L119 VanDerWaalsContact O-N 3.12Å
116	W	92.3	Very high	86.7	Confident	1 Å²	1	84.6 Å²	84.6	0%	0.004	41%	0.406	C	S	.	.	H	α-helix	trans	-64.1	-40.6	173.3	-82.9	103	0	0	0	111.9	V32 M34 F88 K94 S97 L112 V113 D114 E118 L119 E120	V32-W116 HydrophobicContact CB-CE3 4.26Å; V32-W116 HydrophobicContact CB-CZ3 3.85Å; V32-W116 HydrophobicContact CG1-CE3 3.58Å; V32-W116 HydrophobicContact CG1-CH2 4.42Å; V32-W116 HydrophobicContact CG1-CZ3 3.42Å; V32-W116 VanDerWaalsContact CG1-CZ3 3.42Å; M34-W116 HydrophobicContact CB-CH2 4.5Å; M34-W116 HydrophobicContact CB-CZ2 3.94Å; M34-W116 HydrophobicContact CE-CD2 4.15Å; M34-W116 HydrophobicContact CE-CG 4.03Å; M34-W116 HydrophobicContact CE-CZ2 4.44Å; F88-W116 HydrophobicContact CB-CZ2 4.16Å; K94-W116 VanDerWaalsContact CA-CE2 3.5Å; K94-W116 VanDerWaalsContact CA-CZ2 3.48Å; K94-W116 HydrophobicContact CB-CD2 3.78Å; K94-W116 HydrophobicContact CB-CE3 3.9Å; K94-W116 HydrophobicContact CB-CG 4.34Å; K94-W116 HydrophobicContact CB-CH2 4.13Å; K94-W116 HydrophobicContact CB-CZ2 4.01Å; K94-W116 HydrophobicContact CB-CZ3 4.05Å; K94-W116 HydrophobicContact CD-CB 4.24Å; K94-W116 HydrophobicContact CD-CD2 4.2Å; K94-W116 HydrophobicContact CD-CE3 4.24Å; K94-W116 HydrophobicContact CD-CG 4.19Å; K94-W116 HydrophobicContact CG-CB 4.25Å; K94-W116 HydrophobicContact CG-CD2 3.71Å; K94-W116 HydrophobicContact CG-CE3 4.11Å; K94-W116 HydrophobicContact CG-CG 3.74Å; S97-W116 PolarHBondContact OG-NE1 3.09Å; L112-W116 VanDerWaalsContact CD2-CD1 3.48Å; L112-W116 VanDerWaalsContact O-CD1 3.28Å; L112-W116 PolarHBondContact O-N 3.27Å; V113-W116 PolarHBondContact O-N 2.98Å; D114-W116 PolarHBondContact O-N 3.41Å; W116-E118 PolarHBondContact O-N 3.4Å; W116-L119 PolarHBondContact O-N 3.19Å; W116-E120 WeakPolarHBondContact O-CB 3.38Å; W116-E120 VanDerWaalsContact O-CG 3.28Å; W116-E120 WeakPolarHBondContact O-CG 3.36Å; W116-E120 PolarHBondContact O-N 3.02Å
117	R	90.9	Very high	86	Confident	163 Å²	163	83.2 Å²	83.2	62%	0.615	39%	0.393	S	S	*	.	H	α-helix	trans	-61.3	-43.6	175.5	-72.9	-179.9	173.3	-173.5	-1.7	112.2	V113 D114 L119 E120 E121	V113-R117 PolarHBondContact O-N 3.28Å; D114-R117 WeakPolarHBondContact O-CB 3.26Å; D114-R117 PolarHBondContact O-N 3.2Å; D114-R117 VanDerWaalsContact O-N 3.14Å; R117-L119 VanDerWaalsContact C-N 3.32Å; R117-L119 PolarHBondContact O-N 3.12Å; R117-E120 PolarHBondContact O-N 3.28Å; R117-E121 WeakPolarHBondContact O-CB 3.41Å; R117-E121 PolarHBondContact O-N 3.47Å
118	E	89.9	Confident	85.8	Confident	99 Å²	99	77.5 Å²	77.5	46%	0.463	37%	0.373	S	S	.	.	H	α-helix	trans	-58.2	-45.3	175.2	-73.6	175.2	-179.2	0	0	111.9	D114 R115 W116 E121 Q122	D114-E118 WeakPolarHBondContact O-CG 3.32Å; D114-E118 PolarHBondContact O-N 3.34Å; R115-E118 IonicContact NH1-OE2 2.65Å; R115-E118 PolarHBondContact NH1-OE2 3.12Å; R115-E118 PolarHBondContact O-N 2.97Å; W116-E118 PolarHBondContact O-N 3.4Å; E118-E121 PolarHBondContact O-N 2.98Å; E118-Q122 VanDerWaalsContact O-CG 3.28Å; E118-Q122 WeakPolarHBondContact O-CG 3.48Å; E118-Q122 PolarHBondContact O-N 2.89Å
119	L	87.7	Confident	85.5	Confident	23 Å²	23	82.8 Å²	82.8	12%	0.12	40%	0.398	C	S	.	.	H	α-helix	trans	-67.9	-39.5	-180	-69.2	167.8	0	0	0	111.8	V32 M34 R115 W116 R117 Q122 V123	V32-L119 HydrophobicContact CB-CB 4.44Å; V32-L119 HydrophobicContact CG1-CB 3.26Å; V32-L119 HydrophobicContact CG1-CD1 3.64Å; V32-L119 HydrophobicContact CG1-CG 4Å; V32-L119 HydrophobicContact CG2-CB 4.32Å; M34-L119 HydrophobicContact CE-CD1 4.06Å; R115-L119 HydrophobicContact CG-CD1 4.36Å; R115-L119 VanDerWaalsContact O-CG 3.29Å; R115-L119 WeakPolarHBondContact O-CG 3.38Å; R115-L119 PolarHBondContact O-N 3.4Å; R115-L119 VanDerWaalsContact O-N 3.12Å; W116-L119 PolarHBondContact O-N 3.19Å; R117-L119 VanDerWaalsContact C-N 3.32Å; R117-L119 PolarHBondContact O-N 3.12Å; L119-Q122 PolarHBondContact O-N 3.44Å; L119-V123 WeakPolarHBondContact O-CG2 3.5Å; L119-V123 PolarHBondContact O-N 2.89Å
120	E	88.3	Confident	85.4	Confident	49 Å²	49	88 Å²	88	23%	0.229	42%	0.423	C	S	.	.	H	α-helix	trans	-64.1	-42.6	174.8	-75.6	164.9	-172.7	0	0	111.7	V32 K94 W116 R117 Q122 V123 R124	V32-E120 HydrophobicContact CG2-CG 4.23Å; K94-E120 WeakPolarHBondContact CD-OE1 3.24Å; K94-E120 WeakPolarHBondContact CE-OE1 3.44Å; K94-E120 IonicContact NZ-OE1 2.82Å; K94-E120 PolarHBondContact NZ-OE1 3.07Å; K94-E120 IonicContact NZ-OE2 4Å; K94-E120 PolarHBondContact NZ-OE2 2.95Å; W116-E120 WeakPolarHBondContact O-CB 3.38Å; W116-E120 VanDerWaalsContact O-CG 3.28Å; W116-E120 WeakPolarHBondContact O-CG 3.36Å; W116-E120 PolarHBondContact O-N 3.02Å; R117-E120 PolarHBondContact O-N 3.28Å; E120-Q122 VanDerWaalsContact C-N 3.32Å; E120-Q122 PolarHBondContact O-N 2.66Å; E120-V123 PolarHBondContact O-N 3.1Å; E120-R124 WeakPolarHBondContact O-CG 3.11Å; E120-R124 PolarHBondContact O-N 3.41Å
121	E	87	Confident	85	Confident	122 Å²	122	88.8 Å²	88.8	57%	0.57	42%	0.416	S	S	*	.	H	α-helix	trans	-65.4	-36.8	177.4	-167.4	64.5	-164.4	0	0	111.8	R117 E118 V123 R124 K125	R117-E121 WeakPolarHBondContact O-CB 3.41Å; R117-E121 PolarHBondContact O-N 3.47Å; E118-E121 PolarHBondContact O-N 2.98Å; E121-V123 VanDerWaalsContact C-N 3.31Å; E121-V123 PolarHBondContact O-N 3.28Å; E121-R124 PolarHBondContact O-N 3.26Å; E121-K125 PolarHBondContact O-N 3.15Å
122	Q	78.9	Confident	84.5	Confident	80 Å²	80	86.5 Å²	86.5	37%	0.374	41%	0.413	S	S	.	.	H	α-helix	trans	-62.3	-37.5	174.4	-76.3	170.2	32.9	0	0	112.5	E118 L119 E120	E118-Q122 VanDerWaalsContact O-CG 3.28Å; E118-Q122 WeakPolarHBondContact O-CG 3.48Å; E118-Q122 PolarHBondContact O-N 2.89Å; L119-Q122 PolarHBondContact O-N 3.44Å; E120-Q122 VanDerWaalsContact C-N 3.32Å; E120-Q122 PolarHBondContact O-N 2.66Å
123	V	79.2	Confident	84.1	Confident	34 Å²	34	91 Å²	91	21%	0.206	44%	0.44	C	S	.	.	H	α-helix	trans	-75.7	-34.6	176.3	176.6	0	0	0	0	111.5	A26 V32 L119 E120 E121	A26-V123 HydrophobicContact CB-CG2 3.71Å; V32-V123 HydrophobicContact CG2-CB 4.39Å; V32-V123 HydrophobicContact CG2-CG2 3.69Å; L119-V123 WeakPolarHBondContact O-CG2 3.5Å; L119-V123 PolarHBondContact O-N 2.89Å; E120-V123 PolarHBondContact O-N 3.1Å; E121-V123 VanDerWaalsContact C-N 3.31Å; E121-V123 PolarHBondContact O-N 3.28Å
124	R	78.4	Confident	83.8	Confident	197 Å²	197	91.4 Å²	91.4	74%	0.743	45%	0.448	S	S	*	.	H	α-helix	trans	-75.7	-22.7	179.5	-71.3	-178.7	84.6	-176.8	7.2	113.9	E120 E121	E120-R124 WeakPolarHBondContact O-CG 3.11Å; E120-R124 PolarHBondContact O-N 3.41Å; E121-R124 PolarHBondContact O-N 3.26Å
125	K	78.8	Confident	83.1	Confident	144 Å²	144	87.6 Å²	87.6	63%	0.626	43%	0.427	S	S	*	.	S	Bend	trans	-60.2	123.1	179.7	-170.8	-178.5	178.5	-167.4	0	109.4	E121 M127	E121-K125 PolarHBondContact O-N 3.15Å; K125-M127 PolarHBondContact O-N 3.12Å
126	P	72.5	Confident	82.7	Confident	114 Å²	114	89.6 Å²	89.6	74%	0.74	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-62.2	124.1	178.3	24.3	-32.1	0	0	0	109.5
127	M	71.8	Confident	82.5	Confident	58 Å²	58	92.1 Å²	92.1	29%	0.286	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-65.1	140.7	171.7	-81.4	-179.2	141.5	0	0	110	N24 I27 K125 E131 A135	N24-M127 WeakPolarHBondContact OD1-CE 3.49Å; I27-M127 HydrophobicContact CD1-CE 3.24Å; I27-M127 HydrophobicContact CD1-CG 4.18Å; I27-M127 HydrophobicContact CD1-SD 3.72Å; I27-M127 HydrophobicContact CG2-SD 4.15Å; K125-M127 PolarHBondContact O-N 3.12Å; M127-E131 WeakPolarHBondContact CA-OE2 3.21Å; M127-E131 HydrophobicContact CB-CB 3.98Å; M127-E131 HydrophobicContact CE-CB 4.19Å; M127-E131 HydrophobicContact CG-CB 4Å; M127-E131 HydrophobicContact SD-CB 4.39Å; M127-A135 HydrophobicContact CE-CB 3.88Å; M127-A135 HydrophobicContact SD-CB 4.37Å
128	S	82.3	Confident	82.2	Confident	56 Å²	56	87.9 Å²	87.9	39%	0.392	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-63.7	159	161.5	66.3	0	0	0	0	110.7	I130 E131 M132	S128-I130 PolarHBondContact O-N 3.16Å; S128-E131 PolarHBondContact N-OE2 3.19Å; S128-E131 PolarHBondContact O-N 3.07Å; S128-E131 VanDerWaalsContact O-N 3.12Å; S128-E131 WeakPolarHBondContact OG-CB 3.22Å; S128-E131 VanDerWaalsContact OG-CD 3.3Å; S128-E131 VanDerWaalsContact OG-CG 3.26Å; S128-E131 WeakPolarHBondContact OG-CG 3.44Å; S128-E131 PolarHBondContact OG-N 2.84Å; S128-E131 PolarHBondContact OG-OE2 3.46Å; S128-E131 VanDerWaalsContact OG-OE2 3.12Å; S128-M132 PolarHBondContact O-N 3.33Å
129	E	82.5	Confident	81.9	Confident	164 Å²	164	84.7 Å²	84.7	77%	0.766	44%	0.436	S	S	*	.	H	α-helix	trans	-55.4	-37.5	176.5	-64.5	179.3	165.6	0	0	112.3	M132 V133	E129-M132 PolarHBondContact O-N 2.9Å; E129-V133 WeakPolarHBondContact O-CG2 3.42Å; E129-V133 PolarHBondContact O-N 3.44Å
130	I	85.3	Confident	81.9	Confident	142 Å²	142	86.1 Å²	86.1	73%	0.728	45%	0.452	S	S	*	.	H	α-helix	trans	-66.3	-44.2	178.6	-62.8	174.8	0	0	0	110.9	S128 M132 V133 A134	S128-I130 PolarHBondContact O-N 3.16Å; I130-M132 VanDerWaalsContact C-N 3.34Å; I130-V133 PolarHBondContact O-N 2.89Å; I130-A134 WeakPolarHBondContact O-CB 3.35Å; I130-A134 PolarHBondContact O-N 2.91Å
131	E	82.1	Confident	81.9	Confident	79 Å²	79	87.6 Å²	87.6	37%	0.369	46%	0.464	S	S	.	.	H	α-helix	trans	-62.3	-41.9	176.5	-75.1	165.2	166	0	0	111.2	M127 S128 A134 A135	M127-E131 WeakPolarHBondContact CA-OE2 3.21Å; M127-E131 HydrophobicContact CB-CB 3.98Å; M127-E131 HydrophobicContact CE-CB 4.19Å; M127-E131 HydrophobicContact CG-CB 4Å; M127-E131 HydrophobicContact SD-CB 4.39Å; S128-E131 PolarHBondContact N-OE2 3.19Å; S128-E131 PolarHBondContact O-N 3.07Å; S128-E131 VanDerWaalsContact O-N 3.12Å; S128-E131 WeakPolarHBondContact OG-CB 3.22Å; S128-E131 VanDerWaalsContact OG-CD 3.3Å; S128-E131 VanDerWaalsContact OG-CG 3.26Å; S128-E131 WeakPolarHBondContact OG-CG 3.44Å; S128-E131 PolarHBondContact OG-N 2.84Å; S128-E131 PolarHBondContact OG-OE2 3.46Å; S128-E131 VanDerWaalsContact OG-OE2 3.12Å; E131-A134 PolarHBondContact O-N 3.34Å; E131-A135 VanDerWaalsContact O-CB 3.32Å; E131-A135 WeakPolarHBondContact O-CB 3.32Å; E131-A135 PolarHBondContact O-N 3.01Å
132	M	78.8	Confident	81.9	Confident	100 Å²	100	84.8 Å²	84.8	49%	0.493	45%	0.448	S	S	.	.	H	α-helix	trans	-62.1	-46.5	176.7	-176.7	178.1	66.6	0	0	111.9	S128 E129 I130 A134 A135 M136	S128-M132 PolarHBondContact O-N 3.33Å; E129-M132 PolarHBondContact O-N 2.9Å; I130-M132 VanDerWaalsContact C-N 3.34Å; M132-A134 VanDerWaalsContact C-N 3.34Å; M132-A134 PolarHBondContact O-N 3.03Å; M132-A135 PolarHBondContact O-N 3.06Å; M132-M136 HydrophobicContact CG-SD 4.32Å; M132-M136 WeakPolarHBondContact O-CG 3.47Å; M132-M136 PolarHBondContact O-N 2.91Å
133	V	82.5	Confident	82.3	Confident	95 Å²	95	86 Å²	86	58%	0.576	45%	0.454	S	S	*	.	H	α-helix	trans	-62.1	-43	177	171.5	0	0	0	0	111.1	E129 I130 M136 A137	E129-V133 WeakPolarHBondContact O-CG2 3.42Å; E129-V133 PolarHBondContact O-N 3.44Å; I130-V133 PolarHBondContact O-N 2.89Å; V133-M136 PolarHBondContact O-N 2.88Å; V133-A137 WeakPolarHBondContact O-CB 3.33Å; V133-A137 PolarHBondContact O-N 2.96Å
134	A	84.4	Confident	82.9	Confident	49 Å²	49	89.3 Å²	89.3	41%	0.405	47%	0.467	S	S	.	.	H	α-helix	trans	-62.5	-43.5	177.4	0	0	0	0	0	111.7	I130 E131 M132 A137 L138	I130-A134 WeakPolarHBondContact O-CB 3.35Å; I130-A134 PolarHBondContact O-N 2.91Å; E131-A134 PolarHBondContact O-N 3.34Å; M132-A134 VanDerWaalsContact C-N 3.34Å; M132-A134 PolarHBondContact O-N 3.03Å; A134-A137 PolarHBondContact O-N 2.93Å; A134-L138 WeakPolarHBondContact O-CG 3.45Å; A134-L138 PolarHBondContact O-N 3.32Å
135	A	79.3	Confident	83.5	Confident	1 Å²	1	86.8 Å²	86.8	1%	0.008	46%	0.461	C	S	.	.	H	α-helix	trans	-60.5	-46.9	175.9	0	0	0	0	0	111.1	F28 M127 E131 M132 A137 L138 E139	F28-A135 VanDerWaalsContact CE2-C 3.45Å; F28-A135 HydrophobicContact CE2-CB 3.54Å; F28-A135 WeakPolarHBondContact CE2-O 3.33Å; F28-A135 VanDerWaalsContact CZ-C 3.4Å; F28-A135 HydrophobicContact CZ-CB 3.69Å; F28-A135 WeakPolarHBondContact CZ-O 3.35Å; M127-A135 HydrophobicContact CE-CB 3.88Å; M127-A135 HydrophobicContact SD-CB 4.37Å; E131-A135 VanDerWaalsContact O-CB 3.32Å; E131-A135 WeakPolarHBondContact O-CB 3.32Å; E131-A135 PolarHBondContact O-N 3.01Å; M132-A135 PolarHBondContact O-N 3.06Å; A135-A137 PolarHBondContact O-N 3.49Å; A135-L138 PolarHBondContact O-N 3.3Å; A135-E139 PolarHBondContact O-N 3.05Å
136	M	84.4	Confident	84	Confident	111 Å²	111	87.9 Å²	87.9	55%	0.547	46%	0.462	S	S	.	.	H	α-helix	trans	-62.7	-43.1	178	-72.9	178.9	67.6	0	0	112.4	F28 M132 V133 L138 E139 A140	F28-M136 HydrophobicContact CZ-CG 4.26Å; M132-M136 HydrophobicContact CG-SD 4.32Å; M132-M136 WeakPolarHBondContact O-CG 3.47Å; M132-M136 PolarHBondContact O-N 2.91Å; V133-M136 PolarHBondContact O-N 2.88Å; M136-L138 PolarHBondContact O-N 3.07Å; M136-E139 PolarHBondContact O-N 3.4Å; M136-A140 WeakPolarHBondContact O-CB 3.43Å; M136-A140 PolarHBondContact O-N 3.49Å
137	A	87.1	Confident	85	Confident	55 Å²	55	87.2 Å²	87.2	46%	0.455	45%	0.451	S	S	.	.	H	α-helix	trans	-61.7	-42.1	176.4	0	0	0	0	0	112.1	V133 A134 A135 E139 A140 V141	V133-A137 WeakPolarHBondContact O-CB 3.33Å; V133-A137 PolarHBondContact O-N 2.96Å; A134-A137 PolarHBondContact O-N 2.93Å; A135-A137 PolarHBondContact O-N 3.49Å; A137-E139 VanDerWaalsContact C-N 3.35Å; A137-E139 PolarHBondContact O-N 3.31Å; A137-A140 PolarHBondContact O-N 3.5Å; A137-V141 WeakPolarHBondContact O-CG2 3.44Å; A137-V141 PolarHBondContact O-N 2.89Å
138	L	85.6	Confident	85.9	Confident	73 Å²	73	87.9 Å²	87.9	38%	0.382	46%	0.456	S	S	.	.	H	α-helix	trans	-63	-41	176.2	-74.6	171.1	0	0	0	112.1	N24 A134 A135 M136 V141 R142	N24-L138 WeakPolarHBondContact ND2-CD1 3.44Å; A134-L138 WeakPolarHBondContact O-CG 3.45Å; A134-L138 PolarHBondContact O-N 3.32Å; A135-L138 PolarHBondContact O-N 3.3Å; M136-L138 PolarHBondContact O-N 3.07Å; L138-V141 PolarHBondContact O-N 3.12Å; L138-R142 WeakPolarHBondContact O-CG 3.22Å; L138-R142 PolarHBondContact O-N 3.43Å; L138-R142 VanDerWaalsContact O-N 3.12Å
139	E	82.9	Confident	86.3	Confident	32 Å²	32	91.4 Å²	91.4	15%	0.15	46%	0.464	C	S	.	.	H	α-helix	trans	-69.5	-40.2	177.3	-169.9	54.9	-147.2	0	0	111.9	F28 A135 M136 A137 V141 R142 Q143	F28-E139 HydrophobicContact CD2-CB 4.37Å; F28-E139 HydrophobicContact CE2-CB 4.1Å; F28-E139 HydrophobicContact CZ-CB 4.31Å; A135-E139 PolarHBondContact O-N 3.05Å; M136-E139 PolarHBondContact O-N 3.4Å; A137-E139 VanDerWaalsContact C-N 3.35Å; A137-E139 PolarHBondContact O-N 3.31Å; E139-V141 VanDerWaalsContact C-N 3.29Å; E139-V141 PolarHBondContact O-N 3.17Å; E139-R142 WeakPolarHBondContact O-CB 3.25Å; E139-R142 PolarHBondContact O-N 2.91Å; E139-R142 VanDerWaalsContact OE2-CD 3.25Å; E139-R142 WeakPolarHBondContact OE2-CD 3.43Å; E139-R142 IonicContact OE2-CZ 3.1Å; E139-R142 IonicContact OE2-NE 3.24Å; E139-R142 IonicContact OE2-NH1 3.99Å; E139-R142 PolarHBondContact OE2-NH1 3.05Å; E139-Q143 WeakPolarHBondContact O-CG 3.4Å; E139-Q143 PolarHBondContact O-N 3.46Å
140	A	88.3	Confident	86.5	Confident	53 Å²	53	89.2 Å²	89.2	44%	0.438	46%	0.455	S	S	.	.	H	α-helix	trans	-57.2	-42.5	173.4	0	0	0	0	0	111.8	M136 A137 R142 Q143 Q144	M136-A140 WeakPolarHBondContact O-CB 3.43Å; M136-A140 PolarHBondContact O-N 3.49Å; A137-A140 PolarHBondContact O-N 3.5Å; A140-R142 PolarHBondContact O-N 2.86Å; A140-Q143 PolarHBondContact O-N 2.86Å; A140-Q144 WeakPolarHBondContact O-CB 3.48Å; A140-Q144 PolarHBondContact O-N 2.89Å
141	V	88.9	Confident	86.7	Confident	81 Å²	81	89 Å²	89	49%	0.491	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-39	175	171.5	0	0	0	0	111.8	A137 L138 E139 K145	A137-V141 WeakPolarHBondContact O-CG2 3.44Å; A137-V141 PolarHBondContact O-N 2.89Å; L138-V141 PolarHBondContact O-N 3.12Å; E139-V141 VanDerWaalsContact C-N 3.29Å; E139-V141 PolarHBondContact O-N 3.17Å; V141-K145 WeakPolarHBondContact O-CG 3.46Å; V141-K145 PolarHBondContact O-N 3.34Å
142	R	85.9	Confident	86.9	Confident	62 Å²	62	92.1 Å²	92.1	23%	0.234	47%	0.466	C	S	.	.	H	α-helix	trans	-65.8	-42.1	175.6	-71.6	170.3	-178.4	168.9	-4.1	111.6	T25 L138 E139 A140 K145 R146	T25-R142 PolarHBondContact OG1-NH2 3.12Å; T25-R142 VanDerWaalsContact OG1-NH2 3.12Å; L138-R142 WeakPolarHBondContact O-CG 3.22Å; L138-R142 PolarHBondContact O-N 3.43Å; L138-R142 VanDerWaalsContact O-N 3.12Å; E139-R142 WeakPolarHBondContact O-CB 3.25Å; E139-R142 PolarHBondContact O-N 2.91Å; E139-R142 VanDerWaalsContact OE2-CD 3.25Å; E139-R142 WeakPolarHBondContact OE2-CD 3.43Å; E139-R142 IonicContact OE2-CZ 3.1Å; E139-R142 IonicContact OE2-NE 3.24Å; E139-R142 IonicContact OE2-NH1 3.99Å; E139-R142 PolarHBondContact OE2-NH1 3.05Å; A140-R142 PolarHBondContact O-N 2.86Å; R142-K145 PolarHBondContact O-N 3.18Å; R142-R146 WeakPolarHBondContact O-CG 3.26Å; R142-R146 PolarHBondContact O-N 3.46Å
143	Q	87.8	Confident	87.3	Confident	107 Å²	107	93.5 Å²	93.5	50%	0.5	47%	0.469	S	S	.	.	H	α-helix	trans	-64.3	-43.9	177.3	-70.7	-179.1	-4.2	0	0	111.3	E139 A140 K145 R146 L147	E139-Q143 WeakPolarHBondContact O-CG 3.4Å; E139-Q143 PolarHBondContact O-N 3.46Å; A140-Q143 PolarHBondContact O-N 2.86Å; Q143-K145 PolarHBondContact O-N 3.4Å; Q143-R146 WeakPolarHBondContact O-CB 3.4Å; Q143-R146 PolarHBondContact O-N 3.2Å; Q143-L147 PolarHBondContact O-N 3.04Å
144	Q	91	Very high	87.8	Confident	102 Å²	102	93.2 Å²	93.2	48%	0.477	47%	0.467	S	S	.	.	H	α-helix	trans	-56.7	-48.8	176.1	-171.4	61.6	32.9	0	0	111.5	A140 R146 L147 D148	A140-Q144 WeakPolarHBondContact O-CB 3.48Å; A140-Q144 PolarHBondContact O-N 2.89Å; Q144-R146 PolarHBondContact O-N 3.31Å; Q144-L147 WeakPolarHBondContact O-CB 3.46Å; Q144-L147 PolarHBondContact O-N 2.88Å; Q144-D148 PolarHBondContact NE2-OD1 3.36Å; Q144-D148 PolarHBondContact O-N 3.05Å
145	K	91.4	Very high	87.8	Confident	144 Å²	144	93.6 Å²	93.6	63%	0.626	47%	0.467	S	S	*	.	H	α-helix	trans	-59.6	-32.4	176.6	-72.5	179.2	178.5	-178.6	0	113.5	V141 R142 Q143 K149	V141-K145 WeakPolarHBondContact O-CG 3.46Å; V141-K145 PolarHBondContact O-N 3.34Å; R142-K145 PolarHBondContact O-N 3.18Å; Q143-K145 PolarHBondContact O-N 3.4Å; K145-K149 PolarHBondContact O-N 3.02Å
146	R	89.8	Confident	88	Confident	168 Å²	168	99.2 Å²	99.2	63%	0.634	49%	0.493	S	S	*	.	H	α-helix	trans	-70.6	-41	174.8	-71.1	175.7	-179.5	175.8	3.3	111	R142 Q143 Q144 M150	R142-R146 WeakPolarHBondContact O-CG 3.26Å; R142-R146 PolarHBondContact O-N 3.46Å; Q143-R146 WeakPolarHBondContact O-CB 3.4Å; Q143-R146 PolarHBondContact O-N 3.2Å; Q144-R146 PolarHBondContact O-N 3.31Å; R146-M150 WeakPolarHBondContact O-CG 3.41Å; R146-M150 PolarHBondContact O-N 2.95Å; R146-M150 VanDerWaalsContact O-N 3.1Å
147	L	92	Very high	88.1	Confident	99 Å²	99	98 Å²	98	52%	0.518	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-48.2	176.8	-69.2	175.5	0	0	0	111.5	Q143 Q144 K149 M150 E151	Q143-L147 PolarHBondContact O-N 3.04Å; Q144-L147 WeakPolarHBondContact O-CB 3.46Å; Q144-L147 PolarHBondContact O-N 2.88Å; L147-K149 VanDerWaalsContact C-N 3.26Å; L147-K149 PolarHBondContact O-N 3.46Å; L147-M150 CarbonylContact O-C 3.57Å; L147-M150 WeakPolarHBondContact O-CA 3.41Å; L147-M150 WeakPolarHBondContact O-CB 3.46Å; L147-M150 PolarHBondContact O-N 3.35Å; L147-E151 PolarHBondContact O-N 3.45Å
148	D	91.4	Very high	87.9	Confident	72 Å²	72	99 Å²	99	39%	0.385	49%	0.492	S	S	.	.	H	α-helix	trans	-56.2	-43.2	178.8	-58	-20.2	0	0	0	111.1	Q144 M150 E151 E152	Q144-D148 PolarHBondContact NE2-OD1 3.36Å; Q144-D148 PolarHBondContact O-N 3.05Å; D148-M150 VanDerWaalsContact C-N 3.33Å; D148-M150 PolarHBondContact O-N 3.1Å; D148-E151 PolarHBondContact O-N 2.82Å; D148-E152 PolarHBondContact O-N 2.94Å
149	K	90	Very high	87.5	Confident	130 Å²	130	100.7 Å²	100.7	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-67	-32.4	176.5	-173.9	175	-175.8	175.2	0	113	K145 L147 K153	K145-K149 PolarHBondContact O-N 3.02Å; L147-K149 VanDerWaalsContact C-N 3.26Å; L147-K149 PolarHBondContact O-N 3.46Å; K149-K153 WeakPolarHBondContact O-CG 3.45Å; K149-K153 PolarHBondContact O-N 3.26Å
150	M	87.5	Confident	87.2	Confident	118 Å²	118	101.6 Å²	101.6	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-74.3	-39.3	175.2	-76.5	177.1	63.4	0	0	111.1	R146 L147 D148 K153 V154	R146-M150 WeakPolarHBondContact O-CG 3.41Å; R146-M150 PolarHBondContact O-N 2.95Å; R146-M150 VanDerWaalsContact O-N 3.1Å; L147-M150 CarbonylContact O-C 3.57Å; L147-M150 WeakPolarHBondContact O-CA 3.41Å; L147-M150 WeakPolarHBondContact O-CB 3.46Å; L147-M150 PolarHBondContact O-N 3.35Å; D148-M150 VanDerWaalsContact C-N 3.33Å; D148-M150 PolarHBondContact O-N 3.1Å; M150-K153 WeakPolarHBondContact O-CB 3.34Å; M150-K153 PolarHBondContact O-N 3.17Å; M150-V154 WeakPolarHBondContact O-CG2 3.49Å; M150-V154 PolarHBondContact O-N 3.37Å
151	E	89.2	Confident	86.8	Confident	138 Å²	138	101.9 Å²	101.9	65%	0.645	50%	0.502	S	S	*	.	H	α-helix	trans	-60.8	-44.5	176.6	-172.7	173.9	-172.8	0	0	111.6	L147 D148 K153 V154 S155	L147-E151 PolarHBondContact O-N 3.45Å; D148-E151 PolarHBondContact O-N 2.82Å; E151-K153 VanDerWaalsContact C-N 3.32Å; E151-K153 PolarHBondContact O-N 2.89Å; E151-V154 PolarHBondContact O-N 3.22Å; E151-V154 VanDerWaalsContact O-N 3.17Å; E151-S155 PolarHBondContact O-N 2.85Å
152	E	87.5	Confident	86.1	Confident	145 Å²	145	101.8 Å²	101.8	68%	0.678	50%	0.496	S	S	*	.	H	α-helix	trans	-56.9	-45	173.9	-173	-174.1	-179.4	0	0	111.8	D148 S155 H156	D148-E152 PolarHBondContact O-N 2.94Å; E152-S155 PolarHBondContact O-N 3.04Å; E152-H156 PolarHBondContact O-N 3.45Å
153	K	87.1	Confident	85.3	Confident	128 Å²	128	104.9 Å²	104.9	56%	0.557	51%	0.514	S	S	*	.	H	α-helix	trans	-65.3	-41.1	176.8	-71.5	178.1	177.9	-171.3	0	112.3	K149 M150 E151 H156 V157	K149-K153 WeakPolarHBondContact O-CG 3.45Å; K149-K153 PolarHBondContact O-N 3.26Å; M150-K153 WeakPolarHBondContact O-CB 3.34Å; M150-K153 PolarHBondContact O-N 3.17Å; E151-K153 VanDerWaalsContact C-N 3.32Å; E151-K153 PolarHBondContact O-N 2.89Å; K153-H156 PolarHBondContact O-N 2.98Å; K153-V157 VanDerWaalsContact O-CG2 3.28Å; K153-V157 WeakPolarHBondContact O-CG2 3.28Å; K153-V157 PolarHBondContact O-N 3.42Å
154	V	91.4	Very high	84.5	Confident	89 Å²	89	104.6 Å²	104.6	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-44.4	177.7	170.2	0	0	0	0	109.9	M150 E151 H156 V157 T158	M150-V154 WeakPolarHBondContact O-CG2 3.49Å; M150-V154 PolarHBondContact O-N 3.37Å; E151-V154 PolarHBondContact O-N 3.22Å; E151-V154 VanDerWaalsContact O-N 3.17Å; V154-H156 PolarHBondContact O-N 3.46Å; V154-V157 PolarHBondContact O-N 2.65Å; V154-T158 HydrophobicContact CG1-CG2 4.29Å; V154-T158 WeakPolarHBondContact O-CG2 3.42Å; V154-T158 PolarHBondContact O-N 3.3Å; V154-T158 PolarHBondContact O-OG1 3.25Å
155	S	85.8	Confident	83.3	Confident	58 Å²	58	102.9 Å²	102.9	41%	0.406	51%	0.505	S	S	.	.	H	α-helix	trans	-55.5	-51.5	174.4	174.9	0	0	0	0	111.4	E151 E152 V157 T158 E159	E151-S155 PolarHBondContact O-N 2.85Å; E152-S155 PolarHBondContact O-N 3.04Å; S155-V157 VanDerWaalsContact C-N 3.34Å; S155-V157 PolarHBondContact O-N 3.47Å; S155-T158 WeakPolarHBondContact CA-OG1 3.27Å; S155-T158 PolarHBondContact O-N 2.97Å; S155-T158 VanDerWaalsContact O-N 3.11Å; S155-T158 PolarHBondContact O-OG1 3.42Å; S155-E159 PolarHBondContact O-N 2.89Å
156	H	82.3	Confident	81.9	Confident	119 Å²	119	104.3 Å²	104.3	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-60.1	-41.2	178	-176.5	61.4	0	0	0	113.4	E152 K153 V154 E159 T160	E152-H156 PolarHBondContact O-N 3.45Å; K153-H156 PolarHBondContact O-N 2.98Å; V154-H156 PolarHBondContact O-N 3.46Å; H156-E159 PolarHBondContact O-N 3.26Å; H156-T160 PolarHBondContact O-N 2.81Å; H156-T160 PolarHBondContact O-OG1 3.02Å
157	V	86.9	Confident	80.7	Confident	85 Å²	85	97.1 Å²	97.1	52%	0.515	48%	0.484	S	S	.	.	H	α-helix	trans	-64	-43.1	175.2	170.1	0	0	0	0	110.8	K153 V154 S155 E159 T160 V161	K153-V157 VanDerWaalsContact O-CG2 3.28Å; K153-V157 WeakPolarHBondContact O-CG2 3.28Å; K153-V157 PolarHBondContact O-N 3.42Å; V154-V157 PolarHBondContact O-N 2.65Å; S155-V157 VanDerWaalsContact C-N 3.34Å; S155-V157 PolarHBondContact O-N 3.47Å; V157-E159 PolarHBondContact O-N 3.49Å; V157-T160 PolarHBondContact O-N 3.11Å; V157-V161 HydrophobicContact CG1-CG2 4.22Å; V157-V161 WeakPolarHBondContact O-CB 3.44Å; V157-V161 VanDerWaalsContact O-CG2 3.27Å; V157-V161 WeakPolarHBondContact O-CG2 3.32Å; V157-V161 PolarHBondContact O-N 3.34Å
158	T	83.4	Confident	79.8	Confident	75 Å²	75	98.8 Å²	98.8	46%	0.46	50%	0.499	S	S	.	.	H	α-helix	trans	-61.8	-42.3	177.7	56.9	0	0	0	0	112	V154 S155 T160 V161 E162	V154-T158 HydrophobicContact CG1-CG2 4.29Å; V154-T158 WeakPolarHBondContact O-CG2 3.42Å; V154-T158 PolarHBondContact O-N 3.3Å; V154-T158 PolarHBondContact O-OG1 3.25Å; S155-T158 WeakPolarHBondContact CA-OG1 3.27Å; S155-T158 PolarHBondContact O-N 2.97Å; S155-T158 VanDerWaalsContact O-N 3.11Å; S155-T158 PolarHBondContact O-OG1 3.42Å; T158-T160 PolarHBondContact O-N 2.83Å; T158-V161 PolarHBondContact O-N 2.86Å; T158-E162 WeakPolarHBondContact O-CB 3.46Å; T158-E162 WeakPolarHBondContact O-CG 3.3Å; T158-E162 PolarHBondContact O-N 3.26Å
159	E	77.4	Confident	79.3	Confident	110 Å²	110	96.5 Å²	96.5	51%	0.514	49%	0.487	S	S	.	.	H	α-helix	trans	-61.3	-45.3	174.8	-70.9	-179.6	173.3	0	0	111.9	S155 H156 V157 V161 E162 Q163	S155-E159 PolarHBondContact O-N 2.89Å; H156-E159 PolarHBondContact O-N 3.26Å; V157-E159 PolarHBondContact O-N 3.49Å; E159-V161 PolarHBondContact O-N 2.91Å; E159-E162 PolarHBondContact O-N 3.38Å; E159-Q163 WeakPolarHBondContact O-CG 3.43Å; E159-Q163 PolarHBondContact O-N 3.49Å
160	T	76.5	Confident	79.1	Confident	50 Å²	50	97.8 Å²	97.8	31%	0.307	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-42.8	179	-52.5	0	0	0	0	111.2	H156 V157 T158 E162 Q163 I164	H156-T160 PolarHBondContact O-N 2.81Å; H156-T160 PolarHBondContact O-OG1 3.02Å; V157-T160 PolarHBondContact O-N 3.11Å; T158-T160 PolarHBondContact O-N 2.83Å; T160-E162 PolarHBondContact O-N 3.43Å; T160-Q163 WeakPolarHBondContact O-CB 3.25Å; T160-Q163 PolarHBondContact O-N 3.5Å; T160-I164 HydrophobicContact CG2-CD1 4.09Å; T160-I164 VanDerWaalsContact O-CG1 3.25Å; T160-I164 WeakPolarHBondContact O-CG1 3.32Å; T160-I164 PolarHBondContact O-N 2.86Å
161	V	79.5	Confident	79.1	Confident	60 Å²	60	99.7 Å²	99.7	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-42.2	175.7	168.6	0	0	0	0	111	V157 T158 E159 Q163 I164 K165	V157-V161 HydrophobicContact CG1-CG2 4.22Å; V157-V161 WeakPolarHBondContact O-CB 3.44Å; V157-V161 VanDerWaalsContact O-CG2 3.27Å; V157-V161 WeakPolarHBondContact O-CG2 3.32Å; V157-V161 PolarHBondContact O-N 3.34Å; T158-V161 PolarHBondContact O-N 2.86Å; E159-V161 PolarHBondContact O-N 2.91Å; V161-Q163 VanDerWaalsContact C-N 3.34Å; V161-Q163 PolarHBondContact O-N 3.28Å; V161-I164 PolarHBondContact O-N 2.9Å; V161-K165 HydrophobicContact CG1-CD 4.27Å; V161-K165 HydrophobicContact CG1-CG 4.42Å; V161-K165 WeakPolarHBondContact O-CG 3.33Å; V161-K165 PolarHBondContact O-N 3.38Å
162	E	74.4	Confident	79.3	Confident	78 Å²	78	95.6 Å²	95.6	36%	0.364	50%	0.495	S	S	.	.	H	α-helix	trans	-65.7	-36.2	176.2	-73.5	-58.7	127.7	0	0	112.4	T158 E159 T160 K165 R166	T158-E162 WeakPolarHBondContact O-CB 3.46Å; T158-E162 WeakPolarHBondContact O-CG 3.3Å; T158-E162 PolarHBondContact O-N 3.26Å; E159-E162 PolarHBondContact O-N 3.38Å; T160-E162 PolarHBondContact O-N 3.43Å; E162-K165 WeakPolarHBondContact OE1-CD 3.35Å; E162-K165 IonicContact OE1-NZ 2.81Å; E162-K165 PolarHBondContact OE1-NZ 2.93Å; E162-R166 VanDerWaalsContact O-CG 3.3Å; E162-R166 WeakPolarHBondContact O-CG 3.48Å; E162-R166 PolarHBondContact O-N 3.28Å; E162-R166 VanDerWaalsContact O-N 3.1Å
163	Q	69	Low	79.6	Confident	128 Å²	128	91.2 Å²	91.2	60%	0.598	47%	0.473	S	S	*	.	H	α-helix	trans	-63	-44.7	171.7	-72.1	175.1	11.1	0	0	111.6	E159 T160 V161 R166 G167	E159-Q163 WeakPolarHBondContact O-CG 3.43Å; E159-Q163 PolarHBondContact O-N 3.49Å; T160-Q163 WeakPolarHBondContact O-CB 3.25Å; T160-Q163 PolarHBondContact O-N 3.5Å; V161-Q163 VanDerWaalsContact C-N 3.34Å; V161-Q163 PolarHBondContact O-N 3.28Å; Q163-R166 PolarHBondContact O-N 3.1Å; Q163-G167 PolarHBondContact O-N 3.5Å
164	I	70.9	Confident	79.9	Confident	100 Å²	100	85.1 Å²	85.1	51%	0.513	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-47.2	177.1	-68.1	164	0	0	0	110.8	T160 V161 R166 G167 L207	T160-I164 HydrophobicContact CG2-CD1 4.09Å; T160-I164 VanDerWaalsContact O-CG1 3.25Å; T160-I164 WeakPolarHBondContact O-CG1 3.32Å; T160-I164 PolarHBondContact O-N 2.86Å; V161-I164 PolarHBondContact O-N 2.9Å; I164-R166 VanDerWaalsContact C-N 3.31Å; I164-R166 PolarHBondContact O-N 3Å; I164-G167 PolarHBondContact O-N 3.38Å; I164-G167 VanDerWaalsContact O-N 3.15Å; I164-L207 HydrophobicContact CG2-CD1 4.12Å
165	K	66.1	Low	80	Confident	66 Å²	66	81.2 Å²	81.2	29%	0.287	42%	0.424	S	S	.	.	H	α-helix	trans	-57.6	-42.5	178	-76.4	176.6	-175.1	169.7	0	112.1	V161 E162 G167	V161-K165 HydrophobicContact CG1-CD 4.27Å; V161-K165 HydrophobicContact CG1-CG 4.42Å; V161-K165 WeakPolarHBondContact O-CG 3.33Å; V161-K165 PolarHBondContact O-N 3.38Å; E162-K165 WeakPolarHBondContact OE1-CD 3.35Å; E162-K165 IonicContact OE1-NZ 2.81Å; E162-K165 PolarHBondContact OE1-NZ 2.93Å; K165-G167 PolarHBondContact O-N 3.4Å
166	R	60.9	Low	80.4	Confident	175 Å²	175	79.5 Å²	79.5	66%	0.66	41%	0.409	S	S	*	.	H	α-helix	trans	-66.1	-22.9	-178.2	-73	176.9	-163.8	-163.8	6.2	113.3	E162 Q163 I164 R216	E162-R166 VanDerWaalsContact O-CG 3.3Å; E162-R166 WeakPolarHBondContact O-CG 3.48Å; E162-R166 PolarHBondContact O-N 3.28Å; E162-R166 VanDerWaalsContact O-N 3.1Å; Q163-R166 PolarHBondContact O-N 3.1Å; I164-R166 VanDerWaalsContact C-N 3.31Å; I164-R166 PolarHBondContact O-N 3Å; R166-R216 PolarHBondContact O-NH2 2.86Å
167	G	65.9	Low	80.9	Confident	16 Å²	16	84.4 Å²	84.4	17%	0.165	42%	0.423	C	S	.	.			trans	63.4	124	-168.3	0	0	0	0	0	110.2	Q163 I164 K165 I169	Q163-G167 PolarHBondContact O-N 3.5Å; I164-G167 PolarHBondContact O-N 3.38Å; I164-G167 VanDerWaalsContact O-N 3.15Å; K165-G167 PolarHBondContact O-N 3.4Å; G167-I169 PolarHBondContact O-N 3.29Å
168	T	73.1	Confident	81.2	Confident	135 Å²	135	84.9 Å²	84.9	83%	0.828	42%	0.419	S	S	*	.			trans	-66.3	99.3	168	28.4	0	0	0	0	108.1	R170 H204	T168-R170 PolarHBondContact O-N 3.25Å; T168-H204 PolarHBondContact O-CE1 3.37Å; T168-H204 VanDerWaalsContact O-CE1 3.29Å
169	I	81.2	Confident	81.7	Confident	24 Å²	24	81.3 Å²	81.3	12%	0.123	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-55.9	133.4	168.3	-60.3	178.2	0	0	0	106.5	G167 D171 Y173 I218	G167-I169 PolarHBondContact O-N 3.29Å; I169-D171 PolarHBondContact O-N 2.96Å; I169-Y173 VanDerWaalsContact CG2-O 3.26Å; I169-Y173 WeakPolarHBondContact CG2-O 3.4Å; I169-I218 HydrophobicContact CD1-CG2 4.29Å; I169-I218 HydrophobicContact CG1-CG2 4.43Å; I169-I218 HydrophobicContact CG2-CB 4.34Å; I169-I218 HydrophobicContact CG2-CD1 4.07Å; I169-I218 HydrophobicContact CG2-CG2 3.94Å
170	R	84.5	Confident	82.6	Confident	156 Å²	156	78.1 Å²	78.1	59%	0.589	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-48.5	135.1	176.9	-176.5	-179.1	-178.1	-179.1	1.1	110.2	T168 G172 Y173	T168-R170 PolarHBondContact O-N 3.25Å; R170-G172 PolarHBondContact O-N 3.22Å; R170-Y173 HydrophobicContact CB-CD2 4.24Å; R170-Y173 HydrophobicContact CG-CD2 4.24Å; R170-Y173 WeakPolarHBondContact O-CB 3.44Å; R170-Y173 PolarHBondContact O-N 2.82Å
171	D	87.7	Confident	83.4	Confident	158 Å²	158	79.8 Å²	79.8	85%	0.845	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	137.6	176.2	-75.5	-18.5	0	0	0	111.3	I169 Y173	I169-D171 PolarHBondContact O-N 2.96Å; D171-Y173 VanDerWaalsContact C-N 3.32Å
172	G	93.1	Very high	84	Confident	52 Å²	52	82.9 Å²	82.9	54%	0.536	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-3.5	-175.1	0	0	0	0	0	115.2	R170 V221	R170-G172 PolarHBondContact O-N 3.22Å; G172-V221 WeakPolarHBondContact O-CB 3.29Å; G172-V221 WeakPolarHBondContact O-CG2 3.44Å; G172-V221 PolarHBondContact O-N 2.83Å
173	Y	94.8	Very high	84.9	Confident	53 Å²	53	79.3 Å²	79.3	21%	0.208	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	153.8	176.4	-72.9	-103.9	0	0	0	112.8	I169 R170 D171 D202 I218 V219 A220	I169-Y173 VanDerWaalsContact CG2-O 3.26Å; I169-Y173 WeakPolarHBondContact CG2-O 3.4Å; R170-Y173 HydrophobicContact CB-CD2 4.24Å; R170-Y173 HydrophobicContact CG-CD2 4.24Å; R170-Y173 WeakPolarHBondContact O-CB 3.44Å; R170-Y173 PolarHBondContact O-N 2.82Å; D171-Y173 VanDerWaalsContact C-N 3.32Å; Y173-D202 HydrophobicContact CD1-CB 4.2Å; Y173-D202 HydrophobicContact CE1-CB 3.76Å; Y173-I218 HydrophobicContact CD1-CB 4.34Å; Y173-I218 HydrophobicContact CD1-CD1 3.86Å; Y173-I218 HydrophobicContact CD1-CG1 3.94Å; Y173-I218 HydrophobicContact CG-CD1 3.87Å; Y173-I218 HydrophobicContact CG-CG1 4.39Å; Y173-V219 CarbonylContact C-O 3.5Å; Y173-V219 VanDerWaalsContact CA-O 3.31Å; Y173-V219 WeakPolarHBondContact CA-O 3.48Å; Y173-V219 VanDerWaalsContact CD1-C 3.48Å; Y173-A220 HydrophobicContact CD1-CB 4.38Å; Y173-A220 HydrophobicContact CE1-CB 4Å
174	A	93.2	Very high	86.1	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.008	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.2	176.8	0	0	0	0	0	111.7	Q178 L179 I218 V219 V221	A174-Q178 HydrophobicContact CB-CB 4.09Å; A174-Q178 VanDerWaalsContact CB-OE1 3.28Å; A174-L179 HydrophobicContact CB-CD2 3.89Å; A174-L179 HydrophobicContact CB-CG 4.34Å; A174-I218 WeakPolarHBondContact O-CA 3.41Å; A174-V219 PolarHBondContact N-O 3.27Å; A174-V219 PolarHBondContact O-N 3.36Å; A174-V221 HydrophobicContact CB-CG2 3.47Å; A174-V221 VanDerWaalsContact CB-CG2 3.47Å
175	G	93.2	Very high	87.2	Confident	7 Å²	7	69.6 Å²	69.6	7%	0.072	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	158.3	168.9	0	0	0	0	0	111.9	R177 Q178 L179	G175-R177 VanDerWaalsContact C-N 3.26Å; G175-R177 PolarHBondContact O-N 3.22Å; G175-R177 VanDerWaalsContact O-N 3.13Å; G175-Q178 WeakPolarHBondContact O-CB 3.5Å; G175-Q178 PolarHBondContact O-N 2.71Å; G175-L179 PolarHBondContact O-N 3.45Å
176	Y	94.8	Very high	88.6	Confident	21 Å²	21	69.5 Å²	69.5	8%	0.082	36%	0.362	C	S	.	.	H	α-helix	trans	-53.7	-37	-177	-74.4	-75.2	0	0	0	114.6	Q178 L179 V180 D187 C190 R191 V194 T217 V219	Y176-Q178 VanDerWaalsContact C-N 3.27Å; Y176-Q178 PolarHBondContact O-N 2.91Å; Y176-L179 HydrophobicContact CD1-CD1 4.15Å; Y176-L179 WeakPolarHBondContact O-CB 3.42Å; Y176-L179 PolarHBondContact O-N 2.91Å; Y176-L179 VanDerWaalsContact O-N 3.09Å; Y176-V180 WeakPolarHBondContact O-CG2 3.42Å; Y176-V180 PolarHBondContact O-N 3.26Å; Y176-D187 WeakPolarHBondContact CB-OD2 3.46Å; Y176-C190 HydrophobicContact CD1-CB 3.87Å; Y176-C190 HydrophobicContact CE1-CB 4.32Å; Y176-R191 HydrophobicContact CD1-CG 3.85Å; Y176-R191 HydrophobicContact CD2-CG 4.47Å; Y176-R191 HydrophobicContact CE1-CB 4.16Å; Y176-R191 HydrophobicContact CE1-CG 3.42Å; Y176-R191 VanDerWaalsContact CE1-CG 3.42Å; Y176-R191 HydrophobicContact CE2-CG 4.1Å; Y176-R191 HydrophobicContact CG-CG 4.36Å; Y176-V194 HydrophobicContact CE1-CG2 4.02Å; Y176-T217 HydrophobicContact CE2-CG2 4.31Å; Y176-V219 HydrophobicContact CE1-CG2 4.01Å; Y176-V219 HydrophobicContact CE2-CG2 4.26Å
177	R	92.2	Very high	90.3	Very high	223 Å²	223	64 Å²	64	84%	0.842	35%	0.346	S	S	*	.	H	α-helix	trans	-58.2	-37.8	175.7	-170.5	178.3	178.7	120.7	-0.9	112.9	G175 A181	G175-R177 VanDerWaalsContact C-N 3.26Å; G175-R177 PolarHBondContact O-N 3.22Å; G175-R177 VanDerWaalsContact O-N 3.13Å; R177-A181 PolarHBondContact O-N 3.43Å
178	Q	92.6	Very high	91.7	Very high	94 Å²	94	66 Å²	66	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-72.2	-38	176.5	-64.4	177	9.2	0	0	111.1	A174 G175 Y176 A181 K182	A174-Q178 HydrophobicContact CB-CB 4.09Å; A174-Q178 VanDerWaalsContact CB-OE1 3.28Å; G175-Q178 WeakPolarHBondContact O-CB 3.5Å; G175-Q178 PolarHBondContact O-N 2.71Å; Y176-Q178 VanDerWaalsContact C-N 3.27Å; Y176-Q178 PolarHBondContact O-N 2.91Å; Q178-A181 PolarHBondContact O-N 3.2Å; Q178-K182 WeakPolarHBondContact O-CG 3.42Å; Q178-K182 PolarHBondContact O-N 2.93Å
179	L	94.8	Very high	92.8	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.3	-40.5	176.9	-58.5	176.5	0	0	0	112.2	A174 G175 Y176 A181 K182 T183 V219 F224	A174-L179 HydrophobicContact CB-CD2 3.89Å; A174-L179 HydrophobicContact CB-CG 4.34Å; G175-L179 PolarHBondContact O-N 3.45Å; Y176-L179 HydrophobicContact CD1-CD1 4.15Å; Y176-L179 WeakPolarHBondContact O-CB 3.42Å; Y176-L179 PolarHBondContact O-N 2.91Å; Y176-L179 VanDerWaalsContact O-N 3.09Å; L179-A181 VanDerWaalsContact C-N 3.32Å; L179-A181 PolarHBondContact O-N 3.15Å; L179-K182 PolarHBondContact O-N 3.28Å; L179-T183 PolarHBondContact O-N 2.87Å; L179-T183 PolarHBondContact O-OG1 3.34Å; L179-V219 HydrophobicContact CD1-CB 3.81Å; L179-V219 HydrophobicContact CD1-CG1 4.25Å; L179-V219 HydrophobicContact CD1-CG2 3.78Å; L179-F224 HydrophobicContact CB-CE1 3.91Å; L179-F224 HydrophobicContact CB-CZ 3.89Å; L179-F224 HydrophobicContact CD1-CD1 4.38Å; L179-F224 HydrophobicContact CD1-CD2 3.9Å; L179-F224 HydrophobicContact CD1-CE1 4.24Å; L179-F224 HydrophobicContact CD1-CE2 3.78Å; L179-F224 HydrophobicContact CD1-CG 4.21Å; L179-F224 HydrophobicContact CD1-CZ 3.96Å; L179-F224 HydrophobicContact CD2-CD1 3.7Å; L179-F224 HydrophobicContact CD2-CE1 3.87Å; L179-F224 HydrophobicContact CD2-CG 4.09Å; L179-F224 HydrophobicContact CD2-CZ 4.42Å; L179-F224 HydrophobicContact CG-CD1 4.43Å; L179-F224 HydrophobicContact CG-CE1 4.21Å; L179-F224 HydrophobicContact CG-CZ 4.31Å
180	V	95.4	Very high	93.5	Very high	44 Å²	44	60.3 Å²	60.3	27%	0.267	32%	0.324	S	S	.	.	H	α-helix	trans	-57.1	-47	172.1	165.2	0	0	0	0	110.4	Y176 K182 T183 G184 M185 D187	Y176-V180 WeakPolarHBondContact O-CG2 3.42Å; Y176-V180 PolarHBondContact O-N 3.26Å; V180-K182 VanDerWaalsContact C-N 3.33Å; V180-K182 PolarHBondContact O-N 3.31Å; V180-T183 PolarHBondContact O-N 3.04Å; V180-G184 WeakPolarHBondContact O-CA 3.26Å; V180-G184 PolarHBondContact O-N 3.33Å; V180-M185 WeakPolarHBondContact CG1-O 3.33Å; V180-M185 WeakPolarHBondContact CG2-O 3.39Å; V180-D187 HydrophobicContact CG2-CB 3.97Å
181	A	93.5	Very high	94.1	Very high	85 Å²	85	58.1 Å²	58.1	70%	0.702	32%	0.315	S	S	*	.	H	α-helix	trans	-64.3	-36.1	177.6	0	0	0	0	0	112.9	R177 Q178 L179	R177-A181 PolarHBondContact O-N 3.43Å; Q178-A181 PolarHBondContact O-N 3.2Å; L179-A181 VanDerWaalsContact C-N 3.32Å; L179-A181 PolarHBondContact O-N 3.15Å
182	K	92.9	Very high	94.5	Very high	125 Å²	125	54 Å²	54	54%	0.543	29%	0.293	S	S	.	.	H	α-helix	trans	-75	-32.3	179.4	-75	-172.7	176	-162.1	0	114.1	Q178 L179 V180	Q178-K182 WeakPolarHBondContact O-CG 3.42Å; Q178-K182 PolarHBondContact O-N 2.93Å; L179-K182 PolarHBondContact O-N 3.28Å; V180-K182 VanDerWaalsContact C-N 3.33Å; V180-K182 PolarHBondContact O-N 3.31Å
183	T	93.8	Very high	94.7	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-108.5	-15.6	-172.5	58.6	0	0	0	0	114.3	L179 V180 M185 F224 M225 F228	L179-T183 PolarHBondContact O-N 2.87Å; L179-T183 PolarHBondContact O-OG1 3.34Å; V180-T183 PolarHBondContact O-N 3.04Å; T183-M185 HydrophobicContact CG2-CE 4.14Å; T183-M185 PolarHBondContact O-N 3.2Å; T183-M185 PolarHBondContact OG1-N 2.82Å; T183-F224 HydrophobicContact CG2-CE1 3.66Å; T183-F224 HydrophobicContact CG2-CZ 4.37Å; T183-M225 HydrophobicContact CG2-SD 4.17Å; T183-F228 HydrophobicContact CG2-CD1 3.84Å; T183-F228 HydrophobicContact CG2-CD2 3.9Å; T183-F228 HydrophobicContact CG2-CE1 3.93Å; T183-F228 HydrophobicContact CG2-CE2 4Å; T183-F228 HydrophobicContact CG2-CG 3.81Å; T183-F228 HydrophobicContact CG2-CZ 4Å
184	G	93.6	Very high	94.8	Very high	22 Å²	22	49.2 Å²	49.2	23%	0.227	26%	0.259	C	S	.	.			trans	66.5	10.1	-172.9	0	0	0	0	0	114.2	V180 L253	V180-G184 WeakPolarHBondContact O-CA 3.26Å; V180-G184 PolarHBondContact O-N 3.33Å; G184-L253 PolarHBondContact O-N 2.81Å
185	M	94.5	Very high	95	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	29%	0.288	C	S	.	.			trans	-85.6	158.2	173.9	-66.2	-169.2	-65	0	0	111.4	V180 T183 K189 L193 F224 F228 M231 M247 F250 Q251 A252	V180-M185 WeakPolarHBondContact CG1-O 3.33Å; V180-M185 WeakPolarHBondContact CG2-O 3.39Å; T183-M185 HydrophobicContact CG2-CE 4.14Å; T183-M185 PolarHBondContact O-N 3.2Å; T183-M185 PolarHBondContact OG1-N 2.82Å; M185-K189 HydrophobicContact CB-CB 4.21Å; M185-K189 HydrophobicContact SD-CB 4.42Å; M185-L193 HydrophobicContact CE-CD2 4.11Å; M185-F224 HydrophobicContact CE-CZ 4.22Å; M185-F228 HydrophobicContact CE-CD2 3.39Å; M185-F228 HydrophobicContact CE-CE2 3.65Å; M185-F228 HydrophobicContact CE-CG 4.44Å; M185-F228 HydrophobicContact CG-CE2 4.01Å; M185-F228 HydrophobicContact SD-CD2 3.9Å; M185-F228 HydrophobicContact SD-CE2 3.71Å; M185-M231 HydrophobicContact SD-CE 3.96Å; M185-M247 HydrophobicContact SD-CE 4.33Å; M185-F250 HydrophobicContact CG-CD2 4.26Å; M185-F250 HydrophobicContact SD-CD2 4.05Å; M185-F250 HydrophobicContact SD-CE2 4.1Å; M185-Q251 WeakPolarHBondContact CA-O 3.33Å; M185-A252 HydrophobicContact CG-CB 3.99Å
186	S	95	Very high	95.1	Very high	63 Å²	63	56.1 Å²	56.1	44%	0.441	30%	0.3	S	S	.	.			trans	-68.9	156.6	171.5	71.1	0	0	0	0	112	A188 K189 C190	S186-A188 VanDerWaalsContact C-N 3.29Å; S186-A188 PolarHBondContact O-N 3.25Å; S186-K189 PolarHBondContact O-N 2.96Å; S186-K189 WeakPolarHBondContact OG-CG 3.24Å; S186-K189 PolarHBondContact OG-N 3.48Å; S186-C190 PolarHBondContact O-N 3.26Å; S186-C190 PolarHBondContact O-SG 2.89Å
187	D	96	Very high	95.1	Very high	61 Å²	61	57.3 Å²	57.3	33%	0.326	31%	0.305	S	S	.	.	H	α-helix	trans	-55.3	-45.3	178.9	-173.6	-74.5	0	0	0	111.6	Y176 V180 K189 C190 R191	Y176-D187 WeakPolarHBondContact CB-OD2 3.46Å; V180-D187 HydrophobicContact CG2-CB 3.97Å; D187-K189 VanDerWaalsContact C-N 3.28Å; D187-K189 PolarHBondContact O-N 3.4Å; D187-C190 WeakPolarHBondContact O-CB 3.31Å; D187-C190 PolarHBondContact O-N 3.48Å; D187-C190 VanDerWaalsContact O-N 3.11Å; D187-R191 WeakPolarHBondContact O-CG 3.46Å; D187-R191 PolarHBondContact O-N 3.26Å; D187-R191 IonicContact OD1-CZ 3.59Å; D187-R191 IonicContact OD1-NE 2.74Å; D187-R191 PolarHBondContact OD1-NE 2.86Å; D187-R191 IonicContact OD1-NH2 3.64Å; D187-R191 PolarHBondContact OD1-NH2 3.44Å
188	A	96	Very high	95.3	Very high	57 Å²	57	55 Å²	55	47%	0.471	30%	0.303	S	S	.	.	H	α-helix	trans	-57.8	-38.6	175.7	0	0	0	0	0	112.5	S186 R191 N192	S186-A188 VanDerWaalsContact C-N 3.29Å; S186-A188 PolarHBondContact O-N 3.25Å; A188-R191 PolarHBondContact O-N 3.09Å; A188-N192 PolarHBondContact O-N 3.29Å; A188-N192 PolarHBondContact O-OD1 2.92Å
189	K	95.7	Very high	95.5	Very high	40 Å²	40	51 Å²	51	17%	0.174	29%	0.285	C	S	.	.	H	α-helix	trans	-72.6	-37.6	176.6	-66.7	-66	-175.5	175.1	0	111.7	M185 S186 D187 R191 N192 L193 M247 L249 F250	M185-K189 HydrophobicContact CB-CB 4.21Å; M185-K189 HydrophobicContact SD-CB 4.42Å; S186-K189 PolarHBondContact O-N 2.96Å; S186-K189 WeakPolarHBondContact OG-CG 3.24Å; S186-K189 PolarHBondContact OG-N 3.48Å; D187-K189 VanDerWaalsContact C-N 3.28Å; D187-K189 PolarHBondContact O-N 3.4Å; K189-R191 VanDerWaalsContact C-N 3.32Å; K189-R191 PolarHBondContact O-N 3.18Å; K189-N192 PolarHBondContact O-N 2.77Å; K189-L193 PolarHBondContact O-N 3.13Å; K189-M247 HydrophobicContact CB-CE 4.04Å; K189-M247 HydrophobicContact CD-CE 4.19Å; K189-M247 PolarHBondContact NZ-O 2.94Å; K189-M247 WeakPolarHBondContact O-CE 3.35Å; K189-L249 WeakPolarHBondContact CE-O 3.3Å; K189-L249 PolarHBondContact NZ-O 2.95Å; K189-F250 HydrophobicContact CD-CB 3.81Å; K189-F250 HydrophobicContact CG-CB 3.97Å
190	C	96.8	Very high	95.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58.8	-44.2	171.3	-62.9	0	0	0	0	111.3	Y176 S186 D187 L193 V194 F224	Y176-C190 HydrophobicContact CD1-CB 3.87Å; Y176-C190 HydrophobicContact CE1-CB 4.32Å; S186-C190 PolarHBondContact O-N 3.26Å; S186-C190 PolarHBondContact O-SG 2.89Å; D187-C190 WeakPolarHBondContact O-CB 3.31Å; D187-C190 PolarHBondContact O-N 3.48Å; D187-C190 VanDerWaalsContact O-N 3.11Å; C190-L193 PolarHBondContact O-N 3.04Å; C190-V194 WeakPolarHBondContact O-CG2 3.36Å; C190-V194 PolarHBondContact O-N 3.24Å; C190-F224 HydrophobicContact CB-CE2 4.16Å; C190-F224 HydrophobicContact CB-CZ 4.01Å
191	R	97.1	Very high	95.7	Very high	109 Å²	109	55.6 Å²	55.6	41%	0.411	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-43	174.4	-69.3	177.8	-169.5	-106.7	-2.1	112.6	Y176 D187 A188 K189 L193 V194 N195	Y176-R191 HydrophobicContact CD1-CG 3.85Å; Y176-R191 HydrophobicContact CD2-CG 4.47Å; Y176-R191 HydrophobicContact CE1-CB 4.16Å; Y176-R191 HydrophobicContact CE1-CG 3.42Å; Y176-R191 VanDerWaalsContact CE1-CG 3.42Å; Y176-R191 HydrophobicContact CE2-CG 4.1Å; Y176-R191 HydrophobicContact CG-CG 4.36Å; D187-R191 WeakPolarHBondContact O-CG 3.46Å; D187-R191 PolarHBondContact O-N 3.26Å; D187-R191 IonicContact OD1-CZ 3.59Å; D187-R191 IonicContact OD1-NE 2.74Å; D187-R191 PolarHBondContact OD1-NE 2.86Å; D187-R191 IonicContact OD1-NH2 3.64Å; D187-R191 PolarHBondContact OD1-NH2 3.44Å; A188-R191 PolarHBondContact O-N 3.09Å; K189-R191 VanDerWaalsContact C-N 3.32Å; K189-R191 PolarHBondContact O-N 3.18Å; R191-L193 VanDerWaalsContact C-N 3.32Å; R191-L193 PolarHBondContact O-N 3.21Å; R191-V194 PolarHBondContact O-N 2.84Å; R191-N195 PolarHBondContact O-N 3.11Å; R191-N195 PolarHBondContact O-ND2 3.39Å
192	N	96.5	Very high	95.7	Very high	72 Å²	72	54.6 Å²	54.6	39%	0.385	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-41.1	176.5	-70.9	-2.2	0	0	0	111.7	A188 K189 N195 A196 M247	A188-N192 PolarHBondContact O-N 3.29Å; A188-N192 PolarHBondContact O-OD1 2.92Å; K189-N192 PolarHBondContact O-N 2.77Å; N192-N195 PolarHBondContact O-N 2.85Å; N192-A196 WeakPolarHBondContact O-CB 3.32Å; N192-A196 PolarHBondContact O-N 3.19Å; N192-M247 HydrophobicContact CB-SD 4.13Å
193	L	96.5	Very high	95.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-47.1	176	-174.4	70.9	0	0	0	111.1	M185 K189 C190 R191 N195 A196 Y197 I199 F224 A227 F228 M231 M247	M185-L193 HydrophobicContact CE-CD2 4.11Å; K189-L193 PolarHBondContact O-N 3.13Å; C190-L193 PolarHBondContact O-N 3.04Å; R191-L193 VanDerWaalsContact C-N 3.32Å; R191-L193 PolarHBondContact O-N 3.21Å; L193-N195 VanDerWaalsContact C-N 3.3Å; L193-N195 PolarHBondContact O-N 3.31Å; L193-A196 PolarHBondContact O-N 2.8Å; L193-Y197 HydrophobicContact CD1-CD2 3.43Å; L193-Y197 VanDerWaalsContact CD1-CD2 3.43Å; L193-Y197 HydrophobicContact CD1-CE2 3.43Å; L193-Y197 VanDerWaalsContact CD1-CE2 3.43Å; L193-Y197 HydrophobicContact CD1-CG 4.35Å; L193-Y197 HydrophobicContact CG-CD2 4.24Å; L193-Y197 PolarHBondContact O-N 3.03Å; L193-I199 HydrophobicContact CG-CD1 4.13Å; L193-F224 HydrophobicContact CB-CE2 4.41Å; L193-F224 HydrophobicContact CD2-CD2 4.22Å; L193-F224 HydrophobicContact CD2-CE1 4.44Å; L193-F224 HydrophobicContact CD2-CE2 3.81Å; L193-F224 HydrophobicContact CD2-CZ 3.93Å; L193-F224 HydrophobicContact CG-CE2 4.48Å; L193-A227 HydrophobicContact CD1-CB 4.38Å; L193-A227 HydrophobicContact CD2-CB 4.5Å; L193-A227 HydrophobicContact CG-CB 4.44Å; L193-F228 HydrophobicContact CD2-CB 3.84Å; L193-F228 HydrophobicContact CD2-CD2 4.49Å; L193-M231 HydrophobicContact CD1-CB 4.13Å; L193-M231 HydrophobicContact CD1-CG 4.3Å; L193-M231 HydrophobicContact CD1-SD 3.71Å; L193-M247 HydrophobicContact CB-CE 4.16Å; L193-M247 HydrophobicContact CB-SD 4.32Å; L193-M247 HydrophobicContact CD1-SD 4.42Å
194	V	97.5	Very high	95.3	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.024	30%	0.299	C	S	.	.	H	α-helix	trans	-53.5	-48.5	175.7	170.3	0	0	0	0	111.2	Y176 C190 R191 Q198 I199 T201 V219 F224	Y176-V194 HydrophobicContact CE1-CG2 4.02Å; C190-V194 WeakPolarHBondContact O-CG2 3.36Å; C190-V194 PolarHBondContact O-N 3.24Å; R191-V194 PolarHBondContact O-N 2.84Å; V194-Q198 WeakPolarHBondContact O-CA 3.46Å; V194-Q198 PolarHBondContact O-N 3.39Å; V194-I199 HydrophobicContact CB-CB 4.46Å; V194-I199 HydrophobicContact CG1-CB 4.29Å; V194-I199 HydrophobicContact CG2-CB 4.37Å; V194-I199 HydrophobicContact CG2-CD1 4.31Å; V194-I199 PolarHBondContact O-N 2.89Å; V194-T201 HydrophobicContact CG1-CG2 3.58Å; V194-V219 HydrophobicContact CG2-CG1 3.67Å; V194-V219 HydrophobicContact CG2-CG2 4.01Å; V194-F224 HydrophobicContact CG2-CD2 3.76Å; V194-F224 HydrophobicContact CG2-CE2 3.92Å
195	N	96.3	Very high	95	Very high	114 Å²	114	57.3 Å²	57.3	61%	0.61	31%	0.311	S	S	*	.	H	α-helix	trans	-69	-44.5	180	-66.9	-19.7	0	0	0	112.5	R191 N192 L193 Y197 Q198	R191-N195 PolarHBondContact O-N 3.11Å; R191-N195 PolarHBondContact O-ND2 3.39Å; N192-N195 PolarHBondContact O-N 2.85Å; L193-N195 VanDerWaalsContact C-N 3.3Å; L193-N195 PolarHBondContact O-N 3.31Å; N195-Y197 VanDerWaalsContact C-N 3.31Å; N195-Y197 PolarHBondContact O-N 2.73Å; N195-Q198 PolarHBondContact O-N 3.27Å
196	A	95.1	Very high	94.4	Very high	39 Å²	39	59.4 Å²	59.4	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-70.6	-24.5	-174.5	0	0	0	0	0	114	N192 L193 K246	N192-A196 WeakPolarHBondContact O-CB 3.32Å; N192-A196 PolarHBondContact O-N 3.19Å; L193-A196 PolarHBondContact O-N 2.8Å; A196-K246 HydrophobicContact CB-CB 4.47Å
197	Y	95.8	Very high	93.8	Very high	47 Å²	47	59 Å²	59	18%	0.184	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	5.8	178.3	-70.3	-102.6	0	0	0	113	L193 N195 I199 A227 M231 H244 K246	L193-Y197 HydrophobicContact CD1-CD2 3.43Å; L193-Y197 VanDerWaalsContact CD1-CD2 3.43Å; L193-Y197 HydrophobicContact CD1-CE2 3.43Å; L193-Y197 VanDerWaalsContact CD1-CE2 3.43Å; L193-Y197 HydrophobicContact CD1-CG 4.35Å; L193-Y197 HydrophobicContact CG-CD2 4.24Å; L193-Y197 PolarHBondContact O-N 3.03Å; N195-Y197 VanDerWaalsContact C-N 3.31Å; N195-Y197 PolarHBondContact O-N 2.73Å; Y197-I199 VanDerWaalsContact C-N 3.25Å; Y197-I199 PolarHBondContact O-N 3.26Å; Y197-A227 HydrophobicContact CD1-CB 3.84Å; Y197-A227 HydrophobicContact CD2-CB 4.39Å; Y197-A227 HydrophobicContact CE1-CB 4.46Å; Y197-A227 HydrophobicContact CG-CB 3.8Å; Y197-M231 HydrophobicContact CE2-CB 4.43Å; Y197-H244 PolarHBondContact OH-CE1 2.84Å; Y197-K246 HydrophobicContact CE2-CD 4.23Å
198	Q	96.1	Very high	92.9	Very high	175 Å²	175	57 Å²	57	82%	0.818	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	44.5	179.2	-60.2	175.7	-6.4	0	0	112.5	V194 N195	V194-Q198 WeakPolarHBondContact O-CA 3.46Å; V194-Q198 PolarHBondContact O-N 3.39Å; N195-Q198 PolarHBondContact O-N 3.27Å
199	I	96.9	Very high	92	Very high	10 Å²	10	59.7 Å²	59.7	5%	0.051	32%	0.316	C	S	.	.			trans	-68.9	134.1	-177	-68.4	158.2	0	0	0	109.4	L193 V194 Y197 T201 V219 P223 F224 A227	L193-I199 HydrophobicContact CG-CD1 4.13Å; V194-I199 HydrophobicContact CB-CB 4.46Å; V194-I199 HydrophobicContact CG1-CB 4.29Å; V194-I199 HydrophobicContact CG2-CB 4.37Å; V194-I199 HydrophobicContact CG2-CD1 4.31Å; V194-I199 PolarHBondContact O-N 2.89Å; Y197-I199 VanDerWaalsContact C-N 3.25Å; Y197-I199 PolarHBondContact O-N 3.26Å; I199-T201 PolarHBondContact O-N 3.43Å; I199-V219 HydrophobicContact CB-CG1 4.45Å; I199-V219 HydrophobicContact CG2-CG1 3.42Å; I199-V219 VanDerWaalsContact CG2-CG1 3.42Å; I199-P223 HydrophobicContact CG2-CB 4.23Å; I199-F224 HydrophobicContact CD1-CB 4.25Å; I199-F224 HydrophobicContact CD1-CD2 3.86Å; I199-F224 HydrophobicContact CD1-CG 4.4Å; I199-F224 HydrophobicContact CG2-CB 4.1Å; I199-A227 HydrophobicContact CD1-CB 3.77Å; I199-A227 HydrophobicContact CG1-CB 4.29Å
200	P	97	Very high	91.4	Very high	66 Å²	66	63.2 Å²	63.2	43%	0.429	34%	0.336	S	S	.	.			trans	-56.9	130.5	179.4	-26.3	34.6	0	0	0	113	A220	P200-A220 HydrophobicContact CB-CB 4.09Å; P200-A220 PolarHBondContact O-N 2.81Å
201	T	97	Very high	90.5	Very high	74 Å²	74	65.5 Å²	65.5	45%	0.454	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	154.5	174.9	61.4	0	0	0	0	111.2	V194 I199 T217 I218 V219	V194-T201 HydrophobicContact CG1-CG2 3.58Å; I199-T201 PolarHBondContact O-N 3.43Å; T201-T217 HydrophobicContact CG2-CG2 4.08Å; T201-I218 CarbonylContact C-O 3.5Å; T201-I218 VanDerWaalsContact CA-O 3.23Å; T201-I218 WeakPolarHBondContact CA-O 3.31Å; T201-I218 WeakPolarHBondContact CB-O 3.34Å; T201-V219 HydrophobicContact CG2-CG2 4.27Å
202	D	93.6	Very high	89.8	Confident	63 Å²	63	65.7 Å²	65.7	34%	0.337	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	169.2	174	-162.2	-0.4	0	0	0	109.7	Y173 T217 I218	Y173-D202 HydrophobicContact CD1-CB 4.2Å; Y173-D202 HydrophobicContact CE1-CB 3.76Å; D202-T217 WeakPolarHBondContact O-CA 3.34Å; D202-I218 HydrophobicContact CB-CD1 3.99Å; D202-I218 HydrophobicContact CB-CG1 3.86Å; D202-I218 PolarHBondContact N-O 3.35Å; D202-I218 VanDerWaalsContact O-CG1 3.29Å; D202-I218 WeakPolarHBondContact O-CG1 3.38Å; D202-I218 PolarHBondContact O-N 2.91Å
203	T	91.6	Very high	89.1	Confident	84 Å²	84	68.6 Å²	68.6	52%	0.515	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.5	176.6	-56.7	0	0	0	0	109.9	R215	T203-R215 HydrophobicContact CG2-CB 3.97Å; T203-R215 HydrophobicContact CG2-CG 4.3Å
204	H	86.1	Confident	88.7	Confident	20 Å²	20	70.4 Å²	70.4	9%	0.093	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.8	178.7	176.4	71.8	0	0	0	111	T168 R215 R216 I218	T168-H204 PolarHBondContact O-CE1 3.37Å; T168-H204 VanDerWaalsContact O-CE1 3.29Å; H204-R215 WeakPolarHBondContact O-CA 3.33Å; H204-R216 HydrophobicContact CB-CG 4.26Å; H204-R216 PolarHBondContact CD2-NE 2.87Å; H204-R216 PolarHBondContact CD2-NH2 2.85Å; H204-R216 VanDerWaalsContact CD2-NH2 3.31Å; H204-R216 PolarHBondContact N-O 2.99Å; H204-R216 PolarHBondContact NE2-NH2 2.85Å; H204-R216 PolarHBondContact O-N 3.3Å; H204-I218 HydrophobicContact CB-CB 4.48Å; H204-I218 HydrophobicContact CB-CD1 3.9Å; H204-I218 HydrophobicContact CB-CG1 4.05Å; H204-I218 HydrophobicContact CB-CG2 3.63Å
205	E	87	Confident	88.3	Confident	103 Å²	103	79 Å²	79	48%	0.481	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	134.6	174.5	-48.5	-162.5	138.7	0	0	110.2	S214 R215	E205-S214 CarbonylContact C-O 3.6Å; E205-S214 WeakPolarHBondContact CA-O 3.5Å; E205-R215 HydrophobicContact CG-CG 4.2Å; E205-R215 IonicContact OE1-CZ 2.71Å; E205-R215 VanDerWaalsContact OE1-CZ 3.24Å; E205-R215 IonicContact OE1-NE 3.32Å; E205-R215 PolarHBondContact OE1-NE 2.87Å; E205-R215 IonicContact OE1-NH2 3.39Å; E205-R215 PolarHBondContact OE1-NH2 3.3Å
206	F	82.7	Confident	88	Confident	46 Å²	46	77.4 Å²	77.4	20%	0.202	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	156.3	178.9	69.5	-79.1	0	0	0	110.4	T208 S214 R216	F206-T208 HydrophobicContact CE2-CG2 4.21Å; F206-S214 WeakPolarHBondContact CD1-O 3.49Å; F206-S214 PolarHBondContact N-O 3.48Å; F206-S214 PolarHBondContact O-N 3.1Å; F206-R216 HydrophobicContact CD1-CB 4.44Å; F206-R216 HydrophobicContact CD1-CG 3.92Å; F206-R216 HydrophobicContact CE1-CB 3.83Å; F206-R216 HydrophobicContact CE1-CG 3.78Å
207	L	81.6	Confident	88	Confident	56 Å²	56	78.3 Å²	78.3	29%	0.293	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.4	176.7	-83.3	155.1	0	0	0	110	I164 G211 L213	I164-L207 HydrophobicContact CG2-CD1 4.12Å; L207-G211 VanDerWaalsContact CD2-O 3.31Å; L207-G211 WeakPolarHBondContact CD2-O 3.44Å; L207-L213 HydrophobicContact CD2-CD2 4.1Å; L207-L213 HydrophobicContact CD2-CG 4.15Å; L207-L213 HydrophobicContact CG-CD2 4.03Å
208	T	78.7	Confident	87.9	Confident	19 Å²	19	76.2 Å²	76.2	12%	0.117	41%	0.407	C	S	.	.			trans	-67.9	159.7	170.3	61.4	0	0	0	0	110.3	F206 D210 G211 L212 S214	F206-T208 HydrophobicContact CE2-CG2 4.21Å; T208-D210 WeakPolarHBondContact CB-OD1 3.39Å; T208-D210 PolarHBondContact O-N 3.44Å; T208-D210 VanDerWaalsContact O-N 3.11Å; T208-D210 PolarHBondContact OG1-OD1 2.83Å; T208-D210 PolarHBondContact OG1-OD2 2.89Å; T208-G211 WeakPolarHBondContact O-CA 3.49Å; T208-G211 PolarHBondContact O-N 2.88Å; T208-L212 PolarHBondContact N-O 3.06Å; T208-L212 WeakPolarHBondContact OG1-CB 3.44Å; T208-L212 PolarHBondContact OG1-N 3.25Å; T208-L212 PolarHBondContact OG1-O 2.81Å; T208-S214 WeakPolarHBondContact CG2-OG 3.18Å
209	P	76.1	Confident	88	Confident	113 Å²	113	67.9 Å²	67.9	73%	0.734	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-29.5	176.9	-27.3	36.4	0	0	0	114.2	G211	P209-G211 VanDerWaalsContact C-N 3.29Å
210	D	84.2	Confident	88	Confident	113 Å²	113	67.9 Å²	67.9	60%	0.604	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-1.2	175.5	39.7	-61.2	0	0	0	113.9	T208 L212	T208-D210 WeakPolarHBondContact CB-OD1 3.39Å; T208-D210 PolarHBondContact O-N 3.44Å; T208-D210 VanDerWaalsContact O-N 3.11Å; T208-D210 PolarHBondContact OG1-OD1 2.83Å; T208-D210 PolarHBondContact OG1-OD2 2.89Å; D210-L212 WeakPolarHBondContact OD2-CD1 3.38Å
211	G	77.3	Confident	88	Confident	49 Å²	49	65.8 Å²	65.8	51%	0.505	36%	0.356	S	S	.	.	S	Bend	trans	86.2	9.5	173.5	0	0	0	0	0	114.9	L207 T208 P209	L207-G211 VanDerWaalsContact CD2-O 3.31Å; L207-G211 WeakPolarHBondContact CD2-O 3.44Å; T208-G211 WeakPolarHBondContact O-CA 3.49Å; T208-G211 PolarHBondContact O-N 2.88Å; P209-G211 VanDerWaalsContact C-N 3.29Å
212	L	81.9	Confident	88	Confident	112 Å²	112	70.2 Å²	70.2	59%	0.586	37%	0.371	S	S	*	.			trans	-85.2	133.1	177.4	-59.9	176.8	0	0	0	110.6	T208 D210 S214	T208-L212 PolarHBondContact N-O 3.06Å; T208-L212 WeakPolarHBondContact OG1-CB 3.44Å; T208-L212 PolarHBondContact OG1-N 3.25Å; T208-L212 PolarHBondContact OG1-O 2.81Å; D210-L212 WeakPolarHBondContact OD2-CD1 3.38Å; L212-S214 PolarHBondContact O-N 3.37Å
213	L	82.9	Confident	88.2	Confident	134 Å²	134	69.8 Å²	69.8	70%	0.702	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	117.3	169.1	-77.3	165.6	0	0	0	109.3	L207	L207-L213 HydrophobicContact CD2-CD2 4.1Å; L207-L213 HydrophobicContact CD2-CG 4.15Å; L207-L213 HydrophobicContact CG-CD2 4.03Å
214	S	87.9	Confident	88.5	Confident	38 Å²	38	65.8 Å²	65.8	27%	0.266	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	159.4	178.9	-78.8	0	0	0	0	111.4	E205 F206 T208 L212	E205-S214 CarbonylContact C-O 3.6Å; E205-S214 WeakPolarHBondContact CA-O 3.5Å; F206-S214 WeakPolarHBondContact CD1-O 3.49Å; F206-S214 PolarHBondContact N-O 3.48Å; F206-S214 PolarHBondContact O-N 3.1Å; T208-S214 WeakPolarHBondContact CG2-OG 3.18Å; L212-S214 PolarHBondContact O-N 3.37Å
215	R	89.3	Confident	89	Confident	184 Å²	184	66.9 Å²	66.9	69%	0.694	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	140	179	-63.5	-176.2	171.9	161.5	-0.4	110.4	T203 H204 E205	T203-R215 HydrophobicContact CG2-CB 3.97Å; T203-R215 HydrophobicContact CG2-CG 4.3Å; H204-R215 WeakPolarHBondContact O-CA 3.33Å; E205-R215 HydrophobicContact CG-CG 4.2Å; E205-R215 IonicContact OE1-CZ 2.71Å; E205-R215 VanDerWaalsContact OE1-CZ 3.24Å; E205-R215 IonicContact OE1-NE 3.32Å; E205-R215 PolarHBondContact OE1-NE 2.87Å; E205-R215 IonicContact OE1-NH2 3.39Å; E205-R215 PolarHBondContact OE1-NH2 3.3Å
216	R	89.9	Confident	89.4	Confident	80 Å²	80	64.9 Å²	64.9	30%	0.302	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	149.9	170.4	64.8	179.8	177.9	-147.1	-15.7	111	R166 H204 F206 I218	R166-R216 PolarHBondContact O-NH2 2.86Å; H204-R216 HydrophobicContact CB-CG 4.26Å; H204-R216 PolarHBondContact CD2-NE 2.87Å; H204-R216 PolarHBondContact CD2-NH2 2.85Å; H204-R216 VanDerWaalsContact CD2-NH2 3.31Å; H204-R216 PolarHBondContact N-O 2.99Å; H204-R216 PolarHBondContact NE2-NH2 2.85Å; H204-R216 PolarHBondContact O-N 3.3Å; F206-R216 HydrophobicContact CD1-CB 4.44Å; F206-R216 HydrophobicContact CD1-CG 3.92Å; F206-R216 HydrophobicContact CE1-CB 3.83Å; F206-R216 HydrophobicContact CE1-CG 3.78Å; R216-I218 HydrophobicContact CG-CG2 4.39Å
217	T	93.9	Very high	90.1	Very high	58 Å²	58	63.1 Å²	63.1	36%	0.356	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	132.2	169	-47.8	0	0	0	0	110	Y176 T201 D202	Y176-T217 HydrophobicContact CE2-CG2 4.31Å; T201-T217 HydrophobicContact CG2-CG2 4.08Å; D202-T217 WeakPolarHBondContact O-CA 3.34Å
218	I	94.9	Very high	90.8	Very high	3 Å²	3	60.7 Å²	60.7	2%	0.015	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	152.5	171.1	54.1	166.1	0	0	0	109.1	I169 Y173 A174 T201 D202 H204 R216	I169-I218 HydrophobicContact CD1-CG2 4.29Å; I169-I218 HydrophobicContact CG1-CG2 4.43Å; I169-I218 HydrophobicContact CG2-CB 4.34Å; I169-I218 HydrophobicContact CG2-CD1 4.07Å; I169-I218 HydrophobicContact CG2-CG2 3.94Å; Y173-I218 HydrophobicContact CD1-CB 4.34Å; Y173-I218 HydrophobicContact CD1-CD1 3.86Å; Y173-I218 HydrophobicContact CD1-CG1 3.94Å; Y173-I218 HydrophobicContact CG-CD1 3.87Å; Y173-I218 HydrophobicContact CG-CG1 4.39Å; A174-I218 WeakPolarHBondContact O-CA 3.41Å; T201-I218 CarbonylContact C-O 3.5Å; T201-I218 VanDerWaalsContact CA-O 3.23Å; T201-I218 WeakPolarHBondContact CA-O 3.31Å; T201-I218 WeakPolarHBondContact CB-O 3.34Å; D202-I218 HydrophobicContact CB-CD1 3.99Å; D202-I218 HydrophobicContact CB-CG1 3.86Å; D202-I218 PolarHBondContact N-O 3.35Å; D202-I218 VanDerWaalsContact O-CG1 3.29Å; D202-I218 WeakPolarHBondContact O-CG1 3.38Å; D202-I218 PolarHBondContact O-N 2.91Å; H204-I218 HydrophobicContact CB-CB 4.48Å; H204-I218 HydrophobicContact CB-CD1 3.9Å; H204-I218 HydrophobicContact CB-CG1 4.05Å; H204-I218 HydrophobicContact CB-CG2 3.63Å; R216-I218 HydrophobicContact CG-CG2 4.39Å
219	V	97.3	Very high	91.5	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.6	-172	-172.8	0	0	0	0	108.7	Y173 A174 Y176 L179 V194 I199 T201 V221 F224	Y173-V219 CarbonylContact C-O 3.5Å; Y173-V219 VanDerWaalsContact CA-O 3.31Å; Y173-V219 WeakPolarHBondContact CA-O 3.48Å; Y173-V219 VanDerWaalsContact CD1-C 3.48Å; A174-V219 PolarHBondContact N-O 3.27Å; A174-V219 PolarHBondContact O-N 3.36Å; Y176-V219 HydrophobicContact CE1-CG2 4.01Å; Y176-V219 HydrophobicContact CE2-CG2 4.26Å; L179-V219 HydrophobicContact CD1-CB 3.81Å; L179-V219 HydrophobicContact CD1-CG1 4.25Å; L179-V219 HydrophobicContact CD1-CG2 3.78Å; V194-V219 HydrophobicContact CG2-CG1 3.67Å; V194-V219 HydrophobicContact CG2-CG2 4.01Å; I199-V219 HydrophobicContact CB-CG1 4.45Å; I199-V219 HydrophobicContact CG2-CG1 3.42Å; I199-V219 VanDerWaalsContact CG2-CG1 3.42Å; T201-V219 HydrophobicContact CG2-CG2 4.27Å; V219-V221 PolarHBondContact O-N 3.44Å; V219-F224 HydrophobicContact CG1-CB 4.1Å; V219-F224 HydrophobicContact CG1-CD2 4Å; V219-F224 HydrophobicContact CG1-CG 4.39Å
220	A	97.3	Very high	92.4	Very high	10 Å²	10	65.9 Å²	65.9	8%	0.083	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	120.7	174	0	0	0	0	0	109.9	Y173 P200 P223 F224	Y173-A220 HydrophobicContact CD1-CB 4.38Å; Y173-A220 HydrophobicContact CE1-CB 4Å; P200-A220 HydrophobicContact CB-CB 4.09Å; P200-A220 PolarHBondContact O-N 2.81Å; A220-P223 HydrophobicContact CB-CG 3.95Å; A220-F224 VanDerWaalsContact O-CB 3.24Å; A220-F224 WeakPolarHBondContact O-CB 3.23Å; A220-F224 PolarHBondContact O-N 3.44Å
221	V	96.7	Very high	92.9	Very high	23 Å²	23	60.5 Å²	60.5	14%	0.139	31%	0.313	C	S	.	.	H	α-helix	trans	-69.2	-45.6	-169.7	175.9	0	0	0	0	111.6	G172 A174 V219 F224 M225	G172-V221 WeakPolarHBondContact O-CB 3.29Å; G172-V221 WeakPolarHBondContact O-CG2 3.44Å; G172-V221 PolarHBondContact O-N 2.83Å; A174-V221 HydrophobicContact CB-CG2 3.47Å; A174-V221 VanDerWaalsContact CB-CG2 3.47Å; V219-V221 PolarHBondContact O-N 3.44Å; V221-F224 PolarHBondContact O-N 2.77Å; V221-M225 HydrophobicContact CG1-CG 4.13Å; V221-M225 WeakPolarHBondContact O-CG 3.4Å; V221-M225 PolarHBondContact O-N 3.43Å
222	E	96.4	Very high	93.7	Very high	166 Å²	166	58.4 Å²	58.4	78%	0.776	29%	0.29	S	S	*	.	H	α-helix	trans	-62.7	-51.7	-177.2	-72.9	-176.4	173.1	0	0	112.6	F224 M225 A226	E222-F224 VanDerWaalsContact C-N 3.27Å; E222-F224 PolarHBondContact O-N 2.82Å; E222-M225 PolarHBondContact O-N 3.33Å; E222-A226 WeakPolarHBondContact O-CB 3.47Å; E222-A226 PolarHBondContact O-N 3.39Å
223	P	97.5	Very high	94.2	Very high	55 Å²	55	57.5 Å²	57.5	36%	0.357	29%	0.293	S	S	.	.	H	α-helix	trans	-63	-34.7	176.4	-20.8	32.9	0	0	0	112.6	I199 A220 A227	I199-P223 HydrophobicContact CG2-CB 4.23Å; A220-P223 HydrophobicContact CB-CG 3.95Å; P223-A227 WeakPolarHBondContact O-CB 3.48Å; P223-A227 PolarHBondContact O-N 3.12Å
224	F	98.1	Very high	94.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.5	-49.4	175.5	-178.8	-88.1	0	0	0	111.9	L179 T183 M185 C190 L193 V194 I199 V219 A220 V221 E222 A227 F228	L179-F224 HydrophobicContact CB-CE1 3.91Å; L179-F224 HydrophobicContact CB-CZ 3.89Å; L179-F224 HydrophobicContact CD1-CD1 4.38Å; L179-F224 HydrophobicContact CD1-CD2 3.9Å; L179-F224 HydrophobicContact CD1-CE1 4.24Å; L179-F224 HydrophobicContact CD1-CE2 3.78Å; L179-F224 HydrophobicContact CD1-CG 4.21Å; L179-F224 HydrophobicContact CD1-CZ 3.96Å; L179-F224 HydrophobicContact CD2-CD1 3.7Å; L179-F224 HydrophobicContact CD2-CE1 3.87Å; L179-F224 HydrophobicContact CD2-CG 4.09Å; L179-F224 HydrophobicContact CD2-CZ 4.42Å; L179-F224 HydrophobicContact CG-CD1 4.43Å; L179-F224 HydrophobicContact CG-CE1 4.21Å; L179-F224 HydrophobicContact CG-CZ 4.31Å; T183-F224 HydrophobicContact CG2-CE1 3.66Å; T183-F224 HydrophobicContact CG2-CZ 4.37Å; M185-F224 HydrophobicContact CE-CZ 4.22Å; C190-F224 HydrophobicContact CB-CE2 4.16Å; C190-F224 HydrophobicContact CB-CZ 4.01Å; L193-F224 HydrophobicContact CB-CE2 4.41Å; L193-F224 HydrophobicContact CD2-CD2 4.22Å; L193-F224 HydrophobicContact CD2-CE1 4.44Å; L193-F224 HydrophobicContact CD2-CE2 3.81Å; L193-F224 HydrophobicContact CD2-CZ 3.93Å; L193-F224 HydrophobicContact CG-CE2 4.48Å; V194-F224 HydrophobicContact CG2-CD2 3.76Å; V194-F224 HydrophobicContact CG2-CE2 3.92Å; I199-F224 HydrophobicContact CD1-CB 4.25Å; I199-F224 HydrophobicContact CD1-CD2 3.86Å; I199-F224 HydrophobicContact CD1-CG 4.4Å; I199-F224 HydrophobicContact CG2-CB 4.1Å; V219-F224 HydrophobicContact CG1-CB 4.1Å; V219-F224 HydrophobicContact CG1-CD2 4Å; V219-F224 HydrophobicContact CG1-CG 4.39Å; A220-F224 VanDerWaalsContact O-CB 3.24Å; A220-F224 WeakPolarHBondContact O-CB 3.23Å; A220-F224 PolarHBondContact O-N 3.44Å; V221-F224 PolarHBondContact O-N 2.77Å; E222-F224 VanDerWaalsContact C-N 3.27Å; E222-F224 PolarHBondContact O-N 2.82Å; F224-A227 PolarHBondContact O-N 3.38Å; F224-F228 WeakPolarHBondContact O-CB 3.4Å; F224-F228 PolarHBondContact O-N 2.9Å
225	M	96.7	Very high	95	Very high	42 Å²	42	54.4 Å²	54.4	21%	0.207	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-40.1	179.2	-66.8	-57.7	-66.9	0	0	110.8	T183 V221 E222 A227 F228 H229	T183-M225 HydrophobicContact CG2-SD 4.17Å; V221-M225 HydrophobicContact CG1-CG 4.13Å; V221-M225 WeakPolarHBondContact O-CG 3.4Å; V221-M225 PolarHBondContact O-N 3.43Å; E222-M225 PolarHBondContact O-N 3.33Å; M225-A227 PolarHBondContact O-N 3Å; M225-F228 HydrophobicContact CE-CD1 4.29Å; M225-F228 WeakPolarHBondContact O-CB 3.32Å; M225-F228 PolarHBondContact O-N 2.95Å; M225-H229 PolarHBondContact O-N 2.71Å; M225-H229 PolarHBondContact O-ND1 3.45Å
226	A	96.5	Very high	95.2	Very high	62 Å²	62	50.1 Å²	50.1	51%	0.512	26%	0.261	S	S	.	.	H	α-helix	trans	-59.4	-45.3	175.7	0	0	0	0	0	112	E222 R230	E222-A226 WeakPolarHBondContact O-CB 3.47Å; E222-A226 PolarHBondContact O-N 3.39Å; A226-R230 WeakPolarHBondContact O-CB 3.41Å; A226-R230 PolarHBondContact O-N 3.31Å
227	A	96.7	Very high	95.3	Very high	8 Å²	8	50.6 Å²	50.6	7%	0.066	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-39.3	174.9	0	0	0	0	0	112.4	L193 Y197 I199 P223 F224 M225 R230 M231	L193-A227 HydrophobicContact CD1-CB 4.38Å; L193-A227 HydrophobicContact CD2-CB 4.5Å; L193-A227 HydrophobicContact CG-CB 4.44Å; Y197-A227 HydrophobicContact CD1-CB 3.84Å; Y197-A227 HydrophobicContact CD2-CB 4.39Å; Y197-A227 HydrophobicContact CE1-CB 4.46Å; Y197-A227 HydrophobicContact CG-CB 3.8Å; I199-A227 HydrophobicContact CD1-CB 3.77Å; I199-A227 HydrophobicContact CG1-CB 4.29Å; P223-A227 WeakPolarHBondContact O-CB 3.48Å; P223-A227 PolarHBondContact O-N 3.12Å; F224-A227 PolarHBondContact O-N 3.38Å; M225-A227 PolarHBondContact O-N 3Å; A227-R230 PolarHBondContact O-N 3.11Å; A227-M231 VanDerWaalsContact O-CB 3.23Å; A227-M231 WeakPolarHBondContact O-CB 3.18Å; A227-M231 PolarHBondContact O-N 3.44Å
228	F	96.1	Very high	95.1	Very high	6 Å²	6	54.7 Å²	54.7	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-50.5	177	173.2	-109.5	0	0	0	111.7	T183 M185 L193 F224 M225 R230 M231 M232 A252 W255	T183-F228 HydrophobicContact CG2-CD1 3.84Å; T183-F228 HydrophobicContact CG2-CD2 3.9Å; T183-F228 HydrophobicContact CG2-CE1 3.93Å; T183-F228 HydrophobicContact CG2-CE2 4Å; T183-F228 HydrophobicContact CG2-CG 3.81Å; T183-F228 HydrophobicContact CG2-CZ 4Å; M185-F228 HydrophobicContact CE-CD2 3.39Å; M185-F228 HydrophobicContact CE-CE2 3.65Å; M185-F228 HydrophobicContact CE-CG 4.44Å; M185-F228 HydrophobicContact CG-CE2 4.01Å; M185-F228 HydrophobicContact SD-CD2 3.9Å; M185-F228 HydrophobicContact SD-CE2 3.71Å; L193-F228 HydrophobicContact CD2-CB 3.84Å; L193-F228 HydrophobicContact CD2-CD2 4.49Å; F224-F228 WeakPolarHBondContact O-CB 3.4Å; F224-F228 PolarHBondContact O-N 2.9Å; M225-F228 HydrophobicContact CE-CD1 4.29Å; M225-F228 WeakPolarHBondContact O-CB 3.32Å; M225-F228 PolarHBondContact O-N 2.95Å; F228-R230 VanDerWaalsContact C-N 3.33Å; F228-R230 PolarHBondContact O-N 3.23Å; F228-M231 HydrophobicContact CD2-CE 3.68Å; F228-M231 HydrophobicContact CE2-CE 3.92Å; F228-M231 PolarHBondContact O-N 2.92Å; F228-M232 HydrophobicContact CD2-CG 4.04Å; F228-M232 HydrophobicContact CE1-CG 4.18Å; F228-M232 HydrophobicContact CE2-CG 3.6Å; F228-M232 HydrophobicContact CE2-SD 3.99Å; F228-M232 HydrophobicContact CZ-CG 3.69Å; F228-M232 HydrophobicContact CZ-SD 4.31Å; F228-M232 WeakPolarHBondContact O-CB 3.17Å; F228-M232 WeakPolarHBondContact O-CG 3.42Å; F228-M232 PolarHBondContact O-N 3.44Å; F228-A252 HydrophobicContact CE2-CB 4.37Å; F228-A252 HydrophobicContact CZ-CB 4.37Å; F228-W255 HydrophobicContact CD1-CZ3 4.16Å; F228-W255 AromaticContact CE1-CE3 3.59Å; F228-W255 HydrophobicContact CE1-CE3 3.59Å; F228-W255 AromaticContact CE1-CZ3 3.64Å; F228-W255 HydrophobicContact CE1-CZ3 3.64Å; F228-W255 AromaticContact CZ-CE3 3.93Å; F228-W255 HydrophobicContact CZ-CE3 3.93Å; F228-W255 HydrophobicContact CZ-CZ3 4.35Å
229	H	94.9	Very high	94.8	Very high	90 Å²	90	58.4 Å²	58.4	42%	0.417	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-42.2	178.4	-68.3	90	0	0	0	111.3	M225 M232 S233 W255	M225-H229 PolarHBondContact O-N 2.71Å; M225-H229 PolarHBondContact O-ND1 3.45Å; H229-M232 PolarHBondContact O-N 3.02Å; H229-S233 PolarHBondContact O-N 3.36Å; H229-S233 PolarHBondContact O-OG 2.99Å; H229-W255 HydrophobicContact CB-CH2 4.12Å; H229-W255 AromaticContact CD2-CH2 3.4Å; H229-W255 VanDerWaalsContact CD2-CH2 3.4Å; H229-W255 WeakPolarHBondContact CD2-CH2 3.34Å; H229-W255 AromaticContact CD2-CZ3 3.41Å; H229-W255 VanDerWaalsContact CD2-CZ3 3.41Å; H229-W255 WeakPolarHBondContact CD2-CZ3 3.16Å; H229-W255 AromaticContact CG-CH2 3.98Å; H229-W255 AromaticContact NE2-CZ3 3.94Å
230	R	94.6	Very high	94.3	Very high	151 Å²	151	64 Å²	64	57%	0.57	36%	0.357	S	S	*	.	H	α-helix	trans	-60.3	-48.6	175.5	-179.8	177.2	176.8	171.4	4.8	112.1	A226 A227 F228 M232 S233 E234	A226-R230 WeakPolarHBondContact O-CB 3.41Å; A226-R230 PolarHBondContact O-N 3.31Å; A227-R230 PolarHBondContact O-N 3.11Å; F228-R230 VanDerWaalsContact C-N 3.33Å; F228-R230 PolarHBondContact O-N 3.23Å; R230-M232 VanDerWaalsContact C-N 3.31Å; R230-M232 PolarHBondContact O-N 3.32Å; R230-S233 PolarHBondContact O-N 3.35Å; R230-S233 PolarHBondContact O-OG 3.3Å; R230-E234 WeakPolarHBondContact CG-OE1 3.4Å; R230-E234 IonicContact NE-OE1 3.5Å; R230-E234 PolarHBondContact NE-OE1 2.97Å; R230-E234 VanDerWaalsContact NE-OE1 3.1Å; R230-E234 IonicContact NH2-OE1 2.83Å; R230-E234 WeakPolarHBondContact O-CG 3.44Å; R230-E234 PolarHBondContact O-N 3.3Å
231	M	94.8	Very high	94.1	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-59.8	-42.7	177	177.1	-148.5	68.1	0	0	111.2	M185 L193 Y197 A227 F228 E234 A235 H244 M247 F250	M185-M231 HydrophobicContact SD-CE 3.96Å; L193-M231 HydrophobicContact CD1-CB 4.13Å; L193-M231 HydrophobicContact CD1-CG 4.3Å; L193-M231 HydrophobicContact CD1-SD 3.71Å; Y197-M231 HydrophobicContact CE2-CB 4.43Å; A227-M231 VanDerWaalsContact O-CB 3.23Å; A227-M231 WeakPolarHBondContact O-CB 3.18Å; A227-M231 PolarHBondContact O-N 3.44Å; F228-M231 HydrophobicContact CD2-CE 3.68Å; F228-M231 HydrophobicContact CE2-CE 3.92Å; F228-M231 PolarHBondContact O-N 2.92Å; M231-E234 PolarHBondContact O-N 3.03Å; M231-A235 WeakPolarHBondContact O-CB 3.23Å; M231-A235 PolarHBondContact O-N 3Å; M231-A235 VanDerWaalsContact O-N 3.12Å; M231-H244 HydrophobicContact CG-CB 4.39Å; M231-H244 PolarHBondContact O-CD2 3.19Å; M231-M247 HydrophobicContact CG-CG 4Å; M231-M247 HydrophobicContact SD-CB 4.46Å; M231-M247 HydrophobicContact SD-CE 3.66Å; M231-M247 HydrophobicContact SD-CG 3.51Å; M231-M247 VanDerWaalsContact SD-CG 3.51Å; M231-M247 HydrophobicContact SD-SD 4.04Å; M231-F250 HydrophobicContact CE-CE1 4.49Å; M231-F250 HydrophobicContact CE-CE2 3.6Å; M231-F250 HydrophobicContact CE-CZ 3.51Å; M231-F250 HydrophobicContact SD-CE2 4.42Å; M231-F250 HydrophobicContact SD-CZ 4.04Å
232	M	94.3	Very high	93.9	Very high	4 Å²	4	70.9 Å²	70.9	2%	0.02	38%	0.378	C	S	.	.	H	α-helix	trans	-67.7	-35.5	178	-71.9	-56.4	-67	0	0	112.7	F228 H229 R230 E234 A235 W242 F250 A252 W255	F228-M232 HydrophobicContact CD2-CG 4.04Å; F228-M232 HydrophobicContact CE1-CG 4.18Å; F228-M232 HydrophobicContact CE2-CG 3.6Å; F228-M232 HydrophobicContact CE2-SD 3.99Å; F228-M232 HydrophobicContact CZ-CG 3.69Å; F228-M232 HydrophobicContact CZ-SD 4.31Å; F228-M232 WeakPolarHBondContact O-CB 3.17Å; F228-M232 WeakPolarHBondContact O-CG 3.42Å; F228-M232 PolarHBondContact O-N 3.44Å; H229-M232 PolarHBondContact O-N 3.02Å; R230-M232 VanDerWaalsContact C-N 3.31Å; R230-M232 PolarHBondContact O-N 3.32Å; M232-E234 PolarHBondContact O-N 3.28Å; M232-A235 PolarHBondContact O-N 3.37Å; M232-W242 HydrophobicContact CE-CD2 3.75Å; M232-W242 HydrophobicContact CE-CE3 4.21Å; M232-W242 HydrophobicContact CE-CG 4.02Å; M232-W242 HydrophobicContact CE-CZ2 4.14Å; M232-F250 HydrophobicContact SD-CE2 3.54Å; M232-F250 VanDerWaalsContact SD-CE2 3.54Å; M232-F250 HydrophobicContact SD-CZ 3.63Å; M232-A252 HydrophobicContact CE-CB 3.93Å; M232-A252 HydrophobicContact SD-CB 4.02Å; M232-W255 HydrophobicContact CB-CD2 3.89Å; M232-W255 VanDerWaalsContact CB-CE2 3.45Å; M232-W255 HydrophobicContact CB-CE3 4.2Å; M232-W255 HydrophobicContact CB-CH2 3.67Å; M232-W255 HydrophobicContact CB-CZ2 3.35Å; M232-W255 HydrophobicContact CB-CZ3 4.09Å; M232-W255 HydrophobicContact CE-CB 3.76Å; M232-W255 HydrophobicContact CE-CD2 3.8Å; M232-W255 HydrophobicContact CE-CG 3.33Å; M232-W255 HydrophobicContact CG-CD2 3.89Å; M232-W255 HydrophobicContact CG-CE3 3.98Å; M232-W255 HydrophobicContact CG-CG 4.44Å; M232-W255 HydrophobicContact CG-CH2 4.25Å; M232-W255 HydrophobicContact CG-CZ2 4.2Å; M232-W255 HydrophobicContact CG-CZ3 4.15Å
233	S	92.6	Very high	93.9	Very high	93 Å²	93	67.2 Å²	67.2	65%	0.65	36%	0.358	S	S	*	.	H	α-helix	trans	-67.3	-24.9	174.6	62.1	0	0	0	0	113.7	H229 R230	H229-S233 PolarHBondContact O-N 3.36Å; H229-S233 PolarHBondContact O-OG 2.99Å; R230-S233 PolarHBondContact O-N 3.35Å; R230-S233 PolarHBondContact O-OG 3.3Å
234	E	93.3	Very high	93.7	Very high	95 Å²	95	64.8 Å²	64.8	44%	0.444	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-5.4	177.9	-65.7	171.2	-159.7	0	0	112	R230 M231 M232 H244	R230-E234 WeakPolarHBondContact CG-OE1 3.4Å; R230-E234 IonicContact NE-OE1 3.5Å; R230-E234 PolarHBondContact NE-OE1 2.97Å; R230-E234 VanDerWaalsContact NE-OE1 3.1Å; R230-E234 IonicContact NH2-OE1 2.83Å; R230-E234 WeakPolarHBondContact O-CG 3.44Å; R230-E234 PolarHBondContact O-N 3.3Å; M231-E234 PolarHBondContact O-N 3.03Å; M232-E234 PolarHBondContact O-N 3.28Å; E234-H244 IonicContact OE2-NE2 3.38Å; E234-H244 PolarHBondContact OE2-NE2 2.86Å
235	A	93.7	Very high	93.5	Very high	13 Å²	13	69.5 Å²	69.5	11%	0.107	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-86.1	136.6	-173.4	0	0	0	0	0	112.8	M231 M232 W242 Y243 H244 F250	M231-A235 WeakPolarHBondContact O-CB 3.23Å; M231-A235 PolarHBondContact O-N 3Å; M231-A235 VanDerWaalsContact O-N 3.12Å; M232-A235 PolarHBondContact O-N 3.37Å; A235-W242 HydrophobicContact CB-CB 4.28Å; A235-W242 HydrophobicContact CB-CE3 4.05Å; A235-Y243 CarbonylContact C-O 3.54Å; A235-Y243 WeakPolarHBondContact CA-O 3.5Å; A235-H244 HydrophobicContact CB-CB 4.18Å; A235-F250 HydrophobicContact CB-CZ 4.3Å
236	E	93.1	Very high	93.2	Very high	93 Å²	93	73.5 Å²	73.5	44%	0.435	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130.1	175.9	-64.2	179.6	179.3	0	0	111	R238 W242 Y243	E236-R238 IonicContact OE2-CZ 3.56Å; E236-R238 IonicContact OE2-NE 3.03Å; E236-R238 IonicContact OE2-NH2 2.85Å; E236-R238 PolarHBondContact OE2-NH2 3.41Å; E236-W242 WeakPolarHBondContact O-CA 3.38Å; E236-Y243 PolarHBondContact N-O 3.4Å; E236-Y243 PolarHBondContact O-N 3.39Å
237	P	92.1	Very high	93	Very high	90 Å²	90	70.9 Å²	70.9	58%	0.584	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	134.8	174.4	28.6	-33.6	0	0	0	111.1	W242	P237-W242 HydrophobicContact CB-CE3 4.27Å; P237-W242 HydrophobicContact CB-CH2 4.49Å; P237-W242 HydrophobicContact CB-CZ3 4.07Å
238	R	90.7	Very high	92.8	Very high	144 Å²	144	72 Å²	72	54%	0.543	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	73.1	178.8	-63.2	-66.3	-179.8	165.6	-3.7	109.3	E236 T240 R241	E236-R238 IonicContact OE2-CZ 3.56Å; E236-R238 IonicContact OE2-NE 3.03Å; E236-R238 IonicContact OE2-NH2 2.85Å; E236-R238 PolarHBondContact OE2-NH2 3.41Å; R238-T240 PolarHBondContact O-N 3.27Å; R238-R241 CarbonylContact C-O 3.56Å; R238-R241 WeakPolarHBondContact CA-O 3.5Å; R238-R241 PolarHBondContact N-O 2.88Å; R238-R241 PolarHBondContact O-N 2.84Å
239	G	87.6	Confident	92.7	Very high	81 Å²	81	76 Å²	76	84%	0.835	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	-120	-175.2	0	0	0	0	0	111.6	R241	G239-R241 PolarHBondContact O-N 2.83Å
240	T	87.2	Confident	92.6	Very high	118 Å²	118	72 Å²	72	72%	0.724	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	10.7	176.2	60.5	0	0	0	0	113.4	R238 Q251	R238-T240 PolarHBondContact O-N 3.27Å; T240-Q251 PolarHBondContact O-NE2 2.74Å
241	R	92	Very high	92.5	Very high	122 Å²	122	68.8 Å²	68.8	46%	0.46	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	165.5	-176.6	-64.7	-169.7	162.4	175.1	-4.4	110.7	R238 G239 L249 F250 Q251	R238-R241 CarbonylContact C-O 3.56Å; R238-R241 WeakPolarHBondContact CA-O 3.5Å; R238-R241 PolarHBondContact N-O 2.88Å; R238-R241 PolarHBondContact O-N 2.84Å; G239-R241 PolarHBondContact O-N 2.83Å; R241-L249 HydrophobicContact CB-CD2 3.94Å; R241-L249 HydrophobicContact CG-CD2 4.48Å; R241-F250 CarbonylContact C-O 3.56Å; R241-F250 WeakPolarHBondContact CA-O 3.37Å; R241-F250 WeakPolarHBondContact CB-O 3.41Å; R241-Q251 HydrophobicContact CG-CG 3.72Å
242	W	93.5	Very high	92.3	Very high	56 Å²	56	69.2 Å²	69.2	21%	0.212	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.8	176	-60.8	88.6	0	0	0	109.2	M232 A235 E236 P237 L249 F250 W255	M232-W242 HydrophobicContact CE-CD2 3.75Å; M232-W242 HydrophobicContact CE-CE3 4.21Å; M232-W242 HydrophobicContact CE-CG 4.02Å; M232-W242 HydrophobicContact CE-CZ2 4.14Å; A235-W242 HydrophobicContact CB-CB 4.28Å; A235-W242 HydrophobicContact CB-CE3 4.05Å; E236-W242 WeakPolarHBondContact O-CA 3.38Å; P237-W242 HydrophobicContact CB-CE3 4.27Å; P237-W242 HydrophobicContact CB-CH2 4.49Å; P237-W242 HydrophobicContact CB-CZ3 4.07Å; W242-L249 CarbonylContact O-C 3.57Å; W242-L249 VanDerWaalsContact O-CA 3.3Å; W242-L249 WeakPolarHBondContact O-CA 3.4Å; W242-F250 HydrophobicContact CB-CD1 4.21Å; W242-F250 HydrophobicContact CB-CD2 4.48Å; W242-F250 HydrophobicContact CB-CE1 3.71Å; W242-F250 HydrophobicContact CB-CE2 4.02Å; W242-F250 HydrophobicContact CB-CZ 3.6Å; W242-F250 HydrophobicContact CG-CZ 4.41Å; W242-F250 PolarHBondContact N-O 2.86Å; W242-F250 WeakPolarHBondContact O-CD1 3.34Å; W242-F250 PolarHBondContact O-N 3.2Å; W242-W255 AromaticContact CZ2-CD1 3.88Å
243	Y	95.2	Very high	91.8	Very high	89 Å²	89	75.3 Å²	75.3	35%	0.349	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	130.6	172.6	174.5	-96.6	0	0	0	109.7	A235 E236 G248 L249	A235-Y243 CarbonylContact C-O 3.54Å; A235-Y243 WeakPolarHBondContact CA-O 3.5Å; E236-Y243 PolarHBondContact N-O 3.4Å; E236-Y243 PolarHBondContact O-N 3.39Å; Y243-G248 WeakPolarHBondContact CA-O 3.33Å; Y243-L249 HydrophobicContact CD2-CD1 4.28Å
244	H	95.1	Very high	91.1	Very high	4 Å²	4	74.7 Å²	74.7	2%	0.019	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	138	171.2	177	-86.6	0	0	0	109	Y197 M231 E234 A235 K246 M247 G248 F250	Y197-H244 PolarHBondContact OH-CE1 2.84Å; M231-H244 HydrophobicContact CG-CB 4.39Å; M231-H244 PolarHBondContact O-CD2 3.19Å; E234-H244 IonicContact OE2-NE2 3.38Å; E234-H244 PolarHBondContact OE2-NE2 2.86Å; A235-H244 HydrophobicContact CB-CB 4.18Å; H244-K246 VanDerWaalsContact C-N 3.25Å; H244-K246 PolarHBondContact ND1-N 3.11Å; H244-K246 VanDerWaalsContact ND1-N 3.19Å; H244-K246 PolarHBondContact O-N 2.68Å; H244-K246 VanDerWaalsContact O-N 3.11Å; H244-M247 HydrophobicContact CB-CB 4.15Å; H244-M247 HydrophobicContact CB-CG 4.48Å; H244-M247 CarbonylContact O-C 3.52Å; H244-M247 PolarHBondContact O-N 3.46Å; H244-G248 PolarHBondContact N-O 3.23Å; H244-G248 PolarHBondContact O-N 3.29Å; H244-F250 HydrophobicContact CB-CE1 3.98Å
245	P	93.2	Very high	90.3	Very high	99 Å²	99	73.1 Å²	73.1	64%	0.643	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-38.7	-173.5	-29.1	35.2	0	0	0	114.2
246	K	90.8	Very high	88.8	Confident	126 Å²	126	81.2 Å²	81.2	55%	0.548	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-13.3	177.6	-61.3	-174	174.3	-174.5	0	114.9	A196 Y197 H244	A196-K246 HydrophobicContact CB-CB 4.47Å; Y197-K246 HydrophobicContact CE2-CD 4.23Å; H244-K246 VanDerWaalsContact C-N 3.25Å; H244-K246 PolarHBondContact ND1-N 3.11Å; H244-K246 VanDerWaalsContact ND1-N 3.19Å; H244-K246 PolarHBondContact O-N 2.68Å; H244-K246 VanDerWaalsContact O-N 3.11Å
247	M	91.2	Very high	87.1	Confident	7 Å²	7	83 Å²	83	3%	0.034	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-10.4	-169.8	-63.5	-74.4	-71.5	0	0	113.7	M185 K189 N192 L193 M231 H244 F250	M185-M247 HydrophobicContact SD-CE 4.33Å; K189-M247 HydrophobicContact CB-CE 4.04Å; K189-M247 HydrophobicContact CD-CE 4.19Å; K189-M247 PolarHBondContact NZ-O 2.94Å; K189-M247 WeakPolarHBondContact O-CE 3.35Å; N192-M247 HydrophobicContact CB-SD 4.13Å; L193-M247 HydrophobicContact CB-CE 4.16Å; L193-M247 HydrophobicContact CB-SD 4.32Å; L193-M247 HydrophobicContact CD1-SD 4.42Å; M231-M247 HydrophobicContact CG-CG 4Å; M231-M247 HydrophobicContact SD-CB 4.46Å; M231-M247 HydrophobicContact SD-CE 3.66Å; M231-M247 HydrophobicContact SD-CG 3.51Å; M231-M247 VanDerWaalsContact SD-CG 3.51Å; M231-M247 HydrophobicContact SD-SD 4.04Å; H244-M247 HydrophobicContact CB-CB 4.15Å; H244-M247 HydrophobicContact CB-CG 4.48Å; H244-M247 CarbonylContact O-C 3.52Å; H244-M247 PolarHBondContact O-N 3.46Å; M247-F250 HydrophobicContact CB-CD1 3.91Å; M247-F250 HydrophobicContact CB-CE1 4.07Å
248	G	92.7	Very high	86.9	Confident	30 Å²	30	82.6 Å²	82.6	31%	0.309	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.2	-151.8	-170	0	0	0	0	0	111.5	Y243 H244	Y243-G248 WeakPolarHBondContact CA-O 3.33Å; H244-G248 PolarHBondContact N-O 3.23Å; H244-G248 PolarHBondContact O-N 3.29Å
249	L	93.3	Very high	86.7	Confident	91 Å²	91	79.4 Å²	79.4	48%	0.476	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	135.7	169.6	-87.6	105	0	0	0	111.7	K189 R241 W242 Y243	K189-L249 WeakPolarHBondContact CE-O 3.3Å; K189-L249 PolarHBondContact NZ-O 2.95Å; R241-L249 HydrophobicContact CB-CD2 3.94Å; R241-L249 HydrophobicContact CG-CD2 4.48Å; W242-L249 CarbonylContact O-C 3.57Å; W242-L249 VanDerWaalsContact O-CA 3.3Å; W242-L249 WeakPolarHBondContact O-CA 3.4Å; Y243-L249 HydrophobicContact CD2-CD1 4.28Å
250	F	94	Very high	86.6	Confident	6 Å²	6	79.3 Å²	79.3	3%	0.026	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	171.1	174.9	68.2	-79	0	0	0	111.9	M185 K189 M231 M232 A235 R241 W242 H244 M247 A252	M185-F250 HydrophobicContact CG-CD2 4.26Å; M185-F250 HydrophobicContact SD-CD2 4.05Å; M185-F250 HydrophobicContact SD-CE2 4.1Å; K189-F250 HydrophobicContact CD-CB 3.81Å; K189-F250 HydrophobicContact CG-CB 3.97Å; M231-F250 HydrophobicContact CE-CE1 4.49Å; M231-F250 HydrophobicContact CE-CE2 3.6Å; M231-F250 HydrophobicContact CE-CZ 3.51Å; M231-F250 HydrophobicContact SD-CE2 4.42Å; M231-F250 HydrophobicContact SD-CZ 4.04Å; M232-F250 HydrophobicContact SD-CE2 3.54Å; M232-F250 VanDerWaalsContact SD-CE2 3.54Å; M232-F250 HydrophobicContact SD-CZ 3.63Å; A235-F250 HydrophobicContact CB-CZ 4.3Å; R241-F250 CarbonylContact C-O 3.56Å; R241-F250 WeakPolarHBondContact CA-O 3.37Å; R241-F250 WeakPolarHBondContact CB-O 3.41Å; W242-F250 HydrophobicContact CB-CD1 4.21Å; W242-F250 HydrophobicContact CB-CD2 4.48Å; W242-F250 HydrophobicContact CB-CE1 3.71Å; W242-F250 HydrophobicContact CB-CE2 4.02Å; W242-F250 HydrophobicContact CB-CZ 3.6Å; W242-F250 HydrophobicContact CG-CZ 4.41Å; W242-F250 PolarHBondContact N-O 2.86Å; W242-F250 WeakPolarHBondContact O-CD1 3.34Å; W242-F250 PolarHBondContact O-N 3.2Å; H244-F250 HydrophobicContact CB-CE1 3.98Å; M247-F250 HydrophobicContact CB-CD1 3.91Å; M247-F250 HydrophobicContact CB-CE1 4.07Å; F250-A252 HydrophobicContact CD2-CB 4.46Å; F250-A252 HydrophobicContact CE2-CB 4.15Å
251	Q	92.3	Very high	86.6	Confident	84 Å²	84	77 Å²	77	39%	0.393	44%	0.44	S	S	.	.			trans	-116.8	142.7	171.2	-71.8	-178.1	-45.7	0	0	108.6	M185 T240 R241	M185-Q251 WeakPolarHBondContact CA-O 3.33Å; T240-Q251 PolarHBondContact O-NE2 2.74Å; R241-Q251 HydrophobicContact CG-CG 3.72Å
252	A	90.5	Very high	86.2	Confident	9 Å²	9	74.2 Å²	74.2	7%	0.074	44%	0.439	C	S	.	.			trans	-135.3	102.5	170.8	0	0	0	0	0	106.8	M185 F228 M232 F250	M185-A252 HydrophobicContact CG-CB 3.99Å; F228-A252 HydrophobicContact CE2-CB 4.37Å; F228-A252 HydrophobicContact CZ-CB 4.37Å; M232-A252 HydrophobicContact CE-CB 3.93Å; M232-A252 HydrophobicContact SD-CB 4.02Å; F250-A252 HydrophobicContact CD2-CB 4.46Å; F250-A252 HydrophobicContact CE2-CB 4.15Å
253	L	84.4	Confident	85.8	Confident	132 Å²	132	75.4 Å²	75.4	69%	0.691	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	135.6	-179.7	-60.8	175.7	0	0	0	110.2	G184	G184-L253 PolarHBondContact O-N 2.81Å
254	G	77.6	Confident	85.1	Confident	80 Å²	80	74.4 Å²	74.4	83%	0.825	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	2.3	175.4	0	0	0	0	0	115.7	Q256	G254-Q256 PolarHBondContact O-N 3.44Å
255	W	76.7	Confident	84.3	Confident	62 Å²	62	79.8 Å²	79.8	24%	0.235	50%	0.496	C	S	.	.			trans	-72.2	112	169.8	-175.8	-97.1	0	0	0	110.5	F228 H229 M232 W242	F228-W255 HydrophobicContact CD1-CZ3 4.16Å; F228-W255 AromaticContact CE1-CE3 3.59Å; F228-W255 HydrophobicContact CE1-CE3 3.59Å; F228-W255 AromaticContact CE1-CZ3 3.64Å; F228-W255 HydrophobicContact CE1-CZ3 3.64Å; F228-W255 AromaticContact CZ-CE3 3.93Å; F228-W255 HydrophobicContact CZ-CE3 3.93Å; F228-W255 HydrophobicContact CZ-CZ3 4.35Å; H229-W255 HydrophobicContact CB-CH2 4.12Å; H229-W255 AromaticContact CD2-CH2 3.4Å; H229-W255 VanDerWaalsContact CD2-CH2 3.4Å; H229-W255 WeakPolarHBondContact CD2-CH2 3.34Å; H229-W255 AromaticContact CD2-CZ3 3.41Å; H229-W255 VanDerWaalsContact CD2-CZ3 3.41Å; H229-W255 WeakPolarHBondContact CD2-CZ3 3.16Å; H229-W255 AromaticContact CG-CH2 3.98Å; H229-W255 AromaticContact NE2-CZ3 3.94Å; M232-W255 HydrophobicContact CB-CD2 3.89Å; M232-W255 VanDerWaalsContact CB-CE2 3.45Å; M232-W255 HydrophobicContact CB-CE3 4.2Å; M232-W255 HydrophobicContact CB-CH2 3.67Å; M232-W255 HydrophobicContact CB-CZ2 3.35Å; M232-W255 HydrophobicContact CB-CZ3 4.09Å; M232-W255 HydrophobicContact CE-CB 3.76Å; M232-W255 HydrophobicContact CE-CD2 3.8Å; M232-W255 HydrophobicContact CE-CG 3.33Å; M232-W255 HydrophobicContact CG-CD2 3.89Å; M232-W255 HydrophobicContact CG-CE3 3.98Å; M232-W255 HydrophobicContact CG-CG 4.44Å; M232-W255 HydrophobicContact CG-CH2 4.25Å; M232-W255 HydrophobicContact CG-CZ2 4.2Å; M232-W255 HydrophobicContact CG-CZ3 4.15Å; W242-W255 AromaticContact CZ2-CD1 3.88Å
256	Q	61.9	Low	83.6	Confident	182 Å²	182	78.3 Å²	78.3	85%	0.85	48%	0.484	S	S	*	.			trans	-105.1	116.5	165.2	-66.6	176.8	-7.3	0	0	105.4	G254	G254-Q256 PolarHBondContact O-N 3.44Å
257	G	57.8	Low	82.9	Confident	130 Å²	130	73.9 Å²	73.9	100%	1.34	48%	0.478	S	S	*	.			trans	-62.1	0	-179.5	0	0	0	0	0	113.2

Retrieved 257 of 257 residues in 170.9 ms (Link to these results)

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