A0A077YYN6_TRITR Loading...

DUF2362 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YYN6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 427 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	51.1	Low	47.7	Very low	198 Å²	198	114.7 Å²	114.7	98%	0.975	61%	0.605	S	S	*	*				0	-52.3	0	-129.5	170.2	73	0	0	111.2	V3 A4 E5	M1-V3 PolarHBondContact O-N 3.05Å; M1-A4 WeakPolarHBondContact O-CB 3.48Å; M1-A4 PolarHBondContact O-N 3.33Å; M1-E5 PolarHBondContact O-N 2.98Å
2	V	44.4	Very low	47.9	Very low	99 Å²	99	113.5 Å²	113.5	60%	0.6	60%	0.598	S	S	*	*	H	α-helix	trans	-52.4	-47.1	178.3	-175.6	0	0	0	0	114.2	A4 E5 E6	V2-A4 VanDerWaalsContact C-N 3.25Å; V2-A4 PolarHBondContact O-N 3.18Å; V2-E5 PolarHBondContact O-N 3.24Å; V2-E6 PolarHBondContact O-N 3.19Å
3	V	43.2	Very low	48.6	Very low	97 Å²	97	114.5 Å²	114.5	59%	0.588	60%	0.598	S	S	*	*	H	α-helix	trans	-65	-27	179.5	-177.5	0	0	0	0	113.3	M1 K7	M1-V3 PolarHBondContact O-N 3.05Å; V3-K7 WeakPolarHBondContact O-CG 3.48Å; V3-K7 PolarHBondContact O-N 3.49Å
4	A	43.3	Very low	49.4	Very low	68 Å²	68	113.7 Å²	113.7	56%	0.562	59%	0.594	S	S	*	*	H	α-helix	trans	-79.4	-35	177.3	0	0	0	0	0	111.4	M1 V2 K8	M1-A4 WeakPolarHBondContact O-CB 3.48Å; M1-A4 PolarHBondContact O-N 3.33Å; V2-A4 VanDerWaalsContact C-N 3.25Å; V2-A4 PolarHBondContact O-N 3.18Å; A4-K8 WeakPolarHBondContact O-CB 3.42Å; A4-K8 PolarHBondContact O-N 3.27Å; A4-K8 VanDerWaalsContact O-N 3.1Å
5	E	43	Very low	50.3	Low	127 Å²	127	111.9 Å²	111.9	59%	0.593	59%	0.586	S	S	*	*	H	α-helix	trans	-67.1	-44.4	172.2	-95.2	179.5	143.9	0	0	112.2	M1 V2 K7 K8 L9	M1-E5 PolarHBondContact O-N 2.98Å; V2-E5 PolarHBondContact O-N 3.24Å; E5-K7 PolarHBondContact O-N 2.92Å; E5-K8 WeakPolarHBondContact O-CB 3.46Å; E5-K8 PolarHBondContact O-N 3.43Å; E5-K8 VanDerWaalsContact O-N 3.12Å; E5-L9 PolarHBondContact O-N 3.1Å
6	E	43.4	Very low	51.4	Low	127 Å²	127	110.2 Å²	110.2	59%	0.593	58%	0.581	S	S	*	*	H	α-helix	trans	-60.9	-42.7	176.1	-76.9	-177.7	150.4	0	0	112.2	V2 K8 L9 A10	V2-E6 PolarHBondContact O-N 3.19Å; E6-K8 VanDerWaalsContact C-N 3.31Å; E6-K8 PolarHBondContact O-N 2.87Å; E6-L9 PolarHBondContact O-N 3.12Å; E6-A10 WeakPolarHBondContact O-CB 3.49Å; E6-A10 PolarHBondContact O-N 3Å
7	K	49.4	Very low	52.6	Low	142 Å²	142	107.1 Å²	107.1	62%	0.617	57%	0.571	S	S	*	*	H	α-helix	trans	-62.1	-38.9	174.2	-80.4	-173.8	-179.2	-176.6	0	112.2	V3 E5 L11	V3-K7 WeakPolarHBondContact O-CG 3.48Å; V3-K7 PolarHBondContact O-N 3.49Å; E5-K7 PolarHBondContact O-N 2.92Å; K7-L11 WeakPolarHBondContact O-CB 3.45Å; K7-L11 WeakPolarHBondContact O-CD1 3.39Å; K7-L11 PolarHBondContact O-N 3.25Å
8	K	51.8	Low	53.9	Low	145 Å²	145	107.8 Å²	107.8	63%	0.63	57%	0.57	S	S	*	*	H	α-helix	trans	-68.4	-39.5	178.7	-161.2	180	-177.9	-173.6	0	111.2	A4 E5 E6 L11 L12	A4-K8 WeakPolarHBondContact O-CB 3.42Å; A4-K8 PolarHBondContact O-N 3.27Å; A4-K8 VanDerWaalsContact O-N 3.1Å; E5-K8 WeakPolarHBondContact O-CB 3.46Å; E5-K8 PolarHBondContact O-N 3.43Å; E5-K8 VanDerWaalsContact O-N 3.12Å; E6-K8 VanDerWaalsContact C-N 3.31Å; E6-K8 PolarHBondContact O-N 2.87Å; K8-L11 PolarHBondContact O-N 3.49Å; K8-L12 HydrophobicContact CG-CD1 4.48Å; K8-L12 WeakPolarHBondContact O-CD1 3.45Å; K8-L12 WeakPolarHBondContact O-CG 3.47Å; K8-L12 PolarHBondContact O-N 3.02Å
9	L	48	Very low	55.3	Low	107 Å²	107	111.9 Å²	111.9	56%	0.56	58%	0.577	S	S	*	*	H	α-helix	trans	-65.9	-44.4	176.1	-143	87.8	0	0	0	111.6	E5 E6 L11 L12 Q13	E5-L9 PolarHBondContact O-N 3.1Å; E6-L9 PolarHBondContact O-N 3.12Å; L9-L11 PolarHBondContact O-N 3.32Å; L9-L12 PolarHBondContact O-N 3.06Å; L9-Q13 WeakPolarHBondContact O-CG 3.37Å; L9-Q13 PolarHBondContact O-N 3.03Å
10	A	53.5	Low	56.9	Low	45 Å²	45	112.4 Å²	112.4	37%	0.372	58%	0.576	S	S	.	*	H	α-helix	trans	-63.9	-39.2	176.5	0	0	0	0	0	112.4	E6 Q13 N14	E6-A10 WeakPolarHBondContact O-CB 3.49Å; E6-A10 PolarHBondContact O-N 3Å; A10-Q13 PolarHBondContact O-N 3.32Å; A10-N14 WeakPolarHBondContact O-CB 3.41Å; A10-N14 PolarHBondContact O-N 3.49Å
11	L	54	Low	58.4	Low	107 Å²	107	108.8 Å²	108.8	56%	0.56	56%	0.558	S	S	*	*	H	α-helix	trans	-64.1	-41.2	173.5	-89	156.4	0	0	0	112.3	K7 K8 L9 N15	K7-L11 WeakPolarHBondContact O-CB 3.45Å; K7-L11 WeakPolarHBondContact O-CD1 3.39Å; K7-L11 PolarHBondContact O-N 3.25Å; K8-L11 PolarHBondContact O-N 3.49Å; L9-L11 PolarHBondContact O-N 3.32Å; L11-N15 WeakPolarHBondContact O-CB 3.38Å; L11-N15 VanDerWaalsContact O-CG 3.3Å; L11-N15 PolarHBondContact O-N 3.47Å; L11-N15 PolarHBondContact O-ND2 3.16Å
12	L	49.8	Very low	60.2	Low	100 Å²	100	104.2 Å²	104.2	52%	0.524	54%	0.537	S	S	.	.	H	α-helix	trans	-65.2	-45.1	176.3	-78.5	161.4	0	0	0	111.6	K8 L9 N15 V16	K8-L12 HydrophobicContact CG-CD1 4.48Å; K8-L12 WeakPolarHBondContact O-CD1 3.45Å; K8-L12 WeakPolarHBondContact O-CG 3.47Å; K8-L12 PolarHBondContact O-N 3.02Å; L9-L12 PolarHBondContact O-N 3.06Å; L12-N15 PolarHBondContact O-N 3.42Å; L12-V16 WeakPolarHBondContact O-CG2 3.46Å; L12-V16 PolarHBondContact O-N 2.92Å
13	Q	56.5	Low	62.5	Low	127 Å²	127	104 Å²	104	59%	0.593	53%	0.531	S	S	*	.	H	α-helix	trans	-63.6	-42.2	177.1	-75.2	177.5	-19.7	0	0	112.2	L9 A10 N15 V16 S17	L9-Q13 WeakPolarHBondContact O-CG 3.37Å; L9-Q13 PolarHBondContact O-N 3.03Å; A10-Q13 PolarHBondContact O-N 3.32Å; Q13-N15 PolarHBondContact O-N 3.34Å; Q13-V16 PolarHBondContact O-N 3.48Å; Q13-S17 PolarHBondContact O-N 2.94Å
14	N	60.2	Low	65	Low	103 Å²	103	99.7 Å²	99.7	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-61	-43.9	174.5	-79.1	-8	0	0	0	111.8	A10 V16 S17 E18	A10-N14 WeakPolarHBondContact O-CB 3.41Å; A10-N14 PolarHBondContact O-N 3.49Å; N14-V16 VanDerWaalsContact C-N 3.31Å; N14-V16 PolarHBondContact O-N 2.99Å; N14-S17 PolarHBondContact O-N 3.29Å; N14-E18 WeakPolarHBondContact O-CB 3.4Å; N14-E18 WeakPolarHBondContact O-CG 3.44Å; N14-E18 PolarHBondContact O-N 2.88Å
15	N	63.3	Low	67.4	Low	87 Å²	87	98.1 Å²	98.1	47%	0.465	49%	0.486	S	S	.	.	H	α-helix	trans	-63.6	-35.1	178.1	-78	-16.2	0	0	0	113	L11 L12 Q13 R19	L11-N15 WeakPolarHBondContact O-CB 3.38Å; L11-N15 VanDerWaalsContact O-CG 3.3Å; L11-N15 PolarHBondContact O-N 3.47Å; L11-N15 PolarHBondContact O-ND2 3.16Å; L12-N15 PolarHBondContact O-N 3.42Å; Q13-N15 PolarHBondContact O-N 3.34Å; N15-R19 WeakPolarHBondContact O-CG 3.27Å; N15-R19 PolarHBondContact O-N 3.39Å; N15-R19 VanDerWaalsContact O-N 3.16Å
16	V	67.3	Low	69.7	Low	84 Å²	84	95.2 Å²	95.2	51%	0.509	48%	0.48	S	S	.	.	H	α-helix	trans	-69.4	-48	176	173.5	0	0	0	0	110.3	L12 Q13 N14 E18 R19 E20	L12-V16 WeakPolarHBondContact O-CG2 3.46Å; L12-V16 PolarHBondContact O-N 2.92Å; Q13-V16 PolarHBondContact O-N 3.48Å; N14-V16 VanDerWaalsContact C-N 3.31Å; N14-V16 PolarHBondContact O-N 2.99Å; V16-E18 VanDerWaalsContact C-N 3.34Å; V16-E18 PolarHBondContact O-N 3.2Å; V16-R19 PolarHBondContact O-N 3.43Å; V16-E20 PolarHBondContact O-N 2.97Å
17	S	72.2	Confident	72.2	Confident	58 Å²	58	92.1 Å²	92.1	41%	0.406	46%	0.463	S	S	.	.	H	α-helix	trans	-60.8	-41.9	177.8	-173.3	0	0	0	0	112.2	Q13 N14 R19 E20 D21	Q13-S17 PolarHBondContact O-N 2.94Å; N14-S17 PolarHBondContact O-N 3.29Å; S17-R19 PolarHBondContact O-N 3.35Å; S17-E20 PolarHBondContact O-N 3.49Å; S17-D21 PolarHBondContact O-N 2.99Å
18	E	75.8	Confident	74.4	Confident	119 Å²	119	85.5 Å²	85.5	56%	0.556	43%	0.434	S	S	*	.	H	α-helix	trans	-63.4	-40.3	176.5	-79.4	-176.8	173.7	0	0	111.8	N14 V16 D21 I22	N14-E18 WeakPolarHBondContact O-CB 3.4Å; N14-E18 WeakPolarHBondContact O-CG 3.44Å; N14-E18 PolarHBondContact O-N 2.88Å; V16-E18 VanDerWaalsContact C-N 3.34Å; V16-E18 PolarHBondContact O-N 3.2Å; E18-D21 PolarHBondContact O-N 3.03Å; E18-I22 WeakPolarHBondContact O-CD1 3.35Å; E18-I22 VanDerWaalsContact O-CG1 3.22Å; E18-I22 WeakPolarHBondContact O-CG1 3.22Å; E18-I22 PolarHBondContact O-N 2.97Å
19	R	81.5	Confident	76.3	Confident	186 Å²	186	83 Å²	83	70%	0.702	42%	0.424	S	S	*	.	H	α-helix	trans	-64.5	-42.1	175.4	-82.8	-176.4	176.4	-170.5	-0.6	112.5	N15 V16 S17 D21 I22 L23	N15-R19 WeakPolarHBondContact O-CG 3.27Å; N15-R19 PolarHBondContact O-N 3.39Å; N15-R19 VanDerWaalsContact O-N 3.16Å; V16-R19 PolarHBondContact O-N 3.43Å; S17-R19 PolarHBondContact O-N 3.35Å; R19-D21 VanDerWaalsContact C-N 3.34Å; R19-I22 PolarHBondContact O-N 3.38Å; R19-L23 WeakPolarHBondContact O-CG 3.44Å; R19-L23 PolarHBondContact O-N 3.49Å
20	E	87.2	Confident	78.4	Confident	121 Å²	121	83 Å²	83	57%	0.565	42%	0.42	S	S	*	.	H	α-helix	trans	-63.1	-41	175.9	-74.8	-173.1	172.1	0	0	111.8	V16 S17 L23 F24	V16-E20 PolarHBondContact O-N 2.97Å; S17-E20 PolarHBondContact O-N 3.49Å; E20-L23 PolarHBondContact O-N 3.39Å; E20-F24 WeakPolarHBondContact O-CB 3.47Å; E20-F24 PolarHBondContact O-N 3.4Å
21	D	88.3	Confident	80.3	Confident	37 Å²	37	81.1 Å²	81.1	20%	0.198	40%	0.404	C	S	.	.	H	α-helix	trans	-62.9	-46.5	175.8	-78.9	-22.1	0	0	0	111.5	S17 E18 R19 L23 F24 H25 R105 K109	S17-D21 PolarHBondContact O-N 2.99Å; E18-D21 PolarHBondContact O-N 3.03Å; R19-D21 VanDerWaalsContact C-N 3.34Å; D21-L23 VanDerWaalsContact C-N 3.34Å; D21-L23 PolarHBondContact O-N 3.15Å; D21-F24 PolarHBondContact O-N 3.04Å; D21-H25 PolarHBondContact O-CD2 3.44Å; D21-H25 PolarHBondContact O-N 3.41Å; D21-H25 PolarHBondContact O-ND1 3.44Å; D21-R105 IonicContact OD1-NH2 3.76Å; D21-K109 IonicContact OD1-NZ 2.59Å; D21-K109 PolarHBondContact OD1-NZ 2.89Å
22	I	88.5	Confident	82	Confident	103 Å²	103	76.5 Å²	76.5	53%	0.528	38%	0.381	S	S	.	.	H	α-helix	trans	-58.4	-46.9	177.2	-68.6	163.7	0	0	0	110.8	E18 R19 F24 H25 S26	E18-I22 WeakPolarHBondContact O-CD1 3.35Å; E18-I22 VanDerWaalsContact O-CG1 3.22Å; E18-I22 WeakPolarHBondContact O-CG1 3.22Å; E18-I22 PolarHBondContact O-N 2.97Å; R19-I22 PolarHBondContact O-N 3.38Å; I22-F24 PolarHBondContact O-N 3.43Å; I22-H25 PolarHBondContact O-N 2.93Å; I22-S26 PolarHBondContact O-N 3.23Å; I22-S26 PolarHBondContact O-OG 3.4Å; I22-S26 VanDerWaalsContact O-OG 3.13Å
23	L	92.9	Very high	83.9	Confident	93 Å²	93	75.4 Å²	75.4	49%	0.487	39%	0.387	S	S	.	.	H	α-helix	trans	-62.9	-42.8	178.3	-73.9	171.2	0	0	0	111.8	R19 E20 D21 R27	R19-L23 WeakPolarHBondContact O-CG 3.44Å; R19-L23 PolarHBondContact O-N 3.49Å; E20-L23 PolarHBondContact O-N 3.39Å; D21-L23 VanDerWaalsContact C-N 3.34Å; D21-L23 PolarHBondContact O-N 3.15Å; L23-R27 WeakPolarHBondContact O-CB 3.36Å; L23-R27 VanDerWaalsContact O-CG 3.23Å; L23-R27 WeakPolarHBondContact O-CG 3.4Å; L23-R27 PolarHBondContact O-N 2.86Å
24	F	95	Very high	85.5	Confident	8 Å²	8	74.6 Å²	74.6	4%	0.035	39%	0.386	C	S	.	.	H	α-helix	trans	-60.8	-47	175.8	164.2	-100.5	0	0	0	111.6	E20 D21 I22 S26 R27 F28 F108 K109 V112 H248	E20-F24 WeakPolarHBondContact O-CB 3.47Å; E20-F24 PolarHBondContact O-N 3.4Å; D21-F24 PolarHBondContact O-N 3.04Å; I22-F24 PolarHBondContact O-N 3.43Å; F24-S26 PolarHBondContact O-N 2.97Å; F24-R27 PolarHBondContact O-N 3.23Å; F24-F28 PolarHBondContact O-N 2.94Å; F24-F108 HydrophobicContact CE2-CD1 4.22Å; F24-F108 HydrophobicContact CE2-CE1 4.43Å; F24-F108 HydrophobicContact CZ-CD1 4.13Å; F24-F108 HydrophobicContact CZ-CE1 4.17Å; F24-K109 HydrophobicContact CD2-CB 4.08Å; F24-K109 HydrophobicContact CD2-CG 3.68Å; F24-K109 HydrophobicContact CE2-CB 4.27Å; F24-K109 HydrophobicContact CE2-CG 3.74Å; F24-K109 HydrophobicContact CG-CD 4.5Å; F24-K109 HydrophobicContact CG-CG 4.08Å; F24-K109 HydrophobicContact CZ-CG 4.22Å; F24-V112 HydrophobicContact CD2-CB 4.13Å; F24-V112 HydrophobicContact CD2-CG1 3.99Å; F24-V112 HydrophobicContact CE2-CB 3.84Å; F24-V112 HydrophobicContact CE2-CG1 3.95Å; F24-V112 HydrophobicContact CE2-CG2 3.76Å; F24-H248 HydrophobicContact CE1-CB 4.38Å; F24-H248 AromaticContact CE1-ND1 3.46Å; F24-H248 WeakPolarHBondContact CE1-ND1 3.38Å; F24-H248 AromaticContact CZ-CE1 3.84Å; F24-H248 AromaticContact CZ-ND1 3.54Å
25	H	93.2	Very high	86.9	Confident	34 Å²	34	72.7 Å²	72.7	16%	0.157	38%	0.376	C	S	.	.	H	α-helix	trans	-60.3	-46.5	178.7	-61.7	156.3	0	0	0	111.6	D21 I22 R27 F28 Q29 Y195 H248	D21-H25 PolarHBondContact O-CD2 3.44Å; D21-H25 PolarHBondContact O-N 3.41Å; D21-H25 PolarHBondContact O-ND1 3.44Å; I22-H25 PolarHBondContact O-N 2.93Å; H25-R27 PolarHBondContact O-N 3.33Å; H25-F28 PolarHBondContact O-N 3.34Å; H25-Q29 WeakPolarHBondContact O-CB 3.26Å; H25-Q29 PolarHBondContact O-N 3.13Å; H25-Y195 HydrophobicContact CB-CD1 4.03Å; H25-Y195 HydrophobicContact CB-CE1 3.68Å; H25-Y195 AromaticContact CD2-CE1 3.34Å; H25-Y195 WeakPolarHBondContact CD2-CE1 3.47Å; H25-Y195 AromaticContact CD2-CZ 3.27Å; H25-Y195 PolarHBondContact CD2-OH 2.99Å; H25-Y195 AromaticContact CG-CE1 3.35Å; H25-Y195 AromaticContact CG-CZ 3.7Å; H25-Y195 AromaticContact ND1-CE1 3.87Å; H25-Y195 AromaticContact NE2-CE1 3.86Å; H25-Y195 AromaticContact NE2-CZ 3.98Å; H25-Y195 PolarHBondContact NE2-OH 3.35Å; H25-H248 PolarHBondContact NE2-O 3.03Å
26	S	92.6	Very high	88.2	Confident	67 Å²	67	73.7 Å²	73.7	47%	0.469	38%	0.382	S	S	.	.	H	α-helix	trans	-62.1	-40.6	177.7	-61.3	0	0	0	0	112.8	I22 F24 F30	I22-S26 PolarHBondContact O-N 3.23Å; I22-S26 PolarHBondContact O-OG 3.4Å; I22-S26 VanDerWaalsContact O-OG 3.13Å; F24-S26 PolarHBondContact O-N 2.97Å; S26-F30 WeakPolarHBondContact O-CB 3.29Å; S26-F30 PolarHBondContact O-N 3.32Å
27	R	95	Very high	89.2	Confident	62 Å²	62	78.1 Å²	78.1	23%	0.234	39%	0.389	C	S	.	.	H	α-helix	trans	-65.5	-46.1	176.9	-72.9	170	176.5	163	-2.1	111.8	L23 F24 H25 F30 I31 V112 H113 Y116	L23-R27 WeakPolarHBondContact O-CB 3.36Å; L23-R27 VanDerWaalsContact O-CG 3.23Å; L23-R27 WeakPolarHBondContact O-CG 3.4Å; L23-R27 PolarHBondContact O-N 2.86Å; F24-R27 PolarHBondContact O-N 3.23Å; H25-R27 PolarHBondContact O-N 3.33Å; R27-F30 PolarHBondContact O-N 3.34Å; R27-I31 WeakPolarHBondContact O-CG1 3.34Å; R27-I31 PolarHBondContact O-N 3.12Å; R27-V112 HydrophobicContact CB-CG1 4.09Å; R27-H113 PolarHBondContact NH1-ND1 3.39Å; R27-H113 VanDerWaalsContact NH1-ND1 3.15Å; R27-H113 PolarHBondContact NH2-ND1 2.9Å; R27-Y116 HydrophobicContact CB-CD2 3.99Å; R27-Y116 HydrophobicContact CB-CG 4.02Å; R27-Y116 HydrophobicContact CG-CD1 3.83Å; R27-Y116 HydrophobicContact CG-CD2 3.94Å; R27-Y116 HydrophobicContact CG-CE1 4.15Å; R27-Y116 HydrophobicContact CG-CE2 4.25Å; R27-Y116 HydrophobicContact CG-CG 3.72Å
28	F	94.9	Very high	90.2	Very high	3 Å²	3	75.4 Å²	75.4	1%	0.013	37%	0.37	C	S	.	.	H	α-helix	trans	-62	-46.1	178.1	-173.5	-91.9	0	0	0	111.3	F24 H25 F30 I31 A32 L39 L42 F108 V112 A191 Y195 H248	F24-F28 PolarHBondContact O-N 2.94Å; H25-F28 PolarHBondContact O-N 3.34Å; F28-F30 VanDerWaalsContact C-N 3.29Å; F28-F30 PolarHBondContact O-N 3.47Å; F28-I31 PolarHBondContact O-N 3.05Å; F28-A32 HydrophobicContact CE1-CB 4.45Å; F28-A32 WeakPolarHBondContact O-CB 3.23Å; F28-A32 PolarHBondContact O-N 3.11Å; F28-L39 HydrophobicContact CZ-CD1 4.07Å; F28-L42 HydrophobicContact CD2-CD1 4.17Å; F28-L42 HydrophobicContact CE2-CD1 4.02Å; F28-F108 HydrophobicContact CD2-CE1 4.45Å; F28-F108 HydrophobicContact CE2-CE1 4.23Å; F28-F108 HydrophobicContact CE2-CZ 4.06Å; F28-V112 HydrophobicContact CB-CG1 4.09Å; F28-V112 HydrophobicContact CD2-CG1 4.39Å; F28-V112 HydrophobicContact CD2-CG2 3.88Å; F28-A191 HydrophobicContact CE1-CB 4.38Å; F28-A191 HydrophobicContact CZ-CB 4.06Å; F28-Y195 HydrophobicContact CD1-CD2 4.15Å; F28-Y195 AromaticContact CD1-CE2 3.8Å; F28-Y195 HydrophobicContact CD1-CE2 3.8Å; F28-Y195 HydrophobicContact CG-CE2 4.47Å; F28-H248 AromaticContact CD1-CE1 3.7Å; F28-H248 AromaticContact CD2-CE1 3.61Å; F28-H248 AromaticContact CE1-CE1 3.66Å; F28-H248 AromaticContact CE2-CE1 3.56Å; F28-H248 AromaticContact CE2-NE2 3.94Å; F28-H248 AromaticContact CG-CE1 3.65Å; F28-H248 AromaticContact CZ-CE1 3.58Å; F28-H248 AromaticContact CZ-NE2 3.88Å
29	Q	92.4	Very high	90.9	Very high	91 Å²	91	69.8 Å²	69.8	43%	0.425	34%	0.344	S	S	.	.	H	α-helix	trans	-60.7	-39.5	177.4	-173.8	174.3	24.7	0	0	111.9	H25 A32 A33 Y195	H25-Q29 WeakPolarHBondContact O-CB 3.26Å; H25-Q29 PolarHBondContact O-N 3.13Å; Q29-A32 PolarHBondContact O-N 2.94Å; Q29-A33 WeakPolarHBondContact O-CB 3.42Å; Q29-A33 PolarHBondContact O-N 3.26Å; Q29-A33 VanDerWaalsContact O-N 3.08Å; Q29-Y195 HydrophobicContact CB-CD2 4.49Å; Q29-Y195 PolarHBondContact NE2-O 3.47Å
30	F	92.9	Very high	91.4	Very high	108 Å²	108	63.9 Å²	63.9	47%	0.474	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-47.3	174.5	-179.5	-89.4	0	0	0	111.8	S26 R27 F28 A32 A33 N34 Y116	S26-F30 WeakPolarHBondContact O-CB 3.29Å; S26-F30 PolarHBondContact O-N 3.32Å; R27-F30 PolarHBondContact O-N 3.34Å; F28-F30 VanDerWaalsContact C-N 3.29Å; F28-F30 PolarHBondContact O-N 3.47Å; F30-A32 PolarHBondContact O-N 3.33Å; F30-A33 PolarHBondContact O-N 3.41Å; F30-N34 HydrophobicContact CE1-CB 4.41Å; F30-N34 HydrophobicContact CZ-CB 4.47Å; F30-N34 WeakPolarHBondContact O-CB 3.37Å; F30-N34 PolarHBondContact O-N 3.47Å; F30-N34 VanDerWaalsContact O-N 3.13Å; F30-N34 PolarHBondContact O-ND2 3.15Å; F30-Y116 HydrophobicContact CB-CD2 4.32Å; F30-Y116 HydrophobicContact CB-CE2 3.91Å; F30-Y116 AromaticContact CD1-CD2 3.75Å; F30-Y116 HydrophobicContact CD1-CD2 3.75Å; F30-Y116 AromaticContact CD1-CE2 3.47Å; F30-Y116 HydrophobicContact CD1-CE2 3.47Å; F30-Y116 VanDerWaalsContact CD1-CE2 3.47Å; F30-Y116 HydrophobicContact CD2-CE2 4.49Å; F30-Y116 HydrophobicContact CE1-CD2 4.47Å; F30-Y116 HydrophobicContact CE1-CE2 4.1Å; F30-Y116 HydrophobicContact CG-CD2 4.28Å; F30-Y116 AromaticContact CG-CE2 3.7Å; F30-Y116 HydrophobicContact CG-CE2 3.7Å
31	I	92.8	Very high	91.6	Very high	5 Å²	5	58.7 Å²	58.7	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-59.8	-49	177.4	-67.9	160.4	0	0	0	110.2	R27 F28 A33 N34 D35 A38 L42 V112 V115 Y116	R27-I31 WeakPolarHBondContact O-CG1 3.34Å; R27-I31 PolarHBondContact O-N 3.12Å; F28-I31 PolarHBondContact O-N 3.05Å; I31-A33 PolarHBondContact O-N 3.05Å; I31-N34 PolarHBondContact O-N 3.14Å; I31-D35 PolarHBondContact O-N 3.37Å; I31-A38 HydrophobicContact CG2-CB 3.65Å; I31-L42 HydrophobicContact CD1-CD1 4.26Å; I31-L42 HydrophobicContact CG2-CD1 3.99Å; I31-V112 HydrophobicContact CD1-CG1 4.04Å; I31-V115 HydrophobicContact CD1-CB 3.98Å; I31-V115 HydrophobicContact CD1-CG1 3.58Å; I31-V115 HydrophobicContact CG1-CG1 4Å; I31-V115 HydrophobicContact CG2-CG1 4.23Å; I31-Y116 HydrophobicContact CG1-CD2 4.5Å
32	A	90.6	Very high	91.9	Very high	11 Å²	11	57 Å²	57	9%	0.091	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-28.8	-177.9	0	0	0	0	0	113.3	F28 Q29 F30 L39	F28-A32 HydrophobicContact CE1-CB 4.45Å; F28-A32 WeakPolarHBondContact O-CB 3.23Å; F28-A32 PolarHBondContact O-N 3.11Å; Q29-A32 PolarHBondContact O-N 2.94Å; F30-A32 PolarHBondContact O-N 3.33Å; A32-L39 HydrophobicContact CB-CD1 3.96Å; A32-L39 HydrophobicContact CB-CD2 4.17Å
33	A	88.7	Confident	92	Very high	77 Å²	77	52.2 Å²	52.2	64%	0.636	27%	0.268	S	S	*	.	H	α-helix	trans	-89.3	-18.1	179.4	0	0	0	0	0	114.5	Q29 F30 I31	Q29-A33 WeakPolarHBondContact O-CB 3.42Å; Q29-A33 PolarHBondContact O-N 3.26Å; Q29-A33 VanDerWaalsContact O-N 3.08Å; F30-A33 PolarHBondContact O-N 3.41Å; I31-A33 PolarHBondContact O-N 3.05Å
34	N	90.7	Very high	92	Very high	109 Å²	109	50.9 Å²	50.9	58%	0.583	26%	0.262	S	S	*	.	H	α-helix	trans	-127.9	-18.3	-168	-63.6	-85.9	0	0	0	115	F30 I31	F30-N34 HydrophobicContact CE1-CB 4.41Å; F30-N34 HydrophobicContact CZ-CB 4.47Å; F30-N34 WeakPolarHBondContact O-CB 3.37Å; F30-N34 PolarHBondContact O-N 3.47Å; F30-N34 VanDerWaalsContact O-N 3.13Å; F30-N34 PolarHBondContact O-ND2 3.15Å; I31-N34 PolarHBondContact O-N 3.14Å
35	D	90.2	Very high	91.9	Very high	63 Å²	63	51.5 Å²	51.5	34%	0.337	26%	0.264	S	S	.	.			trans	-140.3	90.9	-176.6	-169.5	-17.4	0	0	0	112	I31 R37 A38 L39	I31-D35 PolarHBondContact O-N 3.37Å; D35-R37 PolarHBondContact O-N 3.01Å; D35-R37 WeakPolarHBondContact OD1-CB 3.46Å; D35-R37 PolarHBondContact OD1-N 3.36Å; D35-A38 HydrophobicContact CB-CB 3.81Å; D35-A38 PolarHBondContact O-N 3.47Å; D35-A38 PolarHBondContact OD1-N 2.59Å; D35-A38 WeakPolarHBondContact OD2-CB 3.36Å; D35-L39 WeakPolarHBondContact O-CB 3.31Å; D35-L39 PolarHBondContact O-N 3.39Å
36	D	88.8	Confident	91.8	Very high	109 Å²	109	50.3 Å²	50.3	58%	0.583	26%	0.259	S	S	*	.	H	α-helix	trans	-58.6	-34.4	177.8	-67.7	-23.7	0	0	0	112.6	L39 N40	D36-L39 PolarHBondContact O-N 3.28Å; D36-N40 WeakPolarHBondContact O-CB 3.34Å; D36-N40 PolarHBondContact O-N 2.88Å; D36-N40 PolarHBondContact O-ND2 3.3Å
37	R	89.9	Confident	91.8	Very high	177 Å²	177	48.7 Å²	48.7	67%	0.668	24%	0.244	S	C	*	.	H	α-helix	trans	-70.5	-44.5	-178.8	-72.4	-176.6	-69.8	-179.2	-3.5	110.3	D35 N40 F41	D35-R37 PolarHBondContact O-N 3.01Å; D35-R37 WeakPolarHBondContact OD1-CB 3.46Å; D35-R37 PolarHBondContact OD1-N 3.36Å; R37-N40 PolarHBondContact O-N 3.35Å; R37-F41 PolarHBondContact O-N 2.91Å
38	A	91.7	Very high	91.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-43.6	174.2	0	0	0	0	0	112	I31 D35 F41 L42 V115 F125	I31-A38 HydrophobicContact CG2-CB 3.65Å; D35-A38 HydrophobicContact CB-CB 3.81Å; D35-A38 PolarHBondContact O-N 3.47Å; D35-A38 PolarHBondContact OD1-N 2.59Å; D35-A38 WeakPolarHBondContact OD2-CB 3.36Å; A38-F41 WeakPolarHBondContact O-CB 3.32Å; A38-F41 PolarHBondContact O-N 2.98Å; A38-L42 WeakPolarHBondContact O-CG 3.26Å; A38-L42 PolarHBondContact O-N 2.95Å; A38-V115 HydrophobicContact CB-CG1 3.57Å; A38-F125 HydrophobicContact CB-CE1 4.24Å
39	L	91.4	Very high	91.7	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-48.1	176.7	-178.8	62.5	0	0	0	111.7	F28 A32 D35 D36 F41 L42 V43 L188 A191 L192	F28-L39 HydrophobicContact CZ-CD1 4.07Å; A32-L39 HydrophobicContact CB-CD1 3.96Å; A32-L39 HydrophobicContact CB-CD2 4.17Å; D35-L39 WeakPolarHBondContact O-CB 3.31Å; D35-L39 PolarHBondContact O-N 3.39Å; D36-L39 PolarHBondContact O-N 3.28Å; L39-F41 VanDerWaalsContact C-N 3.26Å; L39-F41 PolarHBondContact O-N 3.5Å; L39-L42 PolarHBondContact O-N 2.83Å; L39-L42 VanDerWaalsContact O-N 3.15Å; L39-V43 HydrophobicContact CD1-CG2 4.38Å; L39-V43 WeakPolarHBondContact O-CG2 3.47Å; L39-V43 PolarHBondContact O-N 3.14Å; L39-L188 HydrophobicContact CD2-CD1 3.49Å; L39-L188 VanDerWaalsContact CD2-CD1 3.49Å; L39-L188 HydrophobicContact CG-CD1 3.61Å; L39-A191 HydrophobicContact CD1-CB 4.1Å; L39-L192 HydrophobicContact CD2-CD2 3.54Å; L39-L192 HydrophobicContact CD2-CG 3.95Å
40	N	91.4	Very high	91.7	Very high	62 Å²	62	46 Å²	46	33%	0.332	23%	0.234	S	C	.	.	H	α-helix	trans	-58.5	-38.8	176.6	-85.3	-74.5	0	0	0	112	D36 R37 V43 N44	D36-N40 WeakPolarHBondContact O-CB 3.34Å; D36-N40 PolarHBondContact O-N 2.88Å; D36-N40 PolarHBondContact O-ND2 3.3Å; R37-N40 PolarHBondContact O-N 3.35Å; N40-V43 PolarHBondContact O-N 3.46Å; N40-N44 WeakPolarHBondContact O-CB 2.94Å; N40-N44 VanDerWaalsContact O-CG 3.23Å; N40-N44 PolarHBondContact O-N 2.93Å; N40-N44 PolarHBondContact O-ND2 3.4Å
41	F	91.9	Very high	91.7	Very high	13 Å²	13	43.1 Å²	43.1	6%	0.057	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-43.6	175.2	165.2	-97.7	0	0	0	112.8	R37 A38 L39 N44 K45 L111 V115 L120 F125	R37-F41 PolarHBondContact O-N 2.91Å; A38-F41 WeakPolarHBondContact O-CB 3.32Å; A38-F41 PolarHBondContact O-N 2.98Å; L39-F41 VanDerWaalsContact C-N 3.26Å; L39-F41 PolarHBondContact O-N 3.5Å; F41-N44 PolarHBondContact O-N 3.13Å; F41-K45 HydrophobicContact CE2-CG 4.32Å; F41-K45 HydrophobicContact CZ-CG 4.23Å; F41-K45 PolarHBondContact O-N 3.37Å; F41-L111 HydrophobicContact CE1-CD1 3.76Å; F41-L111 HydrophobicContact CE1-CD2 3.67Å; F41-L111 HydrophobicContact CE1-CG 3.86Å; F41-L111 HydrophobicContact CZ-CD1 3.98Å; F41-L111 HydrophobicContact CZ-CD2 4.09Å; F41-L111 HydrophobicContact CZ-CG 4.45Å; F41-V115 HydrophobicContact CD1-CG2 4.32Å; F41-V115 HydrophobicContact CE1-CG2 4.23Å; F41-L120 HydrophobicContact CE1-CD1 4.22Å; F41-F125 HydrophobicContact CB-CD1 3.51Å; F41-F125 HydrophobicContact CB-CE1 3.88Å; F41-F125 HydrophobicContact CD1-CD1 4.17Å; F41-F125 AromaticContact CD1-CE1 3.84Å; F41-F125 HydrophobicContact CD1-CE1 3.84Å; F41-F125 HydrophobicContact CD2-CD1 4.16Å; F41-F125 AromaticContact CG-CD1 3.7Å; F41-F125 HydrophobicContact CG-CD1 3.7Å; F41-F125 AromaticContact CG-CE1 3.86Å; F41-F125 HydrophobicContact CG-CE1 3.86Å
42	L	93.5	Very high	91.7	Very high	1 Å²	1	47 Å²	47	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-63	-43.2	176	-68.3	172.2	0	0	0	111.4	F28 I31 A38 L39 N44 K45 E46 F108 L111 V112 V115	F28-L42 HydrophobicContact CD2-CD1 4.17Å; F28-L42 HydrophobicContact CE2-CD1 4.02Å; I31-L42 HydrophobicContact CD1-CD1 4.26Å; I31-L42 HydrophobicContact CG2-CD1 3.99Å; A38-L42 WeakPolarHBondContact O-CG 3.26Å; A38-L42 PolarHBondContact O-N 2.95Å; L39-L42 PolarHBondContact O-N 2.83Å; L39-L42 VanDerWaalsContact O-N 3.15Å; L42-N44 PolarHBondContact O-N 3.17Å; L42-K45 WeakPolarHBondContact O-CB 3.33Å; L42-K45 PolarHBondContact O-N 2.89Å; L42-K45 VanDerWaalsContact O-N 3.16Å; L42-E46 PolarHBondContact O-N 2.92Å; L42-F108 HydrophobicContact CB-CE2 4.25Å; L42-F108 HydrophobicContact CB-CZ 4.27Å; L42-F108 HydrophobicContact CD2-CE2 4.22Å; L42-F108 HydrophobicContact CD2-CZ 4.48Å; L42-L111 HydrophobicContact CD2-CD2 3.8Å; L42-L111 HydrophobicContact CD2-CG 3.92Å; L42-V112 HydrophobicContact CD1-CG2 3.98Å; L42-V112 HydrophobicContact CD2-CG2 3.86Å; L42-V115 HydrophobicContact CD2-CG2 4.19Å
43	V	91.8	Very high	91.9	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-43.5	176.2	170.6	0	0	0	0	111.3	L39 N40 K45 E46 M47 R187 L188 A191	L39-V43 HydrophobicContact CD1-CG2 4.38Å; L39-V43 WeakPolarHBondContact O-CG2 3.47Å; L39-V43 PolarHBondContact O-N 3.14Å; N40-V43 PolarHBondContact O-N 3.46Å; V43-K45 VanDerWaalsContact C-N 3.27Å; V43-K45 PolarHBondContact O-N 2.94Å; V43-E46 WeakPolarHBondContact O-CA 3.39Å; V43-E46 WeakPolarHBondContact O-CB 3.37Å; V43-E46 PolarHBondContact O-N 3.4Å; V43-E46 VanDerWaalsContact O-N 3.13Å; V43-M47 HydrophobicContact CG1-SD 4.39Å; V43-M47 WeakPolarHBondContact O-CG 3.42Å; V43-M47 PolarHBondContact O-N 3.33Å; V43-R187 HydrophobicContact CG1-CB 3.71Å; V43-L188 HydrophobicContact CG2-CD1 4Å; V43-A191 HydrophobicContact CG2-CB 4.03Å
44	N	91.7	Very high	92	Very high	65 Å²	65	43.9 Å²	43.9	35%	0.348	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-37.1	175.3	-74.4	-35.6	0	0	0	111.9	N40 F41 L42 M47 E48	N40-N44 WeakPolarHBondContact O-CB 2.94Å; N40-N44 VanDerWaalsContact O-CG 3.23Å; N40-N44 PolarHBondContact O-N 2.93Å; N40-N44 PolarHBondContact O-ND2 3.4Å; F41-N44 PolarHBondContact O-N 3.13Å; L42-N44 PolarHBondContact O-N 3.17Å; N44-M47 WeakPolarHBondContact O-CB 3.41Å; N44-M47 PolarHBondContact O-N 3.19Å; N44-E48 PolarHBondContact O-N 3.38Å
45	K	93.2	Very high	92.1	Very high	21 Å²	21	40 Å²	40	9%	0.091	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-37.6	173.8	-81.1	-72.5	172.3	-162	0	112.8	F41 L42 V43 M47 E48 Y49 L111 R128	F41-K45 HydrophobicContact CE2-CG 4.32Å; F41-K45 HydrophobicContact CZ-CG 4.23Å; F41-K45 PolarHBondContact O-N 3.37Å; L42-K45 WeakPolarHBondContact O-CB 3.33Å; L42-K45 PolarHBondContact O-N 2.89Å; L42-K45 VanDerWaalsContact O-N 3.16Å; V43-K45 VanDerWaalsContact C-N 3.27Å; V43-K45 PolarHBondContact O-N 2.94Å; K45-M47 VanDerWaalsContact C-N 3.26Å; K45-M47 PolarHBondContact O-N 3.45Å; K45-E48 WeakPolarHBondContact CE-OE2 3.42Å; K45-E48 IonicContact NZ-OE1 3.01Å; K45-E48 PolarHBondContact NZ-OE1 3.3Å; K45-E48 IonicContact NZ-OE2 2.67Å; K45-E48 PolarHBondContact NZ-OE2 3.48Å; K45-E48 PolarHBondContact O-N 2.98Å; K45-Y49 PolarHBondContact O-N 2.87Å; K45-L111 HydrophobicContact CB-CD2 4.14Å; K45-L111 HydrophobicContact CG-CD2 3.86Å; K45-R128 VanDerWaalsContact NZ-NH1 3.14Å
46	E	92.4	Very high	92.2	Very high	8 Å²	8	38.2 Å²	38.2	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-57.5	-40.9	170.7	-131.8	-165.3	148.8	0	0	112	L42 V43 S50 R187 L247	L42-E46 PolarHBondContact O-N 2.92Å; V43-E46 WeakPolarHBondContact O-CA 3.39Å; V43-E46 WeakPolarHBondContact O-CB 3.37Å; V43-E46 PolarHBondContact O-N 3.4Å; V43-E46 VanDerWaalsContact O-N 3.13Å; E46-S50 PolarHBondContact O-N 3.08Å; E46-S50 PolarHBondContact O-OG 3.13Å; E46-S50 VanDerWaalsContact O-OG 3.14Å; E46-R187 PolarHBondContact O-NH1 3Å; E46-R187 IonicContact OE1-CZ 3.92Å; E46-R187 IonicContact OE1-NE 3.82Å; E46-R187 IonicContact OE1-NH2 3.66Å; E46-R187 PolarHBondContact OE1-NH2 2.81Å; E46-R187 IonicContact OE2-CZ 3.91Å; E46-R187 IonicContact OE2-NE 3.78Å; E46-R187 PolarHBondContact OE2-NE 2.87Å; E46-R187 IonicContact OE2-NH2 3.75Å; E46-L247 HydrophobicContact CB-CD1 4.46Å; E46-L247 HydrophobicContact CG-CD1 3.37Å
47	M	91	Very high	92.3	Very high	33 Å²	33	33.8 Å²	33.8	16%	0.163	17%	0.172	C	C	.	.	H	α-helix	trans	-68.7	-41.3	178.4	-67.6	171.5	59.8	0	0	112.1	V43 N44 K45 Y49 S50 A51 M182 A184	V43-M47 HydrophobicContact CG1-SD 4.39Å; V43-M47 WeakPolarHBondContact O-CG 3.42Å; V43-M47 PolarHBondContact O-N 3.33Å; N44-M47 WeakPolarHBondContact O-CB 3.41Å; N44-M47 PolarHBondContact O-N 3.19Å; K45-M47 VanDerWaalsContact C-N 3.26Å; K45-M47 PolarHBondContact O-N 3.45Å; M47-Y49 VanDerWaalsContact C-N 3.35Å; M47-Y49 PolarHBondContact O-N 3.19Å; M47-S50 PolarHBondContact O-N 2.89Å; M47-A51 PolarHBondContact O-N 3.3Å; M47-M182 VanDerWaalsContact CE-O 3.26Å; M47-M182 WeakPolarHBondContact CE-O 3.46Å; M47-A184 HydrophobicContact CE-CB 4.24Å; M47-A184 HydrophobicContact SD-CB 3.75Å
48	E	93.1	Very high	92.3	Very high	83 Å²	83	31.6 Å²	31.6	39%	0.388	17%	0.169	S	C	.	.	H	α-helix	trans	-57.8	-47.8	173.8	-172.3	177.8	151.1	0	0	111	N44 K45 S50 A51 E52	N44-E48 PolarHBondContact O-N 3.38Å; K45-E48 WeakPolarHBondContact CE-OE2 3.42Å; K45-E48 IonicContact NZ-OE1 3.01Å; K45-E48 PolarHBondContact NZ-OE1 3.3Å; K45-E48 IonicContact NZ-OE2 2.67Å; K45-E48 PolarHBondContact NZ-OE2 3.48Å; K45-E48 PolarHBondContact O-N 2.98Å; E48-S50 PolarHBondContact O-N 2.81Å; E48-A51 WeakPolarHBondContact O-CB 3.43Å; E48-A51 PolarHBondContact O-N 3.3Å; E48-A51 VanDerWaalsContact O-N 3.11Å; E48-E52 PolarHBondContact O-N 3.16Å
49	Y	95	Very high	92.4	Very high	16 Å²	16	34.9 Å²	34.9	6%	0.063	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-41.5	175.9	-68.1	-22.5	0	0	0	113.4	K45 M47 A51 E52 V53 Q104 Q107 F108 L247	K45-Y49 PolarHBondContact O-N 2.87Å; M47-Y49 VanDerWaalsContact C-N 3.35Å; M47-Y49 PolarHBondContact O-N 3.19Å; Y49-A51 VanDerWaalsContact C-N 3.3Å; Y49-A51 PolarHBondContact O-N 3.01Å; Y49-E52 PolarHBondContact O-N 3.01Å; Y49-V53 WeakPolarHBondContact O-CG2 3.33Å; Y49-V53 PolarHBondContact O-N 2.95Å; Y49-V53 VanDerWaalsContact O-N 3.08Å; Y49-Q104 HydrophobicContact CD1-CB 4.26Å; Y49-Q104 HydrophobicContact CD1-CG 3.64Å; Y49-Q104 HydrophobicContact CD2-CB 3.98Å; Y49-Q104 HydrophobicContact CD2-CG 4.26Å; Y49-Q104 HydrophobicContact CE1-CB 4.46Å; Y49-Q104 HydrophobicContact CE1-CG 4Å; Y49-Q104 HydrophobicContact CE2-CB 4.22Å; Y49-Q104 HydrophobicContact CG-CB 4Å; Y49-Q104 HydrophobicContact CG-CG 3.77Å; Y49-Q104 PolarHBondContact O-NE2 3.37Å; Y49-Q107 VanDerWaalsContact OH-CB 3.24Å; Y49-Q107 WeakPolarHBondContact OH-CB 3.39Å; Y49-Q107 PolarHBondContact OH-OE1 3.47Å; Y49-F108 HydrophobicContact CE2-CB 4.08Å; Y49-F108 HydrophobicContact CE2-CD2 4.15Å; Y49-L247 HydrophobicContact CD2-CD1 4.24Å; Y49-L247 HydrophobicContact CD2-CD2 4.37Å
50	S	92.4	Very high	92.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-38.7	173.4	-66.3	0	0	0	0	112.2	E46 M47 E48 V53 L54 R187 S244	E46-S50 PolarHBondContact O-N 3.08Å; E46-S50 PolarHBondContact O-OG 3.13Å; E46-S50 VanDerWaalsContact O-OG 3.14Å; M47-S50 PolarHBondContact O-N 2.89Å; E48-S50 PolarHBondContact O-N 2.81Å; S50-V53 PolarHBondContact O-N 3.46Å; S50-L54 WeakPolarHBondContact O-CB 3.3Å; S50-L54 VanDerWaalsContact O-CG 3.29Å; S50-L54 WeakPolarHBondContact O-CG 3.39Å; S50-L54 PolarHBondContact O-N 2.99Å; S50-R187 PolarHBondContact OG-NH1 3.17Å; S50-S244 VanDerWaalsContact OG-CB 3.25Å; S50-S244 WeakPolarHBondContact OG-CB 3.3Å; S50-S244 PolarHBondContact OG-OG 3.33Å
51	A	92.3	Very high	92.2	Very high	49 Å²	49	36.4 Å²	36.4	41%	0.405	20%	0.195	S	C	.	.	H	α-helix	trans	-66.9	-40.5	179.8	0	0	0	0	0	111.6	M47 E48 Y49 L54 G55 M182	M47-A51 PolarHBondContact O-N 3.3Å; E48-A51 WeakPolarHBondContact O-CB 3.43Å; E48-A51 PolarHBondContact O-N 3.3Å; E48-A51 VanDerWaalsContact O-N 3.11Å; Y49-A51 VanDerWaalsContact C-N 3.3Å; Y49-A51 PolarHBondContact O-N 3.01Å; A51-L54 PolarHBondContact O-N 2.75Å; A51-G55 PolarHBondContact O-N 2.97Å; A51-M182 HydrophobicContact CB-CE 3.93Å
52	E	94.4	Very high	92.2	Very high	86 Å²	86	41.5 Å²	41.5	40%	0.402	22%	0.22	S	C	.	.	H	α-helix	trans	-62.2	-44.8	173.8	-69.9	174.2	-128.1	0	0	112.1	E48 Y49 L54 G55 L56 L100	E48-E52 PolarHBondContact O-N 3.16Å; Y49-E52 PolarHBondContact O-N 3.01Å; E52-L54 VanDerWaalsContact C-N 3.35Å; E52-L54 PolarHBondContact O-N 3.34Å; E52-G55 PolarHBondContact O-N 2.98Å; E52-L56 PolarHBondContact O-N 3.02Å; E52-L56 VanDerWaalsContact O-N 3.14Å; E52-L100 HydrophobicContact CB-CD2 4.45Å
53	V	93.5	Very high	92.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-43.8	176.7	165.6	0	0	0	0	111.1	Y49 S50 L56 I57 M97 L100 K101 E242 R243	Y49-V53 WeakPolarHBondContact O-CG2 3.33Å; Y49-V53 PolarHBondContact O-N 2.95Å; Y49-V53 VanDerWaalsContact O-N 3.08Å; S50-V53 PolarHBondContact O-N 3.46Å; V53-L56 PolarHBondContact O-N 2.89Å; V53-I57 HydrophobicContact CG1-CD1 4.06Å; V53-I57 WeakPolarHBondContact O-CG1 3.38Å; V53-I57 PolarHBondContact O-N 3.5Å; V53-M97 HydrophobicContact CB-SD 4.4Å; V53-M97 HydrophobicContact CG1-CE 4.21Å; V53-M97 HydrophobicContact CG1-SD 3.71Å; V53-M97 HydrophobicContact CG2-SD 4.26Å; V53-L100 HydrophobicContact CG2-CD2 4.08Å; V53-K101 HydrophobicContact CG2-CG 4.23Å; V53-E242 VanDerWaalsContact CG1-O 3.23Å; V53-E242 WeakPolarHBondContact CG1-O 3.45Å; V53-R243 VanDerWaalsContact CG1-C 3.48Å; V53-R243 WeakPolarHBondContact CG1-O 3.33Å
54	L	90.9	Very high	92	Very high	22 Å²	22	45.6 Å²	45.6	12%	0.115	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-41.7	176.9	-75.1	169.2	0	0	0	112	S50 A51 E52 L56 I57 E58 M182 R243	S50-L54 WeakPolarHBondContact O-CB 3.3Å; S50-L54 VanDerWaalsContact O-CG 3.29Å; S50-L54 WeakPolarHBondContact O-CG 3.39Å; S50-L54 PolarHBondContact O-N 2.99Å; A51-L54 PolarHBondContact O-N 2.75Å; E52-L54 VanDerWaalsContact C-N 3.35Å; E52-L54 PolarHBondContact O-N 3.34Å; L54-L56 VanDerWaalsContact C-N 3.26Å; L54-L56 PolarHBondContact O-N 3.25Å; L54-I57 WeakPolarHBondContact O-CB 3.38Å; L54-I57 PolarHBondContact O-N 3.42Å; L54-I57 VanDerWaalsContact O-N 3.12Å; L54-E58 WeakPolarHBondContact O-CG 3.36Å; L54-E58 PolarHBondContact O-N 2.95Å; L54-M182 HydrophobicContact CD1-CE 3.5Å; L54-R243 HydrophobicContact CD2-CB 3.96Å; L54-R243 HydrophobicContact CD2-CG 3.89Å
55	G	92.4	Very high	91.9	Very high	28 Å²	28	47.4 Å²	47.4	29%	0.289	25%	0.245	S	C	.	.	H	α-helix	trans	-59.5	-37.5	175.3	0	0	0	0	0	112.7	A51 E52 E58 T59	A51-G55 PolarHBondContact O-N 2.97Å; E52-G55 PolarHBondContact O-N 2.98Å; G55-E58 PolarHBondContact O-N 3.49Å; G55-T59 PolarHBondContact O-N 2.79Å; G55-T59 PolarHBondContact O-OG1 3.06Å
56	L	93.6	Very high	91.8	Very high	26 Å²	26	50.3 Å²	50.3	14%	0.136	26%	0.262	C	S	.	.	H	α-helix	trans	-70	-37	175.5	-169.1	64.9	0	0	0	112.4	E52 V53 L54 R60 Y93 Q96 M97 L100	E52-L56 PolarHBondContact O-N 3.02Å; E52-L56 VanDerWaalsContact O-N 3.14Å; V53-L56 PolarHBondContact O-N 2.89Å; L54-L56 VanDerWaalsContact C-N 3.26Å; L54-L56 PolarHBondContact O-N 3.25Å; L56-R60 WeakPolarHBondContact O-CB 3.24Å; L56-R60 PolarHBondContact O-N 3.45Å; L56-Y93 HydrophobicContact CD1-CD1 3.72Å; L56-Y93 HydrophobicContact CD1-CE1 3.78Å; L56-Y93 HydrophobicContact CG-CD1 4.01Å; L56-Y93 HydrophobicContact CG-CE1 4.46Å; L56-Q96 HydrophobicContact CD2-CB 4.01Å; L56-M97 HydrophobicContact CB-CE 3.96Å; L56-M97 HydrophobicContact CD2-CB 4.32Å; L56-M97 HydrophobicContact CD2-CE 3.75Å; L56-M97 HydrophobicContact CD2-SD 4.19Å; L56-M97 HydrophobicContact CG-CE 3.96Å; L56-L100 HydrophobicContact CD2-CD2 4.23Å
57	I	89.7	Confident	91.6	Very high	16 Å²	16	51 Å²	51	8%	0.082	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-45.7	172.8	-70.6	170.4	0	0	0	110.8	V53 L54 T59 R60 D61 M97 E242 R243	V53-I57 HydrophobicContact CG1-CD1 4.06Å; V53-I57 WeakPolarHBondContact O-CG1 3.38Å; V53-I57 PolarHBondContact O-N 3.5Å; L54-I57 WeakPolarHBondContact O-CB 3.38Å; L54-I57 PolarHBondContact O-N 3.42Å; L54-I57 VanDerWaalsContact O-N 3.12Å; I57-T59 VanDerWaalsContact C-N 3.34Å; I57-T59 PolarHBondContact O-N 3.43Å; I57-R60 WeakPolarHBondContact O-CB 3.24Å; I57-R60 PolarHBondContact O-N 3.2Å; I57-D61 WeakPolarHBondContact O-CB 3.37Å; I57-D61 VanDerWaalsContact O-CG 3.26Å; I57-D61 PolarHBondContact O-N 3.43Å; I57-M97 HydrophobicContact CD1-CE 4.33Å; I57-M97 HydrophobicContact CG1-CE 3.58Å; I57-E242 HydrophobicContact CD1-CG 4.14Å; I57-R243 HydrophobicContact CD1-CG 4.26Å
58	E	90.3	Very high	91.3	Very high	131 Å²	131	51.9 Å²	51.9	61%	0.612	27%	0.268	S	S	*	.	H	α-helix	trans	-61.2	-43.8	179	-73.4	171.5	179.9	0	0	111.1	L54 G55 R60 D61 E62	L54-E58 WeakPolarHBondContact O-CG 3.36Å; L54-E58 PolarHBondContact O-N 2.95Å; G55-E58 PolarHBondContact O-N 3.49Å; E58-R60 PolarHBondContact O-N 2.68Å; E58-D61 PolarHBondContact O-N 2.9Å; E58-E62 WeakPolarHBondContact O-CB 3.41Å; E58-E62 PolarHBondContact O-N 3.04Å
59	T	93.3	Very high	91	Very high	68 Å²	68	52.9 Å²	52.9	42%	0.417	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-42.8	177.7	-48.3	0	0	0	0	111.5	G55 I57 E62 E63 Y93	G55-T59 PolarHBondContact O-N 2.79Å; G55-T59 PolarHBondContact O-OG1 3.06Å; I57-T59 VanDerWaalsContact C-N 3.34Å; I57-T59 PolarHBondContact O-N 3.43Å; T59-E62 PolarHBondContact O-N 3.25Å; T59-E63 WeakPolarHBondContact O-CB 3.42Å; T59-E63 PolarHBondContact O-N 3.34Å; T59-Y93 HydrophobicContact CG2-CE1 4.27Å; T59-Y93 WeakPolarHBondContact CG2-OH 3.37Å
60	R	91.7	Very high	90.7	Very high	21 Å²	21	54.6 Å²	54.6	8%	0.079	29%	0.289	C	S	.	.	H	α-helix	trans	-58.6	-50.2	174.4	179.7	-163.1	68.4	-164.8	-0.5	111.3	L56 I57 E58 E62 E63 L64 Y93 E242	L56-R60 WeakPolarHBondContact O-CB 3.24Å; L56-R60 PolarHBondContact O-N 3.45Å; I57-R60 WeakPolarHBondContact O-CB 3.24Å; I57-R60 PolarHBondContact O-N 3.2Å; E58-R60 PolarHBondContact O-N 2.68Å; R60-E62 VanDerWaalsContact C-N 3.32Å; R60-E62 PolarHBondContact O-N 2.83Å; R60-E63 PolarHBondContact O-N 3.45Å; R60-L64 HydrophobicContact CG-CD1 4.04Å; R60-L64 WeakPolarHBondContact O-CB 3.38Å; R60-L64 WeakPolarHBondContact O-CG 3.35Å; R60-L64 PolarHBondContact O-N 3.05Å; R60-Y93 HydrophobicContact CB-CD1 3.64Å; R60-Y93 HydrophobicContact CB-CD2 3.84Å; R60-Y93 HydrophobicContact CB-CE1 3.96Å; R60-Y93 HydrophobicContact CB-CE2 4.16Å; R60-Y93 HydrophobicContact CB-CG 3.57Å; R60-Y93 HydrophobicContact CG-CD1 4.28Å; R60-Y93 HydrophobicContact CG-CD2 3.73Å; R60-Y93 HydrophobicContact CG-CE2 4.38Å; R60-Y93 HydrophobicContact CG-CG 3.68Å; R60-E242 IonicContact CZ-OE2 3.99Å; R60-E242 VanDerWaalsContact NH1-CD 3.29Å; R60-E242 IonicContact NH1-OE1 3.07Å; R60-E242 PolarHBondContact NH1-OE1 3.28Å; R60-E242 IonicContact NH1-OE2 3.3Å; R60-E242 PolarHBondContact NH1-OE2 3.45Å; R60-E242 VanDerWaalsContact NH1-OE2 3.07Å; R60-E242 IonicContact NH2-OE2 3.69Å
61	D	88.3	Confident	90.3	Very high	74 Å²	74	55.3 Å²	55.3	40%	0.396	29%	0.293	S	S	.	.	H	α-helix	trans	-67.4	-36.9	-174.6	-69.3	-6.4	0	0	0	110.7	I57 E58 E65	I57-D61 WeakPolarHBondContact O-CB 3.37Å; I57-D61 VanDerWaalsContact O-CG 3.26Å; I57-D61 PolarHBondContact O-N 3.43Å; E58-D61 PolarHBondContact O-N 2.9Å; D61-E65 WeakPolarHBondContact O-CB 3.46Å; D61-E65 PolarHBondContact O-N 2.99Å
62	E	91.3	Very high	89.7	Confident	121 Å²	121	60.8 Å²	60.8	57%	0.565	31%	0.308	S	S	*	.	H	α-helix	trans	-64.3	-44.9	173	-175.4	178.1	-175.6	0	0	112.1	E58 T59 R60 E65 N66	E58-E62 WeakPolarHBondContact O-CB 3.41Å; E58-E62 PolarHBondContact O-N 3.04Å; T59-E62 PolarHBondContact O-N 3.25Å; R60-E62 VanDerWaalsContact C-N 3.32Å; R60-E62 PolarHBondContact O-N 2.83Å; E62-E65 PolarHBondContact O-N 2.82Å; E62-N66 WeakPolarHBondContact O-CB 3.48Å; E62-N66 PolarHBondContact O-N 2.91Å; E62-N66 PolarHBondContact O-ND2 2.89Å
63	E	93.3	Very high	89.1	Confident	73 Å²	73	62.3 Å²	62.3	34%	0.341	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-42.8	177.7	-170.7	174	160.9	0	0	111.7	T59 R60 N66 F67 I89 Y93	T59-E63 WeakPolarHBondContact O-CB 3.42Å; T59-E63 PolarHBondContact O-N 3.34Å; R60-E63 PolarHBondContact O-N 3.45Å; E63-N66 PolarHBondContact O-N 3.09Å; E63-F67 WeakPolarHBondContact O-CB 3.34Å; E63-F67 PolarHBondContact O-N 3.17Å; E63-I89 HydrophobicContact CG-CD1 4.32Å; E63-I89 HydrophobicContact CG-CG2 4.45Å; E63-Y93 WeakPolarHBondContact OE2-CE2 3.46Å; E63-Y93 VanDerWaalsContact OE2-CZ 3.31Å; E63-Y93 PolarHBondContact OE2-OH 3.4Å
64	L	88.8	Confident	88.2	Confident	17 Å²	17	68 Å²	68	9%	0.089	35%	0.35	C	S	.	.	H	α-helix	trans	-62.1	-45.4	174	-74.4	171	0	0	0	111.8	R60 N66 F67 E68 R86 I89 M90	R60-L64 HydrophobicContact CG-CD1 4.04Å; R60-L64 WeakPolarHBondContact O-CB 3.38Å; R60-L64 WeakPolarHBondContact O-CG 3.35Å; R60-L64 PolarHBondContact O-N 3.05Å; L64-N66 VanDerWaalsContact C-N 3.33Å; L64-N66 PolarHBondContact O-N 3.44Å; L64-F67 PolarHBondContact O-N 3.43Å; L64-E68 WeakPolarHBondContact O-CG 3.48Å; L64-E68 PolarHBondContact O-N 3.17Å; L64-R86 HydrophobicContact CD2-CG 3.89Å; L64-I89 HydrophobicContact CD2-CB 4.12Å; L64-I89 HydrophobicContact CD2-CD1 4.26Å; L64-I89 HydrophobicContact CD2-CG2 3.77Å; L64-I89 HydrophobicContact CG-CG2 3.94Å; L64-M90 HydrophobicContact CD1-SD 3.67Å
65	E	89.1	Confident	86.9	Confident	102 Å²	102	78.8 Å²	78.8	48%	0.477	39%	0.389	S	S	.	.	H	α-helix	trans	-63.6	-41.1	178.8	-168.2	-174.9	167.9	0	0	111.5	D61 E62 E68 K69	D61-E65 WeakPolarHBondContact O-CB 3.46Å; D61-E65 PolarHBondContact O-N 2.99Å; E62-E65 PolarHBondContact O-N 2.82Å; E65-E68 PolarHBondContact O-N 3.23Å; E65-K69 VanDerWaalsContact CD-NZ 3.3Å; E65-K69 HydrophobicContact CG-CD 4.41Å; E65-K69 WeakPolarHBondContact O-CG 3.43Å; E65-K69 PolarHBondContact O-N 3.5Å; E65-K69 WeakPolarHBondContact OE1-CE 3.47Å; E65-K69 IonicContact OE1-NZ 2.93Å; E65-K69 PolarHBondContact OE1-NZ 3.49Å
66	N	90.6	Very high	85.8	Confident	82 Å²	82	84.9 Å²	84.9	44%	0.439	42%	0.415	S	S	.	.	H	α-helix	trans	-64.3	-41.9	175.9	-73.2	-27.1	0	0	0	111.6	E62 E63 L64 K69 A70	E62-N66 WeakPolarHBondContact O-CB 3.48Å; E62-N66 PolarHBondContact O-N 2.91Å; E62-N66 PolarHBondContact O-ND2 2.89Å; E63-N66 PolarHBondContact O-N 3.09Å; L64-N66 VanDerWaalsContact C-N 3.33Å; L64-N66 PolarHBondContact O-N 3.44Å; N66-K69 PolarHBondContact O-N 2.82Å; N66-A70 WeakPolarHBondContact O-CB 3.5Å; N66-A70 PolarHBondContact O-N 2.89Å
67	F	88.3	Confident	84.5	Confident	24 Å²	24	86.7 Å²	86.7	11%	0.105	42%	0.422	C	S	.	.	H	α-helix	trans	-62.3	-43.6	174	175.8	-112.7	0	0	0	112.3	E63 L64 K69 A70 T71 F77 Y82 H85 R86 I89	E63-F67 WeakPolarHBondContact O-CB 3.34Å; E63-F67 PolarHBondContact O-N 3.17Å; L64-F67 PolarHBondContact O-N 3.43Å; F67-K69 VanDerWaalsContact C-N 3.35Å; F67-K69 PolarHBondContact O-N 3.23Å; F67-A70 PolarHBondContact O-N 2.89Å; F67-T71 HydrophobicContact CD2-CG2 4.15Å; F67-T71 HydrophobicContact CE1-CG2 4.33Å; F67-T71 HydrophobicContact CE2-CG2 3.58Å; F67-T71 HydrophobicContact CZ-CG2 3.7Å; F67-T71 PolarHBondContact O-N 2.98Å; F67-T71 PolarHBondContact O-OG1 3.46Å; F67-F77 HydrophobicContact CE2-CE1 4.48Å; F67-F77 HydrophobicContact CE2-CZ 4.19Å; F67-F77 HydrophobicContact CZ-CE1 4.21Å; F67-F77 HydrophobicContact CZ-CZ 4.36Å; F67-Y82 HydrophobicContact CD1-CE2 4.2Å; F67-Y82 AromaticContact CE1-CD2 3.62Å; F67-Y82 HydrophobicContact CE1-CD2 3.62Å; F67-Y82 AromaticContact CE1-CE2 3.67Å; F67-Y82 HydrophobicContact CE1-CE2 3.67Å; F67-Y82 HydrophobicContact CE1-CG 4.29Å; F67-Y82 AromaticContact CZ-CD2 3.93Å; F67-Y82 HydrophobicContact CZ-CD2 3.93Å; F67-Y82 HydrophobicContact CZ-CE2 4.39Å; F67-H85 AromaticContact CD2-CD2 3.53Å; F67-H85 HydrophobicContact CE1-CB 4.47Å; F67-H85 HydrophobicContact CE2-CB 4.1Å; F67-H85 AromaticContact CE2-CD2 3.32Å; F67-H85 WeakPolarHBondContact CE2-CD2 3.44Å; F67-H85 HydrophobicContact CZ-CB 3.78Å; F67-H85 AromaticContact CZ-CD2 3.79Å; F67-R86 HydrophobicContact CE1-CB 4.13Å; F67-I89 HydrophobicContact CB-CD1 4.16Å; F67-I89 HydrophobicContact CD1-CD1 4.42Å; F67-I89 HydrophobicContact CG-CD1 4.21Å
68	E	85.9	Confident	83.8	Confident	50 Å²	50	94.2 Å²	94.2	23%	0.234	45%	0.45	C	S	.	.	H	α-helix	trans	-63.5	-38.5	176.5	-75.5	-166.8	179.5	0	0	112.6	L64 E65 T71 K72 Y82	L64-E68 WeakPolarHBondContact O-CG 3.48Å; L64-E68 PolarHBondContact O-N 3.17Å; E65-E68 PolarHBondContact O-N 3.23Å; E68-T71 WeakPolarHBondContact CA-OG1 3.3Å; E68-T71 PolarHBondContact O-OG1 3.46Å; E68-K72 VanDerWaalsContact O-CG 3.3Å; E68-K72 WeakPolarHBondContact O-CG 3.46Å; E68-K72 PolarHBondContact O-N 3.46Å; E68-K72 VanDerWaalsContact O-N 3.16Å; E68-Y82 HydrophobicContact CG-CE2 4.42Å; E68-Y82 VanDerWaalsContact CG-OH 3.32Å; E68-Y82 WeakPolarHBondContact CG-OH 3.43Å; E68-Y82 PolarHBondContact OE1-OH 3.49Å
69	K	86.8	Confident	83.2	Confident	104 Å²	104	92.4 Å²	92.4	45%	0.452	45%	0.451	S	S	.	.	H	α-helix	trans	-67.5	-44.2	175.5	-74.4	170.5	-176.6	162.3	0	111.5	E65 N66 F67 K72 T73	E65-K69 VanDerWaalsContact CD-NZ 3.3Å; E65-K69 HydrophobicContact CG-CD 4.41Å; E65-K69 WeakPolarHBondContact O-CG 3.43Å; E65-K69 PolarHBondContact O-N 3.5Å; E65-K69 WeakPolarHBondContact OE1-CE 3.47Å; E65-K69 IonicContact OE1-NZ 2.93Å; E65-K69 PolarHBondContact OE1-NZ 3.49Å; N66-K69 PolarHBondContact O-N 2.82Å; F67-K69 VanDerWaalsContact C-N 3.35Å; F67-K69 PolarHBondContact O-N 3.23Å; K69-K72 PolarHBondContact O-N 3.44Å; K69-T73 PolarHBondContact O-N 3.38Å; K69-T73 PolarHBondContact O-OG1 3.47Å
70	A	86.9	Confident	82.6	Confident	52 Å²	52	93.7 Å²	93.7	43%	0.43	46%	0.456	S	S	.	.	H	α-helix	trans	-61.9	-44.5	178.7	0	0	0	0	0	112	N66 F67 T73 Q74	N66-A70 WeakPolarHBondContact O-CB 3.5Å; N66-A70 PolarHBondContact O-N 2.89Å; F67-A70 PolarHBondContact O-N 2.89Å; A70-T73 WeakPolarHBondContact O-CB 3.29Å; A70-T73 PolarHBondContact O-N 2.91Å; A70-T73 VanDerWaalsContact O-N 3.15Å; A70-Q74 PolarHBondContact O-N 3.24Å
71	T	84.3	Confident	82.2	Confident	16 Å²	16	97.8 Å²	97.8	10%	0.098	48%	0.476	C	S	.	.	H	α-helix	trans	-69	-36.5	179.6	46.3	0	0	0	0	113.3	F67 E68 T73 Q74 F77 Y82	F67-T71 HydrophobicContact CD2-CG2 4.15Å; F67-T71 HydrophobicContact CE1-CG2 4.33Å; F67-T71 HydrophobicContact CE2-CG2 3.58Å; F67-T71 HydrophobicContact CZ-CG2 3.7Å; F67-T71 PolarHBondContact O-N 2.98Å; F67-T71 PolarHBondContact O-OG1 3.46Å; E68-T71 WeakPolarHBondContact CA-OG1 3.3Å; E68-T71 PolarHBondContact O-OG1 3.46Å; T71-T73 PolarHBondContact O-N 3.28Å; T71-Q74 PolarHBondContact O-N 3.05Å; T71-Q74 VanDerWaalsContact O-O 3.1Å; T71-F77 HydrophobicContact CG2-CB 4.45Å; T71-F77 HydrophobicContact CG2-CD1 3.77Å; T71-F77 HydrophobicContact CG2-CD2 3.8Å; T71-F77 HydrophobicContact CG2-CE1 3.85Å; T71-F77 HydrophobicContact CG2-CE2 3.9Å; T71-F77 HydrophobicContact CG2-CG 3.72Å; T71-F77 HydrophobicContact CG2-CZ 3.92Å; T71-Y82 HydrophobicContact CG2-CD2 3.92Å; T71-Y82 HydrophobicContact CG2-CE2 4.48Å
72	K	80.1	Confident	82	Confident	163 Å²	163	96 Å²	96	71%	0.709	46%	0.464	S	S	*	.	H	α-helix	trans	-60.7	-28	170.9	-74.8	170.1	-171.8	162.7	0	113.1	E68 K69	E68-K72 VanDerWaalsContact O-CG 3.3Å; E68-K72 WeakPolarHBondContact O-CG 3.46Å; E68-K72 PolarHBondContact O-N 3.46Å; E68-K72 VanDerWaalsContact O-N 3.16Å; K69-K72 PolarHBondContact O-N 3.44Å
73	T	81.4	Confident	81.6	Confident	119 Å²	119	92.7 Å²	92.7	73%	0.73	45%	0.448	S	S	*	.	H	α-helix	trans	-80.3	-29.1	179.5	-48.1	0	0	0	0	111.9	K69 A70 T71	K69-T73 PolarHBondContact O-N 3.38Å; K69-T73 PolarHBondContact O-OG1 3.47Å; A70-T73 WeakPolarHBondContact O-CB 3.29Å; A70-T73 PolarHBondContact O-N 2.91Å; A70-T73 VanDerWaalsContact O-N 3.15Å; T71-T73 PolarHBondContact O-N 3.28Å
74	Q	75.9	Confident	81.3	Confident	120 Å²	120	94.6 Å²	94.6	56%	0.561	46%	0.458	S	S	*	.			trans	-90	102.5	175.6	-81.9	177.3	-23.2	0	0	111.8	A70 T71 N76 F77	A70-Q74 PolarHBondContact O-N 3.24Å; T71-Q74 PolarHBondContact O-N 3.05Å; T71-Q74 VanDerWaalsContact O-O 3.1Å; Q74-N76 PolarHBondContact O-N 3.46Å; Q74-F77 PolarHBondContact O-N 3.19Å
75	R	63.7	Low	81.2	Confident	248 Å²	248	97.4 Å²	97.4	94%	0.936	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-15.5	178.6	-84	-176	176.5	171.5	-0.4	116
76	N	68.2	Low	81	Confident	155 Å²	155	93.7 Å²	93.7	83%	0.829	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	12.3	-173.8	-73	-9.5	0	0	0	114.3	Q74 R78	Q74-N76 PolarHBondContact O-N 3.46Å; N76-R78 PolarHBondContact O-N 3.19Å
77	F	67	Low	80.8	Confident	65 Å²	65	94.2 Å²	94.2	29%	0.285	45%	0.452	S	S	.	.			trans	-69.1	117.1	177.6	-138.2	-89.8	0	0	0	109.9	F67 T71 Q74 Q81	F67-F77 HydrophobicContact CE2-CE1 4.48Å; F67-F77 HydrophobicContact CE2-CZ 4.19Å; F67-F77 HydrophobicContact CZ-CE1 4.21Å; F67-F77 HydrophobicContact CZ-CZ 4.36Å; T71-F77 HydrophobicContact CG2-CB 4.45Å; T71-F77 HydrophobicContact CG2-CD1 3.77Å; T71-F77 HydrophobicContact CG2-CD2 3.8Å; T71-F77 HydrophobicContact CG2-CE1 3.85Å; T71-F77 HydrophobicContact CG2-CE2 3.9Å; T71-F77 HydrophobicContact CG2-CG 3.72Å; T71-F77 HydrophobicContact CG2-CZ 3.92Å; Q74-F77 PolarHBondContact O-N 3.19Å; F77-Q81 HydrophobicContact CD1-CB 4.2Å; F77-Q81 HydrophobicContact CE1-CB 3.72Å; F77-Q81 HydrophobicContact CZ-CB 4.37Å
78	R	75.1	Confident	80.9	Confident	174 Å²	174	97.8 Å²	97.8	66%	0.657	47%	0.469	S	S	*	.			trans	-72.7	142.5	177	-65.8	-176.6	157.1	-174.6	-3.3	109.7	N76 D80 Q81 Y82	N76-R78 PolarHBondContact O-N 3.19Å; R78-D80 WeakPolarHBondContact CB-OD1 3.36Å; R78-D80 PolarHBondContact O-N 3.05Å; R78-Q81 PolarHBondContact O-N 3.02Å; R78-Q81 VanDerWaalsContact O-N 3.17Å; R78-Y82 PolarHBondContact O-N 3.06Å; R78-Y82 VanDerWaalsContact O-N 3.11Å
79	S	77.5	Confident	81.1	Confident	92 Å²	92	95.7 Å²	95.7	64%	0.643	46%	0.46	S	S	*	.	H	α-helix	trans	-61.1	-31.5	-175.4	-168	0	0	0	0	113.2	Y82 E83	S79-Y82 PolarHBondContact O-N 3.28Å; S79-E83 WeakPolarHBondContact O-CG 3.23Å; S79-E83 PolarHBondContact O-N 3.4Å
80	D	80.4	Confident	81.1	Confident	96 Å²	96	92.3 Å²	92.3	51%	0.513	45%	0.446	S	S	.	.	H	α-helix	trans	-66.8	-44.2	175.8	55.4	-18.8	0	0	0	111.9	R78 Y82 E83 M84	R78-D80 WeakPolarHBondContact CB-OD1 3.36Å; R78-D80 PolarHBondContact O-N 3.05Å; D80-Y82 VanDerWaalsContact C-N 3.31Å; D80-Y82 PolarHBondContact O-N 2.87Å; D80-E83 PolarHBondContact O-N 2.85Å; D80-M84 WeakPolarHBondContact O-CB 3.36Å; D80-M84 PolarHBondContact O-N 3.05Å
81	Q	82.7	Confident	81.3	Confident	107 Å²	107	96.4 Å²	96.4	50%	0.5	46%	0.456	S	S	.	.	H	α-helix	trans	-65.3	-35.7	175.4	-67.9	-170.4	-18.3	0	0	112.3	F77 R78 H85	F77-Q81 HydrophobicContact CD1-CB 4.2Å; F77-Q81 HydrophobicContact CE1-CB 3.72Å; F77-Q81 HydrophobicContact CZ-CB 4.37Å; R78-Q81 PolarHBondContact O-N 3.02Å; R78-Q81 VanDerWaalsContact O-N 3.17Å; Q81-H85 PolarHBondContact O-N 2.89Å; Q81-H85 VanDerWaalsContact O-N 3.12Å
82	Y	84.2	Confident	81.7	Confident	36 Å²	36	99.4 Å²	99.4	14%	0.141	47%	0.472	C	S	.	.	H	α-helix	trans	-62.1	-51.5	177.3	174.8	-89.6	0	0	0	111	F67 E68 T71 R78 S79 D80 H85 R86	F67-Y82 HydrophobicContact CD1-CE2 4.2Å; F67-Y82 AromaticContact CE1-CD2 3.62Å; F67-Y82 HydrophobicContact CE1-CD2 3.62Å; F67-Y82 AromaticContact CE1-CE2 3.67Å; F67-Y82 HydrophobicContact CE1-CE2 3.67Å; F67-Y82 HydrophobicContact CE1-CG 4.29Å; F67-Y82 AromaticContact CZ-CD2 3.93Å; F67-Y82 HydrophobicContact CZ-CD2 3.93Å; F67-Y82 HydrophobicContact CZ-CE2 4.39Å; E68-Y82 HydrophobicContact CG-CE2 4.42Å; E68-Y82 VanDerWaalsContact CG-OH 3.32Å; E68-Y82 WeakPolarHBondContact CG-OH 3.43Å; E68-Y82 PolarHBondContact OE1-OH 3.49Å; T71-Y82 HydrophobicContact CG2-CD2 3.92Å; T71-Y82 HydrophobicContact CG2-CE2 4.48Å; R78-Y82 PolarHBondContact O-N 3.06Å; R78-Y82 VanDerWaalsContact O-N 3.11Å; S79-Y82 PolarHBondContact O-N 3.28Å; D80-Y82 VanDerWaalsContact C-N 3.31Å; D80-Y82 PolarHBondContact O-N 2.87Å; Y82-H85 PolarHBondContact O-N 3.22Å; Y82-R86 VanDerWaalsContact O-CB 3.25Å; Y82-R86 WeakPolarHBondContact O-CB 3.15Å; Y82-R86 PolarHBondContact O-N 3.27Å
83	E	83.3	Confident	82.3	Confident	51 Å²	51	92.5 Å²	92.5	24%	0.238	44%	0.441	C	S	.	.	H	α-helix	trans	-66.1	-41.5	-178.6	-65.7	-58.1	157	0	0	111.4	S79 D80 H85 R86 E87	S79-E83 WeakPolarHBondContact O-CG 3.23Å; S79-E83 PolarHBondContact O-N 3.4Å; D80-E83 PolarHBondContact O-N 2.85Å; E83-H85 PolarHBondContact O-N 2.63Å; E83-R86 PolarHBondContact O-N 2.93Å; E83-E87 WeakPolarHBondContact O-CB 3.32Å; E83-E87 WeakPolarHBondContact O-CG 3.44Å; E83-E87 PolarHBondContact O-N 3.36Å
84	M	86.2	Confident	82.7	Confident	114 Å²	114	87.8 Å²	87.8	56%	0.562	42%	0.416	S	S	*	.	H	α-helix	trans	-56	-52.8	175.7	-90.4	-173	49.9	0	0	112.7	D80 R86 E87 E88	D80-M84 WeakPolarHBondContact O-CB 3.36Å; D80-M84 PolarHBondContact O-N 3.05Å; M84-R86 VanDerWaalsContact C-N 3.3Å; M84-R86 PolarHBondContact O-N 2.8Å; M84-E87 PolarHBondContact O-N 2.62Å; M84-E88 WeakPolarHBondContact O-CG 3.48Å; M84-E88 PolarHBondContact O-N 2.84Å
85	H	86.9	Confident	83.5	Confident	76 Å²	76	85.3 Å²	85.3	35%	0.352	41%	0.412	S	S	.	.	H	α-helix	trans	-69.5	-33.9	-176.3	-165	60.4	0	0	0	112	F67 Q81 Y82 E83 E87 E88 I89	F67-H85 AromaticContact CD2-CD2 3.53Å; F67-H85 HydrophobicContact CE1-CB 4.47Å; F67-H85 HydrophobicContact CE2-CB 4.1Å; F67-H85 AromaticContact CE2-CD2 3.32Å; F67-H85 WeakPolarHBondContact CE2-CD2 3.44Å; F67-H85 HydrophobicContact CZ-CB 3.78Å; F67-H85 AromaticContact CZ-CD2 3.79Å; Q81-H85 PolarHBondContact O-N 2.89Å; Q81-H85 VanDerWaalsContact O-N 3.12Å; Y82-H85 PolarHBondContact O-N 3.22Å; E83-H85 PolarHBondContact O-N 2.63Å; H85-E87 VanDerWaalsContact C-N 3.34Å; H85-E88 IonicContact CE1-OE2 3.08Å; H85-E88 IonicContact CG-OE2 2.58Å; H85-E88 IonicContact ND1-OE2 2.96Å; H85-E88 PolarHBondContact ND1-OE2 3.36Å; H85-E88 WeakPolarHBondContact O-CB 3.29Å; H85-E88 PolarHBondContact O-N 3Å; H85-I89 WeakPolarHBondContact O-CG1 3.18Å; H85-I89 PolarHBondContact O-N 3.46Å
86	R	85.8	Confident	85	Confident	23 Å²	23	77.3 Å²	77.3	9%	0.087	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-42.2	172.8	-168.9	178.4	172.7	-72.6	-7.7	111.6	L64 F67 Y82 E83 M84 I89 M90 G219	L64-R86 HydrophobicContact CD2-CG 3.89Å; F67-R86 HydrophobicContact CE1-CB 4.13Å; Y82-R86 VanDerWaalsContact O-CB 3.25Å; Y82-R86 WeakPolarHBondContact O-CB 3.15Å; Y82-R86 PolarHBondContact O-N 3.27Å; E83-R86 PolarHBondContact O-N 2.93Å; M84-R86 VanDerWaalsContact C-N 3.3Å; M84-R86 PolarHBondContact O-N 2.8Å; R86-I89 PolarHBondContact O-N 3.29Å; R86-M90 WeakPolarHBondContact O-CB 3.43Å; R86-M90 VanDerWaalsContact O-CG 3.24Å; R86-M90 WeakPolarHBondContact O-CG 3.45Å; R86-M90 PolarHBondContact O-N 3.1Å; R86-G219 VanDerWaalsContact NH1-C 3.33Å; R86-G219 PolarHBondContact NH1-O 3Å; R86-G219 PolarHBondContact NH2-O 3.24Å
87	E	86.7	Confident	86.2	Confident	93 Å²	93	70.2 Å²	70.2	44%	0.435	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-40.1	173.8	-77.2	-178.3	171	0	0	112.1	E83 M84 H85 M90 Q91	E83-E87 WeakPolarHBondContact O-CB 3.32Å; E83-E87 WeakPolarHBondContact O-CG 3.44Å; E83-E87 PolarHBondContact O-N 3.36Å; M84-E87 PolarHBondContact O-N 2.62Å; H85-E87 VanDerWaalsContact C-N 3.34Å; E87-M90 PolarHBondContact O-N 2.72Å; E87-Q91 VanDerWaalsContact O-CB 3.28Å; E87-Q91 WeakPolarHBondContact O-CB 3.28Å; E87-Q91 PolarHBondContact O-N 3.13Å
88	E	89.7	Confident	87.4	Confident	100 Å²	100	71.2 Å²	71.2	47%	0.467	36%	0.356	S	S	.	.	H	α-helix	trans	-58.7	-47.9	174.8	-73.3	171.1	173.8	0	0	111.8	M84 H85 Q91 N92	M84-E88 WeakPolarHBondContact O-CG 3.48Å; M84-E88 PolarHBondContact O-N 2.84Å; H85-E88 IonicContact CE1-OE2 3.08Å; H85-E88 IonicContact CG-OE2 2.58Å; H85-E88 IonicContact ND1-OE2 2.96Å; H85-E88 PolarHBondContact ND1-OE2 3.36Å; H85-E88 WeakPolarHBondContact O-CB 3.29Å; H85-E88 PolarHBondContact O-N 3Å; E88-Q91 PolarHBondContact O-N 2.98Å; E88-N92 WeakPolarHBondContact O-CB 3.42Å; E88-N92 PolarHBondContact O-N 2.96Å
89	I	90.4	Very high	88.4	Confident	6 Å²	6	66 Å²	66	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-58.4	-51.5	175.5	-65.4	167.6	0	0	0	109.5	E63 L64 F67 H85 R86 Q91 N92 Y93	E63-I89 HydrophobicContact CG-CD1 4.32Å; E63-I89 HydrophobicContact CG-CG2 4.45Å; L64-I89 HydrophobicContact CD2-CB 4.12Å; L64-I89 HydrophobicContact CD2-CD1 4.26Å; L64-I89 HydrophobicContact CD2-CG2 3.77Å; L64-I89 HydrophobicContact CG-CG2 3.94Å; F67-I89 HydrophobicContact CB-CD1 4.16Å; F67-I89 HydrophobicContact CD1-CD1 4.42Å; F67-I89 HydrophobicContact CG-CD1 4.21Å; H85-I89 WeakPolarHBondContact O-CG1 3.18Å; H85-I89 PolarHBondContact O-N 3.46Å; R86-I89 PolarHBondContact O-N 3.29Å; I89-Q91 VanDerWaalsContact C-N 3.31Å; I89-Q91 PolarHBondContact O-N 2.88Å; I89-N92 PolarHBondContact O-N 3.39Å; I89-Y93 HydrophobicContact CG2-CD2 3.85Å; I89-Y93 HydrophobicContact CG2-CE2 3.96Å; I89-Y93 WeakPolarHBondContact O-CD2 3.38Å; I89-Y93 PolarHBondContact O-N 3.46Å
90	M	87.7	Confident	89.3	Confident	32 Å²	32	63.3 Å²	63.3	16%	0.158	33%	0.328	C	S	.	.	H	α-helix	trans	-59.9	-39.5	-179.5	-71.7	-66.6	-62.3	0	0	112.8	L64 R86 E87 G94 K217	L64-M90 HydrophobicContact CD1-SD 3.67Å; R86-M90 WeakPolarHBondContact O-CB 3.43Å; R86-M90 VanDerWaalsContact O-CG 3.24Å; R86-M90 WeakPolarHBondContact O-CG 3.45Å; R86-M90 PolarHBondContact O-N 3.1Å; E87-M90 PolarHBondContact O-N 2.72Å; M90-G94 PolarHBondContact O-N 2.82Å; M90-K217 WeakPolarHBondContact CE-O 3.4Å
91	Q	90.2	Very high	90	Very high	138 Å²	138	60.5 Å²	60.5	65%	0.645	31%	0.311	S	S	*	.	H	α-helix	trans	-71.6	-39.7	179.3	-173.7	175.7	13.5	0	0	112	E87 E88 I89 G94 S95	E87-Q91 VanDerWaalsContact O-CB 3.28Å; E87-Q91 WeakPolarHBondContact O-CB 3.28Å; E87-Q91 PolarHBondContact O-N 3.13Å; E88-Q91 PolarHBondContact O-N 2.98Å; I89-Q91 VanDerWaalsContact C-N 3.31Å; I89-Q91 PolarHBondContact O-N 2.88Å; Q91-G94 PolarHBondContact O-N 3.36Å; Q91-S95 WeakPolarHBondContact O-CB 3.27Å; Q91-S95 PolarHBondContact O-N 3Å; Q91-S95 PolarHBondContact O-OG 2.84Å
92	N	93.4	Very high	90.6	Very high	80 Å²	80	58.7 Å²	58.7	43%	0.428	31%	0.31	S	S	.	.	H	α-helix	trans	-60.7	-54.3	176.1	-178.6	29.8	0	0	0	110.6	E88 I89 G94 S95 Q96	E88-N92 WeakPolarHBondContact O-CB 3.42Å; E88-N92 PolarHBondContact O-N 2.96Å; I89-N92 PolarHBondContact O-N 3.39Å; N92-G94 VanDerWaalsContact C-N 3.33Å; N92-G94 PolarHBondContact O-N 2.76Å; N92-S95 PolarHBondContact O-N 2.91Å; N92-Q96 VanDerWaalsContact CG-NE2 3.34Å; N92-Q96 PolarHBondContact ND2-NE2 3.49Å; N92-Q96 WeakPolarHBondContact O-CG 3.48Å; N92-Q96 PolarHBondContact O-N 3.44Å; N92-Q96 PolarHBondContact OD1-NE2 2.78Å
93	Y	92.7	Very high	91.2	Very high	18 Å²	18	60.4 Å²	60.4	7%	0.071	32%	0.321	C	S	.	.	H	α-helix	trans	-66.4	-34.6	177.5	-78	-82.2	0	0	0	112.6	L56 T59 R60 E63 I89 S95 Q96 M97	L56-Y93 HydrophobicContact CD1-CD1 3.72Å; L56-Y93 HydrophobicContact CD1-CE1 3.78Å; L56-Y93 HydrophobicContact CG-CD1 4.01Å; L56-Y93 HydrophobicContact CG-CE1 4.46Å; T59-Y93 HydrophobicContact CG2-CE1 4.27Å; T59-Y93 WeakPolarHBondContact CG2-OH 3.37Å; R60-Y93 HydrophobicContact CB-CD1 3.64Å; R60-Y93 HydrophobicContact CB-CD2 3.84Å; R60-Y93 HydrophobicContact CB-CE1 3.96Å; R60-Y93 HydrophobicContact CB-CE2 4.16Å; R60-Y93 HydrophobicContact CB-CG 3.57Å; R60-Y93 HydrophobicContact CG-CD1 4.28Å; R60-Y93 HydrophobicContact CG-CD2 3.73Å; R60-Y93 HydrophobicContact CG-CE2 4.38Å; R60-Y93 HydrophobicContact CG-CG 3.68Å; E63-Y93 WeakPolarHBondContact OE2-CE2 3.46Å; E63-Y93 VanDerWaalsContact OE2-CZ 3.31Å; E63-Y93 PolarHBondContact OE2-OH 3.4Å; I89-Y93 HydrophobicContact CG2-CD2 3.85Å; I89-Y93 HydrophobicContact CG2-CE2 3.96Å; I89-Y93 WeakPolarHBondContact O-CD2 3.38Å; I89-Y93 PolarHBondContact O-N 3.46Å; Y93-S95 VanDerWaalsContact C-N 3.33Å; Y93-S95 PolarHBondContact O-N 3.13Å; Y93-Q96 PolarHBondContact O-N 2.98Å; Y93-M97 WeakPolarHBondContact O-CB 3.33Å; Y93-M97 PolarHBondContact O-N 3.35Å
94	G	89.8	Confident	91.8	Very high	19 Å²	19	58 Å²	58	20%	0.196	31%	0.31	C	S	.	.	H	α-helix	trans	-57.3	-46.5	172.5	0	0	0	0	0	112	M90 Q91 N92 M97 D98	M90-G94 PolarHBondContact O-N 2.82Å; Q91-G94 PolarHBondContact O-N 3.36Å; N92-G94 VanDerWaalsContact C-N 3.33Å; N92-G94 PolarHBondContact O-N 2.76Å; G94-M97 PolarHBondContact O-N 3.02Å; G94-D98 WeakPolarHBondContact O-CB 3.23Å; G94-D98 VanDerWaalsContact O-CG 3.24Å; G94-D98 PolarHBondContact O-N 3.01Å
95	S	92.3	Very high	92.3	Very high	68 Å²	68	55.7 Å²	55.7	48%	0.476	30%	0.295	S	S	.	.	H	α-helix	trans	-66.9	-42.2	178.9	-55.3	0	0	0	0	112.2	Q91 N92 Y93 A99	Q91-S95 WeakPolarHBondContact O-CB 3.27Å; Q91-S95 PolarHBondContact O-N 3Å; Q91-S95 PolarHBondContact O-OG 2.84Å; N92-S95 PolarHBondContact O-N 2.91Å; Y93-S95 VanDerWaalsContact C-N 3.33Å; Y93-S95 PolarHBondContact O-N 3.13Å; S95-A99 WeakPolarHBondContact O-CB 3.41Å; S95-A99 PolarHBondContact O-N 3.09Å
96	Q	95.2	Very high	92.7	Very high	81 Å²	81	60.3 Å²	60.3	38%	0.379	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-41.7	175.6	-69.5	-179.2	48.2	0	0	111.7	L56 N92 Y93 A99 L100	L56-Q96 HydrophobicContact CD2-CB 4.01Å; N92-Q96 VanDerWaalsContact CG-NE2 3.34Å; N92-Q96 PolarHBondContact ND2-NE2 3.49Å; N92-Q96 WeakPolarHBondContact O-CG 3.48Å; N92-Q96 PolarHBondContact O-N 3.44Å; N92-Q96 PolarHBondContact OD1-NE2 2.78Å; Y93-Q96 PolarHBondContact O-N 2.98Å; Q96-A99 PolarHBondContact O-N 3.28Å; Q96-L100 VanDerWaalsContact O-CB 3.31Å; Q96-L100 WeakPolarHBondContact O-CB 3.3Å; Q96-L100 PolarHBondContact O-N 2.88Å
97	M	92.4	Very high	93.2	Very high	6 Å²	6	63.4 Å²	63.4	3%	0.03	33%	0.325	C	S	.	.	H	α-helix	trans	-63.2	-46.5	178.1	-171.1	62.5	69.4	0	0	111.5	V53 L56 I57 Y93 G94 A99 L100 K101	V53-M97 HydrophobicContact CB-SD 4.4Å; V53-M97 HydrophobicContact CG1-CE 4.21Å; V53-M97 HydrophobicContact CG1-SD 3.71Å; V53-M97 HydrophobicContact CG2-SD 4.26Å; L56-M97 HydrophobicContact CB-CE 3.96Å; L56-M97 HydrophobicContact CD2-CB 4.32Å; L56-M97 HydrophobicContact CD2-CE 3.75Å; L56-M97 HydrophobicContact CD2-SD 4.19Å; L56-M97 HydrophobicContact CG-CE 3.96Å; I57-M97 HydrophobicContact CD1-CE 4.33Å; I57-M97 HydrophobicContact CG1-CE 3.58Å; Y93-M97 WeakPolarHBondContact O-CB 3.33Å; Y93-M97 PolarHBondContact O-N 3.35Å; G94-M97 PolarHBondContact O-N 3.02Å; M97-A99 VanDerWaalsContact C-N 3.34Å; M97-A99 PolarHBondContact O-N 3.2Å; M97-L100 PolarHBondContact O-N 2.83Å; M97-K101 HydrophobicContact CG-CD 3.97Å; M97-K101 WeakPolarHBondContact O-CB 3.39Å; M97-K101 VanDerWaalsContact O-CG 3.3Å; M97-K101 WeakPolarHBondContact O-CG 3.45Å; M97-K101 PolarHBondContact O-N 3.5Å; M97-K101 HydrophobicContact SD-CD 4.19Å; M97-K101 WeakPolarHBondContact SD-CE 3.37Å; M97-K101 HydrophobicContact SD-CG 4.35Å
98	D	92.4	Very high	93.7	Very high	86 Å²	86	59 Å²	59	46%	0.46	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-40.4	178.8	-70.3	-17.6	0	0	0	111.1	G94 S102	G94-D98 WeakPolarHBondContact O-CB 3.23Å; G94-D98 VanDerWaalsContact O-CG 3.24Å; G94-D98 PolarHBondContact O-N 3.01Å; D98-S102 WeakPolarHBondContact O-CB 3.36Å; D98-S102 PolarHBondContact O-N 3.13Å; D98-S102 PolarHBondContact O-OG 3.16Å
99	A	95.9	Very high	94	Very high	64 Å²	64	56.3 Å²	56.3	53%	0.529	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-46.7	175.1	0	0	0	0	0	112.2	S95 Q96 M97 S102 L103	S95-A99 WeakPolarHBondContact O-CB 3.41Å; S95-A99 PolarHBondContact O-N 3.09Å; Q96-A99 PolarHBondContact O-N 3.28Å; M97-A99 VanDerWaalsContact C-N 3.34Å; M97-A99 PolarHBondContact O-N 3.2Å; A99-S102 PolarHBondContact O-N 2.91Å; A99-L103 WeakPolarHBondContact O-CB 3.48Å; A99-L103 PolarHBondContact O-N 2.99Å
100	L	97.1	Very high	94.2	Very high	36 Å²	36	60.6 Å²	60.6	19%	0.188	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-52.1	178.9	179.2	61.7	0	0	0	111.2	E52 V53 L56 Q96 M97 S102 L103 Q104	E52-L100 HydrophobicContact CB-CD2 4.45Å; V53-L100 HydrophobicContact CG2-CD2 4.08Å; L56-L100 HydrophobicContact CD2-CD2 4.23Å; Q96-L100 VanDerWaalsContact O-CB 3.31Å; Q96-L100 WeakPolarHBondContact O-CB 3.3Å; Q96-L100 PolarHBondContact O-N 2.88Å; M97-L100 PolarHBondContact O-N 2.83Å; L100-S102 VanDerWaalsContact C-N 3.3Å; L100-S102 PolarHBondContact O-N 3.48Å; L100-L103 WeakPolarHBondContact O-CB 3.46Å; L100-L103 PolarHBondContact O-N 3.37Å; L100-L103 VanDerWaalsContact O-N 3.13Å; L100-Q104 HydrophobicContact CD1-CG 4.22Å; L100-Q104 HydrophobicContact CG-CG 4.44Å; L100-Q104 WeakPolarHBondContact O-CG 3.38Å; L100-Q104 PolarHBondContact O-N 2.67Å
101	K	95.4	Very high	94.5	Very high	37 Å²	37	60.4 Å²	60.4	16%	0.161	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-39.1	179.8	-71.2	177.3	173.3	168.1	0	112	V53 M97 Q104 R105 E242 A245	V53-K101 HydrophobicContact CG2-CG 4.23Å; M97-K101 HydrophobicContact CG-CD 3.97Å; M97-K101 WeakPolarHBondContact O-CB 3.39Å; M97-K101 VanDerWaalsContact O-CG 3.3Å; M97-K101 WeakPolarHBondContact O-CG 3.45Å; M97-K101 PolarHBondContact O-N 3.5Å; M97-K101 HydrophobicContact SD-CD 4.19Å; M97-K101 WeakPolarHBondContact SD-CE 3.37Å; M97-K101 HydrophobicContact SD-CG 4.35Å; K101-Q104 PolarHBondContact O-N 3.01Å; K101-R105 WeakPolarHBondContact O-CB 3.46Å; K101-R105 PolarHBondContact O-N 3.21Å; K101-E242 VanDerWaalsContact CE-O 3.3Å; K101-E242 WeakPolarHBondContact CE-O 3.44Å; K101-E242 PolarHBondContact NZ-O 2.89Å; K101-A245 HydrophobicContact CB-CB 4.04Å; K101-A245 HydrophobicContact CG-CB 3.89Å
102	S	94.8	Very high	94.8	Very high	68 Å²	68	53.8 Å²	53.8	48%	0.476	28%	0.28	S	S	.	.	H	α-helix	trans	-64.2	-39.9	175.7	-64.7	0	0	0	0	112.3	D98 A99 L100 R106	D98-S102 WeakPolarHBondContact O-CB 3.36Å; D98-S102 PolarHBondContact O-N 3.13Å; D98-S102 PolarHBondContact O-OG 3.16Å; A99-S102 PolarHBondContact O-N 2.91Å; L100-S102 VanDerWaalsContact C-N 3.3Å; L100-S102 PolarHBondContact O-N 3.48Å; S102-R106 PolarHBondContact O-N 3.5Å
103	L	96.7	Very high	94.9	Very high	73 Å²	73	51.9 Å²	51.9	38%	0.382	27%	0.268	S	S	.	.	H	α-helix	trans	-65.3	-49.7	174.8	178.1	63.8	0	0	0	111.1	A99 L100 R105 R106 Q107	A99-L103 WeakPolarHBondContact O-CB 3.48Å; A99-L103 PolarHBondContact O-N 2.99Å; L100-L103 WeakPolarHBondContact O-CB 3.46Å; L100-L103 PolarHBondContact O-N 3.37Å; L100-L103 VanDerWaalsContact O-N 3.13Å; L103-R105 PolarHBondContact O-N 2.98Å; L103-R106 PolarHBondContact O-N 2.92Å; L103-Q107 HydrophobicContact CD1-CG 4.16Å; L103-Q107 HydrophobicContact CG-CG 4.39Å; L103-Q107 WeakPolarHBondContact O-CG 3.26Å; L103-Q107 PolarHBondContact O-N 3.09Å
104	Q	97.1	Very high	94.9	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-45	179.3	-70.8	176.5	-16.3	0	0	111.5	Y49 L100 K101 R106 Q107 F108 A245 L247	Y49-Q104 HydrophobicContact CD1-CB 4.26Å; Y49-Q104 HydrophobicContact CD1-CG 3.64Å; Y49-Q104 HydrophobicContact CD2-CB 3.98Å; Y49-Q104 HydrophobicContact CD2-CG 4.26Å; Y49-Q104 HydrophobicContact CE1-CB 4.46Å; Y49-Q104 HydrophobicContact CE1-CG 4Å; Y49-Q104 HydrophobicContact CE2-CB 4.22Å; Y49-Q104 HydrophobicContact CG-CB 4Å; Y49-Q104 HydrophobicContact CG-CG 3.77Å; Y49-Q104 PolarHBondContact O-NE2 3.37Å; L100-Q104 HydrophobicContact CD1-CG 4.22Å; L100-Q104 HydrophobicContact CG-CG 4.44Å; L100-Q104 WeakPolarHBondContact O-CG 3.38Å; L100-Q104 PolarHBondContact O-N 2.67Å; K101-Q104 PolarHBondContact O-N 3.01Å; Q104-R106 VanDerWaalsContact C-N 3.35Å; Q104-R106 PolarHBondContact O-N 2.86Å; Q104-Q107 PolarHBondContact O-N 3.33Å; Q104-F108 VanDerWaalsContact O-CB 3.28Å; Q104-F108 WeakPolarHBondContact O-CB 3.46Å; Q104-F108 PolarHBondContact O-N 3.15Å; Q104-A245 HydrophobicContact CB-CB 4.28Å; Q104-L247 HydrophobicContact CB-CD2 4.35Å
105	R	95.8	Very high	95.1	Very high	65 Å²	65	52.5 Å²	52.5	25%	0.245	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-44.7	175.2	-173.8	176.1	-172.1	-122	-4.5	112	D21 K101 L103 K109 E246 L247 F249	D21-R105 IonicContact OD1-NH2 3.76Å; K101-R105 WeakPolarHBondContact O-CB 3.46Å; K101-R105 PolarHBondContact O-N 3.21Å; L103-R105 PolarHBondContact O-N 2.98Å; R105-K109 WeakPolarHBondContact O-CG 3.49Å; R105-K109 PolarHBondContact O-N 3.07Å; R105-E246 WeakPolarHBondContact CD-O 3.35Å; R105-L247 HydrophobicContact CB-CD2 4.36Å; R105-F249 PolarHBondContact NE-O 3.41Å; R105-F249 PolarHBondContact NH2-O 3.31Å
106	R	95.6	Very high	95.2	Very high	173 Å²	173	53.9 Å²	53.9	65%	0.653	26%	0.264	S	S	*	.	H	α-helix	trans	-64.8	-46.8	178.5	-167.9	-170.5	-52.1	149.1	7.1	111.7	S102 L103 Q104 K109 Q110	S102-R106 PolarHBondContact O-N 3.5Å; L103-R106 PolarHBondContact O-N 2.92Å; Q104-R106 VanDerWaalsContact C-N 3.35Å; Q104-R106 PolarHBondContact O-N 2.86Å; R106-K109 PolarHBondContact O-N 3.2Å; R106-Q110 PolarHBondContact O-N 3.25Å; R106-Q110 VanDerWaalsContact O-N 3.09Å
107	Q	96.2	Very high	95.1	Very high	88 Å²	88	54.7 Å²	54.7	41%	0.411	27%	0.268	S	S	.	.	H	α-helix	trans	-62.8	-42.7	178.1	-72.5	179.7	-13.8	0	0	111.5	Y49 L103 Q104 Q110 L111	Y49-Q107 VanDerWaalsContact OH-CB 3.24Å; Y49-Q107 WeakPolarHBondContact OH-CB 3.39Å; Y49-Q107 PolarHBondContact OH-OE1 3.47Å; L103-Q107 HydrophobicContact CD1-CG 4.16Å; L103-Q107 HydrophobicContact CG-CG 4.39Å; L103-Q107 WeakPolarHBondContact O-CG 3.26Å; L103-Q107 PolarHBondContact O-N 3.09Å; Q104-Q107 PolarHBondContact O-N 3.33Å; Q107-Q110 PolarHBondContact O-N 3.48Å; Q107-L111 WeakPolarHBondContact O-CB 3.41Å; Q107-L111 PolarHBondContact O-N 3.18Å
108	F	96.4	Very high	94.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-45.4	178.3	-167.9	-103	0	0	0	112.1	F24 F28 L42 Y49 Q104 Q110 L111 V112 L247 H248	F24-F108 HydrophobicContact CE2-CD1 4.22Å; F24-F108 HydrophobicContact CE2-CE1 4.43Å; F24-F108 HydrophobicContact CZ-CD1 4.13Å; F24-F108 HydrophobicContact CZ-CE1 4.17Å; F28-F108 HydrophobicContact CD2-CE1 4.45Å; F28-F108 HydrophobicContact CE2-CE1 4.23Å; F28-F108 HydrophobicContact CE2-CZ 4.06Å; L42-F108 HydrophobicContact CB-CE2 4.25Å; L42-F108 HydrophobicContact CB-CZ 4.27Å; L42-F108 HydrophobicContact CD2-CE2 4.22Å; L42-F108 HydrophobicContact CD2-CZ 4.48Å; Y49-F108 HydrophobicContact CE2-CB 4.08Å; Y49-F108 HydrophobicContact CE2-CD2 4.15Å; Q104-F108 VanDerWaalsContact O-CB 3.28Å; Q104-F108 WeakPolarHBondContact O-CB 3.46Å; Q104-F108 PolarHBondContact O-N 3.15Å; F108-Q110 VanDerWaalsContact C-N 3.31Å; F108-Q110 PolarHBondContact O-N 3.45Å; F108-L111 WeakPolarHBondContact O-CB 3.32Å; F108-L111 PolarHBondContact O-N 3.08Å; F108-L111 VanDerWaalsContact O-N 3.17Å; F108-V112 HydrophobicContact CD1-CG2 4.13Å; F108-V112 HydrophobicContact CE1-CG2 3.87Å; F108-V112 HydrophobicContact CZ-CG2 4.26Å; F108-V112 WeakPolarHBondContact O-CG2 3.49Å; F108-V112 PolarHBondContact O-N 3.39Å; F108-L247 HydrophobicContact CB-CD1 4.19Å; F108-L247 HydrophobicContact CB-CD2 4.08Å; F108-L247 HydrophobicContact CD1-CB 3.77Å; F108-L247 HydrophobicContact CD1-CD1 3.92Å; F108-L247 HydrophobicContact CD1-CG 4.37Å; F108-L247 HydrophobicContact CD2-CD1 3.73Å; F108-L247 HydrophobicContact CE1-CB 4.18Å; F108-L247 HydrophobicContact CE1-CD1 4.17Å; F108-L247 HydrophobicContact CE2-CD1 3.99Å; F108-L247 HydrophobicContact CG-CB 4.2Å; F108-L247 HydrophobicContact CG-CD1 3.67Å; F108-L247 HydrophobicContact CG-CD2 4.42Å; F108-L247 HydrophobicContact CG-CG 4.33Å; F108-L247 HydrophobicContact CZ-CD1 4.19Å; F108-H248 AromaticContact CE1-CE1 4Å; F108-H248 AromaticContact CE1-NE2 3.65Å
109	K	96	Very high	94.4	Very high	43 Å²	43	59 Å²	59	19%	0.187	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-42.2	175.7	-75.7	-173.9	167.3	-167.4	0	112.3	D21 F24 R105 R106 H113	D21-K109 IonicContact OD1-NZ 2.59Å; D21-K109 PolarHBondContact OD1-NZ 2.89Å; F24-K109 HydrophobicContact CD2-CB 4.08Å; F24-K109 HydrophobicContact CD2-CG 3.68Å; F24-K109 HydrophobicContact CE2-CB 4.27Å; F24-K109 HydrophobicContact CE2-CG 3.74Å; F24-K109 HydrophobicContact CG-CD 4.5Å; F24-K109 HydrophobicContact CG-CG 4.08Å; F24-K109 HydrophobicContact CZ-CG 4.22Å; R105-K109 WeakPolarHBondContact O-CG 3.49Å; R105-K109 PolarHBondContact O-N 3.07Å; R106-K109 PolarHBondContact O-N 3.2Å; K109-H113 PolarHBondContact O-N 3.34Å; K109-H113 VanDerWaalsContact O-N 3.13Å
110	Q	94.9	Very high	93.5	Very high	96 Å²	96	57.5 Å²	57.5	45%	0.449	28%	0.282	S	S	.	.	H	α-helix	trans	-64.4	-43.2	175.3	-176.2	58.6	44.1	0	0	111.3	R106 Q107 F108 V112 H113 D114	R106-Q110 PolarHBondContact O-N 3.25Å; R106-Q110 VanDerWaalsContact O-N 3.09Å; Q107-Q110 PolarHBondContact O-N 3.48Å; F108-Q110 VanDerWaalsContact C-N 3.31Å; F108-Q110 PolarHBondContact O-N 3.45Å; Q110-V112 PolarHBondContact O-N 3.28Å; Q110-H113 WeakPolarHBondContact O-CB 3.27Å; Q110-H113 PolarHBondContact O-N 3.07Å; Q110-H113 VanDerWaalsContact O-N 3.14Å; Q110-D114 VanDerWaalsContact NE2-CG 3.28Å; Q110-D114 PolarHBondContact NE2-OD1 3.03Å; Q110-D114 PolarHBondContact NE2-OD2 2.92Å; Q110-D114 PolarHBondContact O-N 3.04Å
111	L	95.1	Very high	92.1	Very high	28 Å²	28	63.8 Å²	63.8	15%	0.147	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-45.5	178.4	-170.7	67.3	0	0	0	111.7	F41 L42 K45 Q107 F108 H113 D114 V115 L120	F41-L111 HydrophobicContact CE1-CD1 3.76Å; F41-L111 HydrophobicContact CE1-CD2 3.67Å; F41-L111 HydrophobicContact CE1-CG 3.86Å; F41-L111 HydrophobicContact CZ-CD1 3.98Å; F41-L111 HydrophobicContact CZ-CD2 4.09Å; F41-L111 HydrophobicContact CZ-CG 4.45Å; L42-L111 HydrophobicContact CD2-CD2 3.8Å; L42-L111 HydrophobicContact CD2-CG 3.92Å; K45-L111 HydrophobicContact CB-CD2 4.14Å; K45-L111 HydrophobicContact CG-CD2 3.86Å; Q107-L111 WeakPolarHBondContact O-CB 3.41Å; Q107-L111 PolarHBondContact O-N 3.18Å; F108-L111 WeakPolarHBondContact O-CB 3.32Å; F108-L111 PolarHBondContact O-N 3.08Å; F108-L111 VanDerWaalsContact O-N 3.17Å; L111-H113 VanDerWaalsContact C-N 3.29Å; L111-H113 PolarHBondContact O-N 3.13Å; L111-D114 PolarHBondContact O-N 3.3Å; L111-V115 WeakPolarHBondContact O-CB 3.32Å; L111-V115 VanDerWaalsContact O-CG2 3.26Å; L111-V115 WeakPolarHBondContact O-CG2 3.34Å; L111-V115 PolarHBondContact O-N 2.74Å; L111-L120 HydrophobicContact CD1-CD1 4.02Å
112	V	95.6	Very high	90.5	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.2	-41.4	174.9	169.1	0	0	0	0	111.2	F24 R27 F28 I31 L42 F108 Q110 Y116	F24-V112 HydrophobicContact CD2-CB 4.13Å; F24-V112 HydrophobicContact CD2-CG1 3.99Å; F24-V112 HydrophobicContact CE2-CB 3.84Å; F24-V112 HydrophobicContact CE2-CG1 3.95Å; F24-V112 HydrophobicContact CE2-CG2 3.76Å; R27-V112 HydrophobicContact CB-CG1 4.09Å; F28-V112 HydrophobicContact CB-CG1 4.09Å; F28-V112 HydrophobicContact CD2-CG1 4.39Å; F28-V112 HydrophobicContact CD2-CG2 3.88Å; I31-V112 HydrophobicContact CD1-CG1 4.04Å; L42-V112 HydrophobicContact CD1-CG2 3.98Å; L42-V112 HydrophobicContact CD2-CG2 3.86Å; F108-V112 HydrophobicContact CD1-CG2 4.13Å; F108-V112 HydrophobicContact CE1-CG2 3.87Å; F108-V112 HydrophobicContact CZ-CG2 4.26Å; F108-V112 WeakPolarHBondContact O-CG2 3.49Å; F108-V112 PolarHBondContact O-N 3.39Å; Q110-V112 PolarHBondContact O-N 3.28Å; V112-Y116 VanDerWaalsContact O-CB 3.29Å; V112-Y116 WeakPolarHBondContact O-CB 3.27Å; V112-Y116 PolarHBondContact O-N 2.86Å
113	H	94.9	Very high	88.7	Confident	39 Å²	39	69.9 Å²	69.9	18%	0.181	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-46.1	174.6	175	52.2	0	0	0	112.1	R27 K109 Q110 L111 Y116 E117 K119	R27-H113 PolarHBondContact NH1-ND1 3.39Å; R27-H113 VanDerWaalsContact NH1-ND1 3.15Å; R27-H113 PolarHBondContact NH2-ND1 2.9Å; K109-H113 PolarHBondContact O-N 3.34Å; K109-H113 VanDerWaalsContact O-N 3.13Å; Q110-H113 WeakPolarHBondContact O-CB 3.27Å; Q110-H113 PolarHBondContact O-N 3.07Å; Q110-H113 VanDerWaalsContact O-N 3.14Å; L111-H113 VanDerWaalsContact C-N 3.29Å; L111-H113 PolarHBondContact O-N 3.13Å; H113-Y116 PolarHBondContact O-N 3.34Å; H113-E117 WeakPolarHBondContact CE1-CG 3.47Å; H113-E117 IonicContact CE1-OE1 3.43Å; H113-E117 PolarHBondContact CE1-OE1 2.8Å; H113-E117 IonicContact ND1-OE1 3.75Å; H113-E117 WeakPolarHBondContact O-CG 3.46Å; H113-E117 PolarHBondContact O-N 2.65Å; H113-K119 PolarHBondContact NE2-NZ 2.91Å
114	D	94.3	Very high	87.1	Confident	36 Å²	36	71.1 Å²	71.1	19%	0.193	34%	0.341	C	S	.	.	H	α-helix	trans	-70.3	-33.1	-177.4	-66.8	-31.2	0	0	0	113	Q110 L111 G118 K119	Q110-D114 VanDerWaalsContact NE2-CG 3.28Å; Q110-D114 PolarHBondContact NE2-OD1 3.03Å; Q110-D114 PolarHBondContact NE2-OD2 2.92Å; Q110-D114 PolarHBondContact O-N 3.04Å; L111-D114 PolarHBondContact O-N 3.3Å; D114-G118 PolarHBondContact O-N 3.31Å; D114-K119 HydrophobicContact CB-CB 4.31Å; D114-K119 HydrophobicContact CB-CD 4.4Å; D114-K119 PolarHBondContact O-N 2.84Å; D114-K119 WeakPolarHBondContact OD1-CD 3.32Å; D114-K119 IonicContact OD1-NZ 2.86Å; D114-K119 PolarHBondContact OD1-NZ 3.09Å
115	V	93.3	Very high	85.3	Confident	15 Å²	15	72.9 Å²	72.9	9%	0.091	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-50.2	168.2	170.7	0	0	0	0	110.1	I31 A38 F41 L42 L111 E117 G118 L120	I31-V115 HydrophobicContact CD1-CB 3.98Å; I31-V115 HydrophobicContact CD1-CG1 3.58Å; I31-V115 HydrophobicContact CG1-CG1 4Å; I31-V115 HydrophobicContact CG2-CG1 4.23Å; A38-V115 HydrophobicContact CB-CG1 3.57Å; F41-V115 HydrophobicContact CD1-CG2 4.32Å; F41-V115 HydrophobicContact CE1-CG2 4.23Å; L42-V115 HydrophobicContact CD2-CG2 4.19Å; L111-V115 WeakPolarHBondContact O-CB 3.32Å; L111-V115 VanDerWaalsContact O-CG2 3.26Å; L111-V115 WeakPolarHBondContact O-CG2 3.34Å; L111-V115 PolarHBondContact O-N 2.74Å; V115-E117 VanDerWaalsContact C-N 3.34Å; V115-E117 PolarHBondContact O-N 3.16Å; V115-G118 PolarHBondContact O-N 3.12Å; V115-L120 HydrophobicContact CB-CD1 4.17Å; V115-L120 HydrophobicContact CG2-CD1 3.25Å
116	Y	93.4	Very high	83.1	Confident	97 Å²	97	74.6 Å²	74.6	38%	0.38	37%	0.366	S	S	.	.	H	α-helix	trans	-61.1	-40.8	-177.7	179.8	-95.3	0	0	0	112.6	R27 F30 I31 V112 H113 G118	R27-Y116 HydrophobicContact CB-CD2 3.99Å; R27-Y116 HydrophobicContact CB-CG 4.02Å; R27-Y116 HydrophobicContact CG-CD1 3.83Å; R27-Y116 HydrophobicContact CG-CD2 3.94Å; R27-Y116 HydrophobicContact CG-CE1 4.15Å; R27-Y116 HydrophobicContact CG-CE2 4.25Å; R27-Y116 HydrophobicContact CG-CG 3.72Å; F30-Y116 HydrophobicContact CB-CD2 4.32Å; F30-Y116 HydrophobicContact CB-CE2 3.91Å; F30-Y116 AromaticContact CD1-CD2 3.75Å; F30-Y116 HydrophobicContact CD1-CD2 3.75Å; F30-Y116 AromaticContact CD1-CE2 3.47Å; F30-Y116 HydrophobicContact CD1-CE2 3.47Å; F30-Y116 VanDerWaalsContact CD1-CE2 3.47Å; F30-Y116 HydrophobicContact CD2-CE2 4.49Å; F30-Y116 HydrophobicContact CE1-CD2 4.47Å; F30-Y116 HydrophobicContact CE1-CE2 4.1Å; F30-Y116 HydrophobicContact CG-CD2 4.28Å; F30-Y116 AromaticContact CG-CE2 3.7Å; F30-Y116 HydrophobicContact CG-CE2 3.7Å; I31-Y116 HydrophobicContact CG1-CD2 4.5Å; V112-Y116 VanDerWaalsContact O-CB 3.29Å; V112-Y116 WeakPolarHBondContact O-CB 3.27Å; V112-Y116 PolarHBondContact O-N 2.86Å; H113-Y116 PolarHBondContact O-N 3.34Å; Y116-G118 PolarHBondContact O-N 3.37Å
117	E	92.9	Very high	80.9	Confident	97 Å²	97	74.4 Å²	74.4	45%	0.453	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.1	177.6	-61.3	-64.9	151.4	0	0	113.4	H113 V115 K119	H113-E117 WeakPolarHBondContact CE1-CG 3.47Å; H113-E117 IonicContact CE1-OE1 3.43Å; H113-E117 PolarHBondContact CE1-OE1 2.8Å; H113-E117 IonicContact ND1-OE1 3.75Å; H113-E117 WeakPolarHBondContact O-CG 3.46Å; H113-E117 PolarHBondContact O-N 2.65Å; V115-E117 VanDerWaalsContact C-N 3.34Å; V115-E117 PolarHBondContact O-N 3.16Å; E117-K119 VanDerWaalsContact C-N 3.28Å; E117-K119 HydrophobicContact CB-CD 4.4Å; E117-K119 HydrophobicContact CB-CG 4.05Å; E117-K119 PolarHBondContact O-N 3.34Å
118	G	87.1	Confident	78.6	Confident	60 Å²	60	77.4 Å²	77.4	62%	0.619	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	24	179.9	0	0	0	0	0	114.5	D114 V115 Y116 L120	D114-G118 PolarHBondContact O-N 3.31Å; V115-G118 PolarHBondContact O-N 3.12Å; Y116-G118 PolarHBondContact O-N 3.37Å; G118-L120 VanDerWaalsContact C-N 3.31Å
119	K	84.6	Confident	76.1	Confident	124 Å²	124	84.1 Å²	84.1	54%	0.539	41%	0.409	S	S	.	.			trans	-76.4	-19.3	-179.5	-64.1	179.7	-160.8	156.2	0	113.1	H113 D114 E117	H113-K119 PolarHBondContact NE2-NZ 2.91Å; D114-K119 HydrophobicContact CB-CB 4.31Å; D114-K119 HydrophobicContact CB-CD 4.4Å; D114-K119 PolarHBondContact O-N 2.84Å; D114-K119 WeakPolarHBondContact OD1-CD 3.32Å; D114-K119 IonicContact OD1-NZ 2.86Å; D114-K119 PolarHBondContact OD1-NZ 3.09Å; E117-K119 VanDerWaalsContact C-N 3.28Å; E117-K119 HydrophobicContact CB-CD 4.4Å; E117-K119 HydrophobicContact CB-CG 4.05Å; E117-K119 PolarHBondContact O-N 3.34Å
120	L	76.5	Confident	73.2	Confident	31 Å²	31	87 Å²	87	16%	0.162	43%	0.434	C	S	.	.	S	Bend	trans	-83.1	122.6	178.7	-75.7	157.7	0	0	0	110.6	F41 L111 V115 G118 E124 F125	F41-L120 HydrophobicContact CE1-CD1 4.22Å; L111-L120 HydrophobicContact CD1-CD1 4.02Å; V115-L120 HydrophobicContact CB-CD1 4.17Å; V115-L120 HydrophobicContact CG2-CD1 3.25Å; G118-L120 VanDerWaalsContact C-N 3.31Å; L120-E124 WeakPolarHBondContact CD2-OE2 3.48Å; L120-F125 HydrophobicContact CB-CE2 4.12Å; L120-F125 HydrophobicContact CB-CZ 4.08Å
121	K	66.9	Low	70.3	Confident	169 Å²	169	87.9 Å²	87.9	74%	0.735	45%	0.446	S	S	*	.			trans	-69.9	144.1	176	-65.3	-177.1	-179.6	-180	0	110	D123 E124	K121-D123 PolarHBondContact O-N 3.25Å; K121-E124 PolarHBondContact O-N 3.13Å
122	N	61.9	Low	67.2	Low	115 Å²	115	91.6 Å²	91.6	62%	0.615	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-29.6	-178.9	-82.3	-24.5	0	0	0	114.7	E124 F125	N122-E124 VanDerWaalsContact C-N 3.35Å; N122-E124 PolarHBondContact O-N 3.49Å; N122-F125 PolarHBondContact O-N 2.99Å
123	D	58	Low	64.2	Low	117 Å²	117	100.7 Å²	100.7	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-70.3	-23.2	-179.5	-76.1	-23.5	0	0	0	114.7	K121 F125 V126 K127	K121-D123 PolarHBondContact O-N 3.25Å; D123-F125 VanDerWaalsContact C-N 3.28Å; D123-F125 PolarHBondContact O-N 3.38Å; D123-V126 PolarHBondContact O-N 2.76Å; D123-K127 PolarHBondContact O-N 3.38Å
124	E	62.5	Low	60.9	Low	100 Å²	100	107.6 Å²	107.6	47%	0.467	55%	0.546	S	S	.	.	H	α-helix	trans	-71.9	-24.7	178.7	-70.2	-156.5	169.5	0	0	112.7	L120 K121 N122	L120-E124 WeakPolarHBondContact CD2-OE2 3.48Å; K121-E124 PolarHBondContact O-N 3.13Å; N122-E124 VanDerWaalsContact C-N 3.35Å; N122-E124 PolarHBondContact O-N 3.49Å
125	F	59.9	Low	57.7	Low	37 Å²	37	108.6 Å²	108.6	16%	0.162	57%	0.565	C	S	.	*	H	α-helix	trans	-71.3	-31.6	177.1	-63.3	-80.9	0	0	0	112.6	A38 F41 L120 N122 D123	A38-F125 HydrophobicContact CB-CE1 4.24Å; F41-F125 HydrophobicContact CB-CD1 3.51Å; F41-F125 HydrophobicContact CB-CE1 3.88Å; F41-F125 HydrophobicContact CD1-CD1 4.17Å; F41-F125 AromaticContact CD1-CE1 3.84Å; F41-F125 HydrophobicContact CD1-CE1 3.84Å; F41-F125 HydrophobicContact CD2-CD1 4.16Å; F41-F125 AromaticContact CG-CD1 3.7Å; F41-F125 HydrophobicContact CG-CD1 3.7Å; F41-F125 AromaticContact CG-CE1 3.86Å; F41-F125 HydrophobicContact CG-CE1 3.86Å; L120-F125 HydrophobicContact CB-CE2 4.12Å; L120-F125 HydrophobicContact CB-CZ 4.08Å; N122-F125 PolarHBondContact O-N 2.99Å; D123-F125 VanDerWaalsContact C-N 3.28Å; D123-F125 PolarHBondContact O-N 3.38Å
126	V	49.5	Very low	54.4	Low	101 Å²	101	115.6 Å²	115.6	61%	0.612	60%	0.6	S	S	*	*	H	α-helix	trans	-92	-34.5	-171.6	-178	0	0	0	0	112.5	D123 R128	D123-V126 PolarHBondContact O-N 2.76Å; V126-R128 PolarHBondContact O-N 3.03Å; V126-R128 VanDerWaalsContact O-N 3.07Å
127	K	48.2	Very low	51.4	Low	169 Å²	169	119.4 Å²	119.4	74%	0.735	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-12	-171.5	-91.2	-178	177.3	175.6	0	116	D123	D123-K127 PolarHBondContact O-N 3.38Å
128	R	48.9	Very low	48.2	Very low	152 Å²	152	123.8 Å²	123.8	57%	0.574	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	-2.3	-173.5	-72.1	-176.2	179	154.5	-0.7	115.5	K45 V126 S130	K45-R128 VanDerWaalsContact NZ-NH1 3.14Å; V126-R128 PolarHBondContact O-N 3.03Å; V126-R128 VanDerWaalsContact O-N 3.07Å; R128-S130 PolarHBondContact O-N 2.97Å
129	Q	43.3	Very low	45.3	Very low	141 Å²	141	124.1 Å²	124.1	66%	0.659	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-5.1	179.2	-80.1	-175.4	-13.1	0	0	114.7	V131	Q129-V131 PolarHBondContact O-N 3.27Å
130	S	34.6	Very low	42.6	Very low	102 Å²	102	123 Å²	123	71%	0.713	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	10.8	-167.8	57.1	0	0	0	0	116.9	R128	R128-S130 PolarHBondContact O-N 2.97Å
131	V	34.1	Very low	40.5	Very low	115 Å²	115	128 Å²	128	70%	0.697	67%	0.67	S	S	*	*			trans	-110.8	66.8	175.7	-165.4	0	0	0	0	110.7	Q129 K133	Q129-V131 PolarHBondContact O-N 3.27Å; V131-K133 VanDerWaalsContact C-N 3.31Å; V131-K133 HydrophobicContact CG1-CG 4.19Å; V131-K133 PolarHBondContact O-N 3.1Å; V131-K133 VanDerWaalsContact O-N 3.17Å
132	S	31	Very low	39.2	Very low	106 Å²	106	124 Å²	124	74%	0.741	66%	0.657	S	S	*	*			trans	-79.7	85.1	159.1	57.7	0	0	0	0	108.6	Q134	S132-Q134 VanDerWaalsContact C-N 3.32Å; S132-Q134 PolarHBondContact O-N 3.23Å
133	K	32.1	Very low	38	Very low	192 Å²	192	123.1 Å²	123.1	84%	0.835	66%	0.658	S	S	*	*			trans	-66.9	99.9	159.5	-80.7	-174.7	178.6	-179.9	0	106.9	V131 G135	V131-K133 VanDerWaalsContact C-N 3.31Å; V131-K133 HydrophobicContact CG1-CG 4.19Å; V131-K133 PolarHBondContact O-N 3.1Å; V131-K133 VanDerWaalsContact O-N 3.17Å; K133-G135 PolarHBondContact O-N 2.96Å
134	Q	26	Very low	37.4	Very low	183 Å²	183	120.3 Å²	120.3	86%	0.855	64%	0.644	S	S	*	*			trans	-62.8	84.7	163.1	-78.1	-176.2	-27.1	0	0	108.1	S132 I136	S132-Q134 VanDerWaalsContact C-N 3.32Å; S132-Q134 PolarHBondContact O-N 3.23Å; Q134-I136 PolarHBondContact O-N 2.83Å
135	G	26.7	Very low	36.7	Very low	58 Å²	58	118.9 Å²	118.9	60%	0.598	64%	0.643	S	S	*	*			trans	-75.4	97.8	164.6	0	0	0	0	0	108.2	K133 F137	K133-G135 PolarHBondContact O-N 2.96Å; G135-F137 PolarHBondContact O-N 2.67Å; G135-F137 VanDerWaalsContact O-N 3.09Å
136	I	24.5	Very low	36.4	Very low	162 Å²	162	120.8 Å²	120.8	83%	0.831	66%	0.657	S	S	*	*			trans	-63.4	104.7	161.9	-60.4	170.5	0	0	0	105.7	Q134	Q134-I136 PolarHBondContact O-N 2.83Å
137	F	31.2	Very low	36.4	Very low	177 Å²	177	119.8 Å²	119.8	78%	0.776	65%	0.645	S	S	*	*			trans	-120.8	109.9	170.1	-101.7	-87.6	0	0	0	109.3	G135 A139	G135-F137 PolarHBondContact O-N 2.67Å; G135-F137 VanDerWaalsContact O-N 3.09Å; F137-A139 VanDerWaalsContact C-N 3.3Å; F137-A139 PolarHBondContact O-N 2.8Å
138	E	24	Very low	36	Very low	188 Å²	188	120.2 Å²	120.2	88%	0.879	64%	0.643	S	S	*	*			trans	-70.3	84.9	174.1	-164.4	171.9	-159.3	0	0	108.5	S140	E138-S140 PolarHBondContact O-N 3.47Å
139	A	27.5	Very low	35.6	Very low	68 Å²	68	114.3 Å²	114.3	56%	0.562	62%	0.621	S	S	*	*			trans	-71.4	108	166.1	0	0	0	0	0	107.2	F137 L141	F137-A139 VanDerWaalsContact C-N 3.3Å; F137-A139 PolarHBondContact O-N 2.8Å; A139-L141 HydrophobicContact CB-CG 4.48Å; A139-L141 PolarHBondContact O-N 3.47Å
140	S	26.6	Very low	35.3	Very low	101 Å²	101	109.7 Å²	109.7	71%	0.706	61%	0.611	S	S	*	*			trans	-62.6	90.8	164.3	61	0	0	0	0	108.1	E138 L142	E138-S140 PolarHBondContact O-N 3.47Å; S140-L142 PolarHBondContact O-N 3.01Å; S140-L142 VanDerWaalsContact O-N 3.1Å
141	L	33.3	Very low	35.9	Very low	134 Å²	134	105 Å²	105	70%	0.702	58%	0.578	S	S	*	*			trans	-70.2	107.3	179.6	-73.4	167.7	0	0	0	107.9	A139	A139-L141 HydrophobicContact CB-CG 4.48Å; A139-L141 PolarHBondContact O-N 3.47Å
142	L	38.6	Very low	36.3	Very low	85 Å²	85	100.8 Å²	100.8	45%	0.445	55%	0.551	S	S	.	*			trans	-61.1	141.1	159.7	-68.4	167.8	0	0	0	108	S140 V144 Y401	S140-L142 PolarHBondContact O-N 3.01Å; S140-L142 VanDerWaalsContact O-N 3.1Å; L142-V144 PolarHBondContact O-N 2.95Å; L142-Y401 HydrophobicContact CB-CE2 4.33Å; L142-Y401 HydrophobicContact CD1-CE1 4.44Å
143	P	38.2	Very low	36.9	Very low	98 Å²	98	96.1 Å²	96.1	64%	0.636	52%	0.517	S	S	*	.			trans	-67.9	104.8	-172	25.4	-31.5	0	0	0	110.5
144	V	43.8	Very low	37.3	Very low	57 Å²	57	90.6 Å²	90.6	35%	0.345	49%	0.494	S	S	.	.			trans	-81	118.7	169.4	-179.3	0	0	0	0	107.7	L142 V146 V169 L174	L142-V144 PolarHBondContact O-N 2.95Å; V144-V146 HydrophobicContact CG1-CG2 3.8Å; V144-V169 HydrophobicContact CG1-CG1 3.8Å; V144-V169 HydrophobicContact CG2-CG1 4.4Å; V144-L174 HydrophobicContact CG2-CD2 4.03Å
145	V	49.6	Very low	37.7	Very low	71 Å²	71	90.5 Å²	90.5	43%	0.43	49%	0.486	S	S	.	.			trans	-90.9	114.2	174.9	-175.6	0	0	0	0	107.9	T167 N168 F408	V145-T167 WeakPolarHBondContact O-CA 3.17Å; V145-N168 PolarHBondContact N-OD1 3.4Å; V145-F408 HydrophobicContact CB-CE1 4.11Å; V145-F408 HydrophobicContact CB-CZ 4.18Å; V145-F408 HydrophobicContact CG1-CD1 4.17Å; V145-F408 HydrophobicContact CG1-CE1 3.47Å; V145-F408 VanDerWaalsContact CG1-CE1 3.47Å; V145-F408 HydrophobicContact CG1-CZ 3.89Å
146	V	53.6	Low	38.3	Very low	77 Å²	77	92.9 Å²	92.9	47%	0.467	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	119.5	176.5	-175.8	0	0	0	0	108.9	V144 R148 T167	V144-V146 HydrophobicContact CG1-CG2 3.8Å; V146-R148 HydrophobicContact CG1-CG 4.24Å; V146-T167 HydrophobicContact CB-CG2 4.27Å; V146-T167 HydrophobicContact CG1-CG2 4.03Å; V146-T167 HydrophobicContact CG2-CG2 3.91Å
147	Q	47.8	Very low	39.1	Very low	79 Å²	79	94.2 Å²	94.2	37%	0.369	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.6	171.2	-154.9	167.2	2.2	0	0	110	F149 L166	Q147-F149 HydrophobicContact CB-CE2 4.05Å; Q147-F149 HydrophobicContact CB-CZ 4.23Å; Q147-F149 VanDerWaalsContact CD-CZ 3.42Å; Q147-F149 HydrophobicContact CG-CE1 4.14Å; Q147-F149 HydrophobicContact CG-CE2 3.83Å; Q147-F149 HydrophobicContact CG-CZ 3.54Å; Q147-L166 PolarHBondContact N-O 2.99Å; Q147-L166 PolarHBondContact O-N 3.38Å
148	R	39.9	Very low	39.7	Very low	179 Å²	179	90.9 Å²	90.9	68%	0.675	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	135	-178.4	-63.3	-176.2	179.8	178.7	1	109.9	V146 R165	V146-R148 HydrophobicContact CG1-CG 4.24Å; R148-R165 HydrophobicContact CG-CG 4.32Å
149	F	40.6	Very low	41.3	Very low	28 Å²	28	89 Å²	89	12%	0.123	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.4	176.3	-52	-86.6	0	0	0	110.3	Q147 R151 V164 A412 I415	Q147-F149 HydrophobicContact CB-CE2 4.05Å; Q147-F149 HydrophobicContact CB-CZ 4.23Å; Q147-F149 VanDerWaalsContact CD-CZ 3.42Å; Q147-F149 HydrophobicContact CG-CE1 4.14Å; Q147-F149 HydrophobicContact CG-CE2 3.83Å; Q147-F149 HydrophobicContact CG-CZ 3.54Å; F149-R151 HydrophobicContact CB-CG 3.89Å; F149-R151 VanDerWaalsContact CG-NH2 3.27Å; F149-V164 PolarHBondContact N-O 2.91Å; F149-V164 PolarHBondContact O-N 3.28Å; F149-V164 VanDerWaalsContact O-O 3.07Å; F149-A412 HydrophobicContact CZ-CB 4.23Å; F149-I415 HydrophobicContact CD2-CB 4.49Å; F149-I415 HydrophobicContact CD2-CD1 4.31Å; F149-I415 HydrophobicContact CD2-CG2 4Å; F149-I415 HydrophobicContact CE2-CB 4.31Å; F149-I415 HydrophobicContact CE2-CD1 3.98Å; F149-I415 HydrophobicContact CE2-CG2 4.32Å; F149-I415 HydrophobicContact CG-CG2 4.44Å
150	G	38.2	Very low	42.9	Very low	44 Å²	44	86.4 Å²	86.4	45%	0.454	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	124.4	165.8	0	0	0	0	0	109.2
151	R	45.8	Very low	44.9	Very low	4 Å²	4	86.1 Å²	86.1	2%	0.015	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	141.6	-169.6	-57.5	-167.3	177.9	-91	6	113.7	F149 H162 I415 T416 F419 T421	F149-R151 HydrophobicContact CB-CG 3.89Å; F149-R151 VanDerWaalsContact CG-NH2 3.27Å; R151-H162 PolarHBondContact N-O 3.19Å; R151-H162 PolarHBondContact O-N 2.88Å; R151-I415 VanDerWaalsContact CZ-O 3.28Å; R151-I415 PolarHBondContact NH1-O 3.09Å; R151-T416 VanDerWaalsContact NH1-CA 3.31Å; R151-T416 VanDerWaalsContact NH2-N 3.17Å; R151-T416 PolarHBondContact NH2-OG1 3.1Å; R151-F419 HydrophobicContact CB-CB 4.19Å; R151-F419 WeakPolarHBondContact CD-O 3.46Å; R151-F419 HydrophobicContact CG-CB 4.28Å; R151-F419 PolarHBondContact NH1-O 3.24Å; R151-T421 HydrophobicContact CG-CG2 4.48Å
152	E	43.3	Very low	47.1	Very low	25 Å²	25	80 Å²	80	12%	0.117	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.7	179.4	-87	179.6	-137.5	0	0	111	H154 T160 M161 Q420 T422	E152-H154 VanDerWaalsContact CB-CE1 3.45Å; E152-H154 WeakPolarHBondContact CB-CE1 3.49Å; E152-H154 PolarHBondContact O-ND1 3.38Å; E152-H154 IonicContact OE2-CE1 3.42Å; E152-H154 IonicContact OE2-NE2 2.62Å; E152-T160 WeakPolarHBondContact CA-O 3.28Å; E152-M161 HydrophobicContact CG-CG 3.6Å; E152-M161 HydrophobicContact CG-SD 3.73Å; E152-Q420 PolarHBondContact N-O 3.46Å; E152-T422 HydrophobicContact CB-CG2 4.1Å; E152-T422 HydrophobicContact CG-CG2 4.03Å; E152-T422 VanDerWaalsContact OE1-CB 3.31Å; E152-T422 WeakPolarHBondContact OE1-CB 3.37Å; E152-T422 WeakPolarHBondContact OE1-CG2 3.45Å; E152-T422 PolarHBondContact OE1-OG1 3.46Å; E152-T422 WeakPolarHBondContact OE2-CG2 3.06Å
153	L	43.9	Very low	49.4	Very low	9 Å²	9	78.7 Å²	78.7	5%	0.047	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	116	175.7	-137.6	68.8	0	0	0	109.2	T160 K378 M381 I382 F419	L153-T160 PolarHBondContact N-O 3.38Å; L153-K378 HydrophobicContact CD1-CG 3.63Å; L153-M381 HydrophobicContact CD2-CB 3.62Å; L153-I382 HydrophobicContact CD1-CG1 4.36Å; L153-I382 HydrophobicContact CD2-CB 4.08Å; L153-I382 HydrophobicContact CD2-CD1 4.33Å; L153-I382 HydrophobicContact CD2-CG1 3.21Å; L153-I382 HydrophobicContact CG-CD1 4.08Å; L153-I382 HydrophobicContact CG-CG1 3.43Å; L153-I382 VanDerWaalsContact CG-CG1 3.43Å; L153-F419 HydrophobicContact CD1-CD1 4.2Å
154	H	39.8	Very low	52	Low	75 Å²	75	74.1 Å²	74.1	35%	0.347	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121.7	-173.5	-69.8	79.9	0	0	0	112.8	E152	E152-H154 VanDerWaalsContact CB-CE1 3.45Å; E152-H154 WeakPolarHBondContact CB-CE1 3.49Å; E152-H154 PolarHBondContact O-ND1 3.38Å; E152-H154 IonicContact OE2-CE1 3.42Å; E152-H154 IonicContact OE2-NE2 2.62Å
155	R	35.8	Very low	54.3	Low	182 Å²	182	75.3 Å²	75.3	69%	0.687	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.3	145.9	-152.4	-179.9	-159.7	-131	2.9	106.8	Q157 L158	R155-Q157 PolarHBondContact O-N 2.81Å; R155-L158 PolarHBondContact O-N 2.88Å
156	A	39.3	Very low	56.4	Low	108 Å²	108	71.9 Å²	71.9	89%	0.893	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-5.9	-165.3	0	0	0	0	0	118.9
157	Q	40.2	Very low	58.3	Low	189 Å²	189	68.6 Å²	68.6	88%	0.883	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.5	1.6	-176.1	-71.6	177.4	-29.6	0	0	116	R155	R155-Q157 PolarHBondContact O-N 2.81Å
158	L	44.3	Very low	60.3	Low	107 Å²	107	65.7 Å²	65.7	56%	0.56	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.9	116	177.6	-79.1	163.2	0	0	0	110.2	R155	R155-L158 PolarHBondContact O-N 2.88Å
159	K	56.6	Low	62.4	Low	148 Å²	148	57.6 Å²	57.6	64%	0.643	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	112.2	172.5	-71.4	-175.5	174.2	-167.9	0	108.8
160	T	61.7	Low	64.6	Low	14 Å²	14	56.8 Å²	56.8	9%	0.086	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.8	170.4	63.5	0	0	0	0	109.3	E152 L153 H162 A385 T390	E152-T160 WeakPolarHBondContact CA-O 3.28Å; L153-T160 PolarHBondContact N-O 3.38Å; T160-H162 WeakPolarHBondContact CB-NE2 3.26Å; T160-H162 PolarHBondContact OG1-NE2 2.92Å; T160-A385 HydrophobicContact CG2-CB 4.24Å; T160-T390 HydrophobicContact CG2-CG2 4.5Å; T160-T390 WeakPolarHBondContact CG2-OG1 3.36Å
161	M	69.2	Low	66.8	Low	96 Å²	96	55.1 Å²	55.1	47%	0.473	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	123.5	175.3	-74.1	-114.5	-82.3	0	0	109	E152	E152-M161 HydrophobicContact CG-CG 3.6Å; E152-M161 HydrophobicContact CG-SD 3.73Å
162	H	79.8	Confident	68.6	Low	5 Å²	5	55 Å²	55	2%	0.023	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.1	174.5	-60.4	-51.4	0	0	0	109.9	R151 T160 M381 Y393	R151-H162 PolarHBondContact N-O 3.19Å; R151-H162 PolarHBondContact O-N 2.88Å; T160-H162 WeakPolarHBondContact CB-NE2 3.26Å; T160-H162 PolarHBondContact OG1-NE2 2.92Å; H162-M381 HydrophobicContact CB-CE 3.57Å; H162-M381 WeakPolarHBondContact CD2-CE 3.46Å; H162-Y393 CarbonylContact C-O 3.57Å; H162-Y393 VanDerWaalsContact CA-O 3.29Å; H162-Y393 WeakPolarHBondContact CA-O 3.38Å; H162-Y393 WeakPolarHBondContact CB-O 3.05Å; H162-Y393 AromaticContact CE1-CD2 3.67Å; H162-Y393 AromaticContact ND1-CD2 3.94Å; H162-Y393 PolarHBondContact ND1-N 3.43Å
163	N	87.1	Confident	70.1	Confident	58 Å²	58	56.5 Å²	56.5	31%	0.31	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.1	176	-72.9	-59.5	0	0	0	109.1	Y393 T394 I395	N163-Y393 PolarHBondContact N-O 3.31Å; N163-T394 HydrophobicContact CB-CG2 4.06Å; N163-T394 CarbonylContact O-C 3.59Å; N163-T394 VanDerWaalsContact O-CA 3.28Å; N163-T394 WeakPolarHBondContact O-CA 3.45Å; N163-I395 PolarHBondContact O-N 3.15Å
164	V	91.1	Very high	71.5	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	127.8	174.5	-173.2	0	0	0	0	109	F149 I395 F397 I415 F419	F149-V164 PolarHBondContact N-O 2.91Å; F149-V164 PolarHBondContact O-N 3.28Å; F149-V164 VanDerWaalsContact O-O 3.07Å; V164-I395 CarbonylContact C-O 3.55Å; V164-I395 VanDerWaalsContact CA-O 3.32Å; V164-I395 WeakPolarHBondContact CA-O 3.27Å; V164-F397 HydrophobicContact CG1-CD2 3.83Å; V164-F397 HydrophobicContact CG1-CE2 3.84Å; V164-I415 HydrophobicContact CB-CG2 4.25Å; V164-I415 HydrophobicContact CG1-CD1 4.34Å; V164-I415 HydrophobicContact CG1-CG2 3.73Å; V164-F419 HydrophobicContact CG2-CD1 4.1Å; V164-F419 HydrophobicContact CG2-CE1 4.33Å; V164-F419 HydrophobicContact CG2-CG 4.35Å
165	R	92.3	Very high	73	Confident	82 Å²	82	55.4 Å²	55.4	31%	0.309	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.9	-179.6	-57.6	-178.3	-178.3	178.6	2.2	110.2	R148 T394 I395 H396 F397	R148-R165 HydrophobicContact CG-CG 4.32Å; R165-T394 HydrophobicContact CG-CG2 4.45Å; R165-I395 PolarHBondContact N-O 3.28Å; R165-H396 HydrophobicContact CB-CB 4.32Å; R165-F397 PolarHBondContact O-N 3.2Å
166	L	94	Very high	74.7	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.4	171.1	-174.2	64.4	0	0	0	110.3	Q147 L351 F397 L399 F408 C411 A412 I415	Q147-L166 PolarHBondContact N-O 2.99Å; Q147-L166 PolarHBondContact O-N 3.38Å; L166-L351 HydrophobicContact CD1-CD2 3.93Å; L166-F397 VanDerWaalsContact CA-O 3.28Å; L166-F397 WeakPolarHBondContact CA-O 3.44Å; L166-F397 HydrophobicContact CD1-CB 3.81Å; L166-L399 HydrophobicContact CD1-CD1 4.16Å; L166-L399 HydrophobicContact CD1-CG 4.36Å; L166-L399 HydrophobicContact CD2-CD1 4.49Å; L166-F408 HydrophobicContact CB-CZ 4.48Å; L166-F408 HydrophobicContact CD2-CD2 4.36Å; L166-F408 HydrophobicContact CD2-CE2 3.97Å; L166-F408 HydrophobicContact CD2-CZ 4.1Å; L166-F408 HydrophobicContact CG-CD2 4.46Å; L166-F408 HydrophobicContact CG-CE2 3.72Å; L166-F408 HydrophobicContact CG-CZ 3.97Å; L166-C411 HydrophobicContact CD2-CB 3.92Å; L166-A412 HydrophobicContact CD2-CB 4Å; L166-I415 HydrophobicContact CB-CD1 3.68Å; L166-I415 HydrophobicContact CD2-CD1 4.01Å; L166-I415 HydrophobicContact CG-CD1 4.29Å
167	T	92.7	Very high	75.8	Confident	8 Å²	8	53.7 Å²	53.7	5%	0.049	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	154.8	172.9	61.7	0	0	0	0	111.5	V145 V146 V169 H396 F397 F398 L399	V145-T167 WeakPolarHBondContact O-CA 3.17Å; V146-T167 HydrophobicContact CB-CG2 4.27Å; V146-T167 HydrophobicContact CG1-CG2 4.03Å; V146-T167 HydrophobicContact CG2-CG2 3.91Å; T167-V169 VanDerWaalsContact C-N 3.31Å; T167-V169 PolarHBondContact O-N 2.97Å; T167-V169 PolarHBondContact OG1-O 3.46Å; T167-H396 VanDerWaalsContact CG2-NE2 3.28Å; T167-H396 WeakPolarHBondContact CG2-NE2 3.39Å; T167-H396 PolarHBondContact OG1-NE2 3.46Å; T167-F397 PolarHBondContact N-O 3.31Å; T167-F397 VanDerWaalsContact N-O 3.08Å; T167-F398 CarbonylContact O-C 3.14Å; T167-F398 VanDerWaalsContact O-CA 3.25Å; T167-F398 WeakPolarHBondContact O-CA 3.46Å; T167-L399 PolarHBondContact O-N 3.12Å
168	N	90	Very high	76.7	Confident	17 Å²	17	49.6 Å²	49.6	9%	0.091	22%	0.224	C	C	.	.	S	Bend	trans	-96.2	34.5	176.3	67.8	-33.2	0	0	0	112.3	V145 L399 Y401 V403 F408	V145-N168 PolarHBondContact N-OD1 3.4Å; N168-L399 CarbonylContact C-O 3.58Å; N168-Y401 VanDerWaalsContact O-CA 3.23Å; N168-Y401 WeakPolarHBondContact O-CA 3.43Å; N168-V403 HydrophobicContact CB-CG1 3.97Å; N168-F408 HydrophobicContact CB-CD2 3.8Å; N168-F408 HydrophobicContact CB-CE2 3.91Å
169	V	85.7	Confident	77.6	Confident	10 Å²	10	48.8 Å²	48.8	6%	0.061	22%	0.22	C	C	.	.	S	Bend	trans	-153.3	136	-179.2	66.2	0	0	0	0	109.7	V144 T167 P171 Y173 L174 F398 L399	V144-V169 HydrophobicContact CG1-CG1 3.8Å; V144-V169 HydrophobicContact CG2-CG1 4.4Å; T167-V169 VanDerWaalsContact C-N 3.31Å; T167-V169 PolarHBondContact O-N 2.97Å; T167-V169 PolarHBondContact OG1-O 3.46Å; V169-P171 WeakPolarHBondContact O-CD 3.47Å; V169-Y173 HydrophobicContact CG2-CD2 4.44Å; V169-L174 HydrophobicContact CG1-CD1 3.65Å; V169-L174 HydrophobicContact CG1-CD2 4.11Å; V169-L174 HydrophobicContact CG1-CG 3.87Å; V169-L174 HydrophobicContact CG2-CD2 4.27Å; V169-L174 HydrophobicContact CG2-CG 4.22Å; V169-F398 WeakPolarHBondContact O-CB 3.47Å; V169-L399 PolarHBondContact N-O 3.43Å; V169-L399 VanDerWaalsContact N-O 3.13Å
170	N	86.1	Confident	78	Confident	11 Å²	11	42.5 Å²	42.5	6%	0.059	20%	0.195	C	C	.	.			trans	-65.3	123.5	168.6	169.8	-10.8	0	0	0	108.3	L172 Y173 F398	N170-L172 PolarHBondContact O-N 3.08Å; N170-L172 VanDerWaalsContact O-N 3.12Å; N170-L172 PolarHBondContact OD1-N 3.07Å; N170-Y173 HydrophobicContact CB-CD2 3.57Å; N170-Y173 HydrophobicContact CB-CE2 3.7Å; N170-Y173 WeakPolarHBondContact O-CB 3.31Å; N170-Y173 PolarHBondContact O-N 3.41Å; N170-F398 HydrophobicContact CB-CD2 3.86Å; N170-F398 HydrophobicContact CB-CE2 3.69Å
171	P	84.7	Confident	78.3	Confident	8 Å²	8	42.1 Å²	42.1	5%	0.052	19%	0.192	C	C	.	.	H	α-helix	trans	-54.4	-29.3	-176.7	-29	37	0	0	0	115.6	V169 Y173 L174 E175 Y305 A348 F398	V169-P171 WeakPolarHBondContact O-CD 3.47Å; P171-Y173 VanDerWaalsContact C-N 3.26Å; P171-Y173 PolarHBondContact O-N 3.44Å; P171-L174 WeakPolarHBondContact O-CB 3.45Å; P171-L174 PolarHBondContact O-N 2.73Å; P171-E175 PolarHBondContact O-N 3.19Å; P171-Y305 HydrophobicContact CB-CE2 3.47Å; P171-Y305 VanDerWaalsContact CB-CE2 3.47Å; P171-Y305 WeakPolarHBondContact CB-OH 3.28Å; P171-Y305 HydrophobicContact CG-CE2 4.37Å; P171-Y305 WeakPolarHBondContact CG-OH 3.34Å; P171-A348 HydrophobicContact CG-CB 4.35Å; P171-F398 HydrophobicContact CG-CD1 4.25Å
172	L	82.8	Confident	78.6	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-34	176.5	-70	173	0	0	0	112.4	N170 L174 E175 R176 L202 Q204 L237 A240	N170-L172 PolarHBondContact O-N 3.08Å; N170-L172 VanDerWaalsContact O-N 3.12Å; N170-L172 PolarHBondContact OD1-N 3.07Å; L172-L174 VanDerWaalsContact C-N 3.26Å; L172-L174 PolarHBondContact O-N 3.45Å; L172-E175 PolarHBondContact O-N 2.87Å; L172-R176 PolarHBondContact O-N 3.48Å; L172-L202 HydrophobicContact CD1-CD2 3.57Å; L172-L202 HydrophobicContact CD2-CD2 3.82Å; L172-L202 HydrophobicContact CG-CD2 3.39Å; L172-Q204 HydrophobicContact CD1-CG 4.37Å; L172-L237 HydrophobicContact CD1-CB 4.16Å; L172-L237 HydrophobicContact CD1-CD1 4.26Å; L172-L237 HydrophobicContact CD2-CD1 4.32Å; L172-A240 HydrophobicContact CD2-CB 4.41Å
173	Y	75.8	Confident	78.7	Confident	58 Å²	58	44.2 Å²	44.2	23%	0.227	20%	0.204	C	C	.	.	H	α-helix	trans	-64.5	-34.8	175	-67.2	-66.4	0	0	0	111.7	V169 N170 P171 R176 R177 E236	V169-Y173 HydrophobicContact CG2-CD2 4.44Å; N170-Y173 HydrophobicContact CB-CD2 3.57Å; N170-Y173 HydrophobicContact CB-CE2 3.7Å; N170-Y173 WeakPolarHBondContact O-CB 3.31Å; N170-Y173 PolarHBondContact O-N 3.41Å; P171-Y173 VanDerWaalsContact C-N 3.26Å; P171-Y173 PolarHBondContact O-N 3.44Å; Y173-R176 PolarHBondContact O-N 3.48Å; Y173-R177 WeakPolarHBondContact O-CB 3.28Å; Y173-R177 PolarHBondContact O-N 3.22Å; Y173-E236 HydrophobicContact CD1-CG 4.1Å; Y173-E236 WeakPolarHBondContact CD1-OE2 3.37Å; Y173-E236 HydrophobicContact CE1-CG 3.43Å; Y173-E236 VanDerWaalsContact CE1-CG 3.43Å; Y173-E236 VanDerWaalsContact CE1-OE1 3.25Å; Y173-E236 WeakPolarHBondContact CE1-OE1 3.09Å
174	L	71.8	Confident	78.5	Confident	47 Å²	47	43.3 Å²	43.3	25%	0.246	21%	0.205	C	C	.	.	H	α-helix	trans	-69.4	-42.7	176.5	-63.3	178	0	0	0	110.6	V144 V169 P171 L172 R176 R177 Q178	V144-L174 HydrophobicContact CG2-CD2 4.03Å; V169-L174 HydrophobicContact CG1-CD1 3.65Å; V169-L174 HydrophobicContact CG1-CD2 4.11Å; V169-L174 HydrophobicContact CG1-CG 3.87Å; V169-L174 HydrophobicContact CG2-CD2 4.27Å; V169-L174 HydrophobicContact CG2-CG 4.22Å; P171-L174 WeakPolarHBondContact O-CB 3.45Å; P171-L174 PolarHBondContact O-N 2.73Å; L172-L174 VanDerWaalsContact C-N 3.26Å; L172-L174 PolarHBondContact O-N 3.45Å; L174-R176 PolarHBondContact O-N 2.84Å; L174-R177 PolarHBondContact O-N 2.81Å; L174-Q178 VanDerWaalsContact O-CB 3.3Å; L174-Q178 WeakPolarHBondContact O-CB 3.38Å; L174-Q178 WeakPolarHBondContact O-CG 3.3Å; L174-Q178 PolarHBondContact O-N 2.93Å
175	E	72.5	Confident	78.2	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.065	23%	0.233	C	C	.	.	H	α-helix	trans	-58.7	-37.5	175	-70.1	-170.1	158.8	0	0	112.2	P171 L172 S180 S304 Y305	P171-E175 PolarHBondContact O-N 3.19Å; L172-E175 PolarHBondContact O-N 2.87Å; E175-S180 PolarHBondContact O-OG 2.8Å; E175-S304 WeakPolarHBondContact OE1-CA 3.14Å; E175-S304 VanDerWaalsContact OE1-CB 3.22Å; E175-S304 WeakPolarHBondContact OE1-CB 3.4Å; E175-S304 PolarHBondContact OE1-N 2.83Å; E175-Y305 WeakPolarHBondContact OE1-CD2 3.4Å
176	R	70.3	Confident	77.7	Confident	90 Å²	90	44.2 Å²	44.2	34%	0.34	23%	0.225	S	C	.	.	H	α-helix	trans	-73.6	-39.5	176.8	-167.2	174.5	72.9	83.5	-5.4	112.9	L172 Y173 L174 E236 R243	L172-R176 PolarHBondContact O-N 3.48Å; Y173-R176 PolarHBondContact O-N 3.48Å; L174-R176 PolarHBondContact O-N 2.84Å; R176-E236 IonicContact NE-OE1 3.75Å; R176-E236 IonicContact NE-OE2 3.17Å; R176-E236 PolarHBondContact NE-OE2 2.85Å; R176-E236 VanDerWaalsContact NE-OE2 3.08Å; R176-E236 IonicContact NH2-OE1 3.49Å; R176-R243 PolarHBondContact O-NH1 2.81Å
177	R	64.3	Low	77.3	Confident	164 Å²	164	44.4 Å²	44.4	62%	0.619	23%	0.226	S	C	*	.	H	α-helix	trans	-84.5	-39.9	-174.2	-78.9	-150.2	176.6	-159.6	1.1	113.8	Y173 L174	Y173-R177 WeakPolarHBondContact O-CB 3.28Å; Y173-R177 PolarHBondContact O-N 3.22Å; L174-R177 PolarHBondContact O-N 2.81Å
178	Q	57.5	Low	77	Confident	102 Å²	102	46 Å²	46	48%	0.477	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	133.9	171.1	-60.7	177.7	-0.6	0	0	105	L174 S180	L174-Q178 VanDerWaalsContact O-CB 3.3Å; L174-Q178 WeakPolarHBondContact O-CB 3.38Å; L174-Q178 WeakPolarHBondContact O-CG 3.3Å; L174-Q178 PolarHBondContact O-N 2.93Å; Q178-S180 PolarHBondContact O-N 3.38Å
179	N	63	Low	76.8	Confident	91 Å²	91	50.4 Å²	50.4	49%	0.487	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	51.6	169	-79.4	-23.6	0	0	0	110	L181 M182 D183	N179-L181 PolarHBondContact O-N 3.03Å; N179-M182 HydrophobicContact CB-CB 4.33Å; N179-M182 HydrophobicContact CB-CG 4.37Å; N179-M182 CarbonylContact O-C 3.55Å; N179-M182 WeakPolarHBondContact O-CA 3.44Å; N179-M182 WeakPolarHBondContact O-CB 3.4Å; N179-M182 PolarHBondContact O-N 3.28Å; N179-D183 PolarHBondContact O-N 2.83Å
180	S	65.6	Low	76.8	Confident	15 Å²	15	50.3 Å²	50.3	11%	0.105	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-58.3	-30.5	-177.5	61.9	0	0	0	0	111	E175 Q178 M182 D183 C303	E175-S180 PolarHBondContact O-OG 2.8Å; Q178-S180 PolarHBondContact O-N 3.38Å; S180-M182 PolarHBondContact O-N 2.7Å; S180-D183 WeakPolarHBondContact O-CB 3.3Å; S180-D183 PolarHBondContact O-N 3.14Å; S180-C303 PolarHBondContact O-SG 3.33Å
181	L	68.2	Low	76.8	Confident	6 Å²	6	49.9 Å²	49.9	3%	0.031	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-63.8	-19.2	171.9	-69.1	168.5	0	0	0	113.6	N179 R243	N179-L181 PolarHBondContact O-N 3.03Å; L181-R243 HydrophobicContact CD1-CB 3.43Å; L181-R243 VanDerWaalsContact CD1-CB 3.43Å; L181-R243 HydrophobicContact CD1-CG 4.44Å
182	M	74.7	Confident	76.9	Confident	66 Å²	66	53.4 Å²	53.4	33%	0.325	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-103.2	1.2	175.7	-55.6	-57	154	0	0	112.5	M47 A51 L54 N179 S180 A184	M47-M182 VanDerWaalsContact CE-O 3.26Å; M47-M182 WeakPolarHBondContact CE-O 3.46Å; A51-M182 HydrophobicContact CB-CE 3.93Å; L54-M182 HydrophobicContact CD1-CE 3.5Å; N179-M182 HydrophobicContact CB-CB 4.33Å; N179-M182 HydrophobicContact CB-CG 4.37Å; N179-M182 CarbonylContact O-C 3.55Å; N179-M182 WeakPolarHBondContact O-CA 3.44Å; N179-M182 WeakPolarHBondContact O-CB 3.4Å; N179-M182 PolarHBondContact O-N 3.28Å; S180-M182 PolarHBondContact O-N 2.7Å; M182-A184 PolarHBondContact O-N 3.06Å
183	D	82	Confident	77.1	Confident	79 Å²	79	55.7 Å²	55.7	42%	0.422	28%	0.279	S	S	.	.			trans	-86.9	99.6	171.7	-176.2	-6.4	0	0	0	109.7	N179 S180 S185 A186 R187	N179-D183 PolarHBondContact O-N 2.83Å; S180-D183 WeakPolarHBondContact O-CB 3.3Å; S180-D183 PolarHBondContact O-N 3.14Å; D183-S185 PolarHBondContact O-N 3.44Å; D183-S185 VanDerWaalsContact OD1-CB 3.3Å; D183-S185 WeakPolarHBondContact OD1-CB 3.34Å; D183-S185 PolarHBondContact OD1-N 2.88Å; D183-A186 HydrophobicContact CB-CB 4.02Å; D183-A186 PolarHBondContact O-N 3.5Å; D183-A186 PolarHBondContact OD1-N 3.11Å; D183-R187 PolarHBondContact O-N 3.03Å; D183-R187 VanDerWaalsContact O-N 3.09Å
184	A	83.5	Confident	77.4	Confident	40 Å²	40	53.3 Å²	53.3	33%	0.331	27%	0.27	S	S	.	.	H	α-helix	trans	-56.4	-32.7	178.6	0	0	0	0	0	112.8	M47 M182 L188	M47-A184 HydrophobicContact CE-CB 4.24Å; M47-A184 HydrophobicContact SD-CB 3.75Å; M182-A184 PolarHBondContact O-N 3.06Å; A184-L188 WeakPolarHBondContact O-CB 3.25Å; A184-L188 PolarHBondContact O-N 3.3Å
185	S	84.8	Confident	77.9	Confident	84 Å²	84	53.6 Å²	53.6	59%	0.587	27%	0.268	S	S	*	.	H	α-helix	trans	-69.4	-47	-179.9	-175.3	0	0	0	0	111.2	D183 R187 L188 Q189	D183-S185 PolarHBondContact O-N 3.44Å; D183-S185 VanDerWaalsContact OD1-CB 3.3Å; D183-S185 WeakPolarHBondContact OD1-CB 3.34Å; D183-S185 PolarHBondContact OD1-N 2.88Å; S185-R187 VanDerWaalsContact C-N 3.33Å; S185-R187 PolarHBondContact O-N 3.41Å; S185-L188 PolarHBondContact O-N 3.27Å; S185-Q189 WeakPolarHBondContact O-CB 3.29Å; S185-Q189 PolarHBondContact O-N 3.05Å
186	A	82.5	Confident	78.2	Confident	17 Å²	17	54.4 Å²	54.4	14%	0.14	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-41	177.4	0	0	0	0	0	111.7	D183 Q189 T190 C303	D183-A186 HydrophobicContact CB-CB 4.02Å; D183-A186 PolarHBondContact O-N 3.5Å; D183-A186 PolarHBondContact OD1-N 3.11Å; A186-Q189 PolarHBondContact O-N 3.33Å; A186-T190 WeakPolarHBondContact O-CB 3.5Å; A186-T190 PolarHBondContact O-N 3.14Å; A186-T190 PolarHBondContact O-OG1 2.95Å; A186-C303 HydrophobicContact CB-CB 4.5Å
187	R	85.7	Confident	78.5	Confident	5 Å²	5	55.8 Å²	55.8	2%	0.019	30%	0.295	C	S	.	.	H	α-helix	trans	-68.2	-42.5	175.9	-66.3	-159.8	84.9	147.7	15.2	112.8	V43 E46 S50 D183 S185 Q189 T190 A191	V43-R187 HydrophobicContact CG1-CB 3.71Å; E46-R187 PolarHBondContact O-NH1 3Å; E46-R187 IonicContact OE1-CZ 3.92Å; E46-R187 IonicContact OE1-NE 3.82Å; E46-R187 IonicContact OE1-NH2 3.66Å; E46-R187 PolarHBondContact OE1-NH2 2.81Å; E46-R187 IonicContact OE2-CZ 3.91Å; E46-R187 IonicContact OE2-NE 3.78Å; E46-R187 PolarHBondContact OE2-NE 2.87Å; E46-R187 IonicContact OE2-NH2 3.75Å; S50-R187 PolarHBondContact OG-NH1 3.17Å; D183-R187 PolarHBondContact O-N 3.03Å; D183-R187 VanDerWaalsContact O-N 3.09Å; S185-R187 VanDerWaalsContact C-N 3.33Å; S185-R187 PolarHBondContact O-N 3.41Å; R187-Q189 VanDerWaalsContact C-N 3.3Å; R187-Q189 PolarHBondContact O-N 3.4Å; R187-T190 WeakPolarHBondContact O-CB 3.49Å; R187-T190 PolarHBondContact O-N 3.11Å; R187-A191 WeakPolarHBondContact O-CB 3.25Å; R187-A191 PolarHBondContact O-N 3.39Å
188	L	86.4	Confident	79.5	Confident	42 Å²	42	55.4 Å²	55.4	22%	0.22	29%	0.293	C	S	.	.	H	α-helix	trans	-60.2	-43.9	175.8	-174	68.1	0	0	0	110.8	L39 V43 A184 S185 T190 A191 L192	L39-L188 HydrophobicContact CD2-CD1 3.49Å; L39-L188 VanDerWaalsContact CD2-CD1 3.49Å; L39-L188 HydrophobicContact CG-CD1 3.61Å; V43-L188 HydrophobicContact CG2-CD1 4Å; A184-L188 WeakPolarHBondContact O-CB 3.25Å; A184-L188 PolarHBondContact O-N 3.3Å; S185-L188 PolarHBondContact O-N 3.27Å; L188-T190 VanDerWaalsContact C-N 3.34Å; L188-T190 PolarHBondContact O-N 3.41Å; L188-A191 PolarHBondContact O-N 2.8Å; L188-L192 HydrophobicContact CG-CD1 4.25Å; L188-L192 WeakPolarHBondContact O-CB 3.46Å; L188-L192 VanDerWaalsContact O-CG 3.27Å; L188-L192 WeakPolarHBondContact O-CG 3.36Å; L188-L192 PolarHBondContact O-N 2.82Å
189	Q	85.3	Confident	81.2	Confident	108 Å²	108	52 Å²	52	51%	0.505	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-43.9	175.5	-176.6	174.1	22.7	0	0	112	S185 A186 R187 L192 F193	S185-Q189 WeakPolarHBondContact O-CB 3.29Å; S185-Q189 PolarHBondContact O-N 3.05Å; A186-Q189 PolarHBondContact O-N 3.33Å; R187-Q189 VanDerWaalsContact C-N 3.3Å; R187-Q189 PolarHBondContact O-N 3.4Å; Q189-L192 PolarHBondContact O-N 2.97Å; Q189-F193 HydrophobicContact CG-CD2 3.97Å; Q189-F193 HydrophobicContact CG-CE2 3.44Å; Q189-F193 VanDerWaalsContact CG-CE2 3.44Å; Q189-F193 HydrophobicContact CG-CZ 3.82Å; Q189-F193 WeakPolarHBondContact O-CD2 3.45Å; Q189-F193 WeakPolarHBondContact O-CG 3.49Å; Q189-F193 PolarHBondContact O-N 3.19Å; Q189-F193 VanDerWaalsContact O-N 3.13Å
190	T	85	Confident	82.6	Confident	8 Å²	8	48.7 Å²	48.7	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-47.3	175.8	-58.8	0	0	0	0	110.9	A186 R187 L188 L192 F193 L194 C303 H306	A186-T190 WeakPolarHBondContact O-CB 3.5Å; A186-T190 PolarHBondContact O-N 3.14Å; A186-T190 PolarHBondContact O-OG1 2.95Å; R187-T190 WeakPolarHBondContact O-CB 3.49Å; R187-T190 PolarHBondContact O-N 3.11Å; L188-T190 VanDerWaalsContact C-N 3.34Å; L188-T190 PolarHBondContact O-N 3.41Å; T190-L192 VanDerWaalsContact C-N 3.31Å; T190-L192 PolarHBondContact O-N 2.89Å; T190-F193 PolarHBondContact O-N 3.39Å; T190-F193 VanDerWaalsContact O-N 3.13Å; T190-L194 HydrophobicContact CG2-CD1 3.81Å; T190-L194 WeakPolarHBondContact O-CD1 3.39Å; T190-L194 PolarHBondContact O-N 2.82Å; T190-C303 PolarHBondContact OG1-O 3.03Å; T190-H306 PolarHBondContact O-NE2 3.48Å; T190-H306 VanDerWaalsContact O-NE2 3.08Å
191	A	86.6	Confident	84	Confident	3 Å²	3	48 Å²	48	3%	0.025	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-37.8	177.8	0	0	0	0	0	112.9	F28 L39 V43 R187 L188 F193 L194	F28-A191 HydrophobicContact CE1-CB 4.38Å; F28-A191 HydrophobicContact CZ-CB 4.06Å; L39-A191 HydrophobicContact CD1-CB 4.1Å; V43-A191 HydrophobicContact CG2-CB 4.03Å; R187-A191 WeakPolarHBondContact O-CB 3.25Å; R187-A191 PolarHBondContact O-N 3.39Å; L188-A191 PolarHBondContact O-N 2.8Å; A191-F193 VanDerWaalsContact C-N 3.35Å; A191-L194 WeakPolarHBondContact O-CB 3.47Å
192	L	85.9	Confident	85.3	Confident	82 Å²	82	47.7 Å²	47.7	43%	0.429	26%	0.256	S	S	.	.	H	α-helix	trans	-68.9	-31.9	176.2	-74.9	169.2	0	0	0	113	L39 L188 Q189 T190	L39-L192 HydrophobicContact CD2-CD2 3.54Å; L39-L192 HydrophobicContact CD2-CG 3.95Å; L188-L192 HydrophobicContact CG-CD1 4.25Å; L188-L192 WeakPolarHBondContact O-CB 3.46Å; L188-L192 VanDerWaalsContact O-CG 3.27Å; L188-L192 WeakPolarHBondContact O-CG 3.36Å; L188-L192 PolarHBondContact O-N 2.82Å; Q189-L192 PolarHBondContact O-N 2.97Å; T190-L192 VanDerWaalsContact C-N 3.31Å; T190-L192 PolarHBondContact O-N 2.89Å
193	F	87	Confident	86.3	Confident	48 Å²	48	44.6 Å²	44.6	21%	0.211	24%	0.24	C	C	.	.	H	α-helix	trans	-87.4	-21	178.8	-64.3	-17.1	0	0	0	112.7	Q189 T190 A191 Y195 G196 R198 L199 H306	Q189-F193 HydrophobicContact CG-CD2 3.97Å; Q189-F193 HydrophobicContact CG-CE2 3.44Å; Q189-F193 VanDerWaalsContact CG-CE2 3.44Å; Q189-F193 HydrophobicContact CG-CZ 3.82Å; Q189-F193 WeakPolarHBondContact O-CD2 3.45Å; Q189-F193 WeakPolarHBondContact O-CG 3.49Å; Q189-F193 PolarHBondContact O-N 3.19Å; Q189-F193 VanDerWaalsContact O-N 3.13Å; T190-F193 PolarHBondContact O-N 3.39Å; T190-F193 VanDerWaalsContact O-N 3.13Å; A191-F193 VanDerWaalsContact C-N 3.35Å; F193-Y195 PolarHBondContact O-N 3.28Å; F193-G196 WeakPolarHBondContact O-CA 3.41Å; F193-G196 PolarHBondContact O-N 2.99Å; F193-R198 HydrophobicContact CD1-CB 3.97Å; F193-R198 HydrophobicContact CE1-CB 4.19Å; F193-R198 HydrophobicContact CG-CB 4.19Å; F193-L199 VanDerWaalsContact O-CD2 3.26Å; F193-L199 WeakPolarHBondContact O-CD2 3.4Å; F193-H306 WeakPolarHBondContact CB-NE2 3.45Å
194	L	83.7	Confident	86.8	Confident	8 Å²	8	41 Å²	41	4%	0.042	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	124.5	171.1	-115	101.5	0	0	0	109.8	T190 A191 G196 H248 F249	T190-L194 HydrophobicContact CG2-CD1 3.81Å; T190-L194 WeakPolarHBondContact O-CD1 3.39Å; T190-L194 PolarHBondContact O-N 2.82Å; A191-L194 WeakPolarHBondContact O-CB 3.47Å; L194-G196 PolarHBondContact O-N 3.25Å; L194-H248 HydrophobicContact CD2-CB 3.81Å; L194-H248 WeakPolarHBondContact CD2-ND1 3.47Å; L194-F249 HydrophobicContact CD2-CE2 4.32Å; L194-F249 HydrophobicContact CD2-CZ 4.23Å
195	Y	81.3	Confident	87.2	Confident	53 Å²	53	39.9 Å²	39.9	21%	0.208	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	2.7	-175.1	-40.3	-72.1	0	0	0	116.3	H25 F28 Q29 F193 H248 F249	H25-Y195 HydrophobicContact CB-CD1 4.03Å; H25-Y195 HydrophobicContact CB-CE1 3.68Å; H25-Y195 AromaticContact CD2-CE1 3.34Å; H25-Y195 WeakPolarHBondContact CD2-CE1 3.47Å; H25-Y195 AromaticContact CD2-CZ 3.27Å; H25-Y195 PolarHBondContact CD2-OH 2.99Å; H25-Y195 AromaticContact CG-CE1 3.35Å; H25-Y195 AromaticContact CG-CZ 3.7Å; H25-Y195 AromaticContact ND1-CE1 3.87Å; H25-Y195 AromaticContact NE2-CE1 3.86Å; H25-Y195 AromaticContact NE2-CZ 3.98Å; H25-Y195 PolarHBondContact NE2-OH 3.35Å; F28-Y195 HydrophobicContact CD1-CD2 4.15Å; F28-Y195 AromaticContact CD1-CE2 3.8Å; F28-Y195 HydrophobicContact CD1-CE2 3.8Å; F28-Y195 HydrophobicContact CG-CE2 4.47Å; Q29-Y195 HydrophobicContact CB-CD2 4.49Å; Q29-Y195 PolarHBondContact NE2-O 3.47Å; F193-Y195 PolarHBondContact O-N 3.28Å; Y195-H248 AromaticContact CE2-ND1 3.79Å; Y195-H248 AromaticContact CZ-ND1 3.75Å; Y195-H248 VanDerWaalsContact OH-CB 3.24Å; Y195-H248 WeakPolarHBondContact OH-CB 3.14Å; Y195-H248 PolarHBondContact OH-ND1 2.62Å; Y195-F249 HydrophobicContact CE1-CE1 4.06Å; Y195-F249 HydrophobicContact CE1-CZ 4.25Å
196	G	79.1	Confident	87.5	Confident	31 Å²	31	36 Å²	36	32%	0.32	18%	0.183	S	C	.	.	S	Bend	trans	-88.2	-170.9	173.8	0	0	0	0	0	113.6	F193 L194	F193-G196 WeakPolarHBondContact O-CA 3.41Å; F193-G196 PolarHBondContact O-N 2.99Å; L194-G196 PolarHBondContact O-N 3.25Å
197	N	77.1	Confident	87.8	Confident	120 Å²	120	37 Å²	37	64%	0.642	19%	0.189	S	C	*	.	S	Bend	trans	-104.5	20	178.3	65.8	-9.7	0	0	0	113.3	G343	N197-G343 CarbonylContact C-O 3.55Å; N197-G343 VanDerWaalsContact O-O 3.09Å
198	R	85	Confident	87.8	Confident	155 Å²	155	40.5 Å²	40.5	59%	0.585	21%	0.208	S	C	*	.			trans	-122.9	40.9	-179.7	-66	-170.2	179.1	-140.8	-0	111.8	F193 S345	F193-R198 HydrophobicContact CD1-CB 3.97Å; F193-R198 HydrophobicContact CE1-CB 4.19Å; F193-R198 HydrophobicContact CG-CB 4.19Å; R198-S345 VanDerWaalsContact CA-OG 3.32Å; R198-S345 WeakPolarHBondContact CA-OG 3.46Å
199	L	92.1	Very high	87.7	Confident	30 Å²	30	40.1 Å²	40.1	16%	0.157	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	148.7	-176	-60	174	0	0	0	110.9	F193 H306 G343 V344 S345 S346	F193-L199 VanDerWaalsContact O-CD2 3.26Å; F193-L199 WeakPolarHBondContact O-CD2 3.4Å; L199-H306 HydrophobicContact CB-CB 4.4Å; L199-H306 HydrophobicContact CD2-CB 3.9Å; L199-G343 PolarHBondContact N-O 3.43Å; L199-G343 VanDerWaalsContact N-O 3.09Å; L199-V344 HydrophobicContact CB-CB 4.4Å; L199-V344 HydrophobicContact CB-CG2 4Å; L199-V344 HydrophobicContact CD1-CG2 4.46Å; L199-V344 CarbonylContact O-C 3.51Å; L199-V344 VanDerWaalsContact O-CA 3.32Å; L199-V344 WeakPolarHBondContact O-CA 3.36Å; L199-V344 WeakPolarHBondContact O-CG1 3.47Å; L199-S345 PolarHBondContact O-N 3.35Å; L199-S346 PolarHBondContact O-N 2.95Å
200	C	93.4	Very high	87.7	Confident	23 Å²	23	35.3 Å²	35.3	16%	0.155	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	132.4	171.8	-64.8	0	0	0	0	109.8	S304 Y305 H306 T307 S346	C200-S304 WeakPolarHBondContact CB-O 3.47Å; C200-Y305 HydrophobicContact CB-CD1 4.16Å; C200-H306 PolarHBondContact N-ND1 2.87Å; C200-H306 PolarHBondContact O-N 3.32Å; C200-T307 PolarHBondContact O-N 2.96Å; C200-S346 CarbonylContact C-O 3.6Å; C200-S346 WeakPolarHBondContact CA-O 3.21Å
201	G	95	Very high	87.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	147.6	179.2	0	0	0	0	0	112.1	Y305 T307 S346 L347 A348	G201-Y305 VanDerWaalsContact C-CD1 3.5Å; G201-Y305 WeakPolarHBondContact O-CD1 3.4Å; G201-Y305 WeakPolarHBondContact O-CE1 3.4Å; G201-T307 CarbonylContact C-O 3.59Å; G201-T307 WeakPolarHBondContact CA-O 3.04Å; G201-S346 PolarHBondContact N-O 3.19Å; G201-L347 CarbonylContact O-C 3.29Å; G201-L347 WeakPolarHBondContact O-CA 3.34Å; G201-A348 PolarHBondContact O-N 3.08Å
202	L	95.3	Very high	87.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	133.1	169.9	171.7	67.2	0	0	0	109.4	L172 Q204 Y305 T307 I308 F309 A348 F398	L172-L202 HydrophobicContact CD1-CD2 3.57Å; L172-L202 HydrophobicContact CD2-CD2 3.82Å; L172-L202 HydrophobicContact CG-CD2 3.39Å; L202-Q204 HydrophobicContact CD2-CG 4.36Å; L202-Q204 HydrophobicContact CG-CG 4.45Å; L202-Y305 HydrophobicContact CB-CD1 3.64Å; L202-Y305 HydrophobicContact CB-CD2 4.37Å; L202-Y305 HydrophobicContact CB-CE1 3.97Å; L202-Y305 HydrophobicContact CB-CG 3.85Å; L202-Y305 HydrophobicContact CD2-CD2 4.47Å; L202-T307 PolarHBondContact N-O 2.65Å; L202-I308 HydrophobicContact CB-CD1 3.77Å; L202-I308 HydrophobicContact CD2-CD1 4.04Å; L202-I308 HydrophobicContact CG-CD1 4.33Å; L202-I308 CarbonylContact O-C 3.59Å; L202-I308 WeakPolarHBondContact O-CA 3.1Å; L202-F309 PolarHBondContact O-N 3.33Å; L202-A348 HydrophobicContact CD1-CB 3.54Å; L202-F398 HydrophobicContact CD1-CE1 3.54Å; L202-F398 HydrophobicContact CD1-CZ 3.91Å
203	L	96.1	Very high	87.2	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	122.7	170.3	-171.9	65.4	0	0	0	109.7	F309 L311 L332 V335 A348 I349 P350 L353	L203-F309 CarbonylContact C-O 3.59Å; L203-F309 WeakPolarHBondContact CA-O 3.42Å; L203-F309 HydrophobicContact CD1-CB 3.67Å; L203-L311 HydrophobicContact CD1-CB 3.73Å; L203-L311 HydrophobicContact CD2-CD2 4.26Å; L203-L311 HydrophobicContact CG-CB 4.39Å; L203-L332 HydrophobicContact CD2-CD1 3.63Å; L203-V335 HydrophobicContact CD1-CG1 4.31Å; L203-V335 HydrophobicContact CD1-CG2 3.8Å; L203-A348 WeakPolarHBondContact CB-O 3.15Å; L203-A348 PolarHBondContact N-O 3.26Å; L203-I349 HydrophobicContact CD2-CG2 4.09Å; L203-P350 WeakPolarHBondContact O-CD 3.48Å; L203-L353 HydrophobicContact CD2-CD2 4.37Å
204	Q	92.7	Very high	86.8	Confident	5 Å²	5	32.9 Å²	32.9	2%	0.023	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.4	168.1	-71.6	-67.7	-75.1	0	0	108.8	L172 L202 V206 I308 F309 L311	L172-Q204 HydrophobicContact CD1-CG 4.37Å; L202-Q204 HydrophobicContact CD2-CG 4.36Å; L202-Q204 HydrophobicContact CG-CG 4.45Å; Q204-V206 HydrophobicContact CB-CG1 4.48Å; Q204-I308 HydrophobicContact CB-CG2 4.12Å; Q204-I308 HydrophobicContact CG-CG2 3.72Å; Q204-F309 PolarHBondContact N-O 3.01Å; Q204-L311 PolarHBondContact O-N 3.04Å
205	V	91.8	Very high	86.1	Confident	15 Å²	15	38.2 Å²	38.2	9%	0.091	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	131.5	171.6	174.9	0	0	0	0	107.3	C313 P350 L353	V205-C313 HydrophobicContact CG1-CB 3.59Å; V205-C313 VanDerWaalsContact CG1-SG 3.58Å; V205-P350 HydrophobicContact CG2-CG 3.88Å; V205-L353 HydrophobicContact CG2-CB 4.42Å
206	V	90.7	Very high	85	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.024	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	157.5	-175.6	-59.3	0	0	0	0	111	Q204 H212 H213 Y295 H310 L311 V312 C313	Q204-V206 HydrophobicContact CB-CG1 4.48Å; V206-H212 HydrophobicContact CB-CB 4.22Å; V206-H213 WeakPolarHBondContact CG1-NE2 3.43Å; V206-Y295 HydrophobicContact CG2-CE1 3.97Å; V206-H310 HydrophobicContact CG1-CB 4.24Å; V206-H310 HydrophobicContact CG2-CB 4.09Å; V206-L311 PolarHBondContact N-O 3.07Å; V206-V312 HydrophobicContact CG2-CG2 3.97Å; V206-V312 WeakPolarHBondContact O-CA 3.47Å; V206-C313 PolarHBondContact O-N 3.46Å
207	S	88.1	Confident	83.9	Confident	37 Å²	37	40.4 Å²	40.4	26%	0.259	20%	0.197	S	C	.	.			trans	-70.9	176.8	169.8	59.7	0	0	0	0	111.9	D209 H212	S207-D209 PolarHBondContact O-N 3.23Å; S207-D209 VanDerWaalsContact O-N 3.13Å; S207-H212 PolarHBondContact N-ND1 3.02Å; S207-H212 PolarHBondContact OG-ND1 3.07Å
208	D	86.4	Confident	82.4	Confident	78 Å²	78	38.1 Å²	38.1	42%	0.417	19%	0.187	S	C	.	.	S	Bend	trans	-67.1	-4.6	174.5	62.6	-11.7	0	0	0	115.3	L289 V312	D208-L289 WeakPolarHBondContact CB-O 3.07Å; D208-L289 PolarHBondContact O-N 3.25Å; D208-V312 HydrophobicContact CB-CG1 4.34Å
209	D	85.3	Confident	80.3	Confident	35 Å²	35	31.6 Å²	31.6	19%	0.187	17%	0.168	C	C	.	.			trans	-92.2	126.2	175.7	-173.1	5	0	0	0	113.9	S207 N211 H212 K215	S207-D209 PolarHBondContact O-N 3.23Å; S207-D209 VanDerWaalsContact O-N 3.13Å; D209-N211 PolarHBondContact O-N 2.74Å; D209-N211 PolarHBondContact OD1-N 3.32Å; D209-H212 VanDerWaalsContact O-CB 3.27Å; D209-H212 WeakPolarHBondContact O-CB 3.49Å; D209-H212 PolarHBondContact O-N 2.8Å; D209-K215 WeakPolarHBondContact OD2-CD 3.5Å; D209-K215 WeakPolarHBondContact OD2-CE 3.2Å; D209-K215 IonicContact OD2-NZ 2.74Å; D209-K215 PolarHBondContact OD2-NZ 3.34Å
210	F	83.9	Confident	77.9	Confident	6 Å²	6	34.9 Å²	34.9	3%	0.026	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-30.5	171.1	-71.2	-69.8	0	0	0	113.9	H212 V259 K260 A263 G287 L289	F210-H212 VanDerWaalsContact C-N 3.26Å; F210-H212 PolarHBondContact O-N 3.41Å; F210-V259 HydrophobicContact CD1-CG1 3.9Å; F210-V259 HydrophobicContact CE1-CG1 3.57Å; F210-K260 HydrophobicContact CB-CB 4.36Å; F210-K260 HydrophobicContact CD1-CB 4.23Å; F210-K260 HydrophobicContact CD2-CB 3.81Å; F210-K260 HydrophobicContact CD2-CD 4.13Å; F210-K260 HydrophobicContact CD2-CG 3.66Å; F210-K260 HydrophobicContact CE2-CB 4.1Å; F210-K260 HydrophobicContact CE2-CG 3.93Å; F210-K260 HydrophobicContact CG-CB 3.87Å; F210-K260 HydrophobicContact CG-CG 4.21Å; F210-K260 HydrophobicContact CZ-CB 4.46Å; F210-A263 HydrophobicContact CE1-CB 4.21Å; F210-A263 HydrophobicContact CE2-CB 4.46Å; F210-A263 HydrophobicContact CZ-CB 3.54Å; F210-G287 WeakPolarHBondContact CE2-O 3.48Å; F210-L289 HydrophobicContact CD1-CD1 3.73Å; F210-L289 HydrophobicContact CD1-CG 4.24Å; F210-L289 HydrophobicContact CE1-CD1 3.45Å; F210-L289 VanDerWaalsContact CE1-CD1 3.45Å; F210-L289 HydrophobicContact CE1-CD2 3.55Å; F210-L289 HydrophobicContact CE1-CG 3.6Å; F210-L289 HydrophobicContact CE2-CD1 4.47Å; F210-L289 HydrophobicContact CE2-CD2 4.25Å; F210-L289 HydrophobicContact CE2-CG 3.96Å; F210-L289 HydrophobicContact CG-CD1 4.32Å; F210-L289 HydrophobicContact CZ-CD1 3.88Å; F210-L289 HydrophobicContact CZ-CD2 3.34Å; F210-L289 HydrophobicContact CZ-CG 3.46Å; F210-L289 VanDerWaalsContact CZ-CG 3.46Å
211	N	83	Confident	75.2	Confident	47 Å²	47	37.3 Å²	37.3	25%	0.251	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	15.8	179.5	-70	-26.3	0	0	0	112.9	D209 H213 I214 K215	D209-N211 PolarHBondContact O-N 2.74Å; D209-N211 PolarHBondContact OD1-N 3.32Å; N211-H213 PolarHBondContact O-N 3.2Å; N211-I214 PolarHBondContact O-N 3.45Å; N211-K215 HydrophobicContact CB-CG 4.27Å; N211-K215 WeakPolarHBondContact O-CB 3.5Å; N211-K215 PolarHBondContact O-N 2.88Å
212	H	83.1	Confident	72.5	Confident	28 Å²	28	39.4 Å²	39.4	13%	0.13	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-42.4	179.9	-179.3	84.2	0	0	0	113.3	V206 S207 D209 F210 S234	V206-H212 HydrophobicContact CB-CB 4.22Å; S207-H212 PolarHBondContact N-ND1 3.02Å; S207-H212 PolarHBondContact OG-ND1 3.07Å; D209-H212 VanDerWaalsContact O-CB 3.27Å; D209-H212 WeakPolarHBondContact O-CB 3.49Å; D209-H212 PolarHBondContact O-N 2.8Å; F210-H212 VanDerWaalsContact C-N 3.26Å; F210-H212 PolarHBondContact O-N 3.41Å; H212-S234 WeakPolarHBondContact NE2-CB 3.27Å; H212-S234 WeakPolarHBondContact O-CB 3.37Å; H212-S234 PolarHBondContact O-OG 2.89Å
213	H	82.1	Confident	69.7	Low	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-15.2	-178.7	-59.9	-60.6	0	0	0	115.3	V206 N211 S234 L235 F238 H310	V206-H213 WeakPolarHBondContact CG1-NE2 3.43Å; N211-H213 PolarHBondContact O-N 3.2Å; H213-S234 WeakPolarHBondContact CA-O 3.44Å; H213-S234 PolarHBondContact ND1-O 2.98Å; H213-L235 VanDerWaalsContact O-CD1 3.3Å; H213-L235 WeakPolarHBondContact O-CD1 2.96Å; H213-F238 WeakPolarHBondContact O-CB 3.45Å; H213-H310 AromaticContact CD2-CE1 3.71Å; H213-H310 AromaticContact CD2-ND1 3.71Å; H213-H310 AromaticContact NE2-CE1 3.28Å; H213-H310 PolarHBondContact NE2-CE1 3.43Å; H213-H310 VanDerWaalsContact NE2-CE1 3.28Å; H213-H310 AromaticContact NE2-ND1 2.99Å; H213-H310 PolarHBondContact NE2-ND1 3.46Å
214	I	78.4	Confident	67	Low	14 Å²	14	52.8 Å²	52.8	7%	0.072	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-10	-169	-45.4	-177.3	0	0	0	112	N211 H216 K217 F238 L252 Q253 L256	N211-I214 PolarHBondContact O-N 3.45Å; I214-H216 PolarHBondContact O-N 3.09Å; I214-K217 HydrophobicContact CG2-CB 3.81Å; I214-K217 HydrophobicContact CG2-CD 3.77Å; I214-K217 HydrophobicContact CG2-CG 4.22Å; I214-K217 VanDerWaalsContact O-CB 3.27Å; I214-K217 WeakPolarHBondContact O-CB 3.36Å; I214-K217 PolarHBondContact O-N 3.47Å; I214-F238 HydrophobicContact CD1-CD2 4.39Å; I214-F238 HydrophobicContact CG1-CD2 3.96Å; I214-F238 HydrophobicContact CG2-CD2 4.3Å; I214-F238 HydrophobicContact CG2-CE2 4.29Å; I214-L252 HydrophobicContact CD1-CD2 4.38Å; I214-L252 HydrophobicContact CD1-CG 4.23Å; I214-Q253 HydrophobicContact CD1-CB 3.99Å; I214-Q253 HydrophobicContact CD1-CG 4.47Å; I214-L256 HydrophobicContact CD1-CD1 3.56Å; I214-L256 HydrophobicContact CG1-CD1 4.04Å
215	K	69.2	Low	64.3	Low	120 Å²	120	56.1 Å²	56.1	52%	0.522	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-28.2	-179.3	-119	179	167.5	161.1	0	114.4	D209 N211	D209-K215 WeakPolarHBondContact OD2-CD 3.5Å; D209-K215 WeakPolarHBondContact OD2-CE 3.2Å; D209-K215 IonicContact OD2-NZ 2.74Å; D209-K215 PolarHBondContact OD2-NZ 3.34Å; N211-K215 HydrophobicContact CB-CG 4.27Å; N211-K215 WeakPolarHBondContact O-CB 3.5Å; N211-K215 PolarHBondContact O-N 2.88Å
216	H	57.2	Low	61.7	Low	57 Å²	57	61.5 Å²	61.5	26%	0.264	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	21.3	-180	-54.9	-69.7	0	0	0	113.6	I214 T218 G219 A231 L235	I214-H216 PolarHBondContact O-N 3.09Å; H216-T218 CarbonylContact O-C 3.54Å; H216-T218 VanDerWaalsContact O-C 3.29Å; H216-T218 PolarHBondContact O-N 2.9Å; H216-G219 PolarHBondContact O-N 3.18Å; H216-A231 WeakPolarHBondContact NE2-CB 3.2Å; H216-L235 HydrophobicContact CB-CD1 3.88Å; H216-L235 HydrophobicContact CB-CD2 4.48Å
217	K	55.7	Low	59.3	Low	74 Å²	74	64.2 Å²	64.2	32%	0.322	37%	0.365	S	S	.	.	S	Bend	trans	-52.8	-40.9	174.5	-164.6	-177.9	-171.5	-172.8	0	110.7	M90 I214 G219 F238	M90-K217 WeakPolarHBondContact CE-O 3.4Å; I214-K217 HydrophobicContact CG2-CB 3.81Å; I214-K217 HydrophobicContact CG2-CD 3.77Å; I214-K217 HydrophobicContact CG2-CG 4.22Å; I214-K217 VanDerWaalsContact O-CB 3.27Å; I214-K217 WeakPolarHBondContact O-CB 3.36Å; I214-K217 PolarHBondContact O-N 3.47Å; K217-G219 PolarHBondContact O-N 2.94Å; K217-F238 HydrophobicContact CD-CE2 4.04Å; K217-F238 HydrophobicContact CD-CZ 3.87Å; K217-F238 VanDerWaalsContact CE-CZ 3.46Å; K217-F238 HydrophobicContact CG-CE1 4.05Å; K217-F238 HydrophobicContact CG-CE2 4.18Å; K217-F238 HydrophobicContact CG-CZ 3.65Å
218	T	46.6	Very low	57.1	Low	72 Å²	72	62.6 Å²	62.6	44%	0.442	35%	0.354	S	S	.	.	S	Bend	trans	-79.9	96.9	162.1	46.3	0	0	0	0	107	H216 N220	H216-T218 CarbonylContact O-C 3.54Å; H216-T218 VanDerWaalsContact O-C 3.29Å; H216-T218 PolarHBondContact O-N 2.9Å; T218-N220 PolarHBondContact O-N 3.41Å
219	G	41.1	Very low	55	Low	18 Å²	18	61.1 Å²	61.1	19%	0.186	35%	0.352	C	S	.	.			trans	-63.7	77	-172.6	0	0	0	0	0	112.5	R86 H216 K217 N221	R86-G219 VanDerWaalsContact NH1-C 3.33Å; R86-G219 PolarHBondContact NH1-O 3Å; R86-G219 PolarHBondContact NH2-O 3.24Å; H216-G219 PolarHBondContact O-N 3.18Å; K217-G219 PolarHBondContact O-N 2.94Å; G219-N221 PolarHBondContact O-N 2.81Å
220	N	40.3	Very low	53	Low	99 Å²	99	63.7 Å²	63.7	53%	0.529	37%	0.37	S	S	.	.			trans	-51.2	118.5	160.8	-84.5	-0.1	0	0	0	104.3	T218 V222	T218-N220 PolarHBondContact O-N 3.41Å; N220-V222 PolarHBondContact O-N 2.87Å
221	N	37.7	Very low	51.2	Low	74 Å²	74	64 Å²	64	40%	0.396	37%	0.373	S	S	.	.			trans	-57.8	83.6	159	-90.1	-41.4	0	0	0	104.8	G219 K223	G219-N221 PolarHBondContact O-N 2.81Å; N221-K223 PolarHBondContact O-N 2.91Å
222	V	38.3	Very low	49.7	Very low	43 Å²	43	70 Å²	70	26%	0.261	39%	0.392	S	S	.	.			trans	-61.2	98.3	156.5	-163.6	0	0	0	0	100.8	N220 A224 A227 A228 A231	N220-V222 PolarHBondContact O-N 2.87Å; V222-A224 PolarHBondContact O-N 3.39Å; V222-A227 HydrophobicContact CG1-CB 4.32Å; V222-A228 VanDerWaalsContact CB-CA 3.47Å; V222-A228 HydrophobicContact CB-CB 3.4Å; V222-A228 HydrophobicContact CG1-CB 3.43Å; V222-A228 VanDerWaalsContact CG1-CB 3.43Å; V222-A228 VanDerWaalsContact CG1-N 3.35Å; V222-A228 WeakPolarHBondContact O-CB 3.26Å; V222-A231 HydrophobicContact CG2-CB 4.12Å
223	K	36.5	Very low	48.6	Very low	174 Å²	174	70.9 Å²	70.9	76%	0.757	40%	0.396	S	S	*	.			trans	-42.7	135.7	173.9	-71	178.7	177.4	176.8	0	106.1	N221 T225 A228	N221-K223 PolarHBondContact O-N 2.91Å; K223-T225 WeakPolarHBondContact O-CA 3.27Å; K223-T225 VanDerWaalsContact O-CB 3.3Å; K223-T225 WeakPolarHBondContact O-CB 3.41Å; K223-T225 WeakPolarHBondContact O-CG2 3.39Å; K223-T225 PolarHBondContact O-N 3.07Å; K223-T225 PolarHBondContact O-OG1 3.23Å; K223-A228 WeakPolarHBondContact O-CB 3.38Å
224	A	38.3	Very low	47.6	Very low	107 Å²	107	71.3 Å²	71.3	88%	0.884	40%	0.399	S	S	*	.	S	Bend	trans	-46.4	87.4	179.7	0	0	0	0	0	110.7	V222	V222-A224 PolarHBondContact O-N 3.39Å
225	T	36.4	Very low	47.2	Very low	76 Å²	76	71.3 Å²	71.3	47%	0.466	40%	0.399	S	S	.	.	S	Bend	trans	-135.8	155.3	179.8	52.1	0	0	0	0	102.7	K223 A227 A228 A229	K223-T225 WeakPolarHBondContact O-CA 3.27Å; K223-T225 VanDerWaalsContact O-CB 3.3Å; K223-T225 WeakPolarHBondContact O-CB 3.41Å; K223-T225 WeakPolarHBondContact O-CG2 3.39Å; K223-T225 PolarHBondContact O-N 3.07Å; K223-T225 PolarHBondContact O-OG1 3.23Å; T225-A227 PolarHBondContact O-N 2.96Å; T225-A228 WeakPolarHBondContact O-CA 3.41Å; T225-A228 WeakPolarHBondContact O-CB 3.29Å; T225-A228 PolarHBondContact O-N 3.43Å; T225-A229 PolarHBondContact O-N 3.34Å
226	T	37.5	Very low	47.7	Very low	128 Å²	128	66.7 Å²	66.7	79%	0.785	38%	0.379	S	S	*	.	H	α-helix	trans	-51.5	-34	-177.7	44.5	0	0	0	0	112.5	A228 A229 T230	T226-A228 PolarHBondContact O-N 2.93Å; T226-A229 PolarHBondContact O-N 2.9Å; T226-T230 PolarHBondContact O-N 2.92Å; T226-T230 PolarHBondContact O-OG1 2.85Å; T226-T230 VanDerWaalsContact O-OG1 3.04Å
227	A	39.8	Very low	49.1	Very low	60 Å²	60	64 Å²	64	50%	0.496	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-32.9	172.5	0	0	0	0	0	114.7	V222 T225 T230 A231	V222-A227 HydrophobicContact CG1-CB 4.32Å; T225-A227 PolarHBondContact O-N 2.96Å; A227-T230 PolarHBondContact O-N 3.27Å; A227-A231 WeakPolarHBondContact O-CB 3.46Å; A227-A231 PolarHBondContact O-N 2.91Å
228	A	42.7	Very low	50.6	Low	4 Å²	4	61.4 Å²	61.4	3%	0.033	36%	0.356	C	S	.	.	H	α-helix	trans	-69.5	-39.6	177.7	0	0	0	0	0	113.4	V222 K223 T225 T226 T230 A231 R232	V222-A228 VanDerWaalsContact CB-CA 3.47Å; V222-A228 HydrophobicContact CB-CB 3.4Å; V222-A228 HydrophobicContact CG1-CB 3.43Å; V222-A228 VanDerWaalsContact CG1-CB 3.43Å; V222-A228 VanDerWaalsContact CG1-N 3.35Å; V222-A228 WeakPolarHBondContact O-CB 3.26Å; K223-A228 WeakPolarHBondContact O-CB 3.38Å; T225-A228 WeakPolarHBondContact O-CA 3.41Å; T225-A228 WeakPolarHBondContact O-CB 3.29Å; T225-A228 PolarHBondContact O-N 3.43Å; T226-A228 PolarHBondContact O-N 2.93Å; A228-T230 VanDerWaalsContact C-N 3.3Å; A228-A231 PolarHBondContact O-N 3.33Å; A228-R232 PolarHBondContact O-N 3.35Å
229	A	42.6	Very low	52.4	Low	47 Å²	47	61 Å²	61	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-39	177.2	0	0	0	0	0	110.1	T225 T226 K233	T225-A229 PolarHBondContact O-N 3.34Å; T226-A229 PolarHBondContact O-N 2.9Å; A229-K233 VanDerWaalsContact O-CD 3.27Å; A229-K233 WeakPolarHBondContact O-CD 3.28Å; A229-K233 VanDerWaalsContact O-CG 3.23Å; A229-K233 WeakPolarHBondContact O-CG 3.47Å; A229-K233 PolarHBondContact O-N 2.93Å
230	T	41.9	Very low	54.5	Low	89 Å²	89	60.4 Å²	60.4	55%	0.546	34%	0.342	S	S	.	.	H	α-helix	trans	-67.6	-42.9	174.7	-43.6	0	0	0	0	111.9	T226 A227 A228 R232 K233 S234	T226-T230 PolarHBondContact O-N 2.92Å; T226-T230 PolarHBondContact O-OG1 2.85Å; T226-T230 VanDerWaalsContact O-OG1 3.04Å; A227-T230 PolarHBondContact O-N 3.27Å; A228-T230 VanDerWaalsContact C-N 3.3Å; T230-R232 PolarHBondContact O-N 2.79Å; T230-K233 PolarHBondContact O-N 3.28Å; T230-S234 PolarHBondContact O-N 3.23Å
231	A	46.5	Very low	56.9	Low	13 Å²	13	56.1 Å²	56.1	11%	0.107	32%	0.32	C	S	.	.	H	α-helix	trans	-64.8	-32.1	177.6	0	0	0	0	0	114.2	H216 V222 A227 A228 S234	H216-A231 WeakPolarHBondContact NE2-CB 3.2Å; V222-A231 HydrophobicContact CG2-CB 4.12Å; A227-A231 WeakPolarHBondContact O-CB 3.46Å; A227-A231 PolarHBondContact O-N 2.91Å; A228-A231 PolarHBondContact O-N 3.33Å; A231-S234 PolarHBondContact O-OG 2.62Å
232	R	51.3	Low	59.2	Low	172 Å²	172	53.5 Å²	53.5	65%	0.649	31%	0.305	S	S	*	.	H	α-helix	trans	-70.7	-33.5	174.5	-83.1	-178.2	175	156	-0.4	112.6	A228 T230 L235	A228-R232 PolarHBondContact O-N 3.35Å; T230-R232 PolarHBondContact O-N 2.79Å; R232-L235 WeakPolarHBondContact O-CB 3.33Å; R232-L235 PolarHBondContact O-N 2.89Å
233	K	59.8	Low	61.6	Low	46 Å²	46	53.1 Å²	53.1	20%	0.2	30%	0.299	C	S	.	.	H	α-helix	trans	-72.4	-38.2	-176.6	-69.7	163.2	-175.6	173.5	0	112.1	A229 T230 L235 E236 D356	A229-K233 VanDerWaalsContact O-CD 3.27Å; A229-K233 WeakPolarHBondContact O-CD 3.28Å; A229-K233 VanDerWaalsContact O-CG 3.23Å; A229-K233 WeakPolarHBondContact O-CG 3.47Å; A229-K233 PolarHBondContact O-N 2.93Å; T230-K233 PolarHBondContact O-N 3.28Å; K233-L235 PolarHBondContact O-N 2.94Å; K233-L235 VanDerWaalsContact O-N 3.14Å; K233-E236 PolarHBondContact O-N 3Å; K233-D356 HydrophobicContact CD-CB 4.05Å; K233-D356 WeakPolarHBondContact CE-OD2 3.4Å; K233-D356 VanDerWaalsContact NZ-CG 3.29Å; K233-D356 IonicContact NZ-OD2 2.96Å; K233-D356 PolarHBondContact NZ-OD2 3.43Å
234	S	61.4	Low	64.1	Low	10 Å²	10	44.9 Å²	44.9	7%	0.07	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.2	175	65.4	0	0	0	0	113.2	H212 H213 T230 A231	H212-S234 WeakPolarHBondContact NE2-CB 3.27Å; H212-S234 WeakPolarHBondContact O-CB 3.37Å; H212-S234 PolarHBondContact O-OG 2.89Å; H213-S234 WeakPolarHBondContact CA-O 3.44Å; H213-S234 PolarHBondContact ND1-O 2.98Å; T230-S234 PolarHBondContact O-N 3.23Å; A231-S234 PolarHBondContact O-OG 2.62Å
235	L	71.1	Confident	66.7	Low	15 Å²	15	39.8 Å²	39.8	8%	0.079	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-9.9	-177.7	-128.2	71.1	0	0	0	114.4	H213 H216 R232 K233 L237 F238 H239	H213-L235 VanDerWaalsContact O-CD1 3.3Å; H213-L235 WeakPolarHBondContact O-CD1 2.96Å; H216-L235 HydrophobicContact CB-CD1 3.88Å; H216-L235 HydrophobicContact CB-CD2 4.48Å; R232-L235 WeakPolarHBondContact O-CB 3.33Å; R232-L235 PolarHBondContact O-N 2.89Å; K233-L235 PolarHBondContact O-N 2.94Å; K233-L235 VanDerWaalsContact O-N 3.14Å; L235-L237 VanDerWaalsContact C-N 3.32Å; L235-L237 PolarHBondContact O-N 2.85Å; L235-F238 HydrophobicContact CG-CB 4.46Å; L235-F238 HydrophobicContact CG-CD1 4.28Å; L235-F238 PolarHBondContact O-N 2.96Å; L235-F238 VanDerWaalsContact O-N 3.09Å; L235-H239 WeakPolarHBondContact CD2-NE2 2.77Å; L235-H239 PolarHBondContact O-CD2 3.04Å; L235-H239 PolarHBondContact O-N 3.13Å
236	E	79.3	Confident	69.4	Low	22 Å²	22	36.9 Å²	36.9	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-39.9	-174.5	-72.2	-69.4	157.1	0	0	112.2	Y173 R176 K233 H239 A240	Y173-E236 HydrophobicContact CD1-CG 4.1Å; Y173-E236 WeakPolarHBondContact CD1-OE2 3.37Å; Y173-E236 HydrophobicContact CE1-CG 3.43Å; Y173-E236 VanDerWaalsContact CE1-CG 3.43Å; Y173-E236 VanDerWaalsContact CE1-OE1 3.25Å; Y173-E236 WeakPolarHBondContact CE1-OE1 3.09Å; R176-E236 IonicContact NE-OE1 3.75Å; R176-E236 IonicContact NE-OE2 3.17Å; R176-E236 PolarHBondContact NE-OE2 2.85Å; R176-E236 VanDerWaalsContact NE-OE2 3.08Å; R176-E236 IonicContact NH2-OE1 3.49Å; K233-E236 PolarHBondContact O-N 3Å; E236-H239 PolarHBondContact O-N 3.14Å; E236-A240 WeakPolarHBondContact O-CB 3.21Å; E236-A240 PolarHBondContact O-N 2.88Å
237	L	86.9	Confident	72.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-45.6	173.9	178.1	63.4	0	0	0	111.5	L172 L235 H239 A240 C241 L252 L302 I308	L172-L237 HydrophobicContact CD1-CB 4.16Å; L172-L237 HydrophobicContact CD1-CD1 4.26Å; L172-L237 HydrophobicContact CD2-CD1 4.32Å; L235-L237 VanDerWaalsContact C-N 3.32Å; L235-L237 PolarHBondContact O-N 2.85Å; L237-H239 VanDerWaalsContact C-N 3.34Å; L237-H239 PolarHBondContact O-N 2.81Å; L237-A240 PolarHBondContact O-N 2.89Å; L237-C241 WeakPolarHBondContact O-CB 3.27Å; L237-C241 PolarHBondContact O-N 3.04Å; L237-C241 PolarHBondContact O-SG 3.37Å; L237-L252 HydrophobicContact CD2-CD1 4.5Å; L237-L252 HydrophobicContact CG-CD2 4.43Å; L237-L302 HydrophobicContact CD1-CD1 3.98Å; L237-I308 HydrophobicContact CD1-CD1 4.23Å; L237-I308 HydrophobicContact CD1-CG1 3.92Å; L237-I308 HydrophobicContact CD2-CG1 4.39Å; L237-I308 HydrophobicContact CD2-CG2 4.07Å
238	F	86.8	Confident	74.7	Confident	21 Å²	21	28 Å²	28	9%	0.092	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-46.3	179.4	170.9	-92.6	0	0	0	111	H213 I214 K217 L235 A240 C241 E242 L252	H213-F238 WeakPolarHBondContact O-CB 3.45Å; I214-F238 HydrophobicContact CD1-CD2 4.39Å; I214-F238 HydrophobicContact CG1-CD2 3.96Å; I214-F238 HydrophobicContact CG2-CD2 4.3Å; I214-F238 HydrophobicContact CG2-CE2 4.29Å; K217-F238 HydrophobicContact CD-CE2 4.04Å; K217-F238 HydrophobicContact CD-CZ 3.87Å; K217-F238 VanDerWaalsContact CE-CZ 3.46Å; K217-F238 HydrophobicContact CG-CE1 4.05Å; K217-F238 HydrophobicContact CG-CE2 4.18Å; K217-F238 HydrophobicContact CG-CZ 3.65Å; L235-F238 HydrophobicContact CG-CB 4.46Å; L235-F238 HydrophobicContact CG-CD1 4.28Å; L235-F238 PolarHBondContact O-N 2.96Å; L235-F238 VanDerWaalsContact O-N 3.09Å; F238-A240 PolarHBondContact O-N 3.33Å; F238-C241 CarbonylContact O-C 3.58Å; F238-C241 PolarHBondContact O-N 3.25Å; F238-E242 HydrophobicContact CE1-CB 4.42Å; F238-E242 WeakPolarHBondContact O-CB 3.27Å; F238-E242 PolarHBondContact O-N 2.99Å; F238-L252 HydrophobicContact CB-CD2 4.39Å; F238-L252 HydrophobicContact CD2-CD2 4.39Å
239	H	84.1	Confident	77.2	Confident	62 Å²	62	28.7 Å²	28.7	29%	0.287	14%	0.144	S	C	.	.	H	α-helix	trans	-64.2	-39.4	176.6	-73.7	-50.1	0	0	0	112.8	L235 E236 L237 E242 R243	L235-H239 WeakPolarHBondContact CD2-NE2 2.77Å; L235-H239 PolarHBondContact O-CD2 3.04Å; L235-H239 PolarHBondContact O-N 3.13Å; E236-H239 PolarHBondContact O-N 3.14Å; L237-H239 VanDerWaalsContact C-N 3.34Å; L237-H239 PolarHBondContact O-N 2.81Å; H239-E242 IonicContact ND1-OE2 3.97Å; H239-E242 PolarHBondContact O-N 2.98Å; H239-R243 WeakPolarHBondContact O-CG 3.14Å; H239-R243 PolarHBondContact O-N 2.93Å
240	A	86.5	Confident	79.6	Confident	6 Å²	6	28.2 Å²	28.2	5%	0.05	14%	0.14	C	C	.	.	H	α-helix	trans	-60.5	-48.3	174.8	0	0	0	0	0	111	L172 E236 L237 F238 E242 R243 L302	L172-A240 HydrophobicContact CD2-CB 4.41Å; E236-A240 WeakPolarHBondContact O-CB 3.21Å; E236-A240 PolarHBondContact O-N 2.88Å; L237-A240 PolarHBondContact O-N 2.89Å; F238-A240 PolarHBondContact O-N 3.33Å; A240-E242 VanDerWaalsContact C-N 3.28Å; A240-E242 PolarHBondContact O-N 3.09Å; A240-R243 PolarHBondContact O-N 3.26Å; A240-L302 HydrophobicContact CB-CD2 3.71Å
241	C	89.3	Confident	81.9	Confident	10 Å²	10	27.5 Å²	27.5	7%	0.068	13%	0.133	C	C	.	.	H	α-helix	trans	-66.4	-26.3	175.6	-64.6	0	0	0	0	113.1	L237 F238 R243 L252 H299 N301	L237-C241 WeakPolarHBondContact O-CB 3.27Å; L237-C241 PolarHBondContact O-N 3.04Å; L237-C241 PolarHBondContact O-SG 3.37Å; F238-C241 CarbonylContact O-C 3.58Å; F238-C241 PolarHBondContact O-N 3.25Å; C241-R243 VanDerWaalsContact C-N 3.29Å; C241-R243 PolarHBondContact O-N 3.2Å; C241-L252 HydrophobicContact CB-CD2 4.45Å; C241-H299 VanDerWaalsContact SG-CE1 3.56Å; C241-H299 PolarHBondContact SG-ND1 3.14Å; C241-H299 VanDerWaalsContact SG-ND1 3.38Å; C241-N301 PolarHBondContact O-ND2 3.28Å
242	E	87.1	Confident	84.1	Confident	18 Å²	18	27.4 Å²	27.4	8%	0.084	13%	0.131	C	C	.	.	H	α-helix	trans	-70.1	-28.6	-178.9	-168.5	178.1	-145.7	0	0	111.9	V53 I57 R60 K101 F238 H239 A240 S244	V53-E242 VanDerWaalsContact CG1-O 3.23Å; V53-E242 WeakPolarHBondContact CG1-O 3.45Å; I57-E242 HydrophobicContact CD1-CG 4.14Å; R60-E242 IonicContact CZ-OE2 3.99Å; R60-E242 VanDerWaalsContact NH1-CD 3.29Å; R60-E242 IonicContact NH1-OE1 3.07Å; R60-E242 PolarHBondContact NH1-OE1 3.28Å; R60-E242 IonicContact NH1-OE2 3.3Å; R60-E242 PolarHBondContact NH1-OE2 3.45Å; R60-E242 VanDerWaalsContact NH1-OE2 3.07Å; R60-E242 IonicContact NH2-OE2 3.69Å; K101-E242 VanDerWaalsContact CE-O 3.3Å; K101-E242 WeakPolarHBondContact CE-O 3.44Å; K101-E242 PolarHBondContact NZ-O 2.89Å; F238-E242 HydrophobicContact CE1-CB 4.42Å; F238-E242 WeakPolarHBondContact O-CB 3.27Å; F238-E242 PolarHBondContact O-N 2.99Å; H239-E242 IonicContact ND1-OE2 3.97Å; H239-E242 PolarHBondContact O-N 2.98Å; A240-E242 VanDerWaalsContact C-N 3.28Å; A240-E242 PolarHBondContact O-N 3.09Å; E242-S244 PolarHBondContact O-N 3.23Å
243	R	88	Confident	86	Confident	35 Å²	35	21.8 Å²	21.8	13%	0.132	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-10.3	-173.5	-69.5	171.4	64.8	129.1	-1.2	115.5	V53 L54 I57 R176 L181 H239 A240 C241	V53-R243 VanDerWaalsContact CG1-C 3.48Å; V53-R243 WeakPolarHBondContact CG1-O 3.33Å; L54-R243 HydrophobicContact CD2-CB 3.96Å; L54-R243 HydrophobicContact CD2-CG 3.89Å; I57-R243 HydrophobicContact CD1-CG 4.26Å; R176-R243 PolarHBondContact O-NH1 2.81Å; L181-R243 HydrophobicContact CD1-CB 3.43Å; L181-R243 VanDerWaalsContact CD1-CB 3.43Å; L181-R243 HydrophobicContact CD1-CG 4.44Å; H239-R243 WeakPolarHBondContact O-CG 3.14Å; H239-R243 PolarHBondContact O-N 2.93Å; A240-R243 PolarHBondContact O-N 3.26Å; C241-R243 VanDerWaalsContact C-N 3.29Å; C241-R243 PolarHBondContact O-N 3.2Å
244	S	90.1	Very high	87.5	Confident	2 Å²	2	22.1 Å²	22.1	1%	0.014	12%	0.12	C	C	.	.	S	Bend	trans	-152	151	176.9	-176.9	0	0	0	0	110.8	S50 E242 N301	S50-S244 VanDerWaalsContact OG-CB 3.25Å; S50-S244 WeakPolarHBondContact OG-CB 3.3Å; S50-S244 PolarHBondContact OG-OG 3.33Å; E242-S244 PolarHBondContact O-N 3.23Å; S244-N301 PolarHBondContact O-ND2 3.37Å; S244-N301 VanDerWaalsContact O-ND2 3.07Å
245	A	92.7	Very high	89.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.12	C	C	.	.			trans	-66.3	138.1	176	0	0	0	0	0	110.9	K101 Q104 L247	K101-A245 HydrophobicContact CB-CB 4.04Å; K101-A245 HydrophobicContact CG-CB 3.89Å; Q104-A245 HydrophobicContact CB-CB 4.28Å; A245-L247 HydrophobicContact CB-CD2 3.72Å; A245-L247 HydrophobicContact CB-CG 4.4Å; A245-L247 PolarHBondContact O-N 3.49Å
246	E	93.1	Very high	90.1	Very high	14 Å²	14	21.7 Å²	21.7	7%	0.065	12%	0.116	C	C	.	.			trans	-79.5	99.2	169.7	-179.6	46.3	-112.1	0	0	108.8	R105 H248 F249 A250 H299 S300 N301	R105-E246 WeakPolarHBondContact CD-O 3.35Å; E246-H248 PolarHBondContact OE1-N 3.49Å; E246-H248 VanDerWaalsContact OE1-N 3.09Å; E246-F249 HydrophobicContact CG-CB 4.02Å; E246-F249 VanDerWaalsContact OE1-CD2 3.3Å; E246-F249 WeakPolarHBondContact OE1-CD2 3.4Å; E246-F249 PolarHBondContact OE1-N 3.4Å; E246-A250 WeakPolarHBondContact CG-O 3.39Å; E246-H299 VanDerWaalsContact OE2-CA 3.27Å; E246-H299 WeakPolarHBondContact OE2-CA 3.29Å; E246-S300 PolarHBondContact OE1-N 3.19Å; E246-S300 PolarHBondContact OE1-OG 3.44Å; E246-S300 PolarHBondContact OE2-N 3.39Å; E246-N301 PolarHBondContact OE2-OD1 2.93Å
247	L	94.5	Very high	90.7	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	13%	0.128	C	C	.	.			trans	-86.9	-23.4	-171.2	-58.4	179.7	0	0	0	112.8	E46 Y49 Q104 R105 F108 A245	E46-L247 HydrophobicContact CB-CD1 4.46Å; E46-L247 HydrophobicContact CG-CD1 3.37Å; Y49-L247 HydrophobicContact CD2-CD1 4.24Å; Y49-L247 HydrophobicContact CD2-CD2 4.37Å; Q104-L247 HydrophobicContact CB-CD2 4.35Å; R105-L247 HydrophobicContact CB-CD2 4.36Å; F108-L247 HydrophobicContact CB-CD1 4.19Å; F108-L247 HydrophobicContact CB-CD2 4.08Å; F108-L247 HydrophobicContact CD1-CB 3.77Å; F108-L247 HydrophobicContact CD1-CD1 3.92Å; F108-L247 HydrophobicContact CD1-CG 4.37Å; F108-L247 HydrophobicContact CD2-CD1 3.73Å; F108-L247 HydrophobicContact CE1-CB 4.18Å; F108-L247 HydrophobicContact CE1-CD1 4.17Å; F108-L247 HydrophobicContact CE2-CD1 3.99Å; F108-L247 HydrophobicContact CG-CB 4.2Å; F108-L247 HydrophobicContact CG-CD1 3.67Å; F108-L247 HydrophobicContact CG-CD2 4.42Å; F108-L247 HydrophobicContact CG-CG 4.33Å; F108-L247 HydrophobicContact CZ-CD1 4.19Å; A245-L247 HydrophobicContact CB-CD2 3.72Å; A245-L247 HydrophobicContact CB-CG 4.4Å; A245-L247 PolarHBondContact O-N 3.49Å
248	H	94.1	Very high	90.9	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.009	15%	0.149	C	C	.	.	S	Bend	trans	-106.2	-33.4	-169.1	-75.7	-87.1	0	0	0	113.4	F24 H25 F28 F108 L194 Y195 E246 S300	F24-H248 HydrophobicContact CE1-CB 4.38Å; F24-H248 AromaticContact CE1-ND1 3.46Å; F24-H248 WeakPolarHBondContact CE1-ND1 3.38Å; F24-H248 AromaticContact CZ-CE1 3.84Å; F24-H248 AromaticContact CZ-ND1 3.54Å; H25-H248 PolarHBondContact NE2-O 3.03Å; F28-H248 AromaticContact CD1-CE1 3.7Å; F28-H248 AromaticContact CD2-CE1 3.61Å; F28-H248 AromaticContact CE1-CE1 3.66Å; F28-H248 AromaticContact CE2-CE1 3.56Å; F28-H248 AromaticContact CE2-NE2 3.94Å; F28-H248 AromaticContact CG-CE1 3.65Å; F28-H248 AromaticContact CZ-CE1 3.58Å; F28-H248 AromaticContact CZ-NE2 3.88Å; F108-H248 AromaticContact CE1-CE1 4Å; F108-H248 AromaticContact CE1-NE2 3.65Å; L194-H248 HydrophobicContact CD2-CB 3.81Å; L194-H248 WeakPolarHBondContact CD2-ND1 3.47Å; Y195-H248 AromaticContact CE2-ND1 3.79Å; Y195-H248 AromaticContact CZ-ND1 3.75Å; Y195-H248 VanDerWaalsContact OH-CB 3.24Å; Y195-H248 WeakPolarHBondContact OH-CB 3.14Å; Y195-H248 PolarHBondContact OH-ND1 2.62Å; E246-H248 PolarHBondContact OE1-N 3.49Å; E246-H248 VanDerWaalsContact OE1-N 3.09Å; H248-S300 VanDerWaalsContact CD2-CB 3.41Å; H248-S300 WeakPolarHBondContact CD2-CB 3.27Å; H248-S300 PolarHBondContact CD2-OG 3.32Å; H248-S300 VanDerWaalsContact CD2-OG 3.28Å
249	F	93.6	Very high	91.2	Very high	18 Å²	18	28 Å²	28	8%	0.079	15%	0.152	C	C	.	.	S	Bend	trans	-115.7	-173.6	-178.8	-51.1	-62.5	0	0	0	111.1	R105 L194 Y195 E246 R298	R105-F249 PolarHBondContact NE-O 3.41Å; R105-F249 PolarHBondContact NH2-O 3.31Å; L194-F249 HydrophobicContact CD2-CE2 4.32Å; L194-F249 HydrophobicContact CD2-CZ 4.23Å; Y195-F249 HydrophobicContact CE1-CE1 4.06Å; Y195-F249 HydrophobicContact CE1-CZ 4.25Å; E246-F249 HydrophobicContact CG-CB 4.02Å; E246-F249 VanDerWaalsContact OE1-CD2 3.3Å; E246-F249 WeakPolarHBondContact OE1-CD2 3.4Å; E246-F249 PolarHBondContact OE1-N 3.4Å; F249-R298 HydrophobicContact CB-CB 4.48Å; F249-R298 HydrophobicContact CD1-CB 4.15Å; F249-R298 HydrophobicContact CD2-CB 3.8Å; F249-R298 HydrophobicContact CE1-CB 4.38Å; F249-R298 HydrophobicContact CE2-CB 4.04Å; F249-R298 HydrophobicContact CG-CB 3.86Å; F249-R298 HydrophobicContact CZ-CB 4.33Å
250	A	92.8	Very high	91.6	Very high	36 Å²	36	29.3 Å²	29.3	30%	0.298	16%	0.157	S	C	.	.			trans	-76.6	152.3	166.1	0	0	0	0	0	109.1	E246 Q255	E246-A250 WeakPolarHBondContact CG-O 3.39Å; A250-Q255 HydrophobicContact CB-CG 4.04Å; A250-Q255 PolarHBondContact O-NE2 3.06Å
251	D	91.9	Very high	91.8	Very high	74 Å²	74	36 Å²	36	40%	0.396	18%	0.181	S	C	.	.			trans	-60.8	163.8	175.9	66.7	87.8	0	0	0	112	Q253 S254 Q255	D251-Q253 VanDerWaalsContact C-N 3.3Å; D251-Q253 PolarHBondContact O-N 3.47Å; D251-Q253 WeakPolarHBondContact OD1-CA 3.39Å; D251-Q253 WeakPolarHBondContact OD1-CB 3.44Å; D251-Q253 PolarHBondContact OD1-N 2.96Å; D251-S254 PolarHBondContact O-N 2.93Å; D251-S254 PolarHBondContact OD1-N 2.89Å; D251-S254 PolarHBondContact OD1-OG 2.93Å; D251-S254 VanDerWaalsContact OD2-CB 3.23Å; D251-S254 WeakPolarHBondContact OD2-CB 3.48Å; D251-S254 PolarHBondContact OD2-OG 2.87Å; D251-Q255 WeakPolarHBondContact O-CG 3.23Å; D251-Q255 PolarHBondContact O-N 2.97Å
252	L	91.7	Very high	91.8	Very high	12 Å²	12	39.1 Å²	39.1	6%	0.063	20%	0.2	C	C	.	.	H	α-helix	trans	-56.6	-41.3	-175.7	177.1	63.1	0	0	0	112.5	I214 L237 F238 C241 Q255 L256 T297	I214-L252 HydrophobicContact CD1-CD2 4.38Å; I214-L252 HydrophobicContact CD1-CG 4.23Å; L237-L252 HydrophobicContact CD2-CD1 4.5Å; L237-L252 HydrophobicContact CG-CD2 4.43Å; F238-L252 HydrophobicContact CB-CD2 4.39Å; F238-L252 HydrophobicContact CD2-CD2 4.39Å; C241-L252 HydrophobicContact CB-CD2 4.45Å; L252-Q255 PolarHBondContact O-N 3.18Å; L252-L256 HydrophobicContact CD1-CD1 4.11Å; L252-L256 HydrophobicContact CD1-CG 4.16Å; L252-L256 HydrophobicContact CG-CD1 4.1Å; L252-L256 VanDerWaalsContact O-CG 3.28Å; L252-L256 WeakPolarHBondContact O-CG 3.42Å; L252-L256 PolarHBondContact O-N 3.02Å; L252-T297 HydrophobicContact CD1-CG2 4.15Å
253	Q	90.5	Very high	91.8	Very high	53 Å²	53	39.3 Å²	39.3	25%	0.248	21%	0.205	C	C	.	.	H	α-helix	trans	-66	-48.9	-179.5	-177.8	66.2	61.8	0	0	110.6	I214 D251 Q255 L256 D257	I214-Q253 HydrophobicContact CD1-CB 3.99Å; I214-Q253 HydrophobicContact CD1-CG 4.47Å; D251-Q253 VanDerWaalsContact C-N 3.3Å; D251-Q253 PolarHBondContact O-N 3.47Å; D251-Q253 WeakPolarHBondContact OD1-CA 3.39Å; D251-Q253 WeakPolarHBondContact OD1-CB 3.44Å; D251-Q253 PolarHBondContact OD1-N 2.96Å; Q253-Q255 VanDerWaalsContact C-N 3.25Å; Q253-Q255 PolarHBondContact O-N 3.47Å; Q253-L256 PolarHBondContact O-N 3.32Å; Q253-L256 VanDerWaalsContact O-N 3.1Å; Q253-D257 PolarHBondContact NE2-OD1 3.25Å; Q253-D257 PolarHBondContact O-N 2.84Å
254	S	92.2	Very high	91.7	Very high	53 Å²	53	39.9 Å²	39.9	37%	0.371	21%	0.212	S	C	.	.	H	α-helix	trans	-57.5	-38.9	176.7	-68.1	0	0	0	0	112.4	D251 N258	D251-S254 PolarHBondContact O-N 2.93Å; D251-S254 PolarHBondContact OD1-N 2.89Å; D251-S254 PolarHBondContact OD1-OG 2.93Å; D251-S254 VanDerWaalsContact OD2-CB 3.23Å; D251-S254 WeakPolarHBondContact OD2-CB 3.48Å; D251-S254 PolarHBondContact OD2-OG 2.87Å; S254-N258 WeakPolarHBondContact O-CB 3.36Å; S254-N258 PolarHBondContact O-N 3.21Å
255	Q	94.3	Very high	91.6	Very high	17 Å²	17	43.7 Å²	43.7	8%	0.079	23%	0.232	C	C	.	.	H	α-helix	trans	-65.2	-45.8	175	-70.9	-172.5	72.8	0	0	111.9	A250 D251 L252 Q253 N258 V259 T297 R298	A250-Q255 HydrophobicContact CB-CG 4.04Å; A250-Q255 PolarHBondContact O-NE2 3.06Å; D251-Q255 WeakPolarHBondContact O-CG 3.23Å; D251-Q255 PolarHBondContact O-N 2.97Å; L252-Q255 PolarHBondContact O-N 3.18Å; Q253-Q255 VanDerWaalsContact C-N 3.25Å; Q253-Q255 PolarHBondContact O-N 3.47Å; Q255-N258 PolarHBondContact O-N 3.05Å; Q255-V259 VanDerWaalsContact O-CG2 3.29Å; Q255-V259 WeakPolarHBondContact O-CG2 3.34Å; Q255-V259 PolarHBondContact O-N 3.17Å; Q255-T297 HydrophobicContact CB-CG2 4.01Å; Q255-R298 PolarHBondContact NE2-O 2.75Å; Q255-R298 PolarHBondContact OE1-O 3.26Å
256	L	92.3	Very high	91.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.4	-39.8	178.4	-68.2	173.5	0	0	0	112.1	I214 L252 Q253 N258 V259 K260 Y295 T297	I214-L256 HydrophobicContact CD1-CD1 3.56Å; I214-L256 HydrophobicContact CG1-CD1 4.04Å; L252-L256 HydrophobicContact CD1-CD1 4.11Å; L252-L256 HydrophobicContact CD1-CG 4.16Å; L252-L256 HydrophobicContact CG-CD1 4.1Å; L252-L256 VanDerWaalsContact O-CG 3.28Å; L252-L256 WeakPolarHBondContact O-CG 3.42Å; L252-L256 PolarHBondContact O-N 3.02Å; Q253-L256 PolarHBondContact O-N 3.32Å; Q253-L256 VanDerWaalsContact O-N 3.1Å; L256-N258 VanDerWaalsContact C-N 3.31Å; L256-N258 PolarHBondContact O-N 3.24Å; L256-V259 PolarHBondContact O-N 3.2Å; L256-K260 WeakPolarHBondContact O-CB 3.29Å; L256-K260 PolarHBondContact O-N 3.49Å; L256-Y295 HydrophobicContact CD2-CD2 4.42Å; L256-Y295 HydrophobicContact CD2-CE2 3.65Å; L256-T297 HydrophobicContact CD2-CG2 4.16Å
257	D	92	Very high	90.7	Very high	66 Å²	66	47.8 Å²	47.8	35%	0.353	26%	0.255	S	S	.	.	H	α-helix	trans	-62.5	-40.3	174.9	-70.3	-19.7	0	0	0	111.5	Q253 K260 R261	Q253-D257 PolarHBondContact NE2-OD1 3.25Å; Q253-D257 PolarHBondContact O-N 2.84Å; D257-K260 PolarHBondContact O-N 2.81Å; D257-R261 WeakPolarHBondContact O-CB 3.29Å; D257-R261 PolarHBondContact O-N 2.8Å
258	N	92.1	Very high	90.2	Very high	83 Å²	83	52 Å²	52	44%	0.444	28%	0.275	S	S	.	.	H	α-helix	trans	-66.7	-40.4	175.2	-172.3	49.9	0	0	0	112.2	S254 Q255 L256 R261 T262	S254-N258 WeakPolarHBondContact O-CB 3.36Å; S254-N258 PolarHBondContact O-N 3.21Å; Q255-N258 PolarHBondContact O-N 3.05Å; L256-N258 VanDerWaalsContact C-N 3.31Å; L256-N258 PolarHBondContact O-N 3.24Å; N258-R261 PolarHBondContact O-N 2.85Å; N258-T262 WeakPolarHBondContact O-CB 3.48Å; N258-T262 PolarHBondContact O-N 3.39Å; N258-T262 PolarHBondContact O-OG1 2.8Å
259	V	92.4	Very high	89.7	Confident	25 Å²	25	59.5 Å²	59.5	15%	0.152	31%	0.307	C	S	.	.	H	α-helix	trans	-61.2	-48	174.7	171.2	0	0	0	0	110	F210 Q255 L256 R261 T262 A263 Y295	F210-V259 HydrophobicContact CD1-CG1 3.9Å; F210-V259 HydrophobicContact CE1-CG1 3.57Å; Q255-V259 VanDerWaalsContact O-CG2 3.29Å; Q255-V259 WeakPolarHBondContact O-CG2 3.34Å; Q255-V259 PolarHBondContact O-N 3.17Å; L256-V259 PolarHBondContact O-N 3.2Å; V259-R261 PolarHBondContact O-N 3.41Å; V259-T262 PolarHBondContact O-N 2.95Å; V259-A263 VanDerWaalsContact O-CB 3.3Å; V259-A263 WeakPolarHBondContact O-CB 3.49Å; V259-A263 PolarHBondContact O-N 3.21Å; V259-Y295 HydrophobicContact CG1-CD1 4.49Å; V259-Y295 HydrophobicContact CG1-CD2 3.89Å; V259-Y295 HydrophobicContact CG1-CG 3.75Å; V259-Y295 HydrophobicContact CG2-CD2 4.38Å
260	K	91.6	Very high	89.1	Confident	90 Å²	90	66.1 Å²	66.1	39%	0.391	33%	0.332	S	S	.	.	H	α-helix	trans	-57.2	-47.4	177	-179.7	175.3	-178.9	177.8	0	111.7	F210 L256 D257 A263 T264	F210-K260 HydrophobicContact CB-CB 4.36Å; F210-K260 HydrophobicContact CD1-CB 4.23Å; F210-K260 HydrophobicContact CD2-CB 3.81Å; F210-K260 HydrophobicContact CD2-CD 4.13Å; F210-K260 HydrophobicContact CD2-CG 3.66Å; F210-K260 HydrophobicContact CE2-CB 4.1Å; F210-K260 HydrophobicContact CE2-CG 3.93Å; F210-K260 HydrophobicContact CG-CB 3.87Å; F210-K260 HydrophobicContact CG-CG 4.21Å; F210-K260 HydrophobicContact CZ-CB 4.46Å; L256-K260 WeakPolarHBondContact O-CB 3.29Å; L256-K260 PolarHBondContact O-N 3.49Å; D257-K260 PolarHBondContact O-N 2.81Å; K260-A263 PolarHBondContact O-N 3.08Å; K260-T264 WeakPolarHBondContact O-CB 3.44Å; K260-T264 PolarHBondContact O-N 2.9Å; K260-T264 PolarHBondContact O-OG1 3.15Å
261	R	90.5	Very high	88.5	Confident	146 Å²	146	68.6 Å²	68.6	55%	0.551	35%	0.352	S	S	*	.	H	α-helix	trans	-59.9	-48.8	176.8	-171.2	-175.2	-62.1	116.4	0.6	111.2	D257 N258 V259 A263 T264 L265	D257-R261 WeakPolarHBondContact O-CB 3.29Å; D257-R261 PolarHBondContact O-N 2.8Å; N258-R261 PolarHBondContact O-N 2.85Å; V259-R261 PolarHBondContact O-N 3.41Å; R261-A263 PolarHBondContact O-N 3.25Å; R261-T264 PolarHBondContact O-N 3.5Å; R261-L265 HydrophobicContact CG-CD1 4.19Å; R261-L265 VanDerWaalsContact O-CG 3.32Å; R261-L265 WeakPolarHBondContact O-CG 3.45Å; R261-L265 PolarHBondContact O-N 3.08Å
262	T	89.7	Confident	87.7	Confident	76 Å²	76	72.8 Å²	72.8	47%	0.466	37%	0.367	S	S	.	.	H	α-helix	trans	-64.7	-42.1	-178.2	-57.1	0	0	0	0	111.8	N258 V259 L265 A266	N258-T262 WeakPolarHBondContact O-CB 3.48Å; N258-T262 PolarHBondContact O-N 3.39Å; N258-T262 PolarHBondContact O-OG1 2.8Å; V259-T262 PolarHBondContact O-N 2.95Å; T262-L265 PolarHBondContact O-N 3.39Å; T262-A266 WeakPolarHBondContact O-CB 3.21Å; T262-A266 PolarHBondContact O-N 3.37Å
263	A	88.2	Confident	86.8	Confident	23 Å²	23	75.2 Å²	75.2	19%	0.19	39%	0.385	C	S	.	.	H	α-helix	trans	-63.6	-42.3	177.1	0	0	0	0	0	111.9	F210 V259 K260 R261 A266 K267	F210-A263 HydrophobicContact CE1-CB 4.21Å; F210-A263 HydrophobicContact CE2-CB 4.46Å; F210-A263 HydrophobicContact CZ-CB 3.54Å; V259-A263 VanDerWaalsContact O-CB 3.3Å; V259-A263 WeakPolarHBondContact O-CB 3.49Å; V259-A263 PolarHBondContact O-N 3.21Å; K260-A263 PolarHBondContact O-N 3.08Å; R261-A263 PolarHBondContact O-N 3.25Å; A263-A266 PolarHBondContact O-N 3.46Å; A263-K267 WeakPolarHBondContact O-CG 3.45Å; A263-K267 PolarHBondContact O-N 2.93Å
264	T	86.4	Confident	84.7	Confident	46 Å²	46	79.1 Å²	79.1	28%	0.282	42%	0.415	S	S	.	.	H	α-helix	trans	-63.5	-48.2	177.4	-53	0	0	0	0	110.9	K260 R261 A266 K267 E268	K260-T264 WeakPolarHBondContact O-CB 3.44Å; K260-T264 PolarHBondContact O-N 2.9Å; K260-T264 PolarHBondContact O-OG1 3.15Å; R261-T264 PolarHBondContact O-N 3.5Å; T264-A266 VanDerWaalsContact C-N 3.32Å; T264-A266 PolarHBondContact O-N 3Å; T264-K267 WeakPolarHBondContact O-CB 3.35Å; T264-K267 PolarHBondContact O-N 2.9Å; T264-K267 VanDerWaalsContact O-N 3.16Å; T264-E268 PolarHBondContact O-N 2.84Å
265	L	87.1	Confident	83.1	Confident	83 Å²	83	80.4 Å²	80.4	44%	0.435	44%	0.437	S	S	.	.	H	α-helix	trans	-60.7	-39.5	175.9	-70	172.2	0	0	0	112.5	R261 T262 E268 K269	R261-L265 HydrophobicContact CG-CD1 4.19Å; R261-L265 VanDerWaalsContact O-CG 3.32Å; R261-L265 WeakPolarHBondContact O-CG 3.45Å; R261-L265 PolarHBondContact O-N 3.08Å; T262-L265 PolarHBondContact O-N 3.39Å; L265-E268 PolarHBondContact O-N 2.9Å; L265-K269 WeakPolarHBondContact O-CG 3.37Å; L265-K269 PolarHBondContact O-N 2.87Å
266	A	85.3	Confident	81	Confident	29 Å²	29	89.9 Å²	89.9	24%	0.24	47%	0.472	C	S	.	.	H	α-helix	trans	-65.6	-38.6	176.8	0	0	0	0	0	112	T262 A263 T264 R270	T262-A266 WeakPolarHBondContact O-CB 3.21Å; T262-A266 PolarHBondContact O-N 3.37Å; A263-A266 PolarHBondContact O-N 3.46Å; T264-A266 VanDerWaalsContact C-N 3.32Å; T264-A266 PolarHBondContact O-N 3Å; A266-R270 VanDerWaalsContact O-CG 3.31Å; A266-R270 WeakPolarHBondContact O-CG 3.41Å; A266-R270 PolarHBondContact O-N 2.73Å; A266-R270 VanDerWaalsContact O-N 3.15Å
267	K	82	Confident	78.7	Confident	71 Å²	71	97.4 Å²	97.4	31%	0.309	51%	0.511	S	S	.	.	H	α-helix	trans	-63.8	-48.2	173.9	-76.3	-178.6	176.7	-171.9	0	111.6	A263 T264 K269 R270 A271 A288	A263-K267 WeakPolarHBondContact O-CG 3.45Å; A263-K267 PolarHBondContact O-N 2.93Å; T264-K267 WeakPolarHBondContact O-CB 3.35Å; T264-K267 PolarHBondContact O-N 2.9Å; T264-K267 VanDerWaalsContact O-N 3.16Å; K267-K269 VanDerWaalsContact C-N 3.31Å; K267-K269 PolarHBondContact O-N 2.79Å; K267-R270 PolarHBondContact O-N 3.01Å; K267-R270 VanDerWaalsContact O-N 3.14Å; K267-A271 PolarHBondContact O-N 2.67Å; K267-A288 PolarHBondContact NZ-O 3.4Å
268	E	83.8	Confident	76.4	Confident	90 Å²	90	99.1 Å²	99.1	42%	0.421	53%	0.534	S	S	.	.	H	α-helix	trans	-58.8	-42.2	177.6	-71.9	177.7	-160.5	0	0	112.4	T264 L265 R270 A271 K272	T264-E268 PolarHBondContact O-N 2.84Å; L265-E268 PolarHBondContact O-N 2.9Å; E268-R270 VanDerWaalsContact C-N 3.34Å; E268-R270 PolarHBondContact O-N 2.95Å; E268-A271 PolarHBondContact O-N 3.2Å; E268-K272 WeakPolarHBondContact O-CG 3.46Å; E268-K272 PolarHBondContact O-N 3.09Å; E268-K272 VanDerWaalsContact O-N 3.12Å
269	K	83.8	Confident	73.9	Confident	158 Å²	158	104.1 Å²	104.1	69%	0.687	55%	0.552	S	S	*	*	H	α-helix	trans	-60.9	-42.5	176.2	-77.7	-179.5	-179.7	-178	0	111.9	L265 K267 K272 S273	L265-K269 WeakPolarHBondContact O-CG 3.37Å; L265-K269 PolarHBondContact O-N 2.87Å; K267-K269 VanDerWaalsContact C-N 3.31Å; K267-K269 PolarHBondContact O-N 2.79Å; K269-K272 PolarHBondContact O-N 3.43Å; K269-S273 PolarHBondContact O-N 2.93Å; K269-S273 PolarHBondContact O-OG 2.86Å; K269-S273 VanDerWaalsContact O-OG 3.05Å
270	R	81.5	Confident	71.2	Confident	158 Å²	158	110.4 Å²	110.4	60%	0.596	58%	0.58	S	S	*	*	H	α-helix	trans	-67.8	-36.9	177.6	-69.8	170.8	-168.1	151.3	3.6	112.4	A266 K267 E268 K272 S273	A266-R270 VanDerWaalsContact O-CG 3.31Å; A266-R270 WeakPolarHBondContact O-CG 3.41Å; A266-R270 PolarHBondContact O-N 2.73Å; A266-R270 VanDerWaalsContact O-N 3.15Å; K267-R270 PolarHBondContact O-N 3.01Å; K267-R270 VanDerWaalsContact O-N 3.14Å; E268-R270 VanDerWaalsContact C-N 3.34Å; E268-R270 PolarHBondContact O-N 2.95Å; R270-K272 VanDerWaalsContact C-N 3.28Å; R270-K272 PolarHBondContact O-N 3.22Å; R270-S273 WeakPolarHBondContact O-CB 3.22Å; R270-S273 PolarHBondContact O-N 2.93Å
271	A	79.1	Confident	68.4	Low	88 Å²	88	110 Å²	110	73%	0.727	60%	0.601	S	S	*	*	H	α-helix	trans	-67.1	-30.8	177.5	0	0	0	0	0	112.4	K267 E268	K267-A271 PolarHBondContact O-N 2.67Å; E268-A271 PolarHBondContact O-N 3.2Å
272	K	76.3	Confident	65.8	Low	162 Å²	162	111.5 Å²	111.5	70%	0.704	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-7.3	177.6	-67	173.1	-174.7	171.8	0	113.7	E268 K269 R270 P274	E268-K272 WeakPolarHBondContact O-CG 3.46Å; E268-K272 PolarHBondContact O-N 3.09Å; E268-K272 VanDerWaalsContact O-N 3.12Å; K269-K272 PolarHBondContact O-N 3.43Å; R270-K272 VanDerWaalsContact C-N 3.28Å; R270-K272 PolarHBondContact O-N 3.22Å; K272-P274 VanDerWaalsContact O-CD 3.27Å; K272-P274 WeakPolarHBondContact O-CD 3.35Å
273	S	72	Confident	63.3	Low	63 Å²	63	114.8 Å²	114.8	44%	0.441	63%	0.628	S	S	.	*	S	Bend	trans	-74.2	112.9	177	-56.8	0	0	0	0	111	K269 R270 G275	K269-S273 PolarHBondContact O-N 2.93Å; K269-S273 PolarHBondContact O-OG 2.86Å; K269-S273 VanDerWaalsContact O-OG 3.05Å; R270-S273 WeakPolarHBondContact O-CB 3.22Å; R270-S273 PolarHBondContact O-N 2.93Å; S273-G275 PolarHBondContact O-N 3.28Å
274	P	47.2	Very low	61.1	Low	134 Å²	134	117.2 Å²	117.2	87%	0.87	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	120.8	175.7	29	-31.8	0	0	0	109	K272	K272-P274 VanDerWaalsContact O-CD 3.27Å; K272-P274 WeakPolarHBondContact O-CD 3.35Å
275	G	58.2	Low	59.3	Low	81 Å²	81	119.2 Å²	119.2	84%	0.835	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	130	-9.4	174.8	0	0	0	0	0	116.1	S273	S273-G275 PolarHBondContact O-N 3.28Å
276	R	50.4	Low	57.5	Low	215 Å²	215	125 Å²	125	81%	0.811	68%	0.678	S	S	*	*			trans	-100.8	92.1	164.8	-80	-173.7	174.9	-155.7	-1.3	109.2	A278	R276-A278 PolarHBondContact O-N 3.03Å; R276-A278 VanDerWaalsContact O-N 3.11Å
277	L	43.5	Very low	56.2	Low	159 Å²	159	124.6 Å²	124.6	83%	0.832	68%	0.677	S	S	*	*			trans	-45.2	120.5	157.2	-76.1	160.4	0	0	0	106.9	K279	L277-K279 PolarHBondContact O-N 3.28Å
278	A	43.1	Very low	55.6	Low	101 Å²	101	121.7 Å²	121.7	84%	0.835	67%	0.666	S	S	*	*			trans	-60.5	79.3	172.5	0	0	0	0	0	108.6	R276 E280	R276-A278 PolarHBondContact O-N 3.03Å; R276-A278 VanDerWaalsContact O-N 3.11Å; A278-E280 PolarHBondContact O-N 3.04Å
279	K	39.6	Very low	55.7	Low	188 Å²	188	117.9 Å²	117.9	82%	0.817	65%	0.648	S	S	*	*			trans	-72.3	117.6	164.7	-90.7	-175.3	171.5	-176.3	0	105.8	L277	L277-K279 PolarHBondContact O-N 3.28Å
280	E	37.3	Very low	56	Low	157 Å²	157	112.2 Å²	112.2	73%	0.734	63%	0.628	S	S	*	*	S	Bend	trans	83.8	81.2	171.5	-56.9	178.5	-171.8	0	0	115.8	A278 Y282	A278-E280 PolarHBondContact O-N 3.04Å; E280-Y282 HydrophobicContact CB-CD2 4.25Å; E280-Y282 HydrophobicContact CB-CE2 4.36Å; E280-Y282 PolarHBondContact O-N 3.47Å
281	G	32.7	Very low	56.4	Low	81 Å²	81	107.1 Å²	107.1	84%	0.835	62%	0.616	S	S	*	*				60.2	-10.5	98	0	0	0	0	0	120.6	T283	G281-T283 PolarHBondContact O-N 3.03Å
282	Y	35.5	Very low	57.2	Low	178 Å²	178	103.4 Å²	103.4	70%	0.698	59%	0.586	S	S	*	*			trans	-98	96.2	177	-65.8	-82.9	0	0	0	109.5	E280 L284	E280-Y282 HydrophobicContact CB-CD2 4.25Å; E280-Y282 HydrophobicContact CB-CE2 4.36Å; E280-Y282 PolarHBondContact O-N 3.47Å; Y282-L284 PolarHBondContact O-N 3.36Å
283	T	36.2	Very low	58	Low	146 Å²	146	98.7 Å²	98.7	90%	0.896	57%	0.569	S	S	*	*			trans	-65.3	68.5	157	47.2	0	0	0	0	108.7	G281 S285	G281-T283 PolarHBondContact O-N 3.03Å; T283-S285 PolarHBondContact O-N 2.64Å
284	L	43.5	Very low	59.1	Low	73 Å²	73	97.6 Å²	97.6	38%	0.382	56%	0.559	S	S	.	*			trans	-67.7	127	165.8	-91.6	135.5	0	0	0	107	Y282 A288	Y282-L284 PolarHBondContact O-N 3.36Å; L284-A288 HydrophobicContact CD2-CB 3.81Å
285	S	47.3	Very low	61.3	Low	88 Å²	88	91.9 Å²	91.9	62%	0.615	52%	0.521	S	S	*	.			trans	-46.8	146.3	179.7	52.9	0	0	0	0	111.7	T283 G287 A288	T283-S285 PolarHBondContact O-N 2.64Å; S285-G287 PolarHBondContact O-N 2.65Å; S285-A288 PolarHBondContact O-N 3.27Å
286	E	49	Very low	63.1	Low	206 Å²	206	90.4 Å²	90.4	96%	0.963	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	101.7	180	-138.1	172.2	-170.4	0	0	110.1
287	G	58.2	Low	65.2	Low	20 Å²	20	80.1 Å²	80.1	21%	0.206	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	106.5	1	179.2	0	0	0	0	0	117.9	F210 S285	F210-G287 WeakPolarHBondContact CE2-O 3.48Å; S285-G287 PolarHBondContact O-N 2.65Å
288	A	69.8	Low	67.6	Low	9 Å²	9	78.7 Å²	78.7	7%	0.074	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-80.3	135.3	179.3	0	0	0	0	0	113.3	K267 L284 S285	K267-A288 PolarHBondContact NZ-O 3.4Å; L284-A288 HydrophobicContact CD2-CB 3.81Å; S285-A288 PolarHBondContact O-N 3.27Å
289	L	85.2	Confident	70	Confident	10 Å²	10	74 Å²	74	5%	0.052	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-74.4	148.1	174	-71.2	167.5	0	0	0	111.1	D208 F210 N293 Y295 V312	D208-L289 WeakPolarHBondContact CB-O 3.07Å; D208-L289 PolarHBondContact O-N 3.25Å; F210-L289 HydrophobicContact CD1-CD1 3.73Å; F210-L289 HydrophobicContact CD1-CG 4.24Å; F210-L289 HydrophobicContact CE1-CD1 3.45Å; F210-L289 VanDerWaalsContact CE1-CD1 3.45Å; F210-L289 HydrophobicContact CE1-CD2 3.55Å; F210-L289 HydrophobicContact CE1-CG 3.6Å; F210-L289 HydrophobicContact CE2-CD1 4.47Å; F210-L289 HydrophobicContact CE2-CD2 4.25Å; F210-L289 HydrophobicContact CE2-CG 3.96Å; F210-L289 HydrophobicContact CG-CD1 4.32Å; F210-L289 HydrophobicContact CZ-CD1 3.88Å; F210-L289 HydrophobicContact CZ-CD2 3.34Å; F210-L289 HydrophobicContact CZ-CG 3.46Å; F210-L289 VanDerWaalsContact CZ-CG 3.46Å; L289-N293 HydrophobicContact CD2-CB 4.38Å; L289-Y295 HydrophobicContact CD1-CD1 3.72Å; L289-Y295 HydrophobicContact CD1-CE1 3.43Å; L289-Y295 VanDerWaalsContact CD1-CE1 3.43Å; L289-V312 HydrophobicContact CB-CB 4.35Å; L289-V312 HydrophobicContact CB-CG1 3.99Å; L289-V312 HydrophobicContact CB-CG2 3.65Å; L289-V312 HydrophobicContact CD1-CG2 3.5Å; L289-V312 VanDerWaalsContact CD1-CG2 3.5Å; L289-V312 HydrophobicContact CG-CG2 4.13Å
290	S	89.7	Confident	72.5	Confident	39 Å²	39	65.2 Å²	65.2	27%	0.273	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-94.1	146.3	176	-56.9	0	0	0	0	111	G292 N293	S290-G292 PolarHBondContact O-N 3.49Å; S290-N293 PolarHBondContact N-OD1 3.01Å; S290-N293 WeakPolarHBondContact O-CB 3.26Å; S290-N293 PolarHBondContact O-N 3.3Å; S290-N293 PolarHBondContact O-ND2 3.06Å
291	P	91.9	Very high	75	Confident	52 Å²	52	58 Å²	58	34%	0.338	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	138.8	173.4	-29.1	35.7	0	0	0	112.9	N293 V312 P327	P291-N293 VanDerWaalsContact C-N 3.27Å; P291-N293 PolarHBondContact O-N 3.07Å; P291-V312 CarbonylContact C-O 3.51Å; P291-V312 WeakPolarHBondContact CA-O 3.14Å; P291-P327 HydrophobicContact CB-CB 4.41Å; P291-P327 WeakPolarHBondContact O-CB 3.22Å
292	G	93.9	Very high	77.6	Confident	10 Å²	10	54.3 Å²	54.3	10%	0.103	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-5.5	-173.4	0	0	0	0	0	115.4	S290 V312 P327 G331	S290-G292 PolarHBondContact O-N 3.49Å; G292-V312 PolarHBondContact N-O 3.02Å; G292-P327 VanDerWaalsContact CA-O 3.25Å; G292-P327 WeakPolarHBondContact CA-O 3.45Å; G292-G331 WeakPolarHBondContact O-CA 3.4Å
293	N	93.8	Very high	79.6	Confident	62 Å²	62	46.2 Å²	46.2	33%	0.332	26%	0.257	S	S	.	.			trans	-67.8	146.2	168.2	-71	-170	0	0	0	110.1	L289 S290 P291 V312	L289-N293 HydrophobicContact CD2-CB 4.38Å; S290-N293 PolarHBondContact N-OD1 3.01Å; S290-N293 WeakPolarHBondContact O-CB 3.26Å; S290-N293 PolarHBondContact O-N 3.3Å; S290-N293 PolarHBondContact O-ND2 3.06Å; P291-N293 VanDerWaalsContact C-N 3.27Å; P291-N293 PolarHBondContact O-N 3.07Å; N293-V312 HydrophobicContact CB-CB 4.42Å; N293-V312 HydrophobicContact CB-CG2 4.22Å; N293-V312 PolarHBondContact O-N 3.47Å
294	V	94.6	Very high	81.8	Confident	40 Å²	40	42 Å²	42	24%	0.242	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133	179.4	179.1	0	0	0	0	108.6	F309 H310 L311 V335	V294-F309 HydrophobicContact CG1-CD1 4.3Å; V294-H310 VanDerWaalsContact CA-O 3.29Å; V294-H310 WeakPolarHBondContact CA-O 3.15Å; V294-L311 HydrophobicContact CG2-CD1 3.78Å; V294-V335 HydrophobicContact CB-CG2 4.45Å; V294-V335 HydrophobicContact CG1-CG2 3.69Å; V294-V335 HydrophobicContact CG2-CG2 3.88Å
295	Y	94.8	Very high	84.1	Confident	15 Å²	15	39.4 Å²	39.4	6%	0.059	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	166.7	166.5	62	-87.8	0	0	0	110.4	V206 L256 V259 L289 H310 V312	V206-Y295 HydrophobicContact CG2-CE1 3.97Å; L256-Y295 HydrophobicContact CD2-CD2 4.42Å; L256-Y295 HydrophobicContact CD2-CE2 3.65Å; V259-Y295 HydrophobicContact CG1-CD1 4.49Å; V259-Y295 HydrophobicContact CG1-CD2 3.89Å; V259-Y295 HydrophobicContact CG1-CG 3.75Å; V259-Y295 HydrophobicContact CG2-CD2 4.38Å; L289-Y295 HydrophobicContact CD1-CD1 3.72Å; L289-Y295 HydrophobicContact CD1-CE1 3.43Å; L289-Y295 VanDerWaalsContact CD1-CE1 3.43Å; Y295-H310 HydrophobicContact CD1-CB 3.78Å; Y295-H310 HydrophobicContact CD2-CB 3.6Å; Y295-H310 AromaticContact CD2-CD2 3.53Å; Y295-H310 AromaticContact CD2-CG 3.6Å; Y295-H310 HydrophobicContact CE1-CB 3.44Å; Y295-H310 VanDerWaalsContact CE1-CB 3.44Å; Y295-H310 HydrophobicContact CE2-CB 3.25Å; Y295-H310 AromaticContact CE2-CD2 3.4Å; Y295-H310 WeakPolarHBondContact CE2-CD2 3.05Å; Y295-H310 AromaticContact CE2-CG 3.1Å; Y295-H310 AromaticContact CE2-ND1 3.58Å; Y295-H310 HydrophobicContact CG-CB 3.85Å; Y295-H310 AromaticContact CZ-CG 3.48Å; Y295-H310 VanDerWaalsContact CZ-CG 3.48Å; Y295-H310 AromaticContact CZ-ND1 3.83Å; Y295-H310 PolarHBondContact N-O 2.84Å; Y295-H310 VanDerWaalsContact N-O 3.13Å; Y295-H310 PolarHBondContact O-CD2 3.47Å; Y295-H310 PolarHBondContact O-N 2.98Å; Y295-V312 HydrophobicContact CD1-CG2 4.46Å; Y295-V312 HydrophobicContact CE1-CG2 4.15Å
296	I	95.2	Very high	86.2	Confident	49 Å²	49	35.6 Å²	35.6	25%	0.251	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.8	-169.1	-59.5	172.9	0	0	0	109.3	T307 I308 F309 L338 F342	I296-T307 HydrophobicContact CG2-CG2 3.22Å; I296-I308 WeakPolarHBondContact CA-O 3.3Å; I296-F309 HydrophobicContact CD1-CD1 3.97Å; I296-F309 HydrophobicContact CD1-CE1 3.62Å; I296-F309 HydrophobicContact CG1-CD1 3.74Å; I296-F309 HydrophobicContact CG1-CE1 3.91Å; I296-L338 HydrophobicContact CD1-CD1 4.17Å; I296-F342 HydrophobicContact CD1-CD2 4.48Å; I296-F342 HydrophobicContact CD1-CE2 4.09Å
297	T	94.6	Very high	88.4	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	150.9	164.2	59.3	0	0	0	0	110.3	L252 Q255 L256 H299 T307 I308 H310	L252-T297 HydrophobicContact CD1-CG2 4.15Å; Q255-T297 HydrophobicContact CB-CG2 4.01Å; L256-T297 HydrophobicContact CD2-CG2 4.16Å; T297-H299 WeakPolarHBondContact CB-NE2 3.5Å; T297-H299 PolarHBondContact OG1-NE2 3.02Å; T297-T307 CarbonylContact O-C 3.22Å; T297-T307 WeakPolarHBondContact O-CA 3.3Å; T297-I308 PolarHBondContact N-O 2.92Å; T297-I308 PolarHBondContact O-N 3.12Å; T297-H310 PolarHBondContact OG1-NE2 3.02Å
298	R	94.6	Very high	90.1	Very high	129 Å²	129	25.4 Å²	25.4	49%	0.487	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.4	-176	-63.7	177	-67.2	172.2	0.6	110	F249 Q255 H306 T307	F249-R298 HydrophobicContact CB-CB 4.48Å; F249-R298 HydrophobicContact CD1-CB 4.15Å; F249-R298 HydrophobicContact CD2-CB 3.8Å; F249-R298 HydrophobicContact CE1-CB 4.38Å; F249-R298 HydrophobicContact CE2-CB 4.04Å; F249-R298 HydrophobicContact CG-CB 3.86Å; F249-R298 HydrophobicContact CZ-CB 4.33Å; Q255-R298 PolarHBondContact NE2-O 2.75Å; Q255-R298 PolarHBondContact OE1-O 3.26Å; R298-H306 CarbonylContact C-O 3.55Å; R298-H306 WeakPolarHBondContact CA-O 3.31Å; R298-T307 HydrophobicContact CG-CG2 4.45Å
299	H	92.8	Very high	91.4	Very high	1 Å²	1	25 Å²	25	1%	0.005	14%	0.137	C	C	.	.			trans	-141.4	132	-172.8	-55.6	-87.4	0	0	0	110.4	C241 E246 T297 L302 H306 I308	C241-H299 VanDerWaalsContact SG-CE1 3.56Å; C241-H299 PolarHBondContact SG-ND1 3.14Å; C241-H299 VanDerWaalsContact SG-ND1 3.38Å; E246-H299 VanDerWaalsContact OE2-CA 3.27Å; E246-H299 WeakPolarHBondContact OE2-CA 3.29Å; T297-H299 WeakPolarHBondContact CB-NE2 3.5Å; T297-H299 PolarHBondContact OG1-NE2 3.02Å; H299-L302 HydrophobicContact CB-CB 4.2Å; H299-L302 HydrophobicContact CB-CD1 3.72Å; H299-L302 HydrophobicContact CB-CG 3.75Å; H299-H306 PolarHBondContact N-O 3.21Å; H299-H306 WeakPolarHBondContact O-CA 3.44Å; H299-I308 VanDerWaalsContact CD2-CG1 3.49Å; H299-I308 WeakPolarHBondContact CD2-CG1 3.31Å; H299-I308 WeakPolarHBondContact NE2-CG1 3.43Å
300	S	91.6	Very high	91.9	Very high	4 Å²	4	24.6 Å²	24.6	3%	0.028	13%	0.134	C	C	.	.	S	Bend	trans	-101.3	-18.3	162.7	74.9	0	0	0	0	112	E246 H248 L302	E246-S300 PolarHBondContact OE1-N 3.19Å; E246-S300 PolarHBondContact OE1-OG 3.44Å; E246-S300 PolarHBondContact OE2-N 3.39Å; H248-S300 VanDerWaalsContact CD2-CB 3.41Å; H248-S300 WeakPolarHBondContact CD2-CB 3.27Å; H248-S300 PolarHBondContact CD2-OG 3.32Å; H248-S300 VanDerWaalsContact CD2-OG 3.28Å; S300-L302 VanDerWaalsContact C-N 3.28Å; S300-L302 PolarHBondContact O-N 3.35Å
301	N	90.1	Very high	92.1	Very high	7 Å²	7	22.7 Å²	22.7	4%	0.037	12%	0.121	C	C	.	.	S	Bend	trans	-85.3	1.8	-175.7	68.7	-12	0	0	0	113.8	C241 S244 E246	C241-N301 PolarHBondContact O-ND2 3.28Å; S244-N301 PolarHBondContact O-ND2 3.37Å; S244-N301 VanDerWaalsContact O-ND2 3.07Å; E246-N301 PolarHBondContact OE2-OD1 2.93Å
302	L	88.4	Confident	92.2	Very high	3 Å²	3	20.2 Å²	20.2	2%	0.016	11%	0.105	C	C	.	.	S	Bend	trans	-101.9	125.9	170.2	-59	179.8	0	0	0	109	L237 A240 H299 S300 S304 Y305 I308	L237-L302 HydrophobicContact CD1-CD1 3.98Å; A240-L302 HydrophobicContact CB-CD2 3.71Å; H299-L302 HydrophobicContact CB-CB 4.2Å; H299-L302 HydrophobicContact CB-CD1 3.72Å; H299-L302 HydrophobicContact CB-CG 3.75Å; S300-L302 VanDerWaalsContact C-N 3.28Å; S300-L302 PolarHBondContact O-N 3.35Å; L302-S304 VanDerWaalsContact C-N 3.31Å; L302-S304 PolarHBondContact O-N 3.26Å; L302-Y305 WeakPolarHBondContact CB-O 3.32Å; L302-I308 HydrophobicContact CD1-CD1 3.91Å; L302-I308 HydrophobicContact CD1-CG1 4.15Å
303	C	77.3	Confident	92.1	Very high	7 Å²	7	20.3 Å²	20.3	5%	0.047	10%	0.104	C	C	.	.	S	Bend	trans	-73.3	-12.9	-170	-68.5	0	0	0	0	115.4	S180 A186 T190	S180-C303 PolarHBondContact O-SG 3.33Å; A186-C303 HydrophobicContact CB-CB 4.5Å; T190-C303 PolarHBondContact OG1-O 3.03Å
304	S	82.1	Confident	91.7	Very high	59 Å²	59	18.5 Å²	18.5	41%	0.413	10%	0.1	S	C	.	.	S	Bend	trans	-129.3	-10.9	-178.7	-64	0	0	0	0	114.1	E175 C200 L302	E175-S304 WeakPolarHBondContact OE1-CA 3.14Å; E175-S304 VanDerWaalsContact OE1-CB 3.22Å; E175-S304 WeakPolarHBondContact OE1-CB 3.4Å; E175-S304 PolarHBondContact OE1-N 2.83Å; C200-S304 WeakPolarHBondContact CB-O 3.47Å; L302-S304 VanDerWaalsContact C-N 3.31Å; L302-S304 PolarHBondContact O-N 3.26Å
305	Y	90.8	Very high	91.2	Very high	17 Å²	17	21.8 Å²	21.8	7%	0.067	12%	0.116	C	C	.	.			trans	-132.7	122.6	-174.6	-60.7	-75.5	0	0	0	111.8	P171 E175 C200 G201 L202 L302 A348	P171-Y305 HydrophobicContact CB-CE2 3.47Å; P171-Y305 VanDerWaalsContact CB-CE2 3.47Å; P171-Y305 WeakPolarHBondContact CB-OH 3.28Å; P171-Y305 HydrophobicContact CG-CE2 4.37Å; P171-Y305 WeakPolarHBondContact CG-OH 3.34Å; E175-Y305 WeakPolarHBondContact OE1-CD2 3.4Å; C200-Y305 HydrophobicContact CB-CD1 4.16Å; G201-Y305 VanDerWaalsContact C-CD1 3.5Å; G201-Y305 WeakPolarHBondContact O-CD1 3.4Å; G201-Y305 WeakPolarHBondContact O-CE1 3.4Å; L202-Y305 HydrophobicContact CB-CD1 3.64Å; L202-Y305 HydrophobicContact CB-CD2 4.37Å; L202-Y305 HydrophobicContact CB-CE1 3.97Å; L202-Y305 HydrophobicContact CB-CG 3.85Å; L202-Y305 HydrophobicContact CD2-CD2 4.47Å; L302-Y305 WeakPolarHBondContact CB-O 3.32Å; Y305-A348 HydrophobicContact CE1-CB 3.76Å
306	H	92.7	Very high	90.8	Very high	8 Å²	8	23.6 Å²	23.6	4%	0.037	13%	0.126	C	C	.	.	S	Bend	trans	-88.2	-24.3	179.7	-58.5	73.1	0	0	0	111.6	T190 F193 L199 C200 R298 H299	T190-H306 PolarHBondContact O-NE2 3.48Å; T190-H306 VanDerWaalsContact O-NE2 3.08Å; F193-H306 WeakPolarHBondContact CB-NE2 3.45Å; L199-H306 HydrophobicContact CB-CB 4.4Å; L199-H306 HydrophobicContact CD2-CB 3.9Å; C200-H306 PolarHBondContact N-ND1 2.87Å; C200-H306 PolarHBondContact O-N 3.32Å; R298-H306 CarbonylContact C-O 3.55Å; R298-H306 WeakPolarHBondContact CA-O 3.31Å; H299-H306 PolarHBondContact N-O 3.21Å; H299-H306 WeakPolarHBondContact O-CA 3.44Å
307	T	94.1	Very high	90.5	Very high	13 Å²	13	21.3 Å²	21.3	8%	0.08	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	129.9	-170.8	-24.3	0	0	0	0	110.1	C200 G201 L202 I296 T297 R298	C200-T307 PolarHBondContact O-N 2.96Å; G201-T307 CarbonylContact C-O 3.59Å; G201-T307 WeakPolarHBondContact CA-O 3.04Å; L202-T307 PolarHBondContact N-O 2.65Å; I296-T307 HydrophobicContact CG2-CG2 3.22Å; T297-T307 CarbonylContact O-C 3.22Å; T297-T307 WeakPolarHBondContact O-CA 3.3Å; R298-T307 HydrophobicContact CG-CG2 4.45Å
308	I	95	Very high	90	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.9	171.7	-51.8	-60	0	0	0	108.2	L202 Q204 L237 I296 T297 H299 L302 H310	L202-I308 HydrophobicContact CB-CD1 3.77Å; L202-I308 HydrophobicContact CD2-CD1 4.04Å; L202-I308 HydrophobicContact CG-CD1 4.33Å; L202-I308 CarbonylContact O-C 3.59Å; L202-I308 WeakPolarHBondContact O-CA 3.1Å; Q204-I308 HydrophobicContact CB-CG2 4.12Å; Q204-I308 HydrophobicContact CG-CG2 3.72Å; L237-I308 HydrophobicContact CD1-CD1 4.23Å; L237-I308 HydrophobicContact CD1-CG1 3.92Å; L237-I308 HydrophobicContact CD2-CG1 4.39Å; L237-I308 HydrophobicContact CD2-CG2 4.07Å; I296-I308 WeakPolarHBondContact CA-O 3.3Å; T297-I308 PolarHBondContact N-O 2.92Å; T297-I308 PolarHBondContact O-N 3.12Å; H299-I308 VanDerWaalsContact CD2-CG1 3.49Å; H299-I308 WeakPolarHBondContact CD2-CG1 3.31Å; H299-I308 WeakPolarHBondContact NE2-CG1 3.43Å; L302-I308 HydrophobicContact CD1-CD1 3.91Å; L302-I308 HydrophobicContact CD1-CG1 4.15Å; I308-H310 WeakPolarHBondContact CG2-NE2 3.46Å; I308-H310 PolarHBondContact O-CD2 3.34Å; I308-H310 PolarHBondContact O-NE2 3.12Å
309	F	96.5	Very high	89.5	Confident	1 Å²	1	25.1 Å²	25.1	0%	0.004	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125.8	169.1	-64.9	-89.7	0	0	0	108.1	L202 L203 Q204 V294 I296 V335 L338 C339 V344 L347	L202-F309 PolarHBondContact O-N 3.33Å; L203-F309 CarbonylContact C-O 3.59Å; L203-F309 WeakPolarHBondContact CA-O 3.42Å; L203-F309 HydrophobicContact CD1-CB 3.67Å; Q204-F309 PolarHBondContact N-O 3.01Å; V294-F309 HydrophobicContact CG1-CD1 4.3Å; I296-F309 HydrophobicContact CD1-CD1 3.97Å; I296-F309 HydrophobicContact CD1-CE1 3.62Å; I296-F309 HydrophobicContact CG1-CD1 3.74Å; I296-F309 HydrophobicContact CG1-CE1 3.91Å; F309-V335 HydrophobicContact CB-CG1 4.01Å; F309-V335 HydrophobicContact CB-CG2 4.05Å; F309-V335 HydrophobicContact CD1-CB 4.34Å; F309-V335 HydrophobicContact CD1-CG1 3.82Å; F309-V335 HydrophobicContact CD1-CG2 4.09Å; F309-V335 HydrophobicContact CD2-CG1 4Å; F309-V335 HydrophobicContact CE1-CG1 4.27Å; F309-V335 HydrophobicContact CE2-CG1 4.44Å; F309-V335 HydrophobicContact CG-CG1 3.67Å; F309-V335 HydrophobicContact CG-CG2 4.27Å; F309-L338 HydrophobicContact CE1-CB 3.99Å; F309-C339 VanDerWaalsContact CZ-SG 3.56Å; F309-V344 HydrophobicContact CE2-CG1 4.5Å; F309-V344 HydrophobicContact CE2-CG2 4.5Å; F309-V344 HydrophobicContact CZ-CG2 4.32Å; F309-L347 HydrophobicContact CD2-CD1 4Å; F309-L347 HydrophobicContact CE2-CD1 4.21Å
310	H	94.6	Very high	89.2	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	106.3	-179.2	-57.8	-98.4	0	0	0	108.2	V206 H213 V294 Y295 T297 I308	V206-H310 HydrophobicContact CG1-CB 4.24Å; V206-H310 HydrophobicContact CG2-CB 4.09Å; H213-H310 AromaticContact CD2-CE1 3.71Å; H213-H310 AromaticContact CD2-ND1 3.71Å; H213-H310 AromaticContact NE2-CE1 3.28Å; H213-H310 PolarHBondContact NE2-CE1 3.43Å; H213-H310 VanDerWaalsContact NE2-CE1 3.28Å; H213-H310 AromaticContact NE2-ND1 2.99Å; H213-H310 PolarHBondContact NE2-ND1 3.46Å; V294-H310 VanDerWaalsContact CA-O 3.29Å; V294-H310 WeakPolarHBondContact CA-O 3.15Å; Y295-H310 HydrophobicContact CD1-CB 3.78Å; Y295-H310 HydrophobicContact CD2-CB 3.6Å; Y295-H310 AromaticContact CD2-CD2 3.53Å; Y295-H310 AromaticContact CD2-CG 3.6Å; Y295-H310 HydrophobicContact CE1-CB 3.44Å; Y295-H310 VanDerWaalsContact CE1-CB 3.44Å; Y295-H310 HydrophobicContact CE2-CB 3.25Å; Y295-H310 AromaticContact CE2-CD2 3.4Å; Y295-H310 WeakPolarHBondContact CE2-CD2 3.05Å; Y295-H310 AromaticContact CE2-CG 3.1Å; Y295-H310 AromaticContact CE2-ND1 3.58Å; Y295-H310 HydrophobicContact CG-CB 3.85Å; Y295-H310 AromaticContact CZ-CG 3.48Å; Y295-H310 VanDerWaalsContact CZ-CG 3.48Å; Y295-H310 AromaticContact CZ-ND1 3.83Å; Y295-H310 PolarHBondContact N-O 2.84Å; Y295-H310 VanDerWaalsContact N-O 3.13Å; Y295-H310 PolarHBondContact O-CD2 3.47Å; Y295-H310 PolarHBondContact O-N 2.98Å; T297-H310 PolarHBondContact OG1-NE2 3.02Å; I308-H310 WeakPolarHBondContact CG2-NE2 3.46Å; I308-H310 PolarHBondContact O-CD2 3.34Å; I308-H310 PolarHBondContact O-NE2 3.12Å
311	L	95.6	Very high	89	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	115.6	178.6	174.7	63.9	0	0	0	109.5	L203 Q204 V206 V294 C313 C328 L353	L203-L311 HydrophobicContact CD1-CB 3.73Å; L203-L311 HydrophobicContact CD2-CD2 4.26Å; L203-L311 HydrophobicContact CG-CB 4.39Å; Q204-L311 PolarHBondContact O-N 3.04Å; V206-L311 PolarHBondContact N-O 3.07Å; V294-L311 HydrophobicContact CG2-CD1 3.78Å; L311-C313 PolarHBondContact O-N 3.33Å; L311-C328 HydrophobicContact CD2-CB 4.33Å; L311-L353 HydrophobicContact CD2-CD2 4.41Å
312	V	93.6	Very high	89.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	119.5	176.7	-178.1	0	0	0	0	109.3	V206 D208 L289 P291 G292 N293 Y295 C328	V206-V312 HydrophobicContact CG2-CG2 3.97Å; V206-V312 WeakPolarHBondContact O-CA 3.47Å; D208-V312 HydrophobicContact CB-CG1 4.34Å; L289-V312 HydrophobicContact CB-CB 4.35Å; L289-V312 HydrophobicContact CB-CG1 3.99Å; L289-V312 HydrophobicContact CB-CG2 3.65Å; L289-V312 HydrophobicContact CD1-CG2 3.5Å; L289-V312 VanDerWaalsContact CD1-CG2 3.5Å; L289-V312 HydrophobicContact CG-CG2 4.13Å; P291-V312 CarbonylContact C-O 3.51Å; P291-V312 WeakPolarHBondContact CA-O 3.14Å; G292-V312 PolarHBondContact N-O 3.02Å; N293-V312 HydrophobicContact CB-CB 4.42Å; N293-V312 HydrophobicContact CB-CG2 4.22Å; N293-V312 PolarHBondContact O-N 3.47Å; Y295-V312 HydrophobicContact CD1-CG2 4.46Å; Y295-V312 HydrophobicContact CE1-CG2 4.15Å; V312-C328 PolarHBondContact O-SG 2.94Å
313	C	91.7	Very high	89.5	Confident	12 Å²	12	40.2 Å²	40.2	8%	0.081	21%	0.211	C	C	.	.			trans	-119.3	142.3	174.8	-69.5	0	0	0	0	109.8	V205 V206 L311 V317	V205-C313 HydrophobicContact CG1-CB 3.59Å; V205-C313 VanDerWaalsContact CG1-SG 3.58Å; V206-C313 PolarHBondContact O-N 3.46Å; L311-C313 PolarHBondContact O-N 3.33Å; C313-V317 HydrophobicContact CB-CB 4.12Å; C313-V317 HydrophobicContact CB-CG1 4.43Å; C313-V317 HydrophobicContact CB-CG2 3.82Å
314	G	85.1	Confident	90.3	Very high	23 Å²	23	43 Å²	43	24%	0.237	23%	0.23	C	C	.	.			trans	-86	175.4	167	0	0	0	0	0	111.4	D316 V317	G314-D316 WeakPolarHBondContact CA-OD1 3.4Å; G314-D316 PolarHBondContact O-N 2.86Å; G314-V317 PolarHBondContact O-N 3.02Å
315	D	83.1	Confident	90.9	Very high	109 Å²	109	50 Å²	50	58%	0.583	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.7	174.9	-68.3	-14.7	0	0	0	112.8	V317 S318 R319	D315-V317 PolarHBondContact O-N 3.46Å; D315-S318 PolarHBondContact O-N 3.29Å; D315-S318 PolarHBondContact O-OG 2.82Å; D315-R319 WeakPolarHBondContact O-CB 3.49Å; D315-R319 WeakPolarHBondContact O-CG 3.24Å; D315-R319 PolarHBondContact O-N 3.25Å
316	D	86.9	Confident	91.2	Very high	53 Å²	53	50.3 Å²	50.3	28%	0.283	25%	0.249	S	C	.	.	H	α-helix	trans	-59.2	-35.2	173.7	57.2	-21.1	0	0	0	112.1	G314 S318 R319 E320 H326	G314-D316 WeakPolarHBondContact CA-OD1 3.4Å; G314-D316 PolarHBondContact O-N 2.86Å; D316-S318 VanDerWaalsContact C-N 3.3Å; D316-S318 PolarHBondContact O-N 2.65Å; D316-R319 PolarHBondContact O-N 2.97Å; D316-E320 WeakPolarHBondContact O-CB 3.32Å; D316-E320 PolarHBondContact O-N 3.32Å; D316-H326 IonicContact OD2-CE1 2.65Å; D316-H326 PolarHBondContact OD2-CE1 2.58Å; D316-H326 IonicContact OD2-NE2 3.65Å; D316-H326 PolarHBondContact OD2-NE2 2.88Å
317	V	88.8	Confident	91.4	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-34.1	178.8	179.2	0	0	0	0	112.1	C313 G314 D315 H326 C328 L353 R369	C313-V317 HydrophobicContact CB-CB 4.12Å; C313-V317 HydrophobicContact CB-CG1 4.43Å; C313-V317 HydrophobicContact CB-CG2 3.82Å; G314-V317 PolarHBondContact O-N 3.02Å; D315-V317 PolarHBondContact O-N 3.46Å; V317-H326 VanDerWaalsContact CG2-CE1 3.48Å; V317-H326 WeakPolarHBondContact CG2-CE1 3.49Å; V317-C328 HydrophobicContact CG2-CB 4.08Å; V317-C328 WeakPolarHBondContact CG2-SG 3.44Å; V317-L353 HydrophobicContact CG1-CB 4.01Å; V317-R369 VanDerWaalsContact CG1-NH1 3.34Å; V317-R369 PolarHBondContact O-NH1 3.39Å; V317-R369 PolarHBondContact O-NH2 2.91Å
318	S	85.2	Confident	91.4	Very high	32 Å²	32	52.1 Å²	52.1	22%	0.224	26%	0.262	C	S	.	.	H	α-helix	trans	-88.6	-31.3	178.2	56.3	0	0	0	0	112.7	D315 D316 H361	D315-S318 PolarHBondContact O-N 3.29Å; D315-S318 PolarHBondContact O-OG 2.82Å; D316-S318 VanDerWaalsContact C-N 3.3Å; D316-S318 PolarHBondContact O-N 2.65Å; S318-H361 PolarHBondContact O-NE2 3.39Å
319	R	83.1	Confident	91.6	Very high	176 Å²	176	52.1 Å²	52.1	66%	0.664	26%	0.262	S	S	*	.	H	α-helix	trans	-94.1	-22.4	-171.7	-66.8	-178	174.3	164.4	4	115.3	D315 D316	D315-R319 WeakPolarHBondContact O-CB 3.49Å; D315-R319 WeakPolarHBondContact O-CG 3.24Å; D315-R319 PolarHBondContact O-N 3.25Å; D316-R319 PolarHBondContact O-N 2.97Å
320	E	86.3	Confident	91.6	Very high	126 Å²	126	56.1 Å²	56.1	59%	0.589	28%	0.28	S	S	*	.	S	Bend	trans	-122.2	162	-171.5	-58.8	-174.6	-176.9	0	0	113.1	D316 I322 W365 R369	D316-E320 WeakPolarHBondContact O-CB 3.32Å; D316-E320 PolarHBondContact O-N 3.32Å; E320-I322 PolarHBondContact O-N 2.95Å; E320-W365 PolarHBondContact O-NE1 2.94Å; E320-R369 PolarHBondContact O-NH2 3.12Å
321	D	88.1	Confident	91.7	Very high	92 Å²	92	56.1 Å²	56.1	49%	0.492	28%	0.28	S	S	.	.			trans	-77	113.8	166.9	-87.1	-45.6	0	0	0	108.8	R368	D321-R368 IonicContact OD1-CZ 2.63Å; D321-R368 IonicContact OD1-NE 2.69Å; D321-R368 PolarHBondContact OD1-NE 2.85Å; D321-R368 IonicContact OD1-NH2 3.18Å; D321-R368 PolarHBondContact OD1-NH2 3.12Å; D321-R368 IonicContact OD2-CZ 2.85Å; D321-R368 IonicContact OD2-NE 2.66Å; D321-R368 PolarHBondContact OD2-NE 2.98Å; D321-R368 IonicContact OD2-NH2 3.44Å; D321-R368 PolarHBondContact OD2-NH2 3.4Å
322	I	94.4	Very high	91.8	Very high	21 Å²	21	56.1 Å²	56.1	11%	0.108	28%	0.28	C	S	.	.			trans	-92.3	159.2	177	71.2	179.5	0	0	0	111.1	E320 H326 I329 L353 R369 L372	E320-I322 PolarHBondContact O-N 2.95Å; I322-H326 HydrophobicContact CB-CB 3.98Å; I322-H326 VanDerWaalsContact CG2-CD2 3.42Å; I322-H326 WeakPolarHBondContact CG2-CD2 3.33Å; I322-I329 HydrophobicContact CD1-CD1 4.09Å; I322-I329 HydrophobicContact CD1-CG1 4.01Å; I322-L353 HydrophobicContact CD1-CD1 4.39Å; I322-R369 VanDerWaalsContact CD1-CZ 3.46Å; I322-L372 HydrophobicContact CD1-CD2 4.29Å; I322-L372 HydrophobicContact CG1-CD2 3.67Å; I322-L372 WeakPolarHBondContact O-CD2 3.44Å
323	N	95.1	Very high	91.9	Very high	94 Å²	94	59.9 Å²	59.9	50%	0.503	30%	0.295	S	S	.	.			trans	-122.5	-179.5	174.9	67.5	55.5	0	0	0	111.9	R325 H326	N323-R325 PolarHBondContact O-N 3.45Å; N323-R325 VanDerWaalsContact O-N 3.08Å; N323-R325 WeakPolarHBondContact OD1-CA 3.13Å; N323-R325 VanDerWaalsContact OD1-CB 3.29Å; N323-R325 WeakPolarHBondContact OD1-CB 3.07Å; N323-R325 PolarHBondContact OD1-N 3.49Å; N323-H326 WeakPolarHBondContact O-CB 3.44Å; N323-H326 PolarHBondContact O-N 2.87Å
324	S	94.6	Very high	92.1	Very high	64 Å²	64	62.6 Å²	62.6	45%	0.448	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-10.6	-176	59.8	0	0	0	0	115.4	H330	S324-H330 PolarHBondContact O-CE1 3.17Å; S324-H330 VanDerWaalsContact O-CE1 3.26Å
325	R	94.7	Very high	92.7	Very high	206 Å²	206	61.5 Å²	61.5	78%	0.777	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-1.5	174.9	-55	-178.5	178.7	-178.2	-0.2	113	N323 H330	N323-R325 PolarHBondContact O-N 3.45Å; N323-R325 VanDerWaalsContact O-N 3.08Å; N323-R325 WeakPolarHBondContact OD1-CA 3.13Å; N323-R325 VanDerWaalsContact OD1-CB 3.29Å; N323-R325 WeakPolarHBondContact OD1-CB 3.07Å; N323-R325 PolarHBondContact OD1-N 3.49Å; R325-H330 PolarHBondContact O-NE2 3.46Å
326	H	96.2	Very high	93.2	Very high	24 Å²	24	56.5 Å²	56.5	11%	0.111	27%	0.271	C	S	.	.	S	Bend	trans	-62.9	138.3	179.8	-165.6	-87.5	0	0	0	111	D316 V317 I322 N323 C328 I329 H330	D316-H326 IonicContact OD2-CE1 2.65Å; D316-H326 PolarHBondContact OD2-CE1 2.58Å; D316-H326 IonicContact OD2-NE2 3.65Å; D316-H326 PolarHBondContact OD2-NE2 2.88Å; V317-H326 VanDerWaalsContact CG2-CE1 3.48Å; V317-H326 WeakPolarHBondContact CG2-CE1 3.49Å; I322-H326 HydrophobicContact CB-CB 3.98Å; I322-H326 VanDerWaalsContact CG2-CD2 3.42Å; I322-H326 WeakPolarHBondContact CG2-CD2 3.33Å; N323-H326 WeakPolarHBondContact O-CB 3.44Å; N323-H326 PolarHBondContact O-N 2.87Å; H326-C328 VanDerWaalsContact C-N 3.26Å; H326-C328 VanDerWaalsContact CE1-SG 3.6Å; H326-C328 PolarHBondContact ND1-N 2.68Å; H326-C328 PolarHBondContact O-N 2.8Å; H326-I329 HydrophobicContact CB-CB 4.39Å; H326-I329 HydrophobicContact CB-CG1 4.07Å; H326-I329 WeakPolarHBondContact O-CB 3.49Å; H326-I329 PolarHBondContact O-N 3.08Å; H326-H330 PolarHBondContact O-N 3.49Å; H326-H330 VanDerWaalsContact O-N 3.11Å
327	P	95.9	Very high	93.5	Very high	59 Å²	59	59.7 Å²	59.7	38%	0.383	28%	0.278	S	S	.	.	H	α-helix	trans	-51.8	-41.5	179.8	-29.2	35.5	0	0	0	113.6	P291 G292 I329 H330 G331	P291-P327 HydrophobicContact CB-CB 4.41Å; P291-P327 WeakPolarHBondContact O-CB 3.22Å; G292-P327 VanDerWaalsContact CA-O 3.25Å; G292-P327 WeakPolarHBondContact CA-O 3.45Å; P327-I329 VanDerWaalsContact C-N 3.33Å; P327-I329 PolarHBondContact O-N 3.3Å; P327-H330 CarbonylContact O-C 3.56Å; P327-H330 WeakPolarHBondContact O-CA 3.46Å; P327-H330 WeakPolarHBondContact O-CB 3.45Å; P327-H330 PolarHBondContact O-N 3.47Å; P327-H330 VanDerWaalsContact O-N 3.14Å; P327-G331 PolarHBondContact O-N 3.03Å
328	C	96	Very high	93.6	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.2	-32	178.5	-53.9	0	0	0	0	113.6	L311 V312 V317 H326 G331 L332	L311-C328 HydrophobicContact CD2-CB 4.33Å; V312-C328 PolarHBondContact O-SG 2.94Å; V317-C328 HydrophobicContact CG2-CB 4.08Å; V317-C328 WeakPolarHBondContact CG2-SG 3.44Å; H326-C328 VanDerWaalsContact C-N 3.26Å; H326-C328 VanDerWaalsContact CE1-SG 3.6Å; H326-C328 PolarHBondContact ND1-N 2.68Å; H326-C328 PolarHBondContact O-N 2.8Å; C328-G331 PolarHBondContact O-N 3.47Å; C328-L332 PolarHBondContact O-N 3.5Å
329	I	97.6	Very high	94	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69.7	-36.6	173.4	-64.2	-65.7	0	0	0	110.4	I322 H326 P327 L332 R333 L353 L372 V373 C376 Y380	I322-I329 HydrophobicContact CD1-CD1 4.09Å; I322-I329 HydrophobicContact CD1-CG1 4.01Å; H326-I329 HydrophobicContact CB-CB 4.39Å; H326-I329 HydrophobicContact CB-CG1 4.07Å; H326-I329 WeakPolarHBondContact O-CB 3.49Å; H326-I329 PolarHBondContact O-N 3.08Å; P327-I329 VanDerWaalsContact C-N 3.33Å; P327-I329 PolarHBondContact O-N 3.3Å; I329-L332 PolarHBondContact O-N 3.12Å; I329-R333 PolarHBondContact O-N 2.86Å; I329-L353 HydrophobicContact CD1-CD1 3.86Å; I329-L372 HydrophobicContact CD1-CD2 4.08Å; I329-L372 HydrophobicContact CD1-CG 4.31Å; I329-L372 HydrophobicContact CG1-CD2 4.3Å; I329-V373 HydrophobicContact CD1-CG2 4.33Å; I329-C376 HydrophobicContact CG2-CB 4.19Å; I329-Y380 WeakPolarHBondContact CG2-OH 3.39Å; I329-Y380 PolarHBondContact O-OH 3.41Å
330	H	96.1	Very high	94.2	Very high	85 Å²	85	53.5 Å²	53.5	39%	0.394	26%	0.255	S	S	.	.	H	α-helix	trans	-67.2	-36.7	170.2	-64.9	-23.9	0	0	0	112.9	S324 R325 H326 P327 R333 N334	S324-H330 PolarHBondContact O-CE1 3.17Å; S324-H330 VanDerWaalsContact O-CE1 3.26Å; R325-H330 PolarHBondContact O-NE2 3.46Å; H326-H330 PolarHBondContact O-N 3.49Å; H326-H330 VanDerWaalsContact O-N 3.11Å; P327-H330 CarbonylContact O-C 3.56Å; P327-H330 WeakPolarHBondContact O-CA 3.46Å; P327-H330 WeakPolarHBondContact O-CB 3.45Å; P327-H330 PolarHBondContact O-N 3.47Å; P327-H330 VanDerWaalsContact O-N 3.14Å; H330-R333 WeakPolarHBondContact O-CB 3.21Å; H330-R333 PolarHBondContact O-N 3.18Å; H330-N334 PolarHBondContact O-N 2.85Å
331	G	97.1	Very high	94.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-45.2	171	0	0	0	0	0	111.7	G292 P327 C328 R333 N334 V335	G292-G331 WeakPolarHBondContact O-CA 3.4Å; P327-G331 PolarHBondContact O-N 3.03Å; C328-G331 PolarHBondContact O-N 3.47Å; G331-R333 VanDerWaalsContact C-N 3.33Å; G331-R333 PolarHBondContact O-N 3.35Å; G331-N334 WeakPolarHBondContact O-CA 3.19Å; G331-N334 WeakPolarHBondContact O-CB 3.37Å; G331-N334 PolarHBondContact O-N 3.04Å; G331-V335 PolarHBondContact O-N 3.47Å
332	L	97.7	Very high	94.2	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-40.6	174	179.5	59.9	0	0	0	112.5	L203 C328 I329 N334 V335 V336 I349 V373 V377	L203-L332 HydrophobicContact CD2-CD1 3.63Å; C328-L332 PolarHBondContact O-N 3.5Å; I329-L332 PolarHBondContact O-N 3.12Å; L332-N334 VanDerWaalsContact C-N 3.29Å; L332-N334 PolarHBondContact O-N 2.91Å; L332-V335 WeakPolarHBondContact O-CB 3.42Å; L332-V335 PolarHBondContact O-N 2.96Å; L332-V336 WeakPolarHBondContact O-CG2 3.44Å; L332-V336 PolarHBondContact O-N 2.96Å; L332-V336 VanDerWaalsContact O-N 3.07Å; L332-I349 HydrophobicContact CD1-CD1 4.22Å; L332-I349 HydrophobicContact CD1-CG2 4.21Å; L332-V373 HydrophobicContact CD2-CG1 4.16Å; L332-V377 HydrophobicContact CD1-CG2 4.47Å; L332-V377 HydrophobicContact CD2-CG2 3.7Å; L332-V377 HydrophobicContact CG-CG2 4.19Å
333	R	96.3	Very high	93.9	Very high	80 Å²	80	55 Å²	55	30%	0.302	26%	0.262	S	S	.	.	H	α-helix	trans	-57.2	-44.1	171.9	-175	178.4	180	-145.8	5.7	111.6	I329 H330 G331 V336 R337 Y380 E383	I329-R333 PolarHBondContact O-N 2.86Å; H330-R333 WeakPolarHBondContact O-CB 3.21Å; H330-R333 PolarHBondContact O-N 3.18Å; G331-R333 VanDerWaalsContact C-N 3.33Å; G331-R333 PolarHBondContact O-N 3.35Å; R333-V336 PolarHBondContact O-N 3.2Å; R333-R337 WeakPolarHBondContact O-CG 3.38Å; R333-R337 PolarHBondContact O-N 3.33Å; R333-R337 VanDerWaalsContact O-N 3.09Å; R333-Y380 HydrophobicContact CB-CD1 4.04Å; R333-Y380 HydrophobicContact CB-CD2 3.78Å; R333-Y380 HydrophobicContact CB-CE1 3.87Å; R333-Y380 HydrophobicContact CB-CE2 3.57Å; R333-Y380 HydrophobicContact CB-CG 4.02Å; R333-Y380 HydrophobicContact CG-CD1 3.58Å; R333-Y380 HydrophobicContact CG-CD2 4.11Å; R333-Y380 HydrophobicContact CG-CE1 3.74Å; R333-Y380 HydrophobicContact CG-CE2 4.22Å; R333-Y380 HydrophobicContact CG-CG 3.79Å; R333-E383 IonicContact CZ-OE1 3.21Å; R333-E383 IonicContact CZ-OE2 3.56Å; R333-E383 VanDerWaalsContact CZ-OE2 3.24Å; R333-E383 IonicContact NE-OE1 3.24Å; R333-E383 IonicContact NE-OE2 3.54Å; R333-E383 PolarHBondContact NE-OE2 2.73Å; R333-E383 IonicContact NH2-OE1 2.92Å; R333-E383 PolarHBondContact NH2-OE1 2.9Å; R333-E383 IonicContact NH2-OE2 3.49Å; R333-E383 PolarHBondContact NH2-OE2 3.41Å
334	N	95.5	Very high	93.8	Very high	69 Å²	69	50.6 Å²	50.6	37%	0.369	24%	0.239	S	C	.	.	H	α-helix	trans	-64.2	-40.8	178.1	-67.1	-20.4	0	0	0	111.4	H330 G331 L332 V336 R337 L338	H330-N334 PolarHBondContact O-N 2.85Å; G331-N334 WeakPolarHBondContact O-CA 3.19Å; G331-N334 WeakPolarHBondContact O-CB 3.37Å; G331-N334 PolarHBondContact O-N 3.04Å; L332-N334 VanDerWaalsContact C-N 3.29Å; L332-N334 PolarHBondContact O-N 2.91Å; N334-V336 PolarHBondContact O-N 2.64Å; N334-R337 PolarHBondContact O-N 2.99Å; N334-L338 WeakPolarHBondContact O-CB 3.36Å; N334-L338 VanDerWaalsContact O-CG 3.23Å; N334-L338 WeakPolarHBondContact O-CG 3.49Å; N334-L338 PolarHBondContact O-N 2.96Å
335	V	97.2	Very high	93.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.8	-50.1	174.3	172.6	0	0	0	0	111.4	L203 V294 F309 G331 L332 R337 L338 C339 L347	L203-V335 HydrophobicContact CD1-CG1 4.31Å; L203-V335 HydrophobicContact CD1-CG2 3.8Å; V294-V335 HydrophobicContact CB-CG2 4.45Å; V294-V335 HydrophobicContact CG1-CG2 3.69Å; V294-V335 HydrophobicContact CG2-CG2 3.88Å; F309-V335 HydrophobicContact CB-CG1 4.01Å; F309-V335 HydrophobicContact CB-CG2 4.05Å; F309-V335 HydrophobicContact CD1-CB 4.34Å; F309-V335 HydrophobicContact CD1-CG1 3.82Å; F309-V335 HydrophobicContact CD1-CG2 4.09Å; F309-V335 HydrophobicContact CD2-CG1 4Å; F309-V335 HydrophobicContact CE1-CG1 4.27Å; F309-V335 HydrophobicContact CE2-CG1 4.44Å; F309-V335 HydrophobicContact CG-CG1 3.67Å; F309-V335 HydrophobicContact CG-CG2 4.27Å; G331-V335 PolarHBondContact O-N 3.47Å; L332-V335 WeakPolarHBondContact O-CB 3.42Å; L332-V335 PolarHBondContact O-N 2.96Å; V335-R337 VanDerWaalsContact C-N 3.27Å; V335-R337 PolarHBondContact O-N 3.5Å; V335-L338 PolarHBondContact O-N 3.02Å; V335-C339 PolarHBondContact O-N 2.91Å; V335-C339 PolarHBondContact O-SG 2.92Å; V335-L347 HydrophobicContact CG1-CD1 4.07Å; V335-L347 HydrophobicContact CG1-CD2 3.84Å
336	V	94.7	Very high	93.5	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.024	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-37.6	-179.9	175.4	0	0	0	0	111.7	L332 R333 N334 C339 H340 L347 M381	L332-V336 WeakPolarHBondContact O-CG2 3.44Å; L332-V336 PolarHBondContact O-N 2.96Å; L332-V336 VanDerWaalsContact O-N 3.07Å; R333-V336 PolarHBondContact O-N 3.2Å; N334-V336 PolarHBondContact O-N 2.64Å; V336-C339 PolarHBondContact O-N 3.31Å; V336-H340 PolarHBondContact O-N 3.26Å; V336-H340 PolarHBondContact O-ND1 3.38Å; V336-H340 VanDerWaalsContact O-ND1 3.12Å; V336-L347 HydrophobicContact CG2-CD2 4.23Å; V336-M381 HydrophobicContact CG1-CG 4.36Å
337	R	92.2	Very high	93.5	Very high	119 Å²	119	39 Å²	39	45%	0.449	19%	0.191	S	C	.	.	H	α-helix	trans	-66.2	-47	174.7	-71.3	175.9	70.5	-179	4.9	112	R333 N334 V335 C339 H340 E341	R333-R337 WeakPolarHBondContact O-CG 3.38Å; R333-R337 PolarHBondContact O-N 3.33Å; R333-R337 VanDerWaalsContact O-N 3.09Å; N334-R337 PolarHBondContact O-N 2.99Å; V335-R337 VanDerWaalsContact C-N 3.27Å; V335-R337 PolarHBondContact O-N 3.5Å; R337-C339 PolarHBondContact O-N 3.01Å; R337-H340 WeakPolarHBondContact O-CB 3.42Å; R337-H340 PolarHBondContact O-N 3.49Å; R337-H340 VanDerWaalsContact O-N 3.07Å; R337-E341 PolarHBondContact O-N 3.48Å
338	L	92.5	Very high	93.5	Very high	42 Å²	42	36.1 Å²	36.1	22%	0.22	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-32.7	177.8	-67.8	168.1	0	0	0	111.5	I296 F309 N334 V335 H340 E341 F342	I296-L338 HydrophobicContact CD1-CD1 4.17Å; F309-L338 HydrophobicContact CE1-CB 3.99Å; N334-L338 WeakPolarHBondContact O-CB 3.36Å; N334-L338 VanDerWaalsContact O-CG 3.23Å; N334-L338 WeakPolarHBondContact O-CG 3.49Å; N334-L338 PolarHBondContact O-N 2.96Å; V335-L338 PolarHBondContact O-N 3.02Å; L338-H340 VanDerWaalsContact C-N 3.31Å; L338-H340 PolarHBondContact O-N 3.42Å; L338-E341 PolarHBondContact O-N 3.42Å; L338-F342 HydrophobicContact CB-CD2 4.16Å; L338-F342 HydrophobicContact CB-CE2 4.18Å; L338-F342 HydrophobicContact CD2-CD2 4.46Å; L338-F342 HydrophobicContact CD2-CE2 3.71Å; L338-F342 HydrophobicContact CD2-CZ 4.2Å; L338-F342 HydrophobicContact CG-CE2 4.45Å; L338-F342 WeakPolarHBondContact O-CB 3.3Å; L338-F342 WeakPolarHBondContact O-CD2 3.38Å; L338-F342 PolarHBondContact O-N 3.23Å
339	C	92.9	Very high	93.5	Very high	4 Å²	4	36.1 Å²	36.1	3%	0.027	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-40.1	173.2	-68.5	0	0	0	0	112.3	F309 V335 V336 R337 G343 V344	F309-C339 VanDerWaalsContact CZ-SG 3.56Å; V335-C339 PolarHBondContact O-N 2.91Å; V335-C339 PolarHBondContact O-SG 2.92Å; V336-C339 PolarHBondContact O-N 3.31Å; R337-C339 PolarHBondContact O-N 3.01Å; C339-G343 PolarHBondContact O-N 2.98Å; C339-V344 HydrophobicContact CB-CB 3.84Å; C339-V344 HydrophobicContact CB-CG1 4.33Å; C339-V344 PolarHBondContact O-N 3.04Å
340	H	87.3	Confident	93.4	Very high	34 Å²	34	36.3 Å²	36.3	16%	0.157	17%	0.174	C	C	.	.	H	α-helix	trans	-68.1	-42	174.5	-78.8	69.6	0	0	0	112	V336 R337 L338 C384 Y393	V336-H340 PolarHBondContact O-N 3.26Å; V336-H340 PolarHBondContact O-ND1 3.38Å; V336-H340 VanDerWaalsContact O-ND1 3.12Å; R337-H340 WeakPolarHBondContact O-CB 3.42Å; R337-H340 PolarHBondContact O-N 3.49Å; R337-H340 VanDerWaalsContact O-N 3.07Å; L338-H340 VanDerWaalsContact C-N 3.31Å; L338-H340 PolarHBondContact O-N 3.42Å; H340-C384 HydrophobicContact CB-CB 4.48Å; H340-C384 VanDerWaalsContact CD2-CB 3.49Å; H340-C384 WeakPolarHBondContact CD2-CB 3.47Å; H340-C384 VanDerWaalsContact CE1-CB 3.41Å; H340-C384 WeakPolarHBondContact CE1-CB 3.25Å; H340-C384 VanDerWaalsContact NE2-CB 3.32Å; H340-C384 WeakPolarHBondContact NE2-CB 3.31Å; H340-Y393 AromaticContact CD2-CE2 3.49Å; H340-Y393 VanDerWaalsContact CD2-CE2 3.49Å; H340-Y393 WeakPolarHBondContact CD2-CE2 3.34Å; H340-Y393 AromaticContact CD2-CZ 3.39Å; H340-Y393 PolarHBondContact CD2-OH 3.22Å; H340-Y393 AromaticContact CE1-CD2 3.9Å; H340-Y393 AromaticContact CE1-CE1 3.98Å; H340-Y393 AromaticContact CE1-CE2 3.54Å; H340-Y393 AromaticContact CE1-CZ 3.6Å; H340-Y393 AromaticContact CG-CZ 3.69Å; H340-Y393 AromaticContact ND1-CZ 3.82Å; H340-Y393 AromaticContact NE2-CD2 3.7Å; H340-Y393 AromaticContact NE2-CE2 3.06Å; H340-Y393 WeakPolarHBondContact NE2-CE2 3.35Å; H340-Y393 AromaticContact NE2-CZ 3.38Å
341	E	87	Confident	93.4	Very high	144 Å²	144	32.2 Å²	32.2	67%	0.673	16%	0.155	S	C	*	.	H	α-helix	trans	-65.8	-38.1	-179.1	-171	172.7	172.2	0	0	112.7	R337 L338	R337-E341 PolarHBondContact O-N 3.48Å; L338-E341 PolarHBondContact O-N 3.42Å
342	F	87.6	Confident	93.3	Very high	108 Å²	108	32.3 Å²	32.3	47%	0.474	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	9.8	-176.2	-59.3	-43.8	0	0	0	114.8	I296 L338 V344	I296-F342 HydrophobicContact CD1-CD2 4.48Å; I296-F342 HydrophobicContact CD1-CE2 4.09Å; L338-F342 HydrophobicContact CB-CD2 4.16Å; L338-F342 HydrophobicContact CB-CE2 4.18Å; L338-F342 HydrophobicContact CD2-CD2 4.46Å; L338-F342 HydrophobicContact CD2-CE2 3.71Å; L338-F342 HydrophobicContact CD2-CZ 4.2Å; L338-F342 HydrophobicContact CG-CE2 4.45Å; L338-F342 WeakPolarHBondContact O-CB 3.3Å; L338-F342 WeakPolarHBondContact O-CD2 3.38Å; L338-F342 PolarHBondContact O-N 3.23Å; F342-V344 VanDerWaalsContact C-N 3.34Å; F342-V344 HydrophobicContact CB-CG2 4.47Å; F342-V344 PolarHBondContact O-N 3.42Å
343	G	87.7	Confident	93.2	Very high	19 Å²	19	32.3 Å²	32.3	20%	0.196	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	32.4	177.5	0	0	0	0	0	114.1	N197 L199 C339 S345	N197-G343 CarbonylContact C-O 3.55Å; N197-G343 VanDerWaalsContact O-O 3.09Å; L199-G343 PolarHBondContact N-O 3.43Å; L199-G343 VanDerWaalsContact N-O 3.09Å; C339-G343 PolarHBondContact O-N 2.98Å; G343-S345 PolarHBondContact O-N 3.36Å
344	V	92.3	Very high	92.9	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.012	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	97.8	171.1	-178	0	0	0	0	108.5	L199 F309 C339 F342 S346 Y393	L199-V344 HydrophobicContact CB-CB 4.4Å; L199-V344 HydrophobicContact CB-CG2 4Å; L199-V344 HydrophobicContact CD1-CG2 4.46Å; L199-V344 CarbonylContact O-C 3.51Å; L199-V344 VanDerWaalsContact O-CA 3.32Å; L199-V344 WeakPolarHBondContact O-CA 3.36Å; L199-V344 WeakPolarHBondContact O-CG1 3.47Å; F309-V344 HydrophobicContact CE2-CG1 4.5Å; F309-V344 HydrophobicContact CE2-CG2 4.5Å; F309-V344 HydrophobicContact CZ-CG2 4.32Å; C339-V344 HydrophobicContact CB-CB 3.84Å; C339-V344 HydrophobicContact CB-CG1 4.33Å; C339-V344 PolarHBondContact O-N 3.04Å; F342-V344 VanDerWaalsContact C-N 3.34Å; F342-V344 HydrophobicContact CB-CG2 4.47Å; F342-V344 PolarHBondContact O-N 3.42Å; V344-S346 VanDerWaalsContact CG1-O 3.27Å; V344-S346 WeakPolarHBondContact CG1-O 3.36Å; V344-Y393 WeakPolarHBondContact O-CD1 3.3Å; V344-Y393 VanDerWaalsContact O-CE1 3.27Å; V344-Y393 WeakPolarHBondContact O-CE1 3.03Å
345	S	90.9	Very high	92.2	Very high	21 Å²	21	28.1 Å²	28.1	15%	0.147	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-15.5	-176.7	58.8	0	0	0	0	113.8	R198 L199 G343 Y393 T394	R198-S345 VanDerWaalsContact CA-OG 3.32Å; R198-S345 WeakPolarHBondContact CA-OG 3.46Å; L199-S345 PolarHBondContact O-N 3.35Å; G343-S345 PolarHBondContact O-N 3.36Å; S345-Y393 CarbonylContact O-C 3.41Å; S345-Y393 VanDerWaalsContact O-CA 3.27Å; S345-Y393 WeakPolarHBondContact O-CA 3.42Å; S345-T394 PolarHBondContact O-N 2.75Å
346	S	93.2	Very high	91.6	Very high	24 Å²	24	30.3 Å²	30.3	17%	0.168	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.6	176.7	-173.7	0	0	0	0	110.2	L199 C200 G201 V344 T394	L199-S346 PolarHBondContact O-N 2.95Å; C200-S346 CarbonylContact C-O 3.6Å; C200-S346 WeakPolarHBondContact CA-O 3.21Å; G201-S346 PolarHBondContact N-O 3.19Å; V344-S346 VanDerWaalsContact CG1-O 3.27Å; V344-S346 WeakPolarHBondContact CG1-O 3.36Å; S346-T394 CarbonylContact C-O 3.43Å; S346-T394 VanDerWaalsContact CA-O 3.26Å; S346-T394 WeakPolarHBondContact CA-O 3.33Å
347	L	95.5	Very high	91.2	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	121	179.1	178.3	65.1	0	0	0	110.8	G201 F309 V335 V336 I349 T394 I395 H396	G201-L347 CarbonylContact O-C 3.29Å; G201-L347 WeakPolarHBondContact O-CA 3.34Å; F309-L347 HydrophobicContact CD2-CD1 4Å; F309-L347 HydrophobicContact CE2-CD1 4.21Å; V335-L347 HydrophobicContact CG1-CD1 4.07Å; V335-L347 HydrophobicContact CG1-CD2 3.84Å; V336-L347 HydrophobicContact CG2-CD2 4.23Å; L347-I349 HydrophobicContact CD2-CD1 3.84Å; L347-I349 HydrophobicContact CD2-CG1 3.94Å; L347-I349 HydrophobicContact CG-CD1 4.2Å; L347-I349 HydrophobicContact CG-CG1 3.83Å; L347-T394 PolarHBondContact N-O 2.8Å; L347-I395 HydrophobicContact CB-CD1 4.06Å; L347-I395 WeakPolarHBondContact O-CA 3.16Å; L347-H396 PolarHBondContact O-N 2.96Å
348	A	96.1	Very high	90.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.1	171.4	0	0	0	0	0	111.6	P171 G201 L202 L203 Y305 H396 F398	P171-A348 HydrophobicContact CG-CB 4.35Å; G201-A348 PolarHBondContact O-N 3.08Å; L202-A348 HydrophobicContact CD1-CB 3.54Å; L203-A348 WeakPolarHBondContact CB-O 3.15Å; L203-A348 PolarHBondContact N-O 3.26Å; Y305-A348 HydrophobicContact CE1-CB 3.76Å; A348-H396 CarbonylContact C-O 3.49Å; A348-H396 WeakPolarHBondContact CA-O 3.36Å; A348-H396 HydrophobicContact CB-CB 4.21Å; A348-F398 HydrophobicContact CB-CD1 4.26Å; A348-F398 HydrophobicContact CB-CE1 4.16Å
349	I	96.9	Very high	90.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	126.8	-171.9	-55.8	173.6	0	0	0	110	L203 L332 L347 L351 V373 V377 I395 H396 F397 F398	L203-I349 HydrophobicContact CD2-CG2 4.09Å; L332-I349 HydrophobicContact CD1-CD1 4.22Å; L332-I349 HydrophobicContact CD1-CG2 4.21Å; L347-I349 HydrophobicContact CD2-CD1 3.84Å; L347-I349 HydrophobicContact CD2-CG1 3.94Å; L347-I349 HydrophobicContact CG-CD1 4.2Å; L347-I349 HydrophobicContact CG-CG1 3.83Å; I349-L351 PolarHBondContact O-N 3.17Å; I349-L351 VanDerWaalsContact O-N 3.12Å; I349-V373 HydrophobicContact CG2-CG1 4.49Å; I349-V377 HydrophobicContact CD1-CG1 4.24Å; I349-V377 HydrophobicContact CD1-CG2 3.98Å; I349-I395 HydrophobicContact CD1-CG2 3.82Å; I349-H396 PolarHBondContact N-O 3.44Å; I349-F397 HydrophobicContact CB-CD1 4.01Å; I349-F397 HydrophobicContact CB-CE1 4.19Å; I349-F397 HydrophobicContact CD1-CE1 4.05Å; I349-F397 HydrophobicContact CG2-CD1 4.26Å; I349-F397 HydrophobicContact CG2-CE1 4.25Å; I349-F397 CarbonylContact O-C 3.57Å; I349-F397 WeakPolarHBondContact O-CA 3.41Å; I349-F398 WeakPolarHBondContact O-CD1 3.35Å; I349-F398 PolarHBondContact O-N 3.38Å
350	P	95	Very high	89.8	Confident	3 Å²	3	44 Å²	44	2%	0.019	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	112	169.2	23.8	-28	0	0	0	108.4	L203 V205 L352 L353 F398	L203-P350 WeakPolarHBondContact O-CD 3.48Å; V205-P350 HydrophobicContact CG2-CG 3.88Å; P350-L352 PolarHBondContact O-N 3.3Å; P350-L352 VanDerWaalsContact O-N 3.12Å; P350-L353 PolarHBondContact O-N 3.24Å; P350-F398 HydrophobicContact CB-CD2 4.37Å; P350-F398 HydrophobicContact CB-CE1 4.35Å; P350-F398 HydrophobicContact CB-CE2 3.63Å; P350-F398 HydrophobicContact CB-CZ 3.62Å; P350-F398 HydrophobicContact CG-CE2 4.46Å; P350-F398 HydrophobicContact CG-CZ 3.99Å; P350-F398 VanDerWaalsContact N-CE1 3.29Å
351	L	96.7	Very high	90	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.3	-169.9	179.5	54.5	0	0	0	112.5	L166 I349 A370 V373 F374 F397 F398 L399 C411	L166-L351 HydrophobicContact CD1-CD2 3.93Å; I349-L351 PolarHBondContact O-N 3.17Å; I349-L351 VanDerWaalsContact O-N 3.12Å; L351-A370 HydrophobicContact CD1-CB 4.08Å; L351-A370 HydrophobicContact CD2-CB 3.85Å; L351-A370 HydrophobicContact CG-CB 3.85Å; L351-V373 HydrophobicContact CD1-CB 4.29Å; L351-V373 HydrophobicContact CD1-CG1 4.15Å; L351-V373 WeakPolarHBondContact O-CB 3.35Å; L351-V373 WeakPolarHBondContact O-CG2 3.36Å; L351-F374 HydrophobicContact CD1-CD1 3.7Å; L351-F374 HydrophobicContact CD1-CD2 4.26Å; L351-F374 HydrophobicContact CD1-CE1 3.35Å; L351-F374 HydrophobicContact CD1-CE2 3.97Å; L351-F374 HydrophobicContact CD1-CG 4.14Å; L351-F374 HydrophobicContact CD1-CZ 3.49Å; L351-F374 VanDerWaalsContact CD1-CZ 3.49Å; L351-F374 HydrophobicContact CD2-CE1 4.06Å; L351-F374 HydrophobicContact CD2-CE2 3.98Å; L351-F374 HydrophobicContact CD2-CZ 3.44Å; L351-F374 VanDerWaalsContact CD2-CZ 3.44Å; L351-F374 HydrophobicContact CG-CE1 4.36Å; L351-F374 HydrophobicContact CG-CZ 4.14Å; L351-F397 HydrophobicContact CB-CB 4.32Å; L351-F397 HydrophobicContact CB-CD1 4.48Å; L351-F397 HydrophobicContact CD1-CB 4.43Å; L351-F397 HydrophobicContact CD1-CD1 3.78Å; L351-F397 HydrophobicContact CD1-CE1 4.31Å; L351-F397 HydrophobicContact CD1-CG 4.23Å; L351-F398 PolarHBondContact N-O 2.9Å; L351-L399 HydrophobicContact CB-CD2 4.12Å; L351-L399 HydrophobicContact CB-CG 4.34Å; L351-L399 HydrophobicContact CD2-CD1 4.29Å; L351-L399 HydrophobicContact CD2-CD2 4Å; L351-L399 HydrophobicContact CD2-CG 4.05Å; L351-L399 HydrophobicContact CG-CD2 4.39Å; L351-C411 HydrophobicContact CD2-CB 4.19Å
352	L	95.1	Very high	90.2	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-4	-177.3	-58.3	178.8	0	0	0	113.4	P350 V354 L357 W365 C366 R369 A370 L399	P350-L352 PolarHBondContact O-N 3.3Å; P350-L352 VanDerWaalsContact O-N 3.12Å; L352-V354 HydrophobicContact CB-CG2 3.7Å; L352-V354 PolarHBondContact O-N 3.21Å; L352-L357 HydrophobicContact CD1-CD2 3.61Å; L352-W365 HydrophobicContact CB-CH2 4.47Å; L352-W365 HydrophobicContact CB-CZ3 4.12Å; L352-W365 HydrophobicContact CD1-CZ3 4.42Å; L352-W365 HydrophobicContact CD2-CZ3 4.39Å; L352-C366 HydrophobicContact CD1-CB 4.29Å; L352-C366 HydrophobicContact CD2-CB 4.16Å; L352-C366 VanDerWaalsContact CD2-O 3.3Å; L352-C366 WeakPolarHBondContact CD2-O 3.27Å; L352-R369 HydrophobicContact CB-CG 4.31Å; L352-R369 HydrophobicContact CD2-CB 4.03Å; L352-R369 HydrophobicContact CD2-CG 4.03Å; L352-R369 WeakPolarHBondContact O-CG 3.35Å; L352-R369 PolarHBondContact O-NH1 2.95Å; L352-A370 HydrophobicContact CD2-CB 4.27Å; L352-L399 HydrophobicContact CD1-CD2 3.63Å; L352-L399 HydrophobicContact CD2-CD2 4.21Å; L352-L399 HydrophobicContact CG-CD2 3.65Å
353	L	94.5	Very high	90.5	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.197	C	C	.	.	S	Bend	trans	54.7	32.8	-170.9	-54.8	176.1	0	0	0	113.1	L203 V205 L311 V317 I322 I329 P350 V373	L203-L353 HydrophobicContact CD2-CD2 4.37Å; V205-L353 HydrophobicContact CG2-CB 4.42Å; L311-L353 HydrophobicContact CD2-CD2 4.41Å; V317-L353 HydrophobicContact CG1-CB 4.01Å; I322-L353 HydrophobicContact CD1-CD1 4.39Å; I329-L353 HydrophobicContact CD1-CD1 3.86Å; P350-L353 PolarHBondContact O-N 3.24Å; L353-V373 HydrophobicContact CD1-CG2 4.05Å; L353-V373 HydrophobicContact CG-CG2 4.08Å
354	V	89.7	Confident	90.8	Very high	15 Å²	15	40.2 Å²	40.2	9%	0.091	21%	0.207	C	C	.	.	S	Bend	trans	-136.8	153.1	172.2	-62.5	0	0	0	0	109.1	L352 W365	L352-V354 HydrophobicContact CB-CG2 3.7Å; L352-V354 PolarHBondContact O-N 3.21Å; V354-W365 HydrophobicContact CG1-CH2 4.17Å; V354-W365 HydrophobicContact CG2-CH2 4.49Å
355	D	81.1	Confident	90.9	Very high	45 Å²	45	40.7 Å²	40.7	24%	0.241	21%	0.209	C	C	.	.	S	Bend	trans	-79.2	-30.4	-178.8	-65.2	-37.7	0	0	0	113.1
356	D	84	Confident	91.1	Very high	46 Å²	46	39.8 Å²	39.8	25%	0.246	20%	0.203	C	C	.	.	S	Bend	trans	-153.1	165.5	178.3	-153.6	1.7	0	0	0	112	K233 P400 S402	K233-D356 HydrophobicContact CD-CB 4.05Å; K233-D356 WeakPolarHBondContact CE-OD2 3.4Å; K233-D356 VanDerWaalsContact NZ-CG 3.29Å; K233-D356 IonicContact NZ-OD2 2.96Å; K233-D356 PolarHBondContact NZ-OD2 3.43Å; D356-P400 WeakPolarHBondContact OD1-CB 3.36Å; D356-S402 WeakPolarHBondContact OD1-CB 3.28Å; D356-S402 PolarHBondContact OD1-OG 2.97Å
357	L	86.6	Confident	91.2	Very high	37 Å²	37	40.3 Å²	40.3	19%	0.194	20%	0.203	C	C	.	.			trans	-88.1	144.4	173.7	-57.6	177.9	0	0	0	110.4	L352 H361 P400 V403	L352-L357 HydrophobicContact CD1-CD2 3.61Å; L357-H361 HydrophobicContact CD2-CB 3.9Å; L357-P400 HydrophobicContact CD2-CG 4.48Å; L357-P400 HydrophobicContact CG-CB 4.36Å; L357-P400 HydrophobicContact CG-CG 4.23Å; L357-V403 HydrophobicContact CD1-CB 4.11Å; L357-V403 HydrophobicContact CD1-CG2 4.15Å
358	D	84.2	Confident	91.3	Very high	80 Å²	80	45.5 Å²	45.5	43%	0.428	22%	0.223	S	C	.	.			trans	-131.4	-175.9	170.9	69	23.8	0	0	0	109.4	W360 H361	D358-W360 PolarHBondContact O-N 3.41Å; D358-W360 WeakPolarHBondContact OD1-CA 3.28Å; D358-W360 VanDerWaalsContact OD1-CB 3.27Å; D358-W360 WeakPolarHBondContact OD1-CB 3.26Å; D358-W360 PolarHBondContact OD1-N 3.22Å; D358-H361 VanDerWaalsContact CG-CE1 3.4Å; D358-H361 PolarHBondContact N-ND1 3.29Å; D358-H361 PolarHBondContact O-N 3.44Å; D358-H361 VanDerWaalsContact O-N 3.12Å; D358-H361 IonicContact OD1-CE1 3.47Å; D358-H361 PolarHBondContact OD1-CE1 3.43Å; D358-H361 IonicContact OD1-CG 3.94Å; D358-H361 IonicContact OD1-ND1 3.87Å; D358-H361 PolarHBondContact OD1-ND1 2.9Å; D358-H361 IonicContact OD2-CE1 3.67Å; D358-H361 PolarHBondContact OD2-CE1 3.09Å; D358-H361 IonicContact OD2-ND1 3.54Å
359	E	82.8	Confident	91.3	Very high	170 Å²	170	45.7 Å²	45.7	79%	0.794	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.7	-179	62	-170.8	169.2	0	0	115.1	H361	E359-H361 VanDerWaalsContact C-N 3.34Å
360	W	82.1	Confident	91.3	Very high	170 Å²	170	45.7 Å²	45.7	64%	0.644	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-21.5	178.3	-57.1	93.8	0	0	0	112.1	D358 T362	D358-W360 PolarHBondContact O-N 3.41Å; D358-W360 WeakPolarHBondContact OD1-CA 3.28Å; D358-W360 VanDerWaalsContact OD1-CB 3.27Å; D358-W360 WeakPolarHBondContact OD1-CB 3.26Å; D358-W360 PolarHBondContact OD1-N 3.22Å; W360-T362 PolarHBondContact O-N 2.84Å; W360-T362 VanDerWaalsContact O-N 3.11Å
361	H	90.1	Very high	91.3	Very high	18 Å²	18	49.1 Å²	49.1	8%	0.083	24%	0.239	C	C	.	.			trans	-87.7	79.9	-175.3	-56.9	102	0	0	0	111.8	S318 L357 D358 E359 W365	S318-H361 PolarHBondContact O-NE2 3.39Å; L357-H361 HydrophobicContact CD2-CB 3.9Å; D358-H361 VanDerWaalsContact CG-CE1 3.4Å; D358-H361 PolarHBondContact N-ND1 3.29Å; D358-H361 PolarHBondContact O-N 3.44Å; D358-H361 VanDerWaalsContact O-N 3.12Å; D358-H361 IonicContact OD1-CE1 3.47Å; D358-H361 PolarHBondContact OD1-CE1 3.43Å; D358-H361 IonicContact OD1-CG 3.94Å; D358-H361 IonicContact OD1-ND1 3.87Å; D358-H361 PolarHBondContact OD1-ND1 2.9Å; D358-H361 IonicContact OD2-CE1 3.67Å; D358-H361 PolarHBondContact OD2-CE1 3.09Å; D358-H361 IonicContact OD2-ND1 3.54Å; E359-H361 VanDerWaalsContact C-N 3.34Å; H361-W365 HydrophobicContact CB-CE3 4.29Å; H361-W365 AromaticContact CD2-CE3 3.68Å; H361-W365 AromaticContact CD2-CH2 3.44Å; H361-W365 VanDerWaalsContact CD2-CH2 3.44Å; H361-W365 WeakPolarHBondContact CD2-CH2 3.34Å; H361-W365 AromaticContact CD2-CZ2 3.77Å; H361-W365 AromaticContact CD2-CZ3 3.39Å; H361-W365 WeakPolarHBondContact CD2-CZ3 3.39Å; H361-W365 AromaticContact NE2-CH2 3.89Å
362	T	92.4	Very high	91.4	Very high	78 Å²	78	50.6 Å²	50.6	48%	0.479	25%	0.247	S	C	.	.			trans	-63.2	157.6	172.7	64.8	0	0	0	0	112.3	W360 A364 W365 C366	W360-T362 PolarHBondContact O-N 2.84Å; W360-T362 VanDerWaalsContact O-N 3.11Å; T362-A364 VanDerWaalsContact C-N 3.26Å; T362-A364 PolarHBondContact O-N 3.4Å; T362-W365 WeakPolarHBondContact O-CB 3.48Å; T362-W365 PolarHBondContact O-N 3.48Å; T362-W365 VanDerWaalsContact O-N 3.09Å; T362-W365 WeakPolarHBondContact OG1-CB 3.47Å; T362-W365 PolarHBondContact OG1-N 2.84Å; T362-C366 PolarHBondContact O-N 3.02Å; T362-C366 PolarHBondContact O-SG 2.8Å
363	E	93.4	Very high	91.5	Very high	80 Å²	80	50.6 Å²	50.6	37%	0.374	25%	0.247	S	C	.	.	H	α-helix	trans	-56	-42.1	174.9	-174.7	164.3	-138.6	0	0	111.7	W365 C366 L367 S406 L407	E363-W365 PolarHBondContact O-N 3.26Å; E363-C366 WeakPolarHBondContact O-CB 3.32Å; E363-C366 PolarHBondContact O-N 3.49Å; E363-C366 VanDerWaalsContact O-N 3.17Å; E363-L367 HydrophobicContact CG-CD1 4.21Å; E363-L367 WeakPolarHBondContact O-CG 3.46Å; E363-L367 PolarHBondContact O-N 3.49Å; E363-S406 PolarHBondContact OE1-OG 3.13Å; E363-L407 HydrophobicContact CG-CD1 4.25Å
364	A	93.8	Very high	91.6	Very high	49 Å²	49	50.5 Å²	50.5	41%	0.405	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-38.8	176.9	0	0	0	0	0	112.8	T362 R368	T362-A364 VanDerWaalsContact C-N 3.26Å; T362-A364 PolarHBondContact O-N 3.4Å; A364-R368 WeakPolarHBondContact O-CG 3.32Å; A364-R368 PolarHBondContact O-N 3.07Å; A364-R368 VanDerWaalsContact O-N 3.12Å; A364-R368 PolarHBondContact O-NH1 3.28Å
365	W	94.6	Very high	91.9	Very high	13 Å²	13	55.1 Å²	55.1	5%	0.049	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-45.2	173.2	-179.1	100.5	0	0	0	110.7	E320 L352 V354 H361 T362 E363 L367 R368 R369	E320-W365 PolarHBondContact O-NE1 2.94Å; L352-W365 HydrophobicContact CB-CH2 4.47Å; L352-W365 HydrophobicContact CB-CZ3 4.12Å; L352-W365 HydrophobicContact CD1-CZ3 4.42Å; L352-W365 HydrophobicContact CD2-CZ3 4.39Å; V354-W365 HydrophobicContact CG1-CH2 4.17Å; V354-W365 HydrophobicContact CG2-CH2 4.49Å; H361-W365 HydrophobicContact CB-CE3 4.29Å; H361-W365 AromaticContact CD2-CE3 3.68Å; H361-W365 AromaticContact CD2-CH2 3.44Å; H361-W365 VanDerWaalsContact CD2-CH2 3.44Å; H361-W365 WeakPolarHBondContact CD2-CH2 3.34Å; H361-W365 AromaticContact CD2-CZ2 3.77Å; H361-W365 AromaticContact CD2-CZ3 3.39Å; H361-W365 WeakPolarHBondContact CD2-CZ3 3.39Å; H361-W365 AromaticContact NE2-CH2 3.89Å; T362-W365 WeakPolarHBondContact O-CB 3.48Å; T362-W365 PolarHBondContact O-N 3.48Å; T362-W365 VanDerWaalsContact O-N 3.09Å; T362-W365 WeakPolarHBondContact OG1-CB 3.47Å; T362-W365 PolarHBondContact OG1-N 2.84Å; E363-W365 PolarHBondContact O-N 3.26Å; W365-L367 PolarHBondContact O-N 2.92Å; W365-R368 PolarHBondContact O-N 3.04Å; W365-R369 HydrophobicContact CE3-CB 4.25Å; W365-R369 HydrophobicContact CH2-CB 4.36Å; W365-R369 HydrophobicContact CH2-CG 4.04Å; W365-R369 HydrophobicContact CZ3-CB 4.12Å; W365-R369 HydrophobicContact CZ3-CG 4.15Å; W365-R369 VanDerWaalsContact O-CB 3.26Å; W365-R369 WeakPolarHBondContact O-CB 3.37Å; W365-R369 PolarHBondContact O-N 3.3Å
366	C	95.6	Very high	92.7	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.007	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-45	-179.6	-65.8	0	0	0	0	111.8	L352 T362 E363 R369 A370 L407	L352-C366 HydrophobicContact CD1-CB 4.29Å; L352-C366 HydrophobicContact CD2-CB 4.16Å; L352-C366 VanDerWaalsContact CD2-O 3.3Å; L352-C366 WeakPolarHBondContact CD2-O 3.27Å; T362-C366 PolarHBondContact O-N 3.02Å; T362-C366 PolarHBondContact O-SG 2.8Å; E363-C366 WeakPolarHBondContact O-CB 3.32Å; E363-C366 PolarHBondContact O-N 3.49Å; E363-C366 VanDerWaalsContact O-N 3.17Å; C366-R369 PolarHBondContact O-N 3.26Å; C366-A370 VanDerWaalsContact O-CB 3.26Å; C366-A370 WeakPolarHBondContact O-CB 3.38Å; C366-A370 PolarHBondContact O-N 3.47Å; C366-L407 HydrophobicContact CB-CD1 3.78Å; C366-L407 HydrophobicContact CB-CD2 3.54Å; C366-L407 HydrophobicContact CB-CG 4.26Å
367	L	95.9	Very high	93.2	Very high	35 Å²	35	51.4 Å²	51.4	18%	0.183	25%	0.246	C	C	.	.	H	α-helix	trans	-65.6	-45.8	179	-67.1	169.9	0	0	0	112.1	E363 W365 R369 A370 E371 L407 E410 M414	E363-L367 HydrophobicContact CG-CD1 4.21Å; E363-L367 WeakPolarHBondContact O-CG 3.46Å; E363-L367 PolarHBondContact O-N 3.49Å; W365-L367 PolarHBondContact O-N 2.92Å; L367-R369 VanDerWaalsContact C-N 3.31Å; L367-R369 PolarHBondContact O-N 2.94Å; L367-A370 PolarHBondContact O-N 3.18Å; L367-E371 WeakPolarHBondContact O-CB 3.36Å; L367-E371 PolarHBondContact O-N 2.88Å; L367-L407 HydrophobicContact CD2-CD1 3.55Å; L367-L407 HydrophobicContact CG-CD1 3.76Å; L367-E410 WeakPolarHBondContact CD1-OE2 3.25Å; L367-E410 HydrophobicContact CD2-CB 3.67Å; L367-M414 HydrophobicContact CB-CE 4.39Å; L367-M414 HydrophobicContact CD2-CE 4.08Å
368	R	96	Very high	93.4	Very high	113 Å²	113	52 Å²	52	43%	0.426	25%	0.247	S	C	.	.	H	α-helix	trans	-60	-43	175.4	-74.6	-167.9	-58.9	-89.5	11.6	111.6	D321 A364 W365 E371 L372	D321-R368 IonicContact OD1-CZ 2.63Å; D321-R368 IonicContact OD1-NE 2.69Å; D321-R368 PolarHBondContact OD1-NE 2.85Å; D321-R368 IonicContact OD1-NH2 3.18Å; D321-R368 PolarHBondContact OD1-NH2 3.12Å; D321-R368 IonicContact OD2-CZ 2.85Å; D321-R368 IonicContact OD2-NE 2.66Å; D321-R368 PolarHBondContact OD2-NE 2.98Å; D321-R368 IonicContact OD2-NH2 3.44Å; D321-R368 PolarHBondContact OD2-NH2 3.4Å; A364-R368 WeakPolarHBondContact O-CG 3.32Å; A364-R368 PolarHBondContact O-N 3.07Å; A364-R368 VanDerWaalsContact O-N 3.12Å; A364-R368 PolarHBondContact O-NH1 3.28Å; W365-R368 PolarHBondContact O-N 3.04Å; R368-E371 PolarHBondContact O-N 3.13Å; R368-L372 WeakPolarHBondContact O-CB 3.38Å; R368-L372 PolarHBondContact O-N 3.41Å
369	R	95.9	Very high	93.7	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.015	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-48	178.8	-177.4	62.9	64.4	101.7	-5.8	111.7	V317 E320 I322 L352 W365 C366 L367 E371 L372 V373	V317-R369 VanDerWaalsContact CG1-NH1 3.34Å; V317-R369 PolarHBondContact O-NH1 3.39Å; V317-R369 PolarHBondContact O-NH2 2.91Å; E320-R369 PolarHBondContact O-NH2 3.12Å; I322-R369 VanDerWaalsContact CD1-CZ 3.46Å; L352-R369 HydrophobicContact CB-CG 4.31Å; L352-R369 HydrophobicContact CD2-CB 4.03Å; L352-R369 HydrophobicContact CD2-CG 4.03Å; L352-R369 WeakPolarHBondContact O-CG 3.35Å; L352-R369 PolarHBondContact O-NH1 2.95Å; W365-R369 HydrophobicContact CE3-CB 4.25Å; W365-R369 HydrophobicContact CH2-CB 4.36Å; W365-R369 HydrophobicContact CH2-CG 4.04Å; W365-R369 HydrophobicContact CZ3-CB 4.12Å; W365-R369 HydrophobicContact CZ3-CG 4.15Å; W365-R369 VanDerWaalsContact O-CB 3.26Å; W365-R369 WeakPolarHBondContact O-CB 3.37Å; W365-R369 PolarHBondContact O-N 3.3Å; C366-R369 PolarHBondContact O-N 3.26Å; L367-R369 VanDerWaalsContact C-N 3.31Å; L367-R369 PolarHBondContact O-N 2.94Å; R369-E371 VanDerWaalsContact C-N 3.32Å; R369-E371 PolarHBondContact O-N 2.99Å; R369-L372 PolarHBondContact O-N 3.31Å; R369-V373 WeakPolarHBondContact O-CG2 3.42Å; R369-V373 PolarHBondContact O-N 3.25Å
370	A	96.9	Very high	94.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.9	-45.8	176.5	0	0	0	0	0	111.1	L351 L352 C366 L367 L372 V373 F374 M414	L351-A370 HydrophobicContact CD1-CB 4.08Å; L351-A370 HydrophobicContact CD2-CB 3.85Å; L351-A370 HydrophobicContact CG-CB 3.85Å; L352-A370 HydrophobicContact CD2-CB 4.27Å; C366-A370 VanDerWaalsContact O-CB 3.26Å; C366-A370 WeakPolarHBondContact O-CB 3.38Å; C366-A370 PolarHBondContact O-N 3.47Å; L367-A370 PolarHBondContact O-N 3.18Å; A370-L372 PolarHBondContact O-N 2.82Å; A370-V373 PolarHBondContact O-N 3.11Å; A370-F374 HydrophobicContact CB-CD2 4.44Å; A370-F374 HydrophobicContact CB-CE2 4.18Å; A370-F374 WeakPolarHBondContact O-CB 3.42Å; A370-F374 WeakPolarHBondContact O-CD2 3.49Å; A370-F374 VanDerWaalsContact O-CG 3.27Å; A370-F374 WeakPolarHBondContact O-CG 3.23Å; A370-F374 PolarHBondContact O-N 3.19Å; A370-M414 HydrophobicContact CB-SD 4.45Å
371	E	97	Very high	94.5	Very high	75 Å²	75	34.7 Å²	34.7	35%	0.35	18%	0.179	S	C	.	.	H	α-helix	trans	-59.6	-46.3	178	-166.7	-176.2	-179.8	0	0	112	L367 R368 R369 K375 M414 I418	L367-E371 WeakPolarHBondContact O-CB 3.36Å; L367-E371 PolarHBondContact O-N 2.88Å; R368-E371 PolarHBondContact O-N 3.13Å; R369-E371 VanDerWaalsContact C-N 3.32Å; R369-E371 PolarHBondContact O-N 2.99Å; E371-K375 HydrophobicContact CG-CD 4.1Å; E371-K375 WeakPolarHBondContact O-CB 3.43Å; E371-K375 WeakPolarHBondContact O-CG 3.49Å; E371-K375 PolarHBondContact O-N 3.5Å; E371-K375 VanDerWaalsContact OE1-CE 3.26Å; E371-K375 WeakPolarHBondContact OE1-CE 3.25Å; E371-K375 IonicContact OE1-NZ 2.62Å; E371-K375 PolarHBondContact OE1-NZ 3.16Å; E371-M414 WeakPolarHBondContact CA-SD 3.41Å; E371-M414 HydrophobicContact CB-CE 4.14Å; E371-M414 HydrophobicContact CB-SD 3.49Å; E371-M414 WeakPolarHBondContact CB-SD 3.43Å; E371-M414 HydrophobicContact CG-SD 3.9Å; E371-M414 PolarHBondContact N-SD 3.19Å; E371-I418 HydrophobicContact CG-CD1 4.13Å
372	L	97.6	Very high	94.3	Very high	32 Å²	32	35.9 Å²	35.9	17%	0.168	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-51.4	176.6	174.6	66.8	0	0	0	111.2	I322 I329 R368 R369 A370 K375 C376	I322-L372 HydrophobicContact CD1-CD2 4.29Å; I322-L372 HydrophobicContact CG1-CD2 3.67Å; I322-L372 WeakPolarHBondContact O-CD2 3.44Å; I329-L372 HydrophobicContact CD1-CD2 4.08Å; I329-L372 HydrophobicContact CD1-CG 4.31Å; I329-L372 HydrophobicContact CG1-CD2 4.3Å; R368-L372 WeakPolarHBondContact O-CB 3.38Å; R368-L372 PolarHBondContact O-N 3.41Å; R369-L372 PolarHBondContact O-N 3.31Å; A370-L372 PolarHBondContact O-N 2.82Å; L372-K375 PolarHBondContact O-N 2.77Å; L372-C376 VanDerWaalsContact O-CB 3.3Å; L372-C376 WeakPolarHBondContact O-CB 3.42Å; L372-C376 PolarHBondContact O-N 3.36Å; L372-C376 PolarHBondContact O-SG 2.96Å
373	V	97.9	Very high	94	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-45.4	-177.1	171.5	0	0	0	0	110.6	I329 L332 I349 L351 L353 R369 A370 K375 C376 V377 F397	I329-V373 HydrophobicContact CD1-CG2 4.33Å; L332-V373 HydrophobicContact CD2-CG1 4.16Å; I349-V373 HydrophobicContact CG2-CG1 4.49Å; L351-V373 HydrophobicContact CD1-CB 4.29Å; L351-V373 HydrophobicContact CD1-CG1 4.15Å; L351-V373 WeakPolarHBondContact O-CB 3.35Å; L351-V373 WeakPolarHBondContact O-CG2 3.36Å; L353-V373 HydrophobicContact CD1-CG2 4.05Å; L353-V373 HydrophobicContact CG-CG2 4.08Å; R369-V373 WeakPolarHBondContact O-CG2 3.42Å; R369-V373 PolarHBondContact O-N 3.25Å; A370-V373 PolarHBondContact O-N 3.11Å; V373-K375 PolarHBondContact O-N 3.31Å; V373-C376 PolarHBondContact O-N 2.88Å; V373-V377 HydrophobicContact CG1-CG2 4.28Å; V373-V377 WeakPolarHBondContact O-CB 3.43Å; V373-V377 VanDerWaalsContact O-CG2 3.31Å; V373-V377 WeakPolarHBondContact O-CG2 3.3Å; V373-V377 PolarHBondContact O-N 3.37Å; V373-F397 HydrophobicContact CG1-CE1 4.01Å
374	F	96.5	Very high	93.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.6	-50.5	174.8	-73.4	-39.1	0	0	0	112.3	L351 A370 C376 V377 K378 F397 M414 I415 I418 F419	L351-F374 HydrophobicContact CD1-CD1 3.7Å; L351-F374 HydrophobicContact CD1-CD2 4.26Å; L351-F374 HydrophobicContact CD1-CE1 3.35Å; L351-F374 HydrophobicContact CD1-CE2 3.97Å; L351-F374 HydrophobicContact CD1-CG 4.14Å; L351-F374 HydrophobicContact CD1-CZ 3.49Å; L351-F374 VanDerWaalsContact CD1-CZ 3.49Å; L351-F374 HydrophobicContact CD2-CE1 4.06Å; L351-F374 HydrophobicContact CD2-CE2 3.98Å; L351-F374 HydrophobicContact CD2-CZ 3.44Å; L351-F374 VanDerWaalsContact CD2-CZ 3.44Å; L351-F374 HydrophobicContact CG-CE1 4.36Å; L351-F374 HydrophobicContact CG-CZ 4.14Å; A370-F374 HydrophobicContact CB-CD2 4.44Å; A370-F374 HydrophobicContact CB-CE2 4.18Å; A370-F374 WeakPolarHBondContact O-CB 3.42Å; A370-F374 WeakPolarHBondContact O-CD2 3.49Å; A370-F374 VanDerWaalsContact O-CG 3.27Å; A370-F374 WeakPolarHBondContact O-CG 3.23Å; A370-F374 PolarHBondContact O-N 3.19Å; F374-C376 PolarHBondContact O-N 3.46Å; F374-V377 PolarHBondContact O-N 2.72Å; F374-K378 VanDerWaalsContact O-CB 3.27Å; F374-K378 WeakPolarHBondContact O-CB 3.27Å; F374-K378 PolarHBondContact O-N 3.31Å; F374-F397 HydrophobicContact CD1-CD1 4.23Å; F374-F397 AromaticContact CD1-CD2 3.91Å; F374-F397 HydrophobicContact CD1-CD2 3.91Å; F374-F397 HydrophobicContact CD1-CE1 4Å; F374-F397 AromaticContact CD1-CE2 3.64Å; F374-F397 HydrophobicContact CD1-CE2 3.64Å; F374-F397 HydrophobicContact CD1-CG 4.17Å; F374-F397 AromaticContact CD1-CZ 3.69Å; F374-F397 HydrophobicContact CD1-CZ 3.69Å; F374-F397 HydrophobicContact CE1-CB 4.14Å; F374-F397 AromaticContact CE1-CD1 4Å; F374-F397 HydrophobicContact CE1-CD1 4Å; F374-F397 AromaticContact CE1-CD2 3.47Å; F374-F397 HydrophobicContact CE1-CD2 3.47Å; F374-F397 VanDerWaalsContact CE1-CD2 3.47Å; F374-F397 HydrophobicContact CE1-CE1 4.24Å; F374-F397 AromaticContact CE1-CE2 3.72Å; F374-F397 HydrophobicContact CE1-CE2 3.72Å; F374-F397 AromaticContact CE1-CG 3.59Å; F374-F397 HydrophobicContact CE1-CG 3.59Å; F374-F397 HydrophobicContact CE1-CZ 4.1Å; F374-M414 HydrophobicContact CD2-CG 4.17Å; F374-M414 HydrophobicContact CD2-SD 3.77Å; F374-M414 HydrophobicContact CE2-CB 4.31Å; F374-M414 HydrophobicContact CE2-CG 4.44Å; F374-M414 HydrophobicContact CE2-SD 4.11Å; F374-I415 HydrophobicContact CD1-CG1 4.38Å; F374-I415 HydrophobicContact CE1-CD1 3.96Å; F374-I415 HydrophobicContact CE1-CG1 3.63Å; F374-I415 HydrophobicContact CE2-CG1 3.8Å; F374-I415 HydrophobicContact CZ-CD1 3.74Å; F374-I415 HydrophobicContact CZ-CG1 3.29Å; F374-I418 HydrophobicContact CB-CD1 3.53Å; F374-I418 HydrophobicContact CB-CG2 4.21Å; F374-I418 HydrophobicContact CD2-CD1 3.97Å; F374-I418 HydrophobicContact CG-CD1 4.2Å; F374-F419 HydrophobicContact CB-CE2 3.89Å; F374-F419 HydrophobicContact CB-CZ 4.47Å; F374-F419 AromaticContact CD1-CE2 3.81Å; F374-F419 HydrophobicContact CD1-CE2 3.81Å; F374-F419 HydrophobicContact CD1-CZ 4.45Å; F374-F419 HydrophobicContact CG-CE2 4.07Å
375	K	95.5	Very high	92.7	Very high	111 Å²	111	28.9 Å²	28.9	48%	0.483	14%	0.142	S	C	.	.	H	α-helix	trans	-61.9	-42.5	179.7	-77.5	176.8	172.9	172.2	0	111.9	E371 L372 V373 G379 I418	E371-K375 HydrophobicContact CG-CD 4.1Å; E371-K375 WeakPolarHBondContact O-CB 3.43Å; E371-K375 WeakPolarHBondContact O-CG 3.49Å; E371-K375 PolarHBondContact O-N 3.5Å; E371-K375 VanDerWaalsContact OE1-CE 3.26Å; E371-K375 WeakPolarHBondContact OE1-CE 3.25Å; E371-K375 IonicContact OE1-NZ 2.62Å; E371-K375 PolarHBondContact OE1-NZ 3.16Å; L372-K375 PolarHBondContact O-N 2.77Å; V373-K375 PolarHBondContact O-N 3.31Å; K375-G379 PolarHBondContact O-N 2.83Å; K375-I418 HydrophobicContact CG-CD1 4.17Å; K375-I418 HydrophobicContact CG-CG2 4.36Å
376	C	97	Very high	91.6	Very high	13 Å²	13	33.9 Å²	33.9	9%	0.088	16%	0.164	C	C	.	.	H	α-helix	trans	-64.7	-52.4	178.8	-71	0	0	0	0	111.1	I329 L372 V373 F374 K378 G379 Y380	I329-C376 HydrophobicContact CG2-CB 4.19Å; L372-C376 VanDerWaalsContact O-CB 3.3Å; L372-C376 WeakPolarHBondContact O-CB 3.42Å; L372-C376 PolarHBondContact O-N 3.36Å; L372-C376 PolarHBondContact O-SG 2.96Å; V373-C376 PolarHBondContact O-N 2.88Å; F374-C376 PolarHBondContact O-N 3.46Å; C376-K378 VanDerWaalsContact C-N 3.34Å; C376-K378 PolarHBondContact O-N 3.35Å; C376-G379 WeakPolarHBondContact O-CA 3.43Å; C376-G379 PolarHBondContact O-N 3.29Å; C376-G379 VanDerWaalsContact O-N 3.08Å; C376-Y380 HydrophobicContact CB-CE2 3.71Å; C376-Y380 WeakPolarHBondContact O-CD1 3.15Å; C376-Y380 WeakPolarHBondContact O-CD2 3.5Å; C376-Y380 PolarHBondContact O-N 2.78Å
377	V	95.3	Very high	90.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-44.3	179	173.6	0	0	0	0	111.1	L332 I349 V373 F374 G379 Y380 M381 I395 F397	L332-V377 HydrophobicContact CD1-CG2 4.47Å; L332-V377 HydrophobicContact CD2-CG2 3.7Å; L332-V377 HydrophobicContact CG-CG2 4.19Å; I349-V377 HydrophobicContact CD1-CG1 4.24Å; I349-V377 HydrophobicContact CD1-CG2 3.98Å; V373-V377 HydrophobicContact CG1-CG2 4.28Å; V373-V377 WeakPolarHBondContact O-CB 3.43Å; V373-V377 VanDerWaalsContact O-CG2 3.31Å; V373-V377 WeakPolarHBondContact O-CG2 3.3Å; V373-V377 PolarHBondContact O-N 3.37Å; F374-V377 PolarHBondContact O-N 2.72Å; V377-G379 VanDerWaalsContact C-N 3.33Å; V377-G379 PolarHBondContact O-N 2.59Å; V377-Y380 PolarHBondContact O-N 3.03Å; V377-M381 HydrophobicContact CG1-CG 4.31Å; V377-M381 HydrophobicContact CG1-SD 3.95Å; V377-M381 VanDerWaalsContact O-CG 3.29Å; V377-M381 WeakPolarHBondContact O-CG 3.26Å; V377-M381 PolarHBondContact O-N 3.29Å; V377-I395 HydrophobicContact CG1-CG2 4.25Å; V377-F397 HydrophobicContact CB-CE1 4.47Å; V377-F397 HydrophobicContact CB-CZ 4.02Å; V377-F397 HydrophobicContact CG1-CZ 3.9Å; V377-F397 HydrophobicContact CG2-CE1 4.16Å; V377-F397 HydrophobicContact CG2-CZ 4.21Å
378	K	91.2	Very high	88.4	Confident	49 Å²	49	43.1 Å²	43.1	21%	0.213	21%	0.207	C	C	.	.	H	α-helix	trans	-53.7	-50.7	172.9	-174.2	-167	173.9	177.8	0	111.2	L153 F374 C376 Y380 M381 I382 I418 F419	L153-K378 HydrophobicContact CD1-CG 3.63Å; F374-K378 VanDerWaalsContact O-CB 3.27Å; F374-K378 WeakPolarHBondContact O-CB 3.27Å; F374-K378 PolarHBondContact O-N 3.31Å; C376-K378 VanDerWaalsContact C-N 3.34Å; C376-K378 PolarHBondContact O-N 3.35Å; K378-Y380 VanDerWaalsContact C-N 3.31Å; K378-Y380 PolarHBondContact O-N 3.04Å; K378-M381 PolarHBondContact O-N 3.46Å; K378-I382 HydrophobicContact CG-CD1 4.45Å; K378-I382 WeakPolarHBondContact O-CG1 3.25Å; K378-I382 PolarHBondContact O-N 2.9Å; K378-I382 VanDerWaalsContact O-N 3.07Å; K378-I418 HydrophobicContact CD-CG2 3.89Å; K378-I418 WeakPolarHBondContact CD-O 3.49Å; K378-I418 WeakPolarHBondContact CE-O 3.36Å; K378-I418 PolarHBondContact NZ-O 3.21Å; K378-F419 HydrophobicContact CB-CD1 4.21Å; K378-F419 HydrophobicContact CB-CE1 3.63Å; K378-F419 HydrophobicContact CB-CZ 3.96Å; K378-F419 HydrophobicContact CG-CD1 4.07Å; K378-F419 HydrophobicContact CG-CE1 3.97Å
379	G	91.1	Very high	86.7	Confident	33 Å²	33	43.5 Å²	43.5	34%	0.34	23%	0.227	S	C	.	.	H	α-helix	trans	-59.2	-41	178.7	0	0	0	0	0	112.9	K375 C376 V377 I382 E383	K375-G379 PolarHBondContact O-N 2.83Å; C376-G379 WeakPolarHBondContact O-CA 3.43Å; C376-G379 PolarHBondContact O-N 3.29Å; C376-G379 VanDerWaalsContact O-N 3.08Å; V377-G379 VanDerWaalsContact C-N 3.33Å; V377-G379 PolarHBondContact O-N 2.59Å; G379-I382 PolarHBondContact O-N 3.4Å; G379-E383 PolarHBondContact O-N 3.49Å
380	Y	91.9	Very high	84.8	Confident	23 Å²	23	45 Å²	45	9%	0.09	24%	0.237	C	C	.	.	H	α-helix	trans	-69.7	-37.6	179.3	-53.7	-27.2	0	0	0	112.5	I329 R333 C376 V377 K378 E383 C384	I329-Y380 WeakPolarHBondContact CG2-OH 3.39Å; I329-Y380 PolarHBondContact O-OH 3.41Å; R333-Y380 HydrophobicContact CB-CD1 4.04Å; R333-Y380 HydrophobicContact CB-CD2 3.78Å; R333-Y380 HydrophobicContact CB-CE1 3.87Å; R333-Y380 HydrophobicContact CB-CE2 3.57Å; R333-Y380 HydrophobicContact CB-CG 4.02Å; R333-Y380 HydrophobicContact CG-CD1 3.58Å; R333-Y380 HydrophobicContact CG-CD2 4.11Å; R333-Y380 HydrophobicContact CG-CE1 3.74Å; R333-Y380 HydrophobicContact CG-CE2 4.22Å; R333-Y380 HydrophobicContact CG-CG 3.79Å; C376-Y380 HydrophobicContact CB-CE2 3.71Å; C376-Y380 WeakPolarHBondContact O-CD1 3.15Å; C376-Y380 WeakPolarHBondContact O-CD2 3.5Å; C376-Y380 PolarHBondContact O-N 2.78Å; V377-Y380 PolarHBondContact O-N 3.03Å; K378-Y380 VanDerWaalsContact C-N 3.31Å; K378-Y380 PolarHBondContact O-N 3.04Å; Y380-E383 WeakPolarHBondContact O-CB 3.35Å; Y380-E383 PolarHBondContact O-N 3.28Å; Y380-C384 PolarHBondContact O-N 3.39Å; Y380-C384 PolarHBondContact O-SG 2.69Å
381	M	88.2	Confident	83.3	Confident	2 Å²	2	48 Å²	48	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-43.4	173.2	-68.2	171	75	0	0	111.4	L153 H162 V336 V377 K378 E383 C384 A385 I395 F419	L153-M381 HydrophobicContact CD2-CB 3.62Å; H162-M381 HydrophobicContact CB-CE 3.57Å; H162-M381 WeakPolarHBondContact CD2-CE 3.46Å; V336-M381 HydrophobicContact CG1-CG 4.36Å; V377-M381 HydrophobicContact CG1-CG 4.31Å; V377-M381 HydrophobicContact CG1-SD 3.95Å; V377-M381 VanDerWaalsContact O-CG 3.29Å; V377-M381 WeakPolarHBondContact O-CG 3.26Å; V377-M381 PolarHBondContact O-N 3.29Å; K378-M381 PolarHBondContact O-N 3.46Å; M381-E383 VanDerWaalsContact C-N 3.26Å; M381-E383 PolarHBondContact O-N 2.63Å; M381-C384 PolarHBondContact O-N 3.18Å; M381-A385 WeakPolarHBondContact O-CB 3.35Å; M381-A385 PolarHBondContact O-N 3.03Å; M381-I395 HydrophobicContact CE-CD1 4.44Å; M381-I395 HydrophobicContact CE-CG1 3.7Å; M381-I395 HydrophobicContact SD-CD1 4.28Å; M381-I395 HydrophobicContact SD-CG1 3.56Å; M381-I395 VanDerWaalsContact SD-CG1 3.56Å; M381-F419 HydrophobicContact SD-CE1 4.5Å
382	I	85.9	Confident	82.3	Confident	43 Å²	43	50.7 Å²	50.7	22%	0.221	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-40.6	174.2	-65	173.2	0	0	0	110.5	L153 K378 G379	L153-I382 HydrophobicContact CD1-CG1 4.36Å; L153-I382 HydrophobicContact CD2-CB 4.08Å; L153-I382 HydrophobicContact CD2-CD1 4.33Å; L153-I382 HydrophobicContact CD2-CG1 3.21Å; L153-I382 HydrophobicContact CG-CD1 4.08Å; L153-I382 HydrophobicContact CG-CG1 3.43Å; L153-I382 VanDerWaalsContact CG-CG1 3.43Å; K378-I382 HydrophobicContact CG-CD1 4.45Å; K378-I382 WeakPolarHBondContact O-CG1 3.25Å; K378-I382 PolarHBondContact O-N 2.9Å; K378-I382 VanDerWaalsContact O-N 3.07Å; G379-I382 PolarHBondContact O-N 3.4Å
383	E	86.6	Confident	81.8	Confident	38 Å²	38	49.6 Å²	49.6	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-47.5	177.8	-174.5	-173.2	158.4	0	0	111.5	R333 G379 Y380 M381 A385 K386 Y387	R333-E383 IonicContact CZ-OE1 3.21Å; R333-E383 IonicContact CZ-OE2 3.56Å; R333-E383 VanDerWaalsContact CZ-OE2 3.24Å; R333-E383 IonicContact NE-OE1 3.24Å; R333-E383 IonicContact NE-OE2 3.54Å; R333-E383 PolarHBondContact NE-OE2 2.73Å; R333-E383 IonicContact NH2-OE1 2.92Å; R333-E383 PolarHBondContact NH2-OE1 2.9Å; R333-E383 IonicContact NH2-OE2 3.49Å; R333-E383 PolarHBondContact NH2-OE2 3.41Å; G379-E383 PolarHBondContact O-N 3.49Å; Y380-E383 WeakPolarHBondContact O-CB 3.35Å; Y380-E383 PolarHBondContact O-N 3.28Å; M381-E383 VanDerWaalsContact C-N 3.26Å; M381-E383 PolarHBondContact O-N 2.63Å; E383-A385 VanDerWaalsContact C-N 3.34Å; E383-A385 PolarHBondContact O-N 3.12Å; E383-K386 WeakPolarHBondContact O-CB 2.87Å; E383-K386 PolarHBondContact O-N 3.11Å; E383-Y387 HydrophobicContact CG-CE2 4.37Å; E383-Y387 VanDerWaalsContact O-CD2 3.3Å; E383-Y387 WeakPolarHBondContact O-CD2 3.32Å; E383-Y387 VanDerWaalsContact O-CE2 3.29Å; E383-Y387 WeakPolarHBondContact O-CE2 3.48Å
384	C	83	Confident	81.5	Confident	8 Å²	8	50.6 Å²	50.6	5%	0.054	27%	0.269	C	S	.	.	H	α-helix	trans	-69.7	-31.4	-177.4	-61.7	0	0	0	0	112.6	H340 Y380 M381 K386 Y387	H340-C384 HydrophobicContact CB-CB 4.48Å; H340-C384 VanDerWaalsContact CD2-CB 3.49Å; H340-C384 WeakPolarHBondContact CD2-CB 3.47Å; H340-C384 VanDerWaalsContact CE1-CB 3.41Å; H340-C384 WeakPolarHBondContact CE1-CB 3.25Å; H340-C384 VanDerWaalsContact NE2-CB 3.32Å; H340-C384 WeakPolarHBondContact NE2-CB 3.31Å; Y380-C384 PolarHBondContact O-N 3.39Å; Y380-C384 PolarHBondContact O-SG 2.69Å; M381-C384 PolarHBondContact O-N 3.18Å; C384-K386 PolarHBondContact O-N 2.84Å; C384-Y387 PolarHBondContact O-N 2.54Å
385	A	77.6	Confident	81.4	Confident	13 Å²	13	50.9 Å²	50.9	11%	0.107	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-14.4	177.8	0	0	0	0	0	114.7	T160 M381 E383 Y387 T390	T160-A385 HydrophobicContact CG2-CB 4.24Å; M381-A385 WeakPolarHBondContact O-CB 3.35Å; M381-A385 PolarHBondContact O-N 3.03Å; E383-A385 VanDerWaalsContact C-N 3.34Å; E383-A385 PolarHBondContact O-N 3.12Å; A385-Y387 VanDerWaalsContact C-N 3.32Å; A385-T390 VanDerWaalsContact CA-CG2 3.41Å; A385-T390 HydrophobicContact CB-CG2 3.68Å
386	K	70.4	Confident	81.3	Confident	119 Å²	119	46.9 Å²	46.9	52%	0.517	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-21.4	175.7	-62.7	176.3	-177.6	176.6	0	113.6	E383 C384	E383-K386 WeakPolarHBondContact O-CB 2.87Å; E383-K386 PolarHBondContact O-N 3.11Å; C384-K386 PolarHBondContact O-N 2.84Å
387	Y	66.1	Low	81.3	Confident	184 Å²	184	46.2 Å²	46.2	72%	0.722	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-8.5	-166.1	-58.6	-71.6	0	0	0	113.8	E383 C384 A385	E383-Y387 HydrophobicContact CG-CE2 4.37Å; E383-Y387 VanDerWaalsContact O-CD2 3.3Å; E383-Y387 WeakPolarHBondContact O-CD2 3.32Å; E383-Y387 VanDerWaalsContact O-CE2 3.29Å; E383-Y387 WeakPolarHBondContact O-CE2 3.48Å; C384-Y387 PolarHBondContact O-N 2.54Å; A385-Y387 VanDerWaalsContact C-N 3.32Å
388	A	59.8	Low	81.2	Confident	45 Å²	45	46.6 Å²	46.6	37%	0.372	25%	0.25	S	S	.	.	S	Bend	trans	-140.8	147.4	-179.2	0	0	0	0	0	110.5	T390	A388-T390 PolarHBondContact O-N 2.85Å
389	S	59.2	Low	81.3	Confident	121 Å²	121	44.2 Å²	44.2	85%	0.846	24%	0.24	S	C	*	.			trans	-61.8	93.5	158.1	53.5	0	0	0	0	106.9	P391	S389-P391 VanDerWaalsContact O-CD 3.26Å; S389-P391 WeakPolarHBondContact O-CD 3.44Å
390	T	56.6	Low	81.2	Confident	36 Å²	36	43 Å²	43	22%	0.221	23%	0.227	C	C	.	.			trans	-67.6	120.6	-162.6	44.6	0	0	0	0	111.3	T160 A385 A388 Y393	T160-T390 HydrophobicContact CG2-CG2 4.5Å; T160-T390 WeakPolarHBondContact CG2-OG1 3.36Å; A385-T390 VanDerWaalsContact CA-CG2 3.41Å; A385-T390 HydrophobicContact CB-CG2 3.68Å; A388-T390 PolarHBondContact O-N 2.85Å; T390-Y393 HydrophobicContact CG2-CE2 4.37Å
391	P	64	Low	80.9	Confident	62 Å²	62	47.3 Å²	47.3	40%	0.403	24%	0.243	S	C	.	.			trans	-61.6	156	160.8	26.8	-31.1	0	0	0	109.7	S389 Y393	S389-P391 VanDerWaalsContact O-CD 3.26Å; S389-P391 WeakPolarHBondContact O-CD 3.44Å; P391-Y393 HydrophobicContact CG-CE1 4.43Å; P391-Y393 HydrophobicContact CG-CE2 3.87Å; P391-Y393 WeakPolarHBondContact O-CD2 3.46Å; P391-Y393 VanDerWaalsContact O-CE2 3.28Å; P391-Y393 WeakPolarHBondContact O-CE2 3.2Å; P391-Y393 PolarHBondContact O-N 3.44Å
392	E	77.3	Confident	80.7	Confident	132 Å²	132	50.1 Å²	50.1	62%	0.617	26%	0.263	S	S	*	.			trans	-63.3	103.5	174.1	-68.3	-178.2	170.6	0	0	110
393	Y	86.5	Confident	80.8	Confident	10 Å²	10	48.6 Å²	48.6	4%	0.039	26%	0.256	C	S	.	.			trans	-77.3	143.1	173	-66.5	-85.4	0	0	0	112.3	H162 N163 H340 V344 S345 T390 P391	H162-Y393 CarbonylContact C-O 3.57Å; H162-Y393 VanDerWaalsContact CA-O 3.29Å; H162-Y393 WeakPolarHBondContact CA-O 3.38Å; H162-Y393 WeakPolarHBondContact CB-O 3.05Å; H162-Y393 AromaticContact CE1-CD2 3.67Å; H162-Y393 AromaticContact ND1-CD2 3.94Å; H162-Y393 PolarHBondContact ND1-N 3.43Å; N163-Y393 PolarHBondContact N-O 3.31Å; H340-Y393 AromaticContact CD2-CE2 3.49Å; H340-Y393 VanDerWaalsContact CD2-CE2 3.49Å; H340-Y393 WeakPolarHBondContact CD2-CE2 3.34Å; H340-Y393 AromaticContact CD2-CZ 3.39Å; H340-Y393 PolarHBondContact CD2-OH 3.22Å; H340-Y393 AromaticContact CE1-CD2 3.9Å; H340-Y393 AromaticContact CE1-CE1 3.98Å; H340-Y393 AromaticContact CE1-CE2 3.54Å; H340-Y393 AromaticContact CE1-CZ 3.6Å; H340-Y393 AromaticContact CG-CZ 3.69Å; H340-Y393 AromaticContact ND1-CZ 3.82Å; H340-Y393 AromaticContact NE2-CD2 3.7Å; H340-Y393 AromaticContact NE2-CE2 3.06Å; H340-Y393 WeakPolarHBondContact NE2-CE2 3.35Å; H340-Y393 AromaticContact NE2-CZ 3.38Å; V344-Y393 WeakPolarHBondContact O-CD1 3.3Å; V344-Y393 VanDerWaalsContact O-CE1 3.27Å; V344-Y393 WeakPolarHBondContact O-CE1 3.03Å; S345-Y393 CarbonylContact O-C 3.41Å; S345-Y393 VanDerWaalsContact O-CA 3.27Å; S345-Y393 WeakPolarHBondContact O-CA 3.42Å; T390-Y393 HydrophobicContact CG2-CE2 4.37Å; P391-Y393 HydrophobicContact CG-CE1 4.43Å; P391-Y393 HydrophobicContact CG-CE2 3.87Å; P391-Y393 WeakPolarHBondContact O-CD2 3.46Å; P391-Y393 VanDerWaalsContact O-CE2 3.28Å; P391-Y393 WeakPolarHBondContact O-CE2 3.2Å; P391-Y393 PolarHBondContact O-N 3.44Å
394	T	91.3	Very high	81	Confident	20 Å²	20	50 Å²	50	12%	0.123	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.7	165.9	-60.6	0	0	0	0	109.4	N163 R165 S345 S346 L347	N163-T394 HydrophobicContact CB-CG2 4.06Å; N163-T394 CarbonylContact O-C 3.59Å; N163-T394 VanDerWaalsContact O-CA 3.28Å; N163-T394 WeakPolarHBondContact O-CA 3.45Å; R165-T394 HydrophobicContact CG-CG2 4.45Å; S345-T394 PolarHBondContact O-N 2.75Å; S346-T394 CarbonylContact C-O 3.43Å; S346-T394 VanDerWaalsContact CA-O 3.26Å; S346-T394 WeakPolarHBondContact CA-O 3.33Å; L347-T394 PolarHBondContact N-O 2.8Å
395	I	94	Very high	81.4	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.036	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.6	169	-55.8	-57.5	0	0	0	108.7	N163 V164 R165 L347 I349 V377 M381 F397	N163-I395 PolarHBondContact O-N 3.15Å; V164-I395 CarbonylContact C-O 3.55Å; V164-I395 VanDerWaalsContact CA-O 3.32Å; V164-I395 WeakPolarHBondContact CA-O 3.27Å; R165-I395 PolarHBondContact N-O 3.28Å; L347-I395 HydrophobicContact CB-CD1 4.06Å; L347-I395 WeakPolarHBondContact O-CA 3.16Å; I349-I395 HydrophobicContact CD1-CG2 3.82Å; V377-I395 HydrophobicContact CG1-CG2 4.25Å; M381-I395 HydrophobicContact CE-CD1 4.44Å; M381-I395 HydrophobicContact CE-CG1 3.7Å; M381-I395 HydrophobicContact SD-CD1 4.28Å; M381-I395 HydrophobicContact SD-CG1 3.56Å; M381-I395 VanDerWaalsContact SD-CG1 3.56Å; I395-F397 HydrophobicContact CB-CE2 4.32Å; I395-F397 HydrophobicContact CG2-CD2 3.93Å; I395-F397 HydrophobicContact CG2-CE1 4.13Å; I395-F397 HydrophobicContact CG2-CE2 3.42Å; I395-F397 VanDerWaalsContact CG2-CE2 3.42Å; I395-F397 HydrophobicContact CG2-CZ 3.54Å
396	H	94.6	Very high	82.1	Confident	26 Å²	26	56.5 Å²	56.5	12%	0.12	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	100.3	-179.9	177.3	-167.4	0	0	0	109.7	R165 T167 L347 A348 I349	R165-H396 HydrophobicContact CB-CB 4.32Å; T167-H396 VanDerWaalsContact CG2-NE2 3.28Å; T167-H396 WeakPolarHBondContact CG2-NE2 3.39Å; T167-H396 PolarHBondContact OG1-NE2 3.46Å; L347-H396 PolarHBondContact O-N 2.96Å; A348-H396 CarbonylContact C-O 3.49Å; A348-H396 WeakPolarHBondContact CA-O 3.36Å; A348-H396 HydrophobicContact CB-CB 4.21Å; I349-H396 PolarHBondContact N-O 3.44Å
397	F	96.3	Very high	83.2	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	139.6	170.9	-64	-78.3	0	0	0	110.4	V164 R165 L166 T167 I349 L351 V373 F374 V377 I395 F419	V164-F397 HydrophobicContact CG1-CD2 3.83Å; V164-F397 HydrophobicContact CG1-CE2 3.84Å; R165-F397 PolarHBondContact O-N 3.2Å; L166-F397 VanDerWaalsContact CA-O 3.28Å; L166-F397 WeakPolarHBondContact CA-O 3.44Å; L166-F397 HydrophobicContact CD1-CB 3.81Å; T167-F397 PolarHBondContact N-O 3.31Å; T167-F397 VanDerWaalsContact N-O 3.08Å; I349-F397 HydrophobicContact CB-CD1 4.01Å; I349-F397 HydrophobicContact CB-CE1 4.19Å; I349-F397 HydrophobicContact CD1-CE1 4.05Å; I349-F397 HydrophobicContact CG2-CD1 4.26Å; I349-F397 HydrophobicContact CG2-CE1 4.25Å; I349-F397 CarbonylContact O-C 3.57Å; I349-F397 WeakPolarHBondContact O-CA 3.41Å; L351-F397 HydrophobicContact CB-CB 4.32Å; L351-F397 HydrophobicContact CB-CD1 4.48Å; L351-F397 HydrophobicContact CD1-CB 4.43Å; L351-F397 HydrophobicContact CD1-CD1 3.78Å; L351-F397 HydrophobicContact CD1-CE1 4.31Å; L351-F397 HydrophobicContact CD1-CG 4.23Å; V373-F397 HydrophobicContact CG1-CE1 4.01Å; F374-F397 HydrophobicContact CD1-CD1 4.23Å; F374-F397 AromaticContact CD1-CD2 3.91Å; F374-F397 HydrophobicContact CD1-CD2 3.91Å; F374-F397 HydrophobicContact CD1-CE1 4Å; F374-F397 AromaticContact CD1-CE2 3.64Å; F374-F397 HydrophobicContact CD1-CE2 3.64Å; F374-F397 HydrophobicContact CD1-CG 4.17Å; F374-F397 AromaticContact CD1-CZ 3.69Å; F374-F397 HydrophobicContact CD1-CZ 3.69Å; F374-F397 HydrophobicContact CE1-CB 4.14Å; F374-F397 AromaticContact CE1-CD1 4Å; F374-F397 HydrophobicContact CE1-CD1 4Å; F374-F397 AromaticContact CE1-CD2 3.47Å; F374-F397 HydrophobicContact CE1-CD2 3.47Å; F374-F397 VanDerWaalsContact CE1-CD2 3.47Å; F374-F397 HydrophobicContact CE1-CE1 4.24Å; F374-F397 AromaticContact CE1-CE2 3.72Å; F374-F397 HydrophobicContact CE1-CE2 3.72Å; F374-F397 AromaticContact CE1-CG 3.59Å; F374-F397 HydrophobicContact CE1-CG 3.59Å; F374-F397 HydrophobicContact CE1-CZ 4.1Å; V377-F397 HydrophobicContact CB-CE1 4.47Å; V377-F397 HydrophobicContact CB-CZ 4.02Å; V377-F397 HydrophobicContact CG1-CZ 3.9Å; V377-F397 HydrophobicContact CG2-CE1 4.16Å; V377-F397 HydrophobicContact CG2-CZ 4.21Å; I395-F397 HydrophobicContact CB-CE2 4.32Å; I395-F397 HydrophobicContact CG2-CD2 3.93Å; I395-F397 HydrophobicContact CG2-CE1 4.13Å; I395-F397 HydrophobicContact CG2-CE2 3.42Å; I395-F397 VanDerWaalsContact CG2-CE2 3.42Å; I395-F397 HydrophobicContact CG2-CZ 3.54Å; F397-F419 HydrophobicContact CE2-CE2 4.38Å; F397-F419 HydrophobicContact CE2-CZ 4.16Å; F397-F419 HydrophobicContact CZ-CZ 4.35Å
398	F	94.3	Very high	84.6	Confident	7 Å²	7	42.9 Å²	42.9	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	143.7	171.3	62.3	-90.2	0	0	0	111.5	T167 V169 N170 P171 L202 A348 I349 P350 L351	T167-F398 CarbonylContact O-C 3.14Å; T167-F398 VanDerWaalsContact O-CA 3.25Å; T167-F398 WeakPolarHBondContact O-CA 3.46Å; V169-F398 WeakPolarHBondContact O-CB 3.47Å; N170-F398 HydrophobicContact CB-CD2 3.86Å; N170-F398 HydrophobicContact CB-CE2 3.69Å; P171-F398 HydrophobicContact CG-CD1 4.25Å; L202-F398 HydrophobicContact CD1-CE1 3.54Å; L202-F398 HydrophobicContact CD1-CZ 3.91Å; A348-F398 HydrophobicContact CB-CD1 4.26Å; A348-F398 HydrophobicContact CB-CE1 4.16Å; I349-F398 WeakPolarHBondContact O-CD1 3.35Å; I349-F398 PolarHBondContact O-N 3.38Å; P350-F398 HydrophobicContact CB-CD2 4.37Å; P350-F398 HydrophobicContact CB-CE1 4.35Å; P350-F398 HydrophobicContact CB-CE2 3.63Å; P350-F398 HydrophobicContact CB-CZ 3.62Å; P350-F398 HydrophobicContact CG-CE2 4.46Å; P350-F398 HydrophobicContact CG-CZ 3.99Å; P350-F398 VanDerWaalsContact N-CE1 3.29Å; L351-F398 PolarHBondContact N-O 2.9Å
399	L	93.4	Very high	86.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.262	C	S	.	.			trans	-102.9	154.3	172.4	-75.1	161	0	0	0	109.4	L166 T167 N168 V169 L351 L352 V403 F408 C411	L166-L399 HydrophobicContact CD1-CD1 4.16Å; L166-L399 HydrophobicContact CD1-CG 4.36Å; L166-L399 HydrophobicContact CD2-CD1 4.49Å; T167-L399 PolarHBondContact O-N 3.12Å; N168-L399 CarbonylContact C-O 3.58Å; V169-L399 PolarHBondContact N-O 3.43Å; V169-L399 VanDerWaalsContact N-O 3.13Å; L351-L399 HydrophobicContact CB-CD2 4.12Å; L351-L399 HydrophobicContact CB-CG 4.34Å; L351-L399 HydrophobicContact CD2-CD1 4.29Å; L351-L399 HydrophobicContact CD2-CD2 4Å; L351-L399 HydrophobicContact CD2-CG 4.05Å; L351-L399 HydrophobicContact CG-CD2 4.39Å; L352-L399 HydrophobicContact CD1-CD2 3.63Å; L352-L399 HydrophobicContact CD2-CD2 4.21Å; L352-L399 HydrophobicContact CG-CD2 3.65Å; L399-V403 HydrophobicContact CB-CB 4.36Å; L399-V403 HydrophobicContact CB-CG1 4.02Å; L399-V403 HydrophobicContact CD1-CG1 4.46Å; L399-V403 HydrophobicContact CD1-CG2 4.39Å; L399-F408 HydrophobicContact CD1-CD2 3.85Å; L399-C411 HydrophobicContact CD1-CB 4.13Å
400	P	89	Confident	87.9	Confident	8 Å²	8	46.1 Å²	46.1	5%	0.052	24%	0.239	C	C	.	.			trans	-55.8	150.8	168.5	-25.8	36.1	0	0	0	112.5	D356 L357 S402 V403	D356-P400 WeakPolarHBondContact OD1-CB 3.36Å; L357-P400 HydrophobicContact CD2-CG 4.48Å; L357-P400 HydrophobicContact CG-CB 4.36Å; L357-P400 HydrophobicContact CG-CG 4.23Å; P400-S402 PolarHBondContact O-N 2.95Å; P400-V403 WeakPolarHBondContact O-CB 3.36Å; P400-V403 VanDerWaalsContact O-CG1 3.28Å; P400-V403 WeakPolarHBondContact O-CG1 3.45Å; P400-V403 PolarHBondContact O-N 3.43Å; P400-V403 VanDerWaalsContact O-N 3.15Å
401	Y	84.1	Confident	89.8	Confident	112 Å²	112	44.4 Å²	44.4	44%	0.439	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.8	179.8	-179.6	-98.1	0	0	0	113.5	L142 N168 V403	L142-Y401 HydrophobicContact CB-CE2 4.33Å; L142-Y401 HydrophobicContact CD1-CE1 4.44Å; N168-Y401 VanDerWaalsContact O-CA 3.23Å; N168-Y401 WeakPolarHBondContact O-CA 3.43Å; Y401-V403 PolarHBondContact O-N 3.04Å
402	S	84.4	Confident	91.1	Very high	61 Å²	61	41.6 Å²	41.6	43%	0.427	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-8.5	176.3	58.3	0	0	0	0	114	D356 P400 N404	D356-S402 WeakPolarHBondContact OD1-CB 3.28Å; D356-S402 PolarHBondContact OD1-OG 2.97Å; P400-S402 PolarHBondContact O-N 2.95Å; S402-N404 PolarHBondContact O-N 3.17Å
403	V	89.1	Confident	91.8	Very high	12 Å²	12	41.1 Å²	41.1	7%	0.073	21%	0.208	C	C	.	.			trans	-63	134.4	-178.9	79.7	0	0	0	0	111.1	N168 L357 L399 P400 Y401 L407 F408	N168-V403 HydrophobicContact CB-CG1 3.97Å; L357-V403 HydrophobicContact CD1-CB 4.11Å; L357-V403 HydrophobicContact CD1-CG2 4.15Å; L399-V403 HydrophobicContact CB-CB 4.36Å; L399-V403 HydrophobicContact CB-CG1 4.02Å; L399-V403 HydrophobicContact CD1-CG1 4.46Å; L399-V403 HydrophobicContact CD1-CG2 4.39Å; P400-V403 WeakPolarHBondContact O-CB 3.36Å; P400-V403 VanDerWaalsContact O-CG1 3.28Å; P400-V403 WeakPolarHBondContact O-CG1 3.45Å; P400-V403 PolarHBondContact O-N 3.43Å; P400-V403 VanDerWaalsContact O-N 3.15Å; Y401-V403 PolarHBondContact O-N 3.04Å; V403-L407 HydrophobicContact CG2-CB 4.05Å; V403-L407 HydrophobicContact CG2-CD2 3.53Å; V403-L407 HydrophobicContact CG2-CG 3.72Å; V403-F408 HydrophobicContact CG1-CB 4.39Å
404	N	89.8	Confident	92.1	Very high	67 Å²	67	42 Å²	42	36%	0.358	21%	0.213	S	C	.	.			trans	-69.6	154.1	175.4	73.7	41.7	0	0	0	110.8	S402 S406 L407 F408	S402-N404 PolarHBondContact O-N 3.17Å; N404-S406 VanDerWaalsContact C-N 3.31Å; N404-S406 PolarHBondContact O-N 2.95Å; N404-S406 PolarHBondContact OD1-N 3.17Å; N404-S406 PolarHBondContact OD1-OG 3.48Å; N404-L407 WeakPolarHBondContact OD1-CB 3.34Å; N404-L407 PolarHBondContact OD1-N 3.39Å; N404-F408 PolarHBondContact O-N 2.78Å
405	P	91.5	Very high	92.1	Very high	103 Å²	103	41 Å²	41	67%	0.669	21%	0.207	S	C	*	.	H	α-helix	trans	-67	-23.4	-177.9	-24.5	35.2	0	0	0	115.6	R409	P405-R409 PolarHBondContact O-N 2.96Å
406	S	93.2	Very high	91.5	Very high	55 Å²	55	43.7 Å²	43.7	39%	0.385	22%	0.224	S	C	.	.	H	α-helix	trans	-70.8	-52	177.4	51.6	0	0	0	0	110.6	E363 N404 F408 R409 E410	E363-S406 PolarHBondContact OE1-OG 3.13Å; N404-S406 VanDerWaalsContact C-N 3.31Å; N404-S406 PolarHBondContact O-N 2.95Å; N404-S406 PolarHBondContact OD1-N 3.17Å; N404-S406 PolarHBondContact OD1-OG 3.48Å; S406-F408 VanDerWaalsContact C-N 3.27Å; S406-F408 PolarHBondContact O-N 2.97Å; S406-R409 WeakPolarHBondContact O-CA 3.23Å; S406-R409 WeakPolarHBondContact O-CB 3.28Å; S406-R409 PolarHBondContact O-N 3.29Å; S406-E410 PolarHBondContact O-N 2.93Å
407	L	93.9	Very high	91.2	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-57	-40.7	175.7	175.7	55.4	0	0	0	111.5	E363 C366 L367 V403 N404 R409 E410 C411	E363-L407 HydrophobicContact CG-CD1 4.25Å; C366-L407 HydrophobicContact CB-CD1 3.78Å; C366-L407 HydrophobicContact CB-CD2 3.54Å; C366-L407 HydrophobicContact CB-CG 4.26Å; L367-L407 HydrophobicContact CD2-CD1 3.55Å; L367-L407 HydrophobicContact CG-CD1 3.76Å; V403-L407 HydrophobicContact CG2-CB 4.05Å; V403-L407 HydrophobicContact CG2-CD2 3.53Å; V403-L407 HydrophobicContact CG2-CG 3.72Å; N404-L407 WeakPolarHBondContact OD1-CB 3.34Å; N404-L407 PolarHBondContact OD1-N 3.39Å; L407-R409 VanDerWaalsContact C-N 3.32Å; L407-R409 PolarHBondContact O-N 3.38Å; L407-E410 PolarHBondContact O-N 3.43Å; L407-C411 WeakPolarHBondContact O-CB 3.36Å; L407-C411 PolarHBondContact O-N 2.87Å; L407-C411 PolarHBondContact O-SG 3.21Å
408	F	94.6	Very high	90.9	Very high	13 Å²	13	47.3 Å²	47.3	6%	0.057	25%	0.251	C	S	.	.	H	α-helix	trans	-57.9	-45	173.7	-178.2	-89	0	0	0	112.2	V145 L166 N168 L399 V403 N404 S406 C411 A412	V145-F408 HydrophobicContact CB-CE1 4.11Å; V145-F408 HydrophobicContact CB-CZ 4.18Å; V145-F408 HydrophobicContact CG1-CD1 4.17Å; V145-F408 HydrophobicContact CG1-CE1 3.47Å; V145-F408 VanDerWaalsContact CG1-CE1 3.47Å; V145-F408 HydrophobicContact CG1-CZ 3.89Å; L166-F408 HydrophobicContact CB-CZ 4.48Å; L166-F408 HydrophobicContact CD2-CD2 4.36Å; L166-F408 HydrophobicContact CD2-CE2 3.97Å; L166-F408 HydrophobicContact CD2-CZ 4.1Å; L166-F408 HydrophobicContact CG-CD2 4.46Å; L166-F408 HydrophobicContact CG-CE2 3.72Å; L166-F408 HydrophobicContact CG-CZ 3.97Å; N168-F408 HydrophobicContact CB-CD2 3.8Å; N168-F408 HydrophobicContact CB-CE2 3.91Å; L399-F408 HydrophobicContact CD1-CD2 3.85Å; V403-F408 HydrophobicContact CG1-CB 4.39Å; N404-F408 PolarHBondContact O-N 2.78Å; S406-F408 VanDerWaalsContact C-N 3.27Å; S406-F408 PolarHBondContact O-N 2.97Å; F408-C411 PolarHBondContact O-N 3.15Å; F408-A412 PolarHBondContact O-N 3.26Å
409	R	93.5	Very high	90.3	Very high	156 Å²	156	47.1 Å²	47.1	59%	0.589	25%	0.25	S	C	*	.	H	α-helix	trans	-66	-42.6	179.9	-166.5	-174.5	-46.6	-178.4	7	111.6	P405 S406 L407 C411 A412 E413	P405-R409 PolarHBondContact O-N 2.96Å; S406-R409 WeakPolarHBondContact O-CA 3.23Å; S406-R409 WeakPolarHBondContact O-CB 3.28Å; S406-R409 PolarHBondContact O-N 3.29Å; L407-R409 VanDerWaalsContact C-N 3.32Å; L407-R409 PolarHBondContact O-N 3.38Å; R409-C411 VanDerWaalsContact C-N 3.34Å; R409-C411 PolarHBondContact O-N 3.33Å; R409-A412 WeakPolarHBondContact O-CB 3.26Å; R409-A412 PolarHBondContact O-N 3.25Å; R409-A412 VanDerWaalsContact O-N 3.15Å; R409-E413 WeakPolarHBondContact O-CG 3.37Å; R409-E413 PolarHBondContact O-N 2.99Å
410	E	95.4	Very high	89.3	Confident	78 Å²	78	52.1 Å²	52.1	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-42	176.1	-70	-177.1	-137.3	0	0	111.6	L367 S406 L407 A412 E413 M414	L367-E410 WeakPolarHBondContact CD1-OE2 3.25Å; L367-E410 HydrophobicContact CD2-CB 3.67Å; S406-E410 PolarHBondContact O-N 2.93Å; L407-E410 PolarHBondContact O-N 3.43Å; E410-A412 VanDerWaalsContact C-N 3.33Å; E410-A412 PolarHBondContact O-N 3.37Å; E410-E413 PolarHBondContact O-N 3.44Å; E410-M414 WeakPolarHBondContact O-CB 3.46Å; E410-M414 PolarHBondContact O-N 3.22Å
411	C	95.1	Very high	87.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-42.5	172.6	-67.8	0	0	0	0	111.6	L166 L351 L399 L407 F408 R409 M414 I415	L166-C411 HydrophobicContact CD2-CB 3.92Å; L351-C411 HydrophobicContact CD2-CB 4.19Å; L399-C411 HydrophobicContact CD1-CB 4.13Å; L407-C411 WeakPolarHBondContact O-CB 3.36Å; L407-C411 PolarHBondContact O-N 2.87Å; L407-C411 PolarHBondContact O-SG 3.21Å; F408-C411 PolarHBondContact O-N 3.15Å; R409-C411 VanDerWaalsContact C-N 3.34Å; R409-C411 PolarHBondContact O-N 3.33Å; C411-M414 WeakPolarHBondContact O-CB 3.41Å; C411-M414 PolarHBondContact O-N 3.15Å; C411-I415 WeakPolarHBondContact O-CG1 3.47Å; C411-I415 PolarHBondContact O-N 3.21Å; C411-I415 VanDerWaalsContact O-N 3.13Å
412	A	92.5	Very high	85.9	Confident	3 Å²	3	52 Å²	52	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-41.8	177.4	0	0	0	0	0	113.2	F149 L166 F408 R409 E410 M414 I415	F149-A412 HydrophobicContact CZ-CB 4.23Å; L166-A412 HydrophobicContact CD2-CB 4Å; F408-A412 PolarHBondContact O-N 3.26Å; R409-A412 WeakPolarHBondContact O-CB 3.26Å; R409-A412 PolarHBondContact O-N 3.25Å; R409-A412 VanDerWaalsContact O-N 3.15Å; E410-A412 VanDerWaalsContact C-N 3.33Å; E410-A412 PolarHBondContact O-N 3.37Å; A412-M414 VanDerWaalsContact C-N 3.28Å; A412-M414 PolarHBondContact O-N 3.47Å; A412-I415 WeakPolarHBondContact O-CB 3.42Å; A412-I415 PolarHBondContact O-N 3.31Å
413	E	91.6	Very high	83.7	Confident	122 Å²	122	58 Å²	58	57%	0.57	30%	0.303	S	S	*	.	H	α-helix	trans	-62.3	-38.9	174.3	-73.5	174.7	-169.2	0	0	111	R409 E410 I415 T416 S417	R409-E413 WeakPolarHBondContact O-CG 3.37Å; R409-E413 PolarHBondContact O-N 2.99Å; E410-E413 PolarHBondContact O-N 3.44Å; E413-I415 VanDerWaalsContact C-N 3.33Å; E413-I415 PolarHBondContact O-N 2.96Å; E413-T416 VanDerWaalsContact O-CA 3.31Å; E413-T416 WeakPolarHBondContact O-CA 3.3Å; E413-T416 VanDerWaalsContact O-CB 3.25Å; E413-T416 WeakPolarHBondContact O-CB 3.1Å; E413-T416 PolarHBondContact O-N 3.45Å; E413-S417 PolarHBondContact O-N 2.83Å
414	M	92.6	Very high	81.3	Confident	28 Å²	28	62.7 Å²	62.7	14%	0.138	33%	0.333	C	S	.	.	H	α-helix	trans	-64	-34	176.6	-164.9	-171.6	-63.3	0	0	113.2	L367 A370 E371 F374 E410 C411 A412 T416 S417 I418	L367-M414 HydrophobicContact CB-CE 4.39Å; L367-M414 HydrophobicContact CD2-CE 4.08Å; A370-M414 HydrophobicContact CB-SD 4.45Å; E371-M414 WeakPolarHBondContact CA-SD 3.41Å; E371-M414 HydrophobicContact CB-CE 4.14Å; E371-M414 HydrophobicContact CB-SD 3.49Å; E371-M414 WeakPolarHBondContact CB-SD 3.43Å; E371-M414 HydrophobicContact CG-SD 3.9Å; E371-M414 PolarHBondContact N-SD 3.19Å; F374-M414 HydrophobicContact CD2-CG 4.17Å; F374-M414 HydrophobicContact CD2-SD 3.77Å; F374-M414 HydrophobicContact CE2-CB 4.31Å; F374-M414 HydrophobicContact CE2-CG 4.44Å; F374-M414 HydrophobicContact CE2-SD 4.11Å; E410-M414 WeakPolarHBondContact O-CB 3.46Å; E410-M414 PolarHBondContact O-N 3.22Å; C411-M414 WeakPolarHBondContact O-CB 3.41Å; C411-M414 PolarHBondContact O-N 3.15Å; A412-M414 VanDerWaalsContact C-N 3.28Å; A412-M414 PolarHBondContact O-N 3.47Å; M414-T416 PolarHBondContact O-N 3.16Å; M414-S417 PolarHBondContact O-N 2.88Å; M414-S417 PolarHBondContact O-OG 2.96Å; M414-I418 HydrophobicContact CG-CD1 3.54Å; M414-I418 HydrophobicContact CG-CG1 4.16Å; M414-I418 WeakPolarHBondContact O-CB 3.1Å; M414-I418 WeakPolarHBondContact O-CG1 3.15Å; M414-I418 PolarHBondContact O-N 2.66Å; M414-I418 HydrophobicContact SD-CD1 3.96Å
415	I	90.2	Very high	78.6	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-58.1	-36.8	170.2	-60.1	176.3	0	0	0	109.3	F149 R151 V164 L166 F374 C411 A412 E413 F419	F149-I415 HydrophobicContact CD2-CB 4.49Å; F149-I415 HydrophobicContact CD2-CD1 4.31Å; F149-I415 HydrophobicContact CD2-CG2 4Å; F149-I415 HydrophobicContact CE2-CB 4.31Å; F149-I415 HydrophobicContact CE2-CD1 3.98Å; F149-I415 HydrophobicContact CE2-CG2 4.32Å; F149-I415 HydrophobicContact CG-CG2 4.44Å; R151-I415 VanDerWaalsContact CZ-O 3.28Å; R151-I415 PolarHBondContact NH1-O 3.09Å; V164-I415 HydrophobicContact CB-CG2 4.25Å; V164-I415 HydrophobicContact CG1-CD1 4.34Å; V164-I415 HydrophobicContact CG1-CG2 3.73Å; L166-I415 HydrophobicContact CB-CD1 3.68Å; L166-I415 HydrophobicContact CD2-CD1 4.01Å; L166-I415 HydrophobicContact CG-CD1 4.29Å; F374-I415 HydrophobicContact CD1-CG1 4.38Å; F374-I415 HydrophobicContact CE1-CD1 3.96Å; F374-I415 HydrophobicContact CE1-CG1 3.63Å; F374-I415 HydrophobicContact CE2-CG1 3.8Å; F374-I415 HydrophobicContact CZ-CD1 3.74Å; F374-I415 HydrophobicContact CZ-CG1 3.29Å; C411-I415 WeakPolarHBondContact O-CG1 3.47Å; C411-I415 PolarHBondContact O-N 3.21Å; C411-I415 VanDerWaalsContact O-N 3.13Å; A412-I415 WeakPolarHBondContact O-CB 3.42Å; A412-I415 PolarHBondContact O-N 3.31Å; E413-I415 VanDerWaalsContact C-N 3.33Å; E413-I415 PolarHBondContact O-N 2.96Å; I415-F419 HydrophobicContact CG2-CD2 3.87Å; I415-F419 WeakPolarHBondContact O-CB 3.33Å; I415-F419 PolarHBondContact O-N 2.77Å
416	T	82.9	Confident	75.9	Confident	62 Å²	62	69 Å²	69	38%	0.38	37%	0.365	S	S	.	.	H	α-helix	trans	-68.6	-37.7	-179.8	-48.1	0	0	0	0	114.4	R151 E413 M414	R151-T416 VanDerWaalsContact NH1-CA 3.31Å; R151-T416 VanDerWaalsContact NH2-N 3.17Å; R151-T416 PolarHBondContact NH2-OG1 3.1Å; E413-T416 VanDerWaalsContact O-CA 3.31Å; E413-T416 WeakPolarHBondContact O-CA 3.3Å; E413-T416 VanDerWaalsContact O-CB 3.25Å; E413-T416 WeakPolarHBondContact O-CB 3.1Å; E413-T416 PolarHBondContact O-N 3.45Å; M414-T416 PolarHBondContact O-N 3.16Å
417	S	87.1	Confident	73.1	Confident	88 Å²	88	74.2 Å²	74.2	62%	0.615	41%	0.411	S	S	*	.	H	α-helix	trans	-75.9	-38	175.7	65	0	0	0	0	112.5	E413 M414	E413-S417 PolarHBondContact O-N 2.83Å; M414-S417 PolarHBondContact O-N 2.88Å; M414-S417 PolarHBondContact O-OG 2.96Å
418	I	89.9	Confident	72	Confident	14 Å²	14	77.7 Å²	77.7	7%	0.072	43%	0.431	C	S	.	.	H	α-helix	trans	-80.8	-48.6	-173.8	-66.8	174.2	0	0	0	111.9	E371 F374 K375 K378 M414	E371-I418 HydrophobicContact CG-CD1 4.13Å; F374-I418 HydrophobicContact CB-CD1 3.53Å; F374-I418 HydrophobicContact CB-CG2 4.21Å; F374-I418 HydrophobicContact CD2-CD1 3.97Å; F374-I418 HydrophobicContact CG-CD1 4.2Å; K375-I418 HydrophobicContact CG-CD1 4.17Å; K375-I418 HydrophobicContact CG-CG2 4.36Å; K378-I418 HydrophobicContact CD-CG2 3.89Å; K378-I418 WeakPolarHBondContact CD-O 3.49Å; K378-I418 WeakPolarHBondContact CE-O 3.36Å; K378-I418 PolarHBondContact NZ-O 3.21Å; M414-I418 HydrophobicContact CG-CD1 3.54Å; M414-I418 HydrophobicContact CG-CG1 4.16Å; M414-I418 WeakPolarHBondContact O-CB 3.1Å; M414-I418 WeakPolarHBondContact O-CG1 3.15Å; M414-I418 PolarHBondContact O-N 2.66Å; M414-I418 HydrophobicContact SD-CD1 3.96Å
419	F	83.5	Confident	70.8	Confident	3 Å²	3	81.1 Å²	81.1	1%	0.013	45%	0.451	C	S	.	.	S	Bend	trans	-99.3	104.8	-178.8	-62.7	-95.2	0	0	0	107.4	R151 L153 V164 F374 K378 M381 F397 I415 T421	R151-F419 HydrophobicContact CB-CB 4.19Å; R151-F419 WeakPolarHBondContact CD-O 3.46Å; R151-F419 HydrophobicContact CG-CB 4.28Å; R151-F419 PolarHBondContact NH1-O 3.24Å; L153-F419 HydrophobicContact CD1-CD1 4.2Å; V164-F419 HydrophobicContact CG2-CD1 4.1Å; V164-F419 HydrophobicContact CG2-CE1 4.33Å; V164-F419 HydrophobicContact CG2-CG 4.35Å; F374-F419 HydrophobicContact CB-CE2 3.89Å; F374-F419 HydrophobicContact CB-CZ 4.47Å; F374-F419 AromaticContact CD1-CE2 3.81Å; F374-F419 HydrophobicContact CD1-CE2 3.81Å; F374-F419 HydrophobicContact CD1-CZ 4.45Å; F374-F419 HydrophobicContact CG-CE2 4.07Å; K378-F419 HydrophobicContact CB-CD1 4.21Å; K378-F419 HydrophobicContact CB-CE1 3.63Å; K378-F419 HydrophobicContact CB-CZ 3.96Å; K378-F419 HydrophobicContact CG-CD1 4.07Å; K378-F419 HydrophobicContact CG-CE1 3.97Å; M381-F419 HydrophobicContact SD-CE1 4.5Å; F397-F419 HydrophobicContact CE2-CE2 4.38Å; F397-F419 HydrophobicContact CE2-CZ 4.16Å; F397-F419 HydrophobicContact CZ-CZ 4.35Å; I415-F419 HydrophobicContact CG2-CD2 3.87Å; I415-F419 WeakPolarHBondContact O-CB 3.33Å; I415-F419 PolarHBondContact O-N 2.77Å; F419-T421 PolarHBondContact O-N 3.34Å
420	Q	72.4	Confident	69.6	Low	105 Å²	105	76.9 Å²	76.9	49%	0.491	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-63.3	129.8	-174.8	-73.2	174.2	-5.5	0	0	111.1	E152	E152-Q420 PolarHBondContact N-O 3.46Å
421	T	54.1	Low	68	Low	74 Å²	74	76.9 Å²	76.9	45%	0.454	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-79.1	131.4	170.2	6.9	0	0	0	0	108.8	R151 F419 K423	R151-T421 HydrophobicContact CG-CG2 4.48Å; F419-T421 PolarHBondContact O-N 3.34Å; T421-K423 PolarHBondContact O-N 3.19Å
422	T	46.7	Very low	66.4	Low	45 Å²	45	81.7 Å²	81.7	28%	0.276	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-72.2	125	153.8	30.4	0	0	0	0	108.3	E152	E152-T422 HydrophobicContact CB-CG2 4.1Å; E152-T422 HydrophobicContact CG-CG2 4.03Å; E152-T422 VanDerWaalsContact OE1-CB 3.31Å; E152-T422 WeakPolarHBondContact OE1-CB 3.37Å; E152-T422 WeakPolarHBondContact OE1-CG2 3.45Å; E152-T422 PolarHBondContact OE1-OG1 3.46Å; E152-T422 WeakPolarHBondContact OE2-CG2 3.06Å
423	K	38.3	Very low	64.6	Low	187 Å²	187	86.9 Å²	86.9	81%	0.813	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-63.4	137.9	154.6	-71.1	-176.6	178	-178.4	0	105.9	T421 L425	T421-K423 PolarHBondContact O-N 3.19Å; K423-L425 PolarHBondContact O-N 2.94Å
424	P	38.6	Very low	62.7	Low	109 Å²	109	84.4 Å²	84.4	71%	0.708	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-52.3	131	169.1	23.2	-30.9	0	0	0	107.3	V426	P424-V426 VanDerWaalsContact C-N 3.28Å; P424-V426 PolarHBondContact O-N 2.98Å
425	L	34.1	Very low	60.4	Low	166 Å²	166	88.8 Å²	88.8	87%	0.869	53%	0.529	S	S	*	.			trans	-59.6	100.7	169	-80.4	157.9	0	0	0	105.8	K423 A427	K423-L425 PolarHBondContact O-N 2.94Å; L425-A427 PolarHBondContact O-N 3.3Å; L425-A427 VanDerWaalsContact O-N 3.09Å
426	V	33.3	Very low	57.9	Low	137 Å²	137	96.2 Å²	96.2	83%	0.83	57%	0.573	S	S	*	*			trans	-70.1	104.2	166.5	-177.4	0	0	0	0	104.5	P424	P424-V426 VanDerWaalsContact C-N 3.28Å; P424-V426 PolarHBondContact O-N 2.98Å
427	A	34.1	Very low	55.6	Low	164 Å²	164	99.3 Å²	99.3	100%	1.355	59%	0.591	S	S	*	*			trans	-73.5	0	170.6	0	0	0	0	0	110.3	L425	L425-A427 PolarHBondContact O-N 3.3Å; L425-A427 VanDerWaalsContact O-N 3.09Å

Retrieved 427 of 427 residues in 251.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).