SF3A3_HUMAN Loading...

Splicing factor 3A subunit 3

Component of the 17S U2 SnRNP complex of the spliceosome, a large ribonucleoprotein complex that removes introns from transcribed pre-mRNAs^1,2,3,4,5. The 17S U2 SnRNP complex (1) directly participates in early spliceosome assembly and (2) mediates recognition of the intron branch site during pre-mRNA splicing by promoting the selection of the pre-mRNA branch-site adenosine, the nucleophile for the first step of splicing^6,7,8,9. Within the 17S U2 SnRNP complex, SF3A3 is part of the SF3A subcomplex that contributes to the assembly of the 17S U2 snRNP, and the subsequent assembly of the pre-spliceosome 'E' complex and the pre-catalytic spliceosome 'A' complex^10,11. Involved in pre-mRNA splicing as a component of pre-catalytic spliceosome 'B' complexes^12,13.

AlphaFold DB , UniProt , Accession Q12874, Species HUMAN (Homo sapiens, Human), Gene SF3A3, Length 501 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	60	Low	89.1	Confident	126 Å²	126	68.3 Å²	68.3	62%	0.621	31%	0.308	S	S	*	.				0	98.8	0	-164.1	-168.9	-46.6	0	0	105.2	T3 Q90	M1-T3 HydrophobicContact CG-CG2 4.47Å; M1-T3 PolarHBondContact O-N 3.24Å; M1-T3 VanDerWaalsContact O-N 3.12Å; M1-T3 HydrophobicContact SD-CG2 4.4Å; M1-Q90 HydrophobicContact CE-CB 3.58Å; M1-Q90 HydrophobicContact CE-CG 4.24Å
2	E	76.6	Confident	89.8	Confident	132 Å²	132	68.8 Å²	68.8	62%	0.617	31%	0.311	S	S	*	.			trans	-82	87.4	-178.3	-75.5	-175.3	142.6	0	0	108.8	Q7 R10	E2-Q7 HydrophobicContact CB-CG 4.47Å; E2-R10 IonicContact OE1-NH1 3.02Å; E2-R10 PolarHBondContact OE1-NH1 2.69Å
3	T	89.5	Confident	90.3	Very high	29 Å²	29	66.7 Å²	66.7	18%	0.178	30%	0.302	C	S	.	.			trans	-72.4	157.9	171.5	67.6	0	0	0	0	109.8	M1 L5 E6 Q7 E71	M1-T3 HydrophobicContact CG-CG2 4.47Å; M1-T3 PolarHBondContact O-N 3.24Å; M1-T3 VanDerWaalsContact O-N 3.12Å; M1-T3 HydrophobicContact SD-CG2 4.4Å; T3-L5 PolarHBondContact O-N 2.98Å; T3-E6 PolarHBondContact O-N 2.74Å; T3-E6 WeakPolarHBondContact OG1-CB 3.28Å; T3-E6 PolarHBondContact OG1-N 2.7Å; T3-E6 VanDerWaalsContact OG1-N 3.13Å; T3-Q7 WeakPolarHBondContact O-CG 3.42Å; T3-Q7 PolarHBondContact O-N 2.59Å; T3-E71 VanDerWaalsContact CB-OE1 3.31Å; T3-E71 WeakPolarHBondContact CB-OE1 3.44Å; T3-E71 WeakPolarHBondContact CG2-OE1 3.37Å
4	I	92.4	Very high	90.8	Very high	18 Å²	18	62.9 Å²	62.9	9%	0.092	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-33.7	176.4	-170.2	157.7	0	0	0	112.2	Q7 Q8 L60 L67 R68 E71	I4-Q7 PolarHBondContact O-N 3.12Å; I4-Q8 VanDerWaalsContact O-CG 3.31Å; I4-Q8 WeakPolarHBondContact O-CG 3.42Å; I4-Q8 PolarHBondContact O-N 3.32Å; I4-L60 HydrophobicContact CD1-CD2 3.98Å; I4-L60 HydrophobicContact CG1-CD2 4.07Å; I4-L67 HydrophobicContact CD1-CB 4.12Å; I4-R68 HydrophobicContact CD1-CB 3.84Å; I4-R68 HydrophobicContact CG1-CB 4.41Å; I4-R68 HydrophobicContact CG2-CB 4.39Å; I4-E71 HydrophobicContact CG2-CB 3.58Å; I4-E71 HydrophobicContact CG2-CG 3.74Å
5	L	92.6	Very high	91.3	Very high	46 Å²	46	61.4 Å²	61.4	24%	0.241	28%	0.278	C	S	.	.	H	α-helix	trans	-68	-36.8	173.9	-65.1	176.4	0	0	0	112.3	T3 Q8 R9 E71 L72 I75	T3-L5 PolarHBondContact O-N 2.98Å; L5-Q8 PolarHBondContact O-N 3.35Å; L5-R9 WeakPolarHBondContact O-CB 3.05Å; L5-R9 PolarHBondContact O-N 2.6Å; L5-E71 HydrophobicContact CD1-CG 3.78Å; L5-E71 HydrophobicContact CG-CG 3.79Å; L5-L72 HydrophobicContact CD1-CD2 4.24Å; L5-L72 HydrophobicContact CD2-CD2 4.14Å; L5-I75 HydrophobicContact CD1-CD1 3.52Å
6	E	92	Very high	91.6	Very high	71 Å²	71	66.1 Å²	66.1	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-68.9	-38.6	173.7	177.6	54.5	-156.5	0	0	111.4	T3 R9 R10	T3-E6 PolarHBondContact O-N 2.74Å; T3-E6 WeakPolarHBondContact OG1-CB 3.28Å; T3-E6 PolarHBondContact OG1-N 2.7Å; T3-E6 VanDerWaalsContact OG1-N 3.13Å; E6-R9 PolarHBondContact O-N 3.49Å; E6-R9 IonicContact OE1-CZ 3.64Å; E6-R9 IonicContact OE1-NE 3.33Å; E6-R9 PolarHBondContact OE1-NE 3.39Å; E6-R9 VanDerWaalsContact OE1-NE 3.12Å; E6-R9 IonicContact OE1-NH2 3.51Å; E6-R9 PolarHBondContact OE1-NH2 3.35Å; E6-R9 IonicContact OE2-CZ 2.84Å; E6-R9 IonicContact OE2-NE 2.85Å; E6-R9 PolarHBondContact OE2-NE 3.38Å; E6-R9 IonicContact OE2-NH2 3.31Å; E6-R10 VanDerWaalsContact O-CB 3.25Å; E6-R10 WeakPolarHBondContact O-CB 3.23Å; E6-R10 PolarHBondContact O-N 2.63Å
7	Q	94.3	Very high	91.9	Very high	60 Å²	60	67.4 Å²	67.4	28%	0.28	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-44.8	172.3	-67.1	174.6	22.5	0	0	111.2	E2 T3 I4 R9 R10 Y11 L60	E2-Q7 HydrophobicContact CB-CG 4.47Å; T3-Q7 WeakPolarHBondContact O-CG 3.42Å; T3-Q7 PolarHBondContact O-N 2.59Å; I4-Q7 PolarHBondContact O-N 3.12Å; Q7-R9 PolarHBondContact O-N 3.45Å; Q7-R10 PolarHBondContact O-N 3.32Å; Q7-Y11 VanDerWaalsContact O-CD2 3.23Å; Q7-Y11 WeakPolarHBondContact O-CD2 3.39Å; Q7-Y11 PolarHBondContact O-N 2.92Å; Q7-L60 HydrophobicContact CB-CD1 3.96Å
8	Q	95.8	Very high	92.2	Very high	7 Å²	7	63.7 Å²	63.7	3%	0.033	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-47.3	174.1	-73.7	-173.1	-33.9	0	0	111.6	I4 L5 R10 Y11 H12 L57 L60 R68	I4-Q8 VanDerWaalsContact O-CG 3.31Å; I4-Q8 WeakPolarHBondContact O-CG 3.42Å; I4-Q8 PolarHBondContact O-N 3.32Å; L5-Q8 PolarHBondContact O-N 3.35Å; Q8-R10 VanDerWaalsContact C-N 3.34Å; Q8-R10 PolarHBondContact O-N 3.2Å; Q8-Y11 PolarHBondContact O-N 3.5Å; Q8-H12 PolarHBondContact O-CD2 3.1Å; Q8-H12 PolarHBondContact O-N 3.32Å; Q8-L57 HydrophobicContact CB-CD1 4.21Å; Q8-L57 HydrophobicContact CG-CD1 4.18Å; Q8-L60 HydrophobicContact CG-CB 4.06Å; Q8-L60 HydrophobicContact CG-CD1 3.89Å; Q8-L60 PolarHBondContact NE2-O 3.27Å; Q8-R68 VanDerWaalsContact NE2-CD 3.32Å; Q8-R68 VanDerWaalsContact OE1-NE 3.16Å
9	R	95.2	Very high	92.4	Very high	114 Å²	114	64.8 Å²	64.8	43%	0.43	29%	0.293	S	S	.	.	H	α-helix	trans	-58.7	-45.9	176.7	-171.5	-153.2	67.4	70.1	0.2	111.4	L5 E6 Q7 H12 E13	L5-R9 WeakPolarHBondContact O-CB 3.05Å; L5-R9 PolarHBondContact O-N 2.6Å; E6-R9 PolarHBondContact O-N 3.49Å; E6-R9 IonicContact OE1-CZ 3.64Å; E6-R9 IonicContact OE1-NE 3.33Å; E6-R9 PolarHBondContact OE1-NE 3.39Å; E6-R9 VanDerWaalsContact OE1-NE 3.12Å; E6-R9 IonicContact OE1-NH2 3.51Å; E6-R9 PolarHBondContact OE1-NH2 3.35Å; E6-R9 IonicContact OE2-CZ 2.84Å; E6-R9 IonicContact OE2-NE 2.85Å; E6-R9 PolarHBondContact OE2-NE 3.38Å; E6-R9 IonicContact OE2-NH2 3.31Å; Q7-R9 PolarHBondContact O-N 3.45Å; R9-H12 PolarHBondContact O-N 3.32Å; R9-E13 IonicContact CZ-OE2 3.27Å; R9-E13 IonicContact NH1-OE2 2.67Å; R9-E13 PolarHBondContact NH1-OE2 2.87Å; R9-E13 IonicContact NH2-OE2 3.7Å; R9-E13 PolarHBondContact O-N 2.9Å
10	R	94.9	Very high	92.6	Very high	99 Å²	99	65 Å²	65	37%	0.374	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-47.3	178.7	-178.3	-173.7	147.9	-172.7	-7.2	111.3	E2 E6 Q7 Q8 H12 E13 E14 M106	E2-R10 IonicContact OE1-NH1 3.02Å; E2-R10 PolarHBondContact OE1-NH1 2.69Å; E6-R10 VanDerWaalsContact O-CB 3.25Å; E6-R10 WeakPolarHBondContact O-CB 3.23Å; E6-R10 PolarHBondContact O-N 2.63Å; Q7-R10 PolarHBondContact O-N 3.32Å; Q8-R10 VanDerWaalsContact C-N 3.34Å; Q8-R10 PolarHBondContact O-N 3.2Å; R10-H12 PolarHBondContact O-N 3.5Å; R10-E13 PolarHBondContact O-N 3.49Å; R10-E14 WeakPolarHBondContact O-CB 3.41Å; R10-E14 PolarHBondContact O-N 3.3Å; R10-M106 HydrophobicContact CB-CE 4.43Å; R10-M106 HydrophobicContact CG-CE 3.41Å; R10-M106 VanDerWaalsContact CG-CE 3.41Å
11	Y	96.9	Very high	92.7	Very high	49 Å²	49	62 Å²	62	19%	0.192	28%	0.283	C	S	.	.	H	α-helix	trans	-66.6	-35.5	177.5	-71.6	-43.6	0	0	0	113.1	Q7 Q8 E14 K15 V53 N56 L60	Q7-Y11 VanDerWaalsContact O-CD2 3.23Å; Q7-Y11 WeakPolarHBondContact O-CD2 3.39Å; Q7-Y11 PolarHBondContact O-N 2.92Å; Q8-Y11 PolarHBondContact O-N 3.5Å; Y11-E14 PolarHBondContact O-N 3.18Å; Y11-K15 WeakPolarHBondContact O-CG 3.46Å; Y11-K15 PolarHBondContact O-N 3.44Å; Y11-V53 HydrophobicContact CD1-CG1 3.72Å; Y11-V53 HydrophobicContact CG-CG1 4.09Å; Y11-V53 WeakPolarHBondContact O-CG1 3.42Å; Y11-N56 HydrophobicContact CE1-CB 4.39Å; Y11-N56 HydrophobicContact CE2-CB 4Å; Y11-L60 HydrophobicContact CD2-CD1 3.74Å; Y11-L60 HydrophobicContact CE2-CD1 3.7Å
12	H	97.6	Very high	94.4	Very high	75 Å²	75	57.4 Å²	57.4	35%	0.347	26%	0.26	S	S	.	.	H	α-helix	trans	-62.6	-46.2	171.3	-81.3	-68.2	0	0	0	111.9	Q8 R9 R10 E14 K15 E16 Y61	Q8-H12 PolarHBondContact O-CD2 3.1Å; Q8-H12 PolarHBondContact O-N 3.32Å; R9-H12 PolarHBondContact O-N 3.32Å; R10-H12 PolarHBondContact O-N 3.5Å; H12-E14 PolarHBondContact O-N 3.41Å; H12-K15 PolarHBondContact O-N 3.15Å; H12-E16 PolarHBondContact O-N 3.16Å; H12-E16 VanDerWaalsContact O-N 3.09Å; H12-Y61 AromaticContact NE2-CE2 3.57Å; H12-Y61 AromaticContact NE2-CZ 3.7Å; H12-Y61 PolarHBondContact NE2-OH 3.47Å
13	E	96.7	Very high	95.3	Very high	41 Å²	41	53.3 Å²	53.3	19%	0.192	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-48	175.3	178.1	175.8	-165.5	0	0	111	R9 R10 K15 E16 R17 M106	R9-E13 IonicContact CZ-OE2 3.27Å; R9-E13 IonicContact NH1-OE2 2.67Å; R9-E13 PolarHBondContact NH1-OE2 2.87Å; R9-E13 IonicContact NH2-OE2 3.7Å; R9-E13 PolarHBondContact O-N 2.9Å; R10-E13 PolarHBondContact O-N 3.49Å; E13-K15 VanDerWaalsContact C-N 3.3Å; E13-K15 PolarHBondContact O-N 3Å; E13-E16 PolarHBondContact O-N 2.92Å; E13-E16 VanDerWaalsContact O-N 3.11Å; E13-R17 HydrophobicContact CG-CG 4.22Å; E13-R17 VanDerWaalsContact O-CG 3.25Å; E13-R17 WeakPolarHBondContact O-CG 3.32Å; E13-R17 PolarHBondContact O-N 3.02Å; E13-R17 IonicContact OE1-NE 3.69Å; E13-R17 IonicContact OE1-NH2 3.28Å; E13-M106 HydrophobicContact CB-CE 4.4Å; E13-M106 HydrophobicContact CG-CE 4.32Å; E13-M106 HydrophobicContact CG-SD 4.23Å
14	E	97.2	Very high	95.6	Very high	14 Å²	14	55.9 Å²	55.9	7%	0.065	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-41.7	-180	-170.4	168.5	-178.1	0	0	112	R10 Y11 H12 R17 L18 R49 V53 M106 F110	R10-E14 WeakPolarHBondContact O-CB 3.41Å; R10-E14 PolarHBondContact O-N 3.3Å; Y11-E14 PolarHBondContact O-N 3.18Å; H12-E14 PolarHBondContact O-N 3.41Å; E14-R17 PolarHBondContact O-N 3.43Å; E14-L18 HydrophobicContact CG-CD1 4.07Å; E14-L18 WeakPolarHBondContact O-CB 3.02Å; E14-L18 WeakPolarHBondContact O-CD1 3.46Å; E14-L18 VanDerWaalsContact O-CG 3.26Å; E14-L18 WeakPolarHBondContact O-CG 3.33Å; E14-L18 PolarHBondContact O-N 3.48Å; E14-R49 IonicContact OE1-CZ 2.63Å; E14-R49 IonicContact OE1-NE 3.81Å; E14-R49 PolarHBondContact OE1-NE 2.95Å; E14-R49 IonicContact OE1-NH2 3.23Å; E14-R49 PolarHBondContact OE1-NH2 3.48Å; E14-V53 HydrophobicContact CB-CG1 4.33Å; E14-V53 HydrophobicContact CG-CG2 4.01Å; E14-M106 VanDerWaalsContact CA-SD 3.56Å; E14-M106 HydrophobicContact CB-CE 4.19Å; E14-M106 HydrophobicContact CB-SD 3.6Å; E14-M106 HydrophobicContact CG-SD 4.01Å; E14-F110 HydrophobicContact CG-CZ 4.26Å
15	K	97.4	Very high	95.6	Very high	40 Å²	40	55.1 Å²	55.1	17%	0.174	25%	0.254	C	S	.	.	H	α-helix	trans	-60.2	-46.2	173.4	-76.1	-179.5	60.3	154.6	0	112.7	Y11 H12 E13 R17 L18 M19 Y50 V53 S54 L57	Y11-K15 WeakPolarHBondContact O-CG 3.46Å; Y11-K15 PolarHBondContact O-N 3.44Å; H12-K15 PolarHBondContact O-N 3.15Å; E13-K15 VanDerWaalsContact C-N 3.3Å; E13-K15 PolarHBondContact O-N 3Å; K15-R17 VanDerWaalsContact C-N 3.33Å; K15-L18 PolarHBondContact O-N 2.98Å; K15-M19 WeakPolarHBondContact O-CG 3.42Å; K15-M19 PolarHBondContact O-N 3.11Å; K15-Y50 HydrophobicContact CB-CD2 4.21Å; K15-Y50 HydrophobicContact CB-CE2 3.81Å; K15-Y50 HydrophobicContact CD-CE2 4.47Å; K15-Y50 VanDerWaalsContact CE-CZ 3.5Å; K15-Y50 VanDerWaalsContact CE-OH 3.31Å; K15-Y50 WeakPolarHBondContact CE-OH 3.35Å; K15-Y50 HydrophobicContact CG-CD2 4.17Å; K15-Y50 HydrophobicContact CG-CE2 3.97Å; K15-V53 HydrophobicContact CD-CG1 4.21Å; K15-V53 HydrophobicContact CG-CB 4.3Å; K15-V53 HydrophobicContact CG-CG1 3.61Å; K15-S54 WeakPolarHBondContact CD-OG 3.34Å; K15-S54 VanDerWaalsContact CE-OG 3.24Å; K15-S54 WeakPolarHBondContact CE-OG 3.28Å; K15-S54 PolarHBondContact NZ-OG 2.99Å; K15-L57 HydrophobicContact CD-CD2 3.88Å
16	E	97	Very high	95.6	Very high	136 Å²	136	59.1 Å²	59.1	64%	0.636	27%	0.273	S	S	*	.	H	α-helix	trans	-63.4	-40.8	178.6	-71.8	-165.4	127.9	0	0	111.7	H12 E13 M19 D20	H12-E16 PolarHBondContact O-N 3.16Å; H12-E16 VanDerWaalsContact O-N 3.09Å; E13-E16 PolarHBondContact O-N 2.92Å; E13-E16 VanDerWaalsContact O-N 3.11Å; E16-M19 HydrophobicContact CB-CE 4.46Å; E16-M19 HydrophobicContact CG-CE 4.12Å; E16-M19 PolarHBondContact O-N 3.31Å; E16-D20 PolarHBondContact O-N 2.92Å
17	R	96.4	Very high	95.7	Very high	89 Å²	89	62.9 Å²	62.9	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-66	-42.6	176.9	-64.2	-66.6	-177.6	-179.6	1.3	112.4	E13 E14 K15 M19 D20 V21 F110	E13-R17 HydrophobicContact CG-CG 4.22Å; E13-R17 VanDerWaalsContact O-CG 3.25Å; E13-R17 WeakPolarHBondContact O-CG 3.32Å; E13-R17 PolarHBondContact O-N 3.02Å; E13-R17 IonicContact OE1-NE 3.69Å; E13-R17 IonicContact OE1-NH2 3.28Å; E14-R17 PolarHBondContact O-N 3.43Å; K15-R17 VanDerWaalsContact C-N 3.33Å; R17-M19 VanDerWaalsContact C-N 3.33Å; R17-M19 PolarHBondContact O-N 3.1Å; R17-D20 PolarHBondContact O-N 3.25Å; R17-V21 WeakPolarHBondContact O-CG2 3.47Å; R17-V21 PolarHBondContact O-N 2.78Å; R17-F110 HydrophobicContact CB-CD1 3.9Å; R17-F110 HydrophobicContact CB-CD2 3.49Å; R17-F110 VanDerWaalsContact CB-CD2 3.49Å; R17-F110 HydrophobicContact CB-CE1 3.69Å; R17-F110 HydrophobicContact CB-CE2 3.28Å; R17-F110 HydrophobicContact CB-CG 3.8Å; R17-F110 HydrophobicContact CB-CZ 3.39Å; R17-F110 HydrophobicContact CG-CD2 3.88Å; R17-F110 HydrophobicContact CG-CE2 3.82Å; R17-F110 HydrophobicContact CG-CG 4.5Å; R17-F110 HydrophobicContact CG-CZ 4.38Å
18	L	97	Very high	95.6	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-44.3	174.6	-74.4	162.5	0	0	0	111	E14 K15 D20 V21 M22 M46 R49 Y50 V53 F110	E14-L18 HydrophobicContact CG-CD1 4.07Å; E14-L18 WeakPolarHBondContact O-CB 3.02Å; E14-L18 WeakPolarHBondContact O-CD1 3.46Å; E14-L18 VanDerWaalsContact O-CG 3.26Å; E14-L18 WeakPolarHBondContact O-CG 3.33Å; E14-L18 PolarHBondContact O-N 3.48Å; K15-L18 PolarHBondContact O-N 2.98Å; L18-D20 PolarHBondContact O-N 3.17Å; L18-V21 PolarHBondContact O-N 2.95Å; L18-M22 HydrophobicContact CB-CE 4.34Å; L18-M22 WeakPolarHBondContact O-CB 3.26Å; L18-M22 WeakPolarHBondContact O-CE 3.5Å; L18-M22 VanDerWaalsContact O-CG 3.24Å; L18-M22 WeakPolarHBondContact O-CG 3.5Å; L18-M22 PolarHBondContact O-N 2.81Å; L18-M46 HydrophobicContact CD2-CB 4.1Å; L18-M46 HydrophobicContact CD2-CG 4.37Å; L18-R49 HydrophobicContact CD1-CB 4.28Å; L18-R49 HydrophobicContact CD1-CG 3.9Å; L18-R49 HydrophobicContact CD2-CB 4.28Å; L18-R49 HydrophobicContact CD2-CG 4.25Å; L18-Y50 HydrophobicContact CB-CD2 4.15Å; L18-V53 HydrophobicContact CD1-CG2 4.48Å; L18-F110 HydrophobicContact CB-CE1 4.46Å; L18-F110 HydrophobicContact CD2-CE1 3.71Å; L18-F110 HydrophobicContact CD2-CZ 4.23Å; L18-F110 HydrophobicContact CG-CE1 3.76Å; L18-F110 HydrophobicContact CG-CZ 3.95Å
19	M	96.3	Very high	95.4	Very high	85 Å²	85	68.8 Å²	68.8	42%	0.419	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-42.9	175.9	-71.4	-175.7	-59.9	0	0	112.4	K15 E16 R17 M22 A23 Y50	K15-M19 WeakPolarHBondContact O-CG 3.42Å; K15-M19 PolarHBondContact O-N 3.11Å; E16-M19 HydrophobicContact CB-CE 4.46Å; E16-M19 HydrophobicContact CG-CE 4.12Å; E16-M19 PolarHBondContact O-N 3.31Å; R17-M19 VanDerWaalsContact C-N 3.33Å; R17-M19 PolarHBondContact O-N 3.1Å; M19-M22 HydrophobicContact CG-CE 4.28Å; M19-A23 VanDerWaalsContact O-CB 3.3Å; M19-A23 WeakPolarHBondContact O-CB 3.38Å; M19-A23 PolarHBondContact O-N 3.36Å; M19-Y50 HydrophobicContact CE-CE2 4.45Å; M19-Y50 HydrophobicContact CG-CD2 4.09Å; M19-Y50 HydrophobicContact CG-CE2 3.56Å; M19-Y50 HydrophobicContact SD-CE2 3.81Å
20	D	95.7	Very high	95.2	Very high	67 Å²	67	65.2 Å²	65.2	36%	0.358	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-46.6	177.5	177.4	57.6	0	0	0	112.1	E16 R17 L18 A23 K24	E16-D20 PolarHBondContact O-N 2.92Å; R17-D20 PolarHBondContact O-N 3.25Å; L18-D20 PolarHBondContact O-N 3.17Å; D20-A23 PolarHBondContact O-N 3.4Å; D20-K24 WeakPolarHBondContact O-CG 3.35Å; D20-K24 PolarHBondContact O-N 3.2Å; D20-K24 VanDerWaalsContact OD1-CE 3.25Å; D20-K24 WeakPolarHBondContact OD1-CE 3.16Å; D20-K24 IonicContact OD1-NZ 2.74Å; D20-K24 PolarHBondContact OD1-NZ 3.36Å; D20-K24 WeakPolarHBondContact OD2-CE 3.19Å; D20-K24 IonicContact OD2-NZ 3.52Å; D20-K24 PolarHBondContact OD2-NZ 3Å
21	V	94.9	Very high	94.9	Very high	3 Å²	3	63.1 Å²	63.1	2%	0.018	31%	0.311	C	S	.	.	H	α-helix	trans	-68.6	-42.5	179.1	-179.9	0	0	0	0	111.5	R17 L18 A23 K24 E25 M46 F110 L114	R17-V21 WeakPolarHBondContact O-CG2 3.47Å; R17-V21 PolarHBondContact O-N 2.78Å; L18-V21 PolarHBondContact O-N 2.95Å; V21-A23 VanDerWaalsContact C-N 3.32Å; V21-A23 PolarHBondContact O-N 2.93Å; V21-K24 PolarHBondContact O-N 2.96Å; V21-E25 WeakPolarHBondContact O-CB 3.37Å; V21-E25 PolarHBondContact O-N 3.36Å; V21-M46 HydrophobicContact CB-SD 4.11Å; V21-M46 HydrophobicContact CG1-CE 3.57Å; V21-M46 HydrophobicContact CG1-SD 3.55Å; V21-M46 VanDerWaalsContact CG1-SD 3.55Å; V21-F110 HydrophobicContact CB-CD1 4.32Å; V21-F110 HydrophobicContact CG2-CB 3.86Å; V21-F110 HydrophobicContact CG2-CD1 3.61Å; V21-F110 HydrophobicContact CG2-CG 4.15Å; V21-L114 HydrophobicContact CG1-CD2 4.15Å
22	M	95.7	Very high	94.5	Very high	29 Å²	29	62 Å²	62	14%	0.143	31%	0.309	C	S	.	.	H	α-helix	trans	-58.3	-44.2	173.5	-74.2	-174.9	-64.5	0	0	111.5	L18 M19 K24 E25 M26 M46 Q47 Y50	L18-M22 HydrophobicContact CB-CE 4.34Å; L18-M22 WeakPolarHBondContact O-CB 3.26Å; L18-M22 WeakPolarHBondContact O-CE 3.5Å; L18-M22 VanDerWaalsContact O-CG 3.24Å; L18-M22 WeakPolarHBondContact O-CG 3.5Å; L18-M22 PolarHBondContact O-N 2.81Å; M19-M22 HydrophobicContact CG-CE 4.28Å; M22-K24 PolarHBondContact O-N 3.42Å; M22-E25 PolarHBondContact O-N 3.22Å; M22-M26 WeakPolarHBondContact O-CB 3.24Å; M22-M26 VanDerWaalsContact O-CG 3.31Å; M22-M26 WeakPolarHBondContact O-CG 3.37Å; M22-M26 PolarHBondContact O-N 2.94Å; M22-M46 HydrophobicContact CG-CB 3.45Å; M22-M46 VanDerWaalsContact CG-CB 3.45Å; M22-M46 HydrophobicContact CG-CG 4.25Å; M22-M46 HydrophobicContact CG-SD 3.79Å; M22-M46 HydrophobicContact SD-CB 3.85Å; M22-Q47 HydrophobicContact SD-CB 4.22Å; M22-Y50 HydrophobicContact CE-CD2 4.28Å; M22-Y50 HydrophobicContact CE-CG 4.39Å
23	A	96	Very high	94.2	Very high	46 Å²	46	61.2 Å²	61.2	38%	0.38	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-43.3	177.3	0	0	0	0	0	111.8	M19 D20 V21 M26 L27	M19-A23 VanDerWaalsContact O-CB 3.3Å; M19-A23 WeakPolarHBondContact O-CB 3.38Å; M19-A23 PolarHBondContact O-N 3.36Å; D20-A23 PolarHBondContact O-N 3.4Å; V21-A23 VanDerWaalsContact C-N 3.32Å; V21-A23 PolarHBondContact O-N 2.93Å; A23-M26 PolarHBondContact O-N 2.82Å; A23-L27 WeakPolarHBondContact O-CB 3.42Å; A23-L27 WeakPolarHBondContact O-CG 3.32Å; A23-L27 PolarHBondContact O-N 2.92Å
24	K	94.8	Very high	94	Very high	83 Å²	83	61.4 Å²	61.4	36%	0.361	31%	0.307	S	S	.	.	H	α-helix	trans	-62.8	-42.2	175.4	-74.1	167.7	177.9	167.3	0	111.9	D20 V21 M22 L27 T28 L114	D20-K24 WeakPolarHBondContact O-CG 3.35Å; D20-K24 PolarHBondContact O-N 3.2Å; D20-K24 VanDerWaalsContact OD1-CE 3.25Å; D20-K24 WeakPolarHBondContact OD1-CE 3.16Å; D20-K24 IonicContact OD1-NZ 2.74Å; D20-K24 PolarHBondContact OD1-NZ 3.36Å; D20-K24 WeakPolarHBondContact OD2-CE 3.19Å; D20-K24 IonicContact OD2-NZ 3.52Å; D20-K24 PolarHBondContact OD2-NZ 3Å; V21-K24 PolarHBondContact O-N 2.96Å; M22-K24 PolarHBondContact O-N 3.42Å; K24-L27 PolarHBondContact O-N 2.97Å; K24-T28 PolarHBondContact O-N 3.42Å; K24-T28 PolarHBondContact O-OG1 3.43Å; K24-L114 HydrophobicContact CB-CD2 4.45Å; K24-L114 HydrophobicContact CD-CD1 4.26Å; K24-L114 HydrophobicContact CD-CD2 4.43Å
25	E	93.9	Very high	93.7	Very high	3 Å²	3	62.7 Å²	62.7	1%	0.014	31%	0.314	C	S	.	.	H	α-helix	trans	-61	-50.7	177.4	-170.2	61.7	-160.7	0	0	110.4	V21 M22 L27 T28 K30 S39 R42 T43 R117	V21-E25 WeakPolarHBondContact O-CB 3.37Å; V21-E25 PolarHBondContact O-N 3.36Å; M22-E25 PolarHBondContact O-N 3.22Å; E25-L27 VanDerWaalsContact C-N 3.33Å; E25-L27 PolarHBondContact O-N 3.31Å; E25-T28 PolarHBondContact O-N 3.43Å; E25-K30 PolarHBondContact O-NZ 3.29Å; E25-S39 WeakPolarHBondContact CG-OG 3.33Å; E25-S39 WeakPolarHBondContact OE1-CA 2.84Å; E25-S39 WeakPolarHBondContact OE1-CB 3.29Å; E25-S39 PolarHBondContact OE1-OG 3.33Å; E25-R42 IonicContact OE1-CZ 3.45Å; E25-R42 VanDerWaalsContact OE1-CZ 3.24Å; E25-R42 IonicContact OE1-NE 3.62Å; E25-R42 PolarHBondContact OE1-NE 3.33Å; E25-R42 IonicContact OE1-NH2 3.37Å; E25-R42 PolarHBondContact OE1-NH2 2.83Å; E25-R42 IonicContact OE2-NE 3.63Å; E25-T43 WeakPolarHBondContact CG-OG1 3.35Å; E25-R117 WeakPolarHBondContact OE2-CD 3.38Å; E25-R117 IonicContact OE2-NH1 3.06Å
26	M	92.8	Very high	93.6	Very high	130 Å²	130	64.1 Å²	64.1	64%	0.64	32%	0.321	S	S	*	.	H	α-helix	trans	-61	-37.4	177.5	-69.3	-176.4	81	0	0	113.3	M22 A23 K30 T43	M22-M26 WeakPolarHBondContact O-CB 3.24Å; M22-M26 VanDerWaalsContact O-CG 3.31Å; M22-M26 WeakPolarHBondContact O-CG 3.37Å; M22-M26 PolarHBondContact O-N 2.94Å; A23-M26 PolarHBondContact O-N 2.82Å; M26-K30 PolarHBondContact O-NZ 3.15Å; M26-T43 HydrophobicContact CG-CG2 4.46Å
27	L	93.8	Very high	93.5	Very high	149 Å²	149	57.8 Å²	57.8	78%	0.78	29%	0.292	S	S	*	.	H	α-helix	trans	-78.1	-17.8	-180	-71.6	171.9	0	0	0	114.3	A23 K24 E25	A23-L27 WeakPolarHBondContact O-CB 3.42Å; A23-L27 WeakPolarHBondContact O-CG 3.32Å; A23-L27 PolarHBondContact O-N 2.92Å; K24-L27 PolarHBondContact O-N 2.97Å; E25-L27 VanDerWaalsContact C-N 3.33Å; E25-L27 PolarHBondContact O-N 3.31Å
28	T	91.8	Very high	93.4	Very high	50 Å²	50	53.9 Å²	53.9	31%	0.307	28%	0.277	S	S	.	.	S	Bend	trans	-67.2	137.8	177.3	-60	0	0	0	0	108.5	K24 E25 K30 R117	K24-T28 PolarHBondContact O-N 3.42Å; K24-T28 PolarHBondContact O-OG1 3.43Å; E25-T28 PolarHBondContact O-N 3.43Å; T28-K30 WeakPolarHBondContact O-CD 3.33Å; T28-K30 WeakPolarHBondContact O-CE 3.42Å; T28-K30 PolarHBondContact O-NZ 3.23Å; T28-R117 PolarHBondContact OG1-NH1 3.03Å; T28-R117 VanDerWaalsContact OG1-NH1 3.14Å
29	K	91.3	Very high	93.3	Very high	142 Å²	142	53.9 Å²	53.9	62%	0.617	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-72.8	131.6	175	-178.3	-169.7	173.4	-151.9	0	108.1	D371	K29-D371 IonicContact NZ-OD2 2.61Å; K29-D371 PolarHBondContact NZ-OD2 3.34Å
30	K	92.2	Very high	93.3	Very high	38 Å²	38	51.3 Å²	51.3	17%	0.165	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-98	123.1	174.4	-68.1	66.4	166	-177.5	0	107.1	E25 M26 T28 D35 Q36 S39	E25-K30 PolarHBondContact O-NZ 3.29Å; M26-K30 PolarHBondContact O-NZ 3.15Å; T28-K30 WeakPolarHBondContact O-CD 3.33Å; T28-K30 WeakPolarHBondContact O-CE 3.42Å; T28-K30 PolarHBondContact O-NZ 3.23Å; K30-D35 WeakPolarHBondContact CA-OD2 3.43Å; K30-D35 HydrophobicContact CB-CB 4.44Å; K30-Q36 HydrophobicContact CB-CB 4.1Å; K30-Q36 HydrophobicContact CG-CB 4.32Å; K30-S39 VanDerWaalsContact CE-CB 3.46Å; K30-S39 WeakPolarHBondContact CE-OG 3.36Å
31	S	87.1	Confident	93.3	Very high	55 Å²	55	49.9 Å²	49.9	39%	0.385	26%	0.257	S	S	.	.			trans	-84.5	-34.7	-174.7	45.6	0	0	0	0	112.7	D371	S31-D371 WeakPolarHBondContact CA-OD2 3.43Å; S31-D371 WeakPolarHBondContact CB-OD2 3.44Å
32	T	89.6	Confident	93.2	Very high	25 Å²	25	51.9 Å²	51.9	15%	0.153	26%	0.264	C	S	.	.	S	Bend	trans	-127.2	162	-174.8	67.5	0	0	0	0	111.1	R34 D35 Q36	T32-R34 PolarHBondContact O-N 2.93Å; T32-D35 PolarHBondContact O-N 2.93Å; T32-D35 PolarHBondContact OG1-N 3.17Å; T32-Q36 PolarHBondContact O-N 3.4Å
33	L	91.8	Very high	93.2	Very high	60 Å²	60	50.9 Å²	50.9	31%	0.314	26%	0.259	S	S	.	.	H	α-helix	trans	-56.7	-40.7	171.6	178.5	61.9	0	0	0	111.6	Q36 I37 R138	L33-Q36 WeakPolarHBondContact O-CB 3.26Å; L33-Q36 PolarHBondContact O-N 3.43Å; L33-I37 HydrophobicContact CD1-CD1 4.02Å; L33-I37 HydrophobicContact CD1-CG1 4.28Å; L33-I37 HydrophobicContact CG-CD1 3.93Å; L33-I37 WeakPolarHBondContact O-CG1 3.29Å; L33-I37 PolarHBondContact O-N 3.39Å; L33-R138 HydrophobicContact CD2-CB 3.91Å; L33-R138 HydrophobicContact CD2-CG 4.48Å
34	R	92.2	Very high	93.2	Very high	44 Å²	44	52.4 Å²	52.4	17%	0.166	26%	0.255	C	S	.	.	H	α-helix	trans	-59.7	-46.9	175.4	177.2	178.6	-67.2	160.2	7.6	111.6	T32 Q36 I37 N38 Y136 S367 E368	T32-R34 PolarHBondContact O-N 2.93Å; R34-Q36 VanDerWaalsContact C-N 3.3Å; R34-Q36 PolarHBondContact O-N 2.71Å; R34-I37 PolarHBondContact O-N 2.7Å; R34-N38 VanDerWaalsContact O-CB 3.32Å; R34-N38 WeakPolarHBondContact O-CB 3.22Å; R34-N38 VanDerWaalsContact O-CG 3.24Å; R34-N38 PolarHBondContact O-N 2.94Å; R34-N38 PolarHBondContact O-ND2 2.84Å; R34-Y136 HydrophobicContact CB-CD1 3.74Å; R34-Y136 HydrophobicContact CB-CE1 4.09Å; R34-Y136 HydrophobicContact CB-CG 4.27Å; R34-Y136 HydrophobicContact CG-CD1 3.69Å; R34-Y136 HydrophobicContact CG-CD2 4.5Å; R34-Y136 HydrophobicContact CG-CE1 3.6Å; R34-Y136 HydrophobicContact CG-CE2 4.42Å; R34-Y136 HydrophobicContact CG-CG 4.17Å; R34-S367 PolarHBondContact NH2-OG 3.49Å; R34-E368 IonicContact NH1-OE1 3.95Å
35	D	91.1	Very high	93.2	Very high	41 Å²	41	51.4 Å²	51.4	22%	0.219	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-36.7	177.5	-171.3	31.3	0	0	0	111.7	K30 T32 S39 R42	K30-D35 WeakPolarHBondContact CA-OD2 3.43Å; K30-D35 HydrophobicContact CB-CB 4.44Å; T32-D35 PolarHBondContact O-N 2.93Å; T32-D35 PolarHBondContact OG1-N 3.17Å; D35-S39 WeakPolarHBondContact O-CB 3.5Å; D35-S39 PolarHBondContact O-N 2.9Å; D35-R42 IonicContact OD1-NH2 3.12Å
36	Q	94.4	Very high	93.3	Very high	71 Å²	71	52 Å²	52	33%	0.332	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-52.7	173.3	-176.3	58.2	50.3	0	0	112.6	K30 T32 L33 R34 N38 S39 D40	K30-Q36 HydrophobicContact CB-CB 4.1Å; K30-Q36 HydrophobicContact CG-CB 4.32Å; T32-Q36 PolarHBondContact O-N 3.4Å; L33-Q36 WeakPolarHBondContact O-CB 3.26Å; L33-Q36 PolarHBondContact O-N 3.43Å; R34-Q36 VanDerWaalsContact C-N 3.3Å; R34-Q36 PolarHBondContact O-N 2.71Å; Q36-N38 PolarHBondContact O-N 3.34Å; Q36-S39 PolarHBondContact O-N 2.96Å; Q36-D40 PolarHBondContact NE2-OD1 3.12Å; Q36-D40 PolarHBondContact NE2-OD2 2.67Å; Q36-D40 VanDerWaalsContact O-CG 3.31Å; Q36-D40 PolarHBondContact O-N 3.16Å
37	I	95.3	Very high	93.5	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-59.9	-48	178.3	-70.2	168.5	0	0	0	110.3	L33 R34 S39 D40 H41 F130 Y136 R199 V200	L33-I37 HydrophobicContact CD1-CD1 4.02Å; L33-I37 HydrophobicContact CD1-CG1 4.28Å; L33-I37 HydrophobicContact CG-CD1 3.93Å; L33-I37 WeakPolarHBondContact O-CG1 3.29Å; L33-I37 PolarHBondContact O-N 3.39Å; R34-I37 PolarHBondContact O-N 2.7Å; I37-S39 VanDerWaalsContact C-N 3.31Å; I37-S39 PolarHBondContact O-N 2.79Å; I37-D40 PolarHBondContact O-N 3.38Å; I37-D40 VanDerWaalsContact O-N 3.17Å; I37-H41 PolarHBondContact O-CD2 3.25Å; I37-H41 VanDerWaalsContact O-CD2 3.23Å; I37-H41 PolarHBondContact O-N 2.95Å; I37-F130 HydrophobicContact CD1-CZ 4.23Å; I37-F130 HydrophobicContact CG2-CE2 4.2Å; I37-F130 HydrophobicContact CG2-CZ 4.41Å; I37-Y136 HydrophobicContact CB-CE1 4.22Å; I37-Y136 HydrophobicContact CD1-CD1 4.17Å; I37-Y136 WeakPolarHBondContact CD1-O 3.42Å; I37-Y136 HydrophobicContact CG2-CE1 4.02Å; I37-R199 WeakPolarHBondContact CG2-O 3.47Å; I37-V200 HydrophobicContact CD1-CG1 4.39Å; I37-V200 HydrophobicContact CD1-CG2 4.41Å
38	N	94.1	Very high	93.6	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-39.8	179.1	-74.5	-18.9	0	0	0	112.4	R34 Q36 H41 R42 Q125 L127 Y136	R34-N38 VanDerWaalsContact O-CB 3.32Å; R34-N38 WeakPolarHBondContact O-CB 3.22Å; R34-N38 VanDerWaalsContact O-CG 3.24Å; R34-N38 PolarHBondContact O-N 2.94Å; R34-N38 PolarHBondContact O-ND2 2.84Å; Q36-N38 PolarHBondContact O-N 3.34Å; N38-H41 PolarHBondContact O-N 3.15Å; N38-R42 WeakPolarHBondContact O-CG 3.42Å; N38-R42 PolarHBondContact O-N 3.33Å; N38-Q125 PolarHBondContact ND2-O 2.68Å; N38-L127 WeakPolarHBondContact OD1-CB 3.47Å; N38-Y136 PolarHBondContact OD1-OH 3.42Å
39	S	94.3	Very high	93.9	Very high	1 Å²	1	46 Å²	46	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-40.5	176.2	-168.7	0	0	0	0	112.2	E25 K30 D35 Q36 I37 R42 T43	E25-S39 WeakPolarHBondContact CG-OG 3.33Å; E25-S39 WeakPolarHBondContact OE1-CA 2.84Å; E25-S39 WeakPolarHBondContact OE1-CB 3.29Å; E25-S39 PolarHBondContact OE1-OG 3.33Å; K30-S39 VanDerWaalsContact CE-CB 3.46Å; K30-S39 WeakPolarHBondContact CE-OG 3.36Å; D35-S39 WeakPolarHBondContact O-CB 3.5Å; D35-S39 PolarHBondContact O-N 2.9Å; Q36-S39 PolarHBondContact O-N 2.96Å; I37-S39 VanDerWaalsContact C-N 3.31Å; I37-S39 PolarHBondContact O-N 2.79Å; S39-R42 PolarHBondContact O-N 3.07Å; S39-T43 WeakPolarHBondContact O-CB 3.45Å; S39-T43 PolarHBondContact O-N 3.25Å; S39-T43 PolarHBondContact O-OG1 3.45Å
40	D	96.3	Very high	94.2	Very high	31 Å²	31	41.8 Å²	41.8	17%	0.166	21%	0.209	C	C	.	.	H	α-helix	trans	-66.8	-39.3	177.4	-69.8	-20.7	0	0	0	111.4	Q36 I37 T43 R44 P202 L203	Q36-D40 PolarHBondContact NE2-OD1 3.12Å; Q36-D40 PolarHBondContact NE2-OD2 2.67Å; Q36-D40 VanDerWaalsContact O-CG 3.31Å; Q36-D40 PolarHBondContact O-N 3.16Å; I37-D40 PolarHBondContact O-N 3.38Å; I37-D40 VanDerWaalsContact O-N 3.17Å; D40-T43 PolarHBondContact O-N 3.42Å; D40-R44 WeakPolarHBondContact O-CB 3.2Å; D40-R44 PolarHBondContact O-N 2.85Å; D40-P202 HydrophobicContact CB-CG 3.69Å; D40-L203 HydrophobicContact CB-CD1 4.02Å; D40-L203 HydrophobicContact CB-CG 4.11Å; D40-L203 WeakPolarHBondContact OD1-CD1 3.44Å
41	H	95.5	Very high	94.4	Very high	38 Å²	38	45.6 Å²	45.6	18%	0.176	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-43.1	173.8	-84.7	-74.7	0	0	0	113	I37 N38 T43 R44 A45 L127 V128 R199 P202	I37-H41 PolarHBondContact O-CD2 3.25Å; I37-H41 VanDerWaalsContact O-CD2 3.23Å; I37-H41 PolarHBondContact O-N 2.95Å; N38-H41 PolarHBondContact O-N 3.15Å; H41-T43 VanDerWaalsContact C-N 3.3Å; H41-T43 PolarHBondContact O-N 3.27Å; H41-R44 WeakPolarHBondContact O-CB 3.35Å; H41-R44 PolarHBondContact O-N 2.89Å; H41-A45 PolarHBondContact O-N 3.12Å; H41-L127 HydrophobicContact CB-CD2 3.57Å; H41-L127 HydrophobicContact CB-CG 4.46Å; H41-V128 HydrophobicContact CB-CG2 4.49Å; H41-V128 WeakPolarHBondContact CD2-CG2 3.24Å; H41-V128 WeakPolarHBondContact NE2-CG2 3.37Å; H41-R199 PolarHBondContact NE2-O 3.34Å; H41-P202 HydrophobicContact CB-CG 4.49Å; H41-P202 VanDerWaalsContact CE1-CB 3.46Å; H41-P202 WeakPolarHBondContact CE1-CB 3.26Å
42	R	94.2	Very high	94.9	Very high	44 Å²	44	49 Å²	49	17%	0.166	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-44.6	172.8	-74.8	-173.2	-61.9	-97.9	3	111.1	E25 D35 N38 S39 R44 A45 M46 L127	E25-R42 IonicContact OE1-CZ 3.45Å; E25-R42 VanDerWaalsContact OE1-CZ 3.24Å; E25-R42 IonicContact OE1-NE 3.62Å; E25-R42 PolarHBondContact OE1-NE 3.33Å; E25-R42 IonicContact OE1-NH2 3.37Å; E25-R42 PolarHBondContact OE1-NH2 2.83Å; E25-R42 IonicContact OE2-NE 3.63Å; D35-R42 IonicContact OD1-NH2 3.12Å; N38-R42 WeakPolarHBondContact O-CG 3.42Å; N38-R42 PolarHBondContact O-N 3.33Å; S39-R42 PolarHBondContact O-N 3.07Å; R42-R44 VanDerWaalsContact C-N 3.33Å; R42-R44 PolarHBondContact O-N 2.98Å; R42-A45 PolarHBondContact O-N 3.37Å; R42-M46 HydrophobicContact CB-CE 4.24Å; R42-M46 VanDerWaalsContact O-CG 3.32Å; R42-M46 WeakPolarHBondContact O-CG 3.16Å; R42-M46 PolarHBondContact O-N 3.37Å; R42-M46 VanDerWaalsContact O-N 3.07Å; R42-L127 HydrophobicContact CG-CD2 4.07Å
43	T	95.7	Very high	95.3	Very high	8 Å²	8	48 Å²	48	5%	0.049	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-42.2	177.1	-58.1	0	0	0	0	110.8	E25 M26 S39 D40 H41 M46 Q47 L203	E25-T43 WeakPolarHBondContact CG-OG1 3.35Å; M26-T43 HydrophobicContact CG-CG2 4.46Å; S39-T43 WeakPolarHBondContact O-CB 3.45Å; S39-T43 PolarHBondContact O-N 3.25Å; S39-T43 PolarHBondContact O-OG1 3.45Å; D40-T43 PolarHBondContact O-N 3.42Å; H41-T43 VanDerWaalsContact C-N 3.3Å; H41-T43 PolarHBondContact O-N 3.27Å; T43-M46 PolarHBondContact O-N 3.31Å; T43-Q47 WeakPolarHBondContact O-CB 3.28Å; T43-Q47 PolarHBondContact O-N 3.46Å; T43-L203 HydrophobicContact CG2-CD1 4.23Å; T43-L203 HydrophobicContact CG2-CD2 3.9Å
44	R	95.9	Very high	95.6	Very high	79 Å²	79	46.3 Å²	46.3	30%	0.298	23%	0.225	S	C	.	.	H	α-helix	trans	-60.6	-47.5	176.4	178.4	63	-156.1	-156.8	9	112	D40 H41 R42 M46 Q47 D48 P202 L203	D40-R44 WeakPolarHBondContact O-CB 3.2Å; D40-R44 PolarHBondContact O-N 2.85Å; H41-R44 WeakPolarHBondContact O-CB 3.35Å; H41-R44 PolarHBondContact O-N 2.89Å; R42-R44 VanDerWaalsContact C-N 3.33Å; R42-R44 PolarHBondContact O-N 2.98Å; R44-M46 VanDerWaalsContact C-N 3.3Å; R44-M46 PolarHBondContact O-N 3.3Å; R44-Q47 WeakPolarHBondContact O-CB 3.44Å; R44-Q47 PolarHBondContact O-N 2.93Å; R44-Q47 VanDerWaalsContact O-N 3.09Å; R44-D48 IonicContact CZ-OD1 3.33Å; R44-D48 VanDerWaalsContact CZ-OD1 3.28Å; R44-D48 IonicContact CZ-OD2 3.07Å; R44-D48 IonicContact NE-OD1 2.72Å; R44-D48 PolarHBondContact NE-OD1 3.24Å; R44-D48 VanDerWaalsContact NE-OD1 3.17Å; R44-D48 IonicContact NE-OD2 3.87Å; R44-D48 PolarHBondContact NE-OD2 3.02Å; R44-D48 IonicContact NH2-OD1 3.97Å; R44-D48 PolarHBondContact NH2-OD1 2.77Å; R44-D48 IonicContact NH2-OD2 3.35Å; R44-D48 PolarHBondContact O-N 2.92Å; R44-P202 HydrophobicContact CB-CB 4.18Å; R44-P202 WeakPolarHBondContact CD-O 3.41Å; R44-P202 HydrophobicContact CG-CB 4.35Å; R44-L203 HydrophobicContact CB-CD2 3.99Å
45	A	94.8	Very high	95.9	Very high	61 Å²	61	45.1 Å²	45.1	50%	0.504	23%	0.227	S	C	.	.	H	α-helix	trans	-59.8	-40.1	177.6	0	0	0	0	0	112.2	H41 R42 D48 R49	H41-A45 PolarHBondContact O-N 3.12Å; R42-A45 PolarHBondContact O-N 3.37Å; A45-D48 PolarHBondContact O-N 3.09Å; A45-R49 PolarHBondContact O-N 3.36Å; A45-R49 VanDerWaalsContact O-N 3.07Å
46	M	95.8	Very high	96.1	Very high	16 Å²	16	45.9 Å²	45.9	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-66.8	-38.3	174.5	-66	174.5	-154.9	0	0	112.2	L18 V21 M22 R42 T43 R44 Y50	L18-M46 HydrophobicContact CD2-CB 4.1Å; L18-M46 HydrophobicContact CD2-CG 4.37Å; V21-M46 HydrophobicContact CB-SD 4.11Å; V21-M46 HydrophobicContact CG1-CE 3.57Å; V21-M46 HydrophobicContact CG1-SD 3.55Å; V21-M46 VanDerWaalsContact CG1-SD 3.55Å; M22-M46 HydrophobicContact CG-CB 3.45Å; M22-M46 VanDerWaalsContact CG-CB 3.45Å; M22-M46 HydrophobicContact CG-CG 4.25Å; M22-M46 HydrophobicContact CG-SD 3.79Å; M22-M46 HydrophobicContact SD-CB 3.85Å; R42-M46 HydrophobicContact CB-CE 4.24Å; R42-M46 VanDerWaalsContact O-CG 3.32Å; R42-M46 WeakPolarHBondContact O-CG 3.16Å; R42-M46 PolarHBondContact O-N 3.37Å; R42-M46 VanDerWaalsContact O-N 3.07Å; T43-M46 PolarHBondContact O-N 3.31Å; R44-M46 VanDerWaalsContact C-N 3.3Å; R44-M46 PolarHBondContact O-N 3.3Å; M46-Y50 WeakPolarHBondContact O-CB 3.43Å; M46-Y50 PolarHBondContact O-N 2.6Å
47	Q	96.1	Very high	96.2	Very high	75 Å²	75	42.9 Å²	42.9	35%	0.35	22%	0.217	S	C	.	.	H	α-helix	trans	-64.4	-44.5	175.7	-176	-176.3	1.3	0	0	111.4	M22 T43 R44 R49 Y50 M51	M22-Q47 HydrophobicContact SD-CB 4.22Å; T43-Q47 WeakPolarHBondContact O-CB 3.28Å; T43-Q47 PolarHBondContact O-N 3.46Å; R44-Q47 WeakPolarHBondContact O-CB 3.44Å; R44-Q47 PolarHBondContact O-N 2.93Å; R44-Q47 VanDerWaalsContact O-N 3.09Å; Q47-R49 PolarHBondContact O-N 2.71Å; Q47-Y50 WeakPolarHBondContact O-CB 3.48Å; Q47-Y50 PolarHBondContact O-N 2.96Å; Q47-Y50 VanDerWaalsContact O-N 3.15Å; Q47-M51 WeakPolarHBondContact O-CG 3.34Å; Q47-M51 PolarHBondContact O-N 2.9Å
48	D	96.6	Very high	96.3	Very high	70 Å²	70	49.9 Å²	49.9	37%	0.374	24%	0.243	S	C	.	.	H	α-helix	trans	-61.2	-45.6	177.3	-74.3	-35.5	0	0	0	111.3	R44 A45 Y50 M51 E52	R44-D48 IonicContact CZ-OD1 3.33Å; R44-D48 VanDerWaalsContact CZ-OD1 3.28Å; R44-D48 IonicContact CZ-OD2 3.07Å; R44-D48 IonicContact NE-OD1 2.72Å; R44-D48 PolarHBondContact NE-OD1 3.24Å; R44-D48 VanDerWaalsContact NE-OD1 3.17Å; R44-D48 IonicContact NE-OD2 3.87Å; R44-D48 PolarHBondContact NE-OD2 3.02Å; R44-D48 IonicContact NH2-OD1 3.97Å; R44-D48 PolarHBondContact NH2-OD1 2.77Å; R44-D48 IonicContact NH2-OD2 3.35Å; R44-D48 PolarHBondContact O-N 2.92Å; A45-D48 PolarHBondContact O-N 3.09Å; D48-Y50 VanDerWaalsContact C-N 3.32Å; D48-Y50 PolarHBondContact O-N 3.11Å; D48-M51 PolarHBondContact O-N 3.21Å; D48-E52 PolarHBondContact O-N 2.89Å
49	R	97.1	Very high	96.4	Very high	58 Å²	58	52.9 Å²	52.9	22%	0.219	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-40.7	173.1	-173.4	176.4	167.8	178	6.3	111.9	E14 L18 A45 Q47 M51 E52 V53 E109	E14-R49 IonicContact OE1-CZ 2.63Å; E14-R49 IonicContact OE1-NE 3.81Å; E14-R49 PolarHBondContact OE1-NE 2.95Å; E14-R49 IonicContact OE1-NH2 3.23Å; E14-R49 PolarHBondContact OE1-NH2 3.48Å; L18-R49 HydrophobicContact CD1-CB 4.28Å; L18-R49 HydrophobicContact CD1-CG 3.9Å; L18-R49 HydrophobicContact CD2-CB 4.28Å; L18-R49 HydrophobicContact CD2-CG 4.25Å; A45-R49 PolarHBondContact O-N 3.36Å; A45-R49 VanDerWaalsContact O-N 3.07Å; Q47-R49 PolarHBondContact O-N 2.71Å; R49-M51 VanDerWaalsContact C-N 3.3Å; R49-M51 PolarHBondContact O-N 2.81Å; R49-E52 PolarHBondContact O-N 3.47Å; R49-V53 HydrophobicContact CG-CG2 4.35Å; R49-V53 WeakPolarHBondContact O-CB 3.35Å; R49-V53 VanDerWaalsContact O-CG2 3.23Å; R49-V53 WeakPolarHBondContact O-CG2 3.38Å; R49-V53 PolarHBondContact O-N 3.33Å; R49-E109 IonicContact CZ-OE1 2.88Å; R49-E109 VanDerWaalsContact CZ-OE1 3.25Å; R49-E109 IonicContact CZ-OE2 3.49Å; R49-E109 IonicContact NH1-OE1 3.43Å; R49-E109 PolarHBondContact NH1-OE1 3.29Å; R49-E109 IonicContact NH1-OE2 2.72Å; R49-E109 IonicContact NH2-OE1 2.77Å; R49-E109 PolarHBondContact NH2-OE1 2.93Å; R49-E109 VanDerWaalsContact NH2-OE1 3.07Å; R49-E109 IonicContact NH2-OE2 2.77Å; R49-E109 PolarHBondContact NH2-OE2 3.15Å
50	Y	97.9	Very high	96.4	Very high	54 Å²	54	54.3 Å²	54.3	21%	0.212	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-40	176.7	179.2	-84.5	0	0	0	111.9	K15 L18 M19 M22 M46 Q47 D48 S54	K15-Y50 HydrophobicContact CB-CD2 4.21Å; K15-Y50 HydrophobicContact CB-CE2 3.81Å; K15-Y50 HydrophobicContact CD-CE2 4.47Å; K15-Y50 VanDerWaalsContact CE-CZ 3.5Å; K15-Y50 VanDerWaalsContact CE-OH 3.31Å; K15-Y50 WeakPolarHBondContact CE-OH 3.35Å; K15-Y50 HydrophobicContact CG-CD2 4.17Å; K15-Y50 HydrophobicContact CG-CE2 3.97Å; L18-Y50 HydrophobicContact CB-CD2 4.15Å; M19-Y50 HydrophobicContact CE-CE2 4.45Å; M19-Y50 HydrophobicContact CG-CD2 4.09Å; M19-Y50 HydrophobicContact CG-CE2 3.56Å; M19-Y50 HydrophobicContact SD-CE2 3.81Å; M22-Y50 HydrophobicContact CE-CD2 4.28Å; M22-Y50 HydrophobicContact CE-CG 4.39Å; M46-Y50 WeakPolarHBondContact O-CB 3.43Å; M46-Y50 PolarHBondContact O-N 2.6Å; Q47-Y50 WeakPolarHBondContact O-CB 3.48Å; Q47-Y50 PolarHBondContact O-N 2.96Å; Q47-Y50 VanDerWaalsContact O-N 3.15Å; D48-Y50 VanDerWaalsContact C-N 3.32Å; D48-Y50 PolarHBondContact O-N 3.11Å; Y50-S54 WeakPolarHBondContact CE1-OG 3.44Å; Y50-S54 VanDerWaalsContact O-CB 3.23Å; Y50-S54 WeakPolarHBondContact O-CB 3.18Å; Y50-S54 PolarHBondContact O-N 3.33Å; Y50-S54 PolarHBondContact O-OG 3.36Å
51	M	97	Very high	96.4	Very high	117 Å²	117	57.9 Å²	57.9	58%	0.576	28%	0.279	S	S	*	.	H	α-helix	trans	-68.4	-42.6	177.4	-70.2	-58.5	-67.8	0	0	111.7	Q47 D48 R49 S54 G55	Q47-M51 WeakPolarHBondContact O-CG 3.34Å; Q47-M51 PolarHBondContact O-N 2.9Å; D48-M51 PolarHBondContact O-N 3.21Å; R49-M51 VanDerWaalsContact C-N 3.3Å; R49-M51 PolarHBondContact O-N 2.81Å; M51-S54 PolarHBondContact O-N 2.91Å; M51-G55 PolarHBondContact O-N 3.31Å
52	E	97.8	Very high	96.4	Very high	126 Å²	126	60.2 Å²	60.2	59%	0.589	29%	0.293	S	S	*	.	H	α-helix	trans	-59.6	-52.3	174.5	-174.2	-173	168.5	0	0	111.3	D48 R49 S54 G55 N56	D48-E52 PolarHBondContact O-N 2.89Å; R49-E52 PolarHBondContact O-N 3.47Å; E52-S54 VanDerWaalsContact C-N 3.26Å; E52-S54 PolarHBondContact O-N 3.01Å; E52-G55 WeakPolarHBondContact O-CA 3.5Å; E52-G55 PolarHBondContact O-N 2.85Å; E52-N56 PolarHBondContact O-N 3.31Å; E52-N56 PolarHBondContact O-ND2 3.4Å
53	V	97.6	Very high	96.5	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-40	178.3	174.2	0	0	0	0	111	Y11 E14 K15 L18 R49 N56 L57	Y11-V53 HydrophobicContact CD1-CG1 3.72Å; Y11-V53 HydrophobicContact CG-CG1 4.09Å; Y11-V53 WeakPolarHBondContact O-CG1 3.42Å; E14-V53 HydrophobicContact CB-CG1 4.33Å; E14-V53 HydrophobicContact CG-CG2 4.01Å; K15-V53 HydrophobicContact CD-CG1 4.21Å; K15-V53 HydrophobicContact CG-CB 4.3Å; K15-V53 HydrophobicContact CG-CG1 3.61Å; L18-V53 HydrophobicContact CD1-CG2 4.48Å; R49-V53 HydrophobicContact CG-CG2 4.35Å; R49-V53 WeakPolarHBondContact O-CB 3.35Å; R49-V53 VanDerWaalsContact O-CG2 3.23Å; R49-V53 WeakPolarHBondContact O-CG2 3.38Å; R49-V53 PolarHBondContact O-N 3.33Å; V53-N56 PolarHBondContact O-N 3.21Å; V53-L57 VanDerWaalsContact O-CB 3.25Å; V53-L57 WeakPolarHBondContact O-CB 3.46Å; V53-L57 PolarHBondContact O-N 2.72Å
54	S	97.9	Very high	96.4	Very high	25 Å²	25	67.3 Å²	67.3	18%	0.175	33%	0.326	C	S	.	.	H	α-helix	trans	-64.9	-38.4	176	-66.1	0	0	0	0	112.6	K15 Y50 M51 E52 R58	K15-S54 WeakPolarHBondContact CD-OG 3.34Å; K15-S54 VanDerWaalsContact CE-OG 3.24Å; K15-S54 WeakPolarHBondContact CE-OG 3.28Å; K15-S54 PolarHBondContact NZ-OG 2.99Å; Y50-S54 WeakPolarHBondContact CE1-OG 3.44Å; Y50-S54 VanDerWaalsContact O-CB 3.23Å; Y50-S54 WeakPolarHBondContact O-CB 3.18Å; Y50-S54 PolarHBondContact O-N 3.33Å; Y50-S54 PolarHBondContact O-OG 3.36Å; M51-S54 PolarHBondContact O-N 2.91Å; E52-S54 VanDerWaalsContact C-N 3.26Å; E52-S54 PolarHBondContact O-N 3.01Å; S54-R58 WeakPolarHBondContact O-CB 3.38Å; S54-R58 PolarHBondContact O-N 3.4Å
55	G	97.8	Very high	96.3	Very high	19 Å²	19	68.3 Å²	68.3	20%	0.196	34%	0.337	C	S	.	.	H	α-helix	trans	-62.6	-50.5	173.4	0	0	0	0	0	111.9	M51 E52 L57 R58 D59	M51-G55 PolarHBondContact O-N 3.31Å; E52-G55 WeakPolarHBondContact O-CA 3.5Å; E52-G55 PolarHBondContact O-N 2.85Å; G55-L57 VanDerWaalsContact C-N 3.34Å; G55-L57 PolarHBondContact O-N 2.93Å; G55-R58 WeakPolarHBondContact O-CB 3.21Å; G55-R58 PolarHBondContact O-N 2.81Å; G55-D59 VanDerWaalsContact O-CG 3.31Å; G55-D59 PolarHBondContact O-N 3.4Å
56	N	96.5	Very high	96.2	Very high	56 Å²	56	66.5 Å²	66.5	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-59.1	-44.9	177.6	-68.3	-26.1	0	0	0	111.7	Y11 E52 V53 R58 D59 L60	Y11-N56 HydrophobicContact CE1-CB 4.39Å; Y11-N56 HydrophobicContact CE2-CB 4Å; E52-N56 PolarHBondContact O-N 3.31Å; E52-N56 PolarHBondContact O-ND2 3.4Å; V53-N56 PolarHBondContact O-N 3.21Å; N56-R58 PolarHBondContact O-N 3.25Å; N56-D59 PolarHBondContact O-N 3.19Å; N56-L60 WeakPolarHBondContact O-CG 3.24Å; N56-L60 PolarHBondContact O-N 3.09Å
57	L	96.7	Very high	96.1	Very high	8 Å²	8	69.8 Å²	69.8	4%	0.042	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-43.1	178.1	-177.9	61.6	0	0	0	112.2	Q8 K15 V53 G55 D59 L60 Y61	Q8-L57 HydrophobicContact CB-CD1 4.21Å; Q8-L57 HydrophobicContact CG-CD1 4.18Å; K15-L57 HydrophobicContact CD-CD2 3.88Å; V53-L57 VanDerWaalsContact O-CB 3.25Å; V53-L57 WeakPolarHBondContact O-CB 3.46Å; V53-L57 PolarHBondContact O-N 2.72Å; G55-L57 VanDerWaalsContact C-N 3.34Å; G55-L57 PolarHBondContact O-N 2.93Å; L57-D59 VanDerWaalsContact C-N 3.33Å; L57-L60 PolarHBondContact O-N 3.34Å; L57-Y61 HydrophobicContact CD1-CD2 3.94Å; L57-Y61 HydrophobicContact CD1-CE2 3.55Å; L57-Y61 HydrophobicContact CD2-CE2 4.45Å; L57-Y61 HydrophobicContact CG-CD2 3.98Å; L57-Y61 HydrophobicContact CG-CE2 3.84Å; L57-Y61 VanDerWaalsContact O-CD2 3.23Å; L57-Y61 WeakPolarHBondContact O-CD2 3.31Å; L57-Y61 PolarHBondContact O-N 2.86Å; L57-Y61 VanDerWaalsContact O-N 3.08Å
58	R	97.2	Very high	95.9	Very high	149 Å²	149	69.1 Å²	69.1	56%	0.562	34%	0.335	S	S	*	.	H	α-helix	trans	-58.8	-47.6	174.5	179.6	-166.1	65.5	-154.9	-7	110.5	S54 G55 N56 L60 Y61 D62	S54-R58 WeakPolarHBondContact O-CB 3.38Å; S54-R58 PolarHBondContact O-N 3.4Å; G55-R58 WeakPolarHBondContact O-CB 3.21Å; G55-R58 PolarHBondContact O-N 2.81Å; N56-R58 PolarHBondContact O-N 3.25Å; R58-L60 VanDerWaalsContact C-N 3.28Å; R58-L60 PolarHBondContact O-N 3.22Å; R58-Y61 CarbonylContact O-C 3.39Å; R58-Y61 WeakPolarHBondContact O-CA 3.35Å; R58-Y61 PolarHBondContact O-N 3.44Å; R58-D62 PolarHBondContact O-N 3.27Å
59	D	95.9	Very high	95.8	Very high	70 Å²	70	72.1 Å²	72.1	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-34.7	-178.1	-68.3	-0.2	0	0	0	111.8	G55 N56 L57 D63	G55-D59 VanDerWaalsContact O-CG 3.31Å; G55-D59 PolarHBondContact O-N 3.4Å; N56-D59 PolarHBondContact O-N 3.19Å; L57-D59 VanDerWaalsContact C-N 3.33Å; D59-D63 PolarHBondContact O-N 2.85Å
60	L	95.1	Very high	95.5	Very high	31 Å²	31	75.4 Å²	75.4	16%	0.162	36%	0.363	C	S	.	.	H	α-helix	trans	-67.4	-32.6	170.8	-69.3	-175	0	0	0	113.5	I4 Q7 Q8 Y11 N56 L57 R58 R68	I4-L60 HydrophobicContact CD1-CD2 3.98Å; I4-L60 HydrophobicContact CG1-CD2 4.07Å; Q7-L60 HydrophobicContact CB-CD1 3.96Å; Q8-L60 HydrophobicContact CG-CB 4.06Å; Q8-L60 HydrophobicContact CG-CD1 3.89Å; Q8-L60 PolarHBondContact NE2-O 3.27Å; Y11-L60 HydrophobicContact CD2-CD1 3.74Å; Y11-L60 HydrophobicContact CE2-CD1 3.7Å; N56-L60 WeakPolarHBondContact O-CG 3.24Å; N56-L60 PolarHBondContact O-N 3.09Å; L57-L60 PolarHBondContact O-N 3.34Å; R58-L60 VanDerWaalsContact C-N 3.28Å; R58-L60 PolarHBondContact O-N 3.22Å; L60-R68 WeakPolarHBondContact O-CD 3.28Å
61	Y	95.8	Very high	95.2	Very high	106 Å²	106	74 Å²	74	42%	0.416	36%	0.358	S	S	.	.	H	α-helix	trans	-77.8	-31.9	175.7	-85.6	-69.2	0	0	0	113.2	H12 L57 R58 D63	H12-Y61 AromaticContact NE2-CE2 3.57Å; H12-Y61 AromaticContact NE2-CZ 3.7Å; H12-Y61 PolarHBondContact NE2-OH 3.47Å; L57-Y61 HydrophobicContact CD1-CD2 3.94Å; L57-Y61 HydrophobicContact CD1-CE2 3.55Å; L57-Y61 HydrophobicContact CD2-CE2 4.45Å; L57-Y61 HydrophobicContact CG-CD2 3.98Å; L57-Y61 HydrophobicContact CG-CE2 3.84Å; L57-Y61 VanDerWaalsContact O-CD2 3.23Å; L57-Y61 WeakPolarHBondContact O-CD2 3.31Å; L57-Y61 PolarHBondContact O-N 2.86Å; L57-Y61 VanDerWaalsContact O-N 3.08Å; R58-Y61 CarbonylContact O-C 3.39Å; R58-Y61 WeakPolarHBondContact O-CA 3.35Å; R58-Y61 PolarHBondContact O-N 3.44Å; Y61-D63 PolarHBondContact O-N 3.19Å
62	D	95.7	Very high	95	Very high	88 Å²	88	71 Å²	71	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-61.3	-23.9	173.4	-79.6	-2.9	0	0	0	111.8	R58 K64	R58-D62 PolarHBondContact O-N 3.27Å; D62-K64 VanDerWaalsContact C-N 3.3Å; D62-K64 HydrophobicContact CB-CG 4.26Å; D62-K64 PolarHBondContact O-N 3.38Å; D62-K64 IonicContact OD2-NZ 2.89Å
63	D	94.8	Very high	94.7	Very high	33 Å²	33	69.7 Å²	69.7	18%	0.176	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	44.1	169.9	-168.9	32.1	0	0	0	113.1	D59 Y61 D65 G66 L67 R68 K69	D59-D63 PolarHBondContact O-N 2.85Å; Y61-D63 PolarHBondContact O-N 3.19Å; D63-D65 PolarHBondContact O-N 3.3Å; D63-G66 PolarHBondContact O-N 3.46Å; D63-G66 VanDerWaalsContact O-N 3.09Å; D63-G66 WeakPolarHBondContact OD1-CA 3.32Å; D63-G66 PolarHBondContact OD1-N 3.31Å; D63-L67 PolarHBondContact OD1-N 2.76Å; D63-L67 VanDerWaalsContact OD1-N 3.17Å; D63-R68 HydrophobicContact CB-CB 4.07Å; D63-R68 VanDerWaalsContact CG-CB 3.45Å; D63-R68 WeakPolarHBondContact OD1-CA 3.19Å; D63-R68 WeakPolarHBondContact OD1-CB 3.33Å; D63-R68 PolarHBondContact OD1-N 3.13Å; D63-K69 VanDerWaalsContact OD2-CB 3.27Å; D63-K69 WeakPolarHBondContact OD2-CB 3.45Å; D63-K69 PolarHBondContact OD2-N 2.89Å
64	K	94.1	Very high	94.3	Very high	168 Å²	168	71.1 Å²	71.1	73%	0.73	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-27.2	-174.9	-66.8	176.2	-175.1	160	0	113.2	D62	D62-K64 VanDerWaalsContact C-N 3.3Å; D62-K64 HydrophobicContact CB-CG 4.26Å; D62-K64 PolarHBondContact O-N 3.38Å; D62-K64 IonicContact OD2-NZ 2.89Å
65	D	93.3	Very high	93.8	Very high	100 Å²	100	72.9 Å²	72.9	54%	0.535	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-9.3	177.7	57.5	16.1	0	0	0	113.4	D63 L67	D63-D65 PolarHBondContact O-N 3.3Å; D65-L67 HydrophobicContact CB-CG 4.17Å; D65-L67 VanDerWaalsContact CG-CG 3.49Å; D65-L67 PolarHBondContact O-N 3.1Å; D65-L67 WeakPolarHBondContact OD1-CB 3.19Å; D65-L67 PolarHBondContact OD1-N 2.96Å; D65-L67 VanDerWaalsContact OD2-CD1 3.27Å; D65-L67 WeakPolarHBondContact OD2-CD1 3.44Å
66	G	93.5	Very high	93.5	Very high	22 Å²	22	76.3 Å²	76.3	23%	0.227	38%	0.382	C	S	.	.	S	Bend	trans	74.7	2	-178	0	0	0	0	0	114.6	D63 R68 K69 E70	D63-G66 PolarHBondContact O-N 3.46Å; D63-G66 VanDerWaalsContact O-N 3.09Å; D63-G66 WeakPolarHBondContact OD1-CA 3.32Å; D63-G66 PolarHBondContact OD1-N 3.31Å; G66-R68 PolarHBondContact O-N 3.46Å; G66-K69 PolarHBondContact O-N 2.81Å; G66-E70 WeakPolarHBondContact O-CG 3.31Å; G66-E70 PolarHBondContact O-N 2.88Å
67	L	93	Very high	92.9	Very high	86 Å²	86	74.4 Å²	74.4	45%	0.45	38%	0.375	S	S	.	.	H	α-helix	trans	-63.8	-32.3	-176.8	-68.8	-178.6	0	0	0	111.8	I4 D63 D65 E70 E71	I4-L67 HydrophobicContact CD1-CB 4.12Å; D63-L67 PolarHBondContact OD1-N 2.76Å; D63-L67 VanDerWaalsContact OD1-N 3.17Å; D65-L67 HydrophobicContact CB-CG 4.17Å; D65-L67 VanDerWaalsContact CG-CG 3.49Å; D65-L67 PolarHBondContact O-N 3.1Å; D65-L67 WeakPolarHBondContact OD1-CB 3.19Å; D65-L67 PolarHBondContact OD1-N 2.96Å; D65-L67 VanDerWaalsContact OD2-CD1 3.27Å; D65-L67 WeakPolarHBondContact OD2-CD1 3.44Å; L67-E70 PolarHBondContact O-N 3.48Å; L67-E71 WeakPolarHBondContact O-CB 3.46Å; L67-E71 PolarHBondContact O-N 3.15Å
68	R	93.1	Very high	92.4	Very high	60 Å²	60	80.6 Å²	80.6	23%	0.226	42%	0.416	C	S	.	.	H	α-helix	trans	-69	-44.4	177.3	-171.8	-177.1	171.7	-85.1	-7.1	110.5	I4 Q8 L60 D63 G66 E70 E71 L72	I4-R68 HydrophobicContact CD1-CB 3.84Å; I4-R68 HydrophobicContact CG1-CB 4.41Å; I4-R68 HydrophobicContact CG2-CB 4.39Å; Q8-R68 VanDerWaalsContact NE2-CD 3.32Å; Q8-R68 VanDerWaalsContact OE1-NE 3.16Å; L60-R68 WeakPolarHBondContact O-CD 3.28Å; D63-R68 HydrophobicContact CB-CB 4.07Å; D63-R68 VanDerWaalsContact CG-CB 3.45Å; D63-R68 WeakPolarHBondContact OD1-CA 3.19Å; D63-R68 WeakPolarHBondContact OD1-CB 3.33Å; D63-R68 PolarHBondContact OD1-N 3.13Å; G66-R68 PolarHBondContact O-N 3.46Å; R68-E70 VanDerWaalsContact C-N 3.34Å; R68-E71 PolarHBondContact O-N 3.36Å; R68-L72 HydrophobicContact CG-CD1 4.37Å; R68-L72 WeakPolarHBondContact O-CB 3.47Å; R68-L72 VanDerWaalsContact O-CG 3.31Å; R68-L72 WeakPolarHBondContact O-CG 3.38Å; R68-L72 PolarHBondContact O-N 2.73Å
69	K	93.5	Very high	91.9	Very high	134 Å²	134	79.5 Å²	79.5	58%	0.583	42%	0.421	S	S	*	.	H	α-helix	trans	-62.4	-41.3	174.4	-177.2	177.2	-179.5	-178.6	0	111.8	D63 G66 L72 N73	D63-K69 VanDerWaalsContact OD2-CB 3.27Å; D63-K69 WeakPolarHBondContact OD2-CB 3.45Å; D63-K69 PolarHBondContact OD2-N 2.89Å; G66-K69 PolarHBondContact O-N 2.81Å; K69-L72 PolarHBondContact O-N 2.9Å; K69-N73 WeakPolarHBondContact O-CB 3.49Å; K69-N73 PolarHBondContact O-N 2.7Å; K69-N73 PolarHBondContact O-ND2 3.07Å; K69-N73 VanDerWaalsContact O-ND2 3.13Å
70	E	92	Very high	91.6	Very high	126 Å²	126	80.3 Å²	80.3	59%	0.589	42%	0.423	S	S	*	.	H	α-helix	trans	-60.5	-47.6	174.8	-74.3	-176.2	175.3	0	0	111.9	G66 L67 R68 L72 N73 A74	G66-E70 WeakPolarHBondContact O-CG 3.31Å; G66-E70 PolarHBondContact O-N 2.88Å; L67-E70 PolarHBondContact O-N 3.48Å; R68-E70 VanDerWaalsContact C-N 3.34Å; E70-L72 PolarHBondContact O-N 3.2Å; E70-N73 PolarHBondContact O-N 3.09Å; E70-A74 WeakPolarHBondContact O-CB 3.31Å; E70-A74 PolarHBondContact O-N 3.3Å
71	E	91.4	Very high	91.4	Very high	25 Å²	25	85.4 Å²	85.4	12%	0.117	44%	0.444	C	S	.	.	H	α-helix	trans	-60.5	-45.3	177.5	177.8	68.7	177.1	0	0	111.9	T3 I4 L5 L67 R68 N73 A74 I75 R87	T3-E71 VanDerWaalsContact CB-OE1 3.31Å; T3-E71 WeakPolarHBondContact CB-OE1 3.44Å; T3-E71 WeakPolarHBondContact CG2-OE1 3.37Å; I4-E71 HydrophobicContact CG2-CB 3.58Å; I4-E71 HydrophobicContact CG2-CG 3.74Å; L5-E71 HydrophobicContact CD1-CG 3.78Å; L5-E71 HydrophobicContact CG-CG 3.79Å; L67-E71 WeakPolarHBondContact O-CB 3.46Å; L67-E71 PolarHBondContact O-N 3.15Å; R68-E71 PolarHBondContact O-N 3.36Å; E71-N73 PolarHBondContact O-N 3Å; E71-A74 WeakPolarHBondContact O-CB 3.18Å; E71-A74 PolarHBondContact O-N 3.46Å; E71-I75 WeakPolarHBondContact O-CG1 3.34Å; E71-I75 PolarHBondContact O-N 2.98Å; E71-I75 VanDerWaalsContact O-N 3.17Å; E71-R87 VanDerWaalsContact CD-NH2 3.3Å; E71-R87 IonicContact OE1-CZ 3.7Å; E71-R87 IonicContact OE1-NH1 3.99Å; E71-R87 PolarHBondContact OE1-NH1 2.92Å; E71-R87 IonicContact OE1-NH2 2.68Å; E71-R87 PolarHBondContact OE1-NH2 2.88Å; E71-R87 IonicContact OE2-CZ 2.67Å; E71-R87 IonicContact OE2-NH1 3.17Å; E71-R87 IonicContact OE2-NH2 2.92Å; E71-R87 PolarHBondContact OE2-NH2 3.46Å
72	L	91.9	Very high	91.2	Very high	54 Å²	54	83.5 Å²	83.5	28%	0.283	45%	0.45	S	S	.	.	H	α-helix	trans	-62	-42.6	176	-74.2	173.1	0	0	0	112	L5 R68 K69 E70 A74 I75 S76	L5-L72 HydrophobicContact CD1-CD2 4.24Å; L5-L72 HydrophobicContact CD2-CD2 4.14Å; R68-L72 HydrophobicContact CG-CD1 4.37Å; R68-L72 WeakPolarHBondContact O-CB 3.47Å; R68-L72 VanDerWaalsContact O-CG 3.31Å; R68-L72 WeakPolarHBondContact O-CG 3.38Å; R68-L72 PolarHBondContact O-N 2.73Å; K69-L72 PolarHBondContact O-N 2.9Å; E70-L72 PolarHBondContact O-N 3.2Å; L72-A74 VanDerWaalsContact C-N 3.3Å; L72-A74 PolarHBondContact O-N 2.96Å; L72-I75 HydrophobicContact CD2-CD1 4.32Å; L72-I75 WeakPolarHBondContact O-CG1 3.17Å; L72-I75 PolarHBondContact O-N 2.73Å; L72-S76 WeakPolarHBondContact O-CB 3.45Å; L72-S76 PolarHBondContact O-N 2.93Å
73	N	91.4	Very high	91	Very high	98 Å²	98	81.9 Å²	81.9	52%	0.524	44%	0.44	S	S	.	.	H	α-helix	trans	-66.4	-32.9	176.6	-71.3	-26.3	0	0	0	112.2	K69 E70 E71 G77	K69-N73 WeakPolarHBondContact O-CB 3.49Å; K69-N73 PolarHBondContact O-N 2.7Å; K69-N73 PolarHBondContact O-ND2 3.07Å; K69-N73 VanDerWaalsContact O-ND2 3.13Å; E70-N73 PolarHBondContact O-N 3.09Å; E71-N73 PolarHBondContact O-N 3Å; N73-G77 WeakPolarHBondContact O-CA 3.2Å; N73-G77 PolarHBondContact O-N 3.43Å
74	A	88.9	Confident	90.8	Very high	35 Å²	35	86 Å²	86	29%	0.289	46%	0.456	S	S	.	.	H	α-helix	trans	-66.2	-40.6	177.1	0	0	0	0	0	111.6	E70 E71 L72 E83	E70-A74 WeakPolarHBondContact O-CB 3.31Å; E70-A74 PolarHBondContact O-N 3.3Å; E71-A74 WeakPolarHBondContact O-CB 3.18Å; E71-A74 PolarHBondContact O-N 3.46Å; L72-A74 VanDerWaalsContact C-N 3.3Å; L72-A74 PolarHBondContact O-N 2.96Å; A74-E83 HydrophobicContact CB-CG 4.33Å
75	I	89	Confident	90.8	Very high	62 Å²	62	85.1 Å²	85.1	32%	0.318	45%	0.449	S	S	.	.	H	α-helix	trans	-87	-23.6	-177.7	66.2	173.4	0	0	0	114.5	L5 E71 L72	L5-I75 HydrophobicContact CD1-CD1 3.52Å; E71-I75 WeakPolarHBondContact O-CG1 3.34Å; E71-I75 PolarHBondContact O-N 2.98Å; E71-I75 VanDerWaalsContact O-N 3.17Å; L72-I75 HydrophobicContact CD2-CD1 4.32Å; L72-I75 WeakPolarHBondContact O-CG1 3.17Å; L72-I75 PolarHBondContact O-N 2.73Å
76	S	89.9	Confident	90.7	Very high	92 Å²	92	83.9 Å²	83.9	64%	0.643	44%	0.443	S	S	*	.	H	α-helix	trans	-111.7	6.1	180	-58.5	0	0	0	0	113.5	L72	L72-S76 WeakPolarHBondContact O-CB 3.45Å; L72-S76 PolarHBondContact O-N 2.93Å
77	G	85.1	Confident	90.6	Very high	16 Å²	16	84.8 Å²	84.8	17%	0.165	44%	0.439	C	S	.	.	S	Bend	trans	-83.9	176.9	-178.4	0	0	0	0	0	113.9	N73 N79 E80	N73-G77 WeakPolarHBondContact O-CA 3.2Å; N73-G77 PolarHBondContact O-N 3.43Å; G77-N79 PolarHBondContact O-N 3.29Å; G77-E80 WeakPolarHBondContact O-CB 3.5Å; G77-E80 PolarHBondContact O-N 2.81Å; G77-E80 VanDerWaalsContact O-N 3.11Å
78	P	86.4	Confident	90.6	Very high	137 Å²	137	83.3 Å²	83.3	89%	0.89	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.1	-177.5	-21.9	31.9	0	0	0	114.9
79	N	86	Confident	90.7	Very high	127 Å²	127	86.4 Å²	86.4	68%	0.679	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	21.6	-178.8	-76	-16.5	0	0	0	113.1	G77 F81 A82 E83	G77-N79 PolarHBondContact O-N 3.29Å; N79-F81 VanDerWaalsContact C-N 3.26Å; N79-F81 PolarHBondContact O-N 3.44Å; N79-F81 VanDerWaalsContact O-N 3.12Å; N79-A82 PolarHBondContact O-N 2.97Å; N79-E83 PolarHBondContact O-N 3.01Å; N79-E83 VanDerWaalsContact O-N 3.12Å
80	E	89.2	Confident	90.7	Very high	87 Å²	87	83.7 Å²	83.7	41%	0.407	44%	0.436	S	S	.	.	H	α-helix	trans	-47.1	-42.9	-176.4	60.2	-178.1	-172.5	0	0	113.9	G77 E83 F84	G77-E80 WeakPolarHBondContact O-CB 3.5Å; G77-E80 PolarHBondContact O-N 2.81Å; G77-E80 VanDerWaalsContact O-N 3.11Å; E80-E83 PolarHBondContact O-N 3.24Å; E80-F84 VanDerWaalsContact O-CB 3.3Å; E80-F84 WeakPolarHBondContact O-CB 3.21Å; E80-F84 PolarHBondContact O-N 3.34Å
81	F	91.1	Very high	90.6	Very high	137 Å²	137	81.6 Å²	81.6	60%	0.601	43%	0.428	S	S	*	.	H	α-helix	trans	-68.3	-40.4	-179.3	-68.6	-72.4	0	0	0	112.6	N79 E83 F84 Y85	N79-F81 VanDerWaalsContact C-N 3.26Å; N79-F81 PolarHBondContact O-N 3.44Å; N79-F81 VanDerWaalsContact O-N 3.12Å; F81-E83 VanDerWaalsContact C-N 3.34Å; F81-F84 PolarHBondContact O-N 3.17Å; F81-Y85 WeakPolarHBondContact O-CD2 3.19Å; F81-Y85 PolarHBondContact O-N 2.61Å
82	A	92	Very high	90.7	Very high	66 Å²	66	86.9 Å²	86.9	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-65.7	-42.3	179.1	0	0	0	0	0	110.7	N79 Y85 N86	N79-A82 PolarHBondContact O-N 2.97Å; A82-Y85 PolarHBondContact O-N 2.86Å; A82-N86 WeakPolarHBondContact O-CB 3.34Å; A82-N86 PolarHBondContact O-N 3.47Å
83	E	90.6	Very high	90.9	Very high	55 Å²	55	87.7 Å²	87.7	26%	0.257	45%	0.453	S	S	.	.	H	α-helix	trans	-64.7	-45.1	175.6	-175.6	57.6	-159.6	0	0	111.5	A74 N79 E80 F81 Y85 N86 R87	A74-E83 HydrophobicContact CB-CG 4.33Å; N79-E83 PolarHBondContact O-N 3.01Å; N79-E83 VanDerWaalsContact O-N 3.12Å; E80-E83 PolarHBondContact O-N 3.24Å; F81-E83 VanDerWaalsContact C-N 3.34Å; E83-Y85 PolarHBondContact O-N 3.37Å; E83-N86 WeakPolarHBondContact O-CB 3.22Å; E83-N86 PolarHBondContact O-N 3.09Å; E83-R87 WeakPolarHBondContact O-CG 3.04Å; E83-R87 PolarHBondContact O-N 3.2Å; E83-R87 IonicContact OE1-CZ 3.75Å; E83-R87 IonicContact OE1-NE 3.43Å; E83-R87 PolarHBondContact OE1-NE 3.39Å; E83-R87 IonicContact OE1-NH2 3.28Å; E83-R87 PolarHBondContact OE1-NH2 2.84Å
84	F	91	Very high	90.8	Very high	119 Å²	119	87.2 Å²	87.2	52%	0.522	45%	0.446	S	S	.	.	H	α-helix	trans	-54.7	-51.1	174.6	172.5	-95.5	0	0	0	112.1	E80 F81 N86 R87 L88	E80-F84 VanDerWaalsContact O-CB 3.3Å; E80-F84 WeakPolarHBondContact O-CB 3.21Å; E80-F84 PolarHBondContact O-N 3.34Å; F81-F84 PolarHBondContact O-N 3.17Å; F84-N86 VanDerWaalsContact C-N 3.32Å; F84-N86 PolarHBondContact O-N 2.9Å; F84-R87 PolarHBondContact O-N 3.24Å; F84-L88 HydrophobicContact CE1-CD2 4.13Å; F84-L88 HydrophobicContact CZ-CD2 4.41Å; F84-L88 WeakPolarHBondContact O-CB 3.44Å; F84-L88 PolarHBondContact O-N 3.07Å
85	Y	93.8	Very high	90.9	Very high	149 Å²	149	91.1 Å²	91.1	58%	0.584	46%	0.458	S	S	*	.	H	α-helix	trans	-67	-33.5	-179.8	-75.3	-61.6	0	0	0	112.6	F81 A82 E83 L88 K89	F81-Y85 WeakPolarHBondContact O-CD2 3.19Å; F81-Y85 PolarHBondContact O-N 2.61Å; A82-Y85 PolarHBondContact O-N 2.86Å; E83-Y85 PolarHBondContact O-N 3.37Å; Y85-L88 HydrophobicContact CD1-CD2 4.42Å; Y85-K89 WeakPolarHBondContact O-CB 3.49Å; Y85-K89 PolarHBondContact O-N 2.84Å
86	N	92	Very high	91.1	Very high	74 Å²	74	96.9 Å²	96.9	40%	0.396	48%	0.476	S	S	.	.	H	α-helix	trans	-62.9	-50.5	173.5	-174.3	13	0	0	0	111.1	A82 E83 F84 L88 K89 Q90	A82-N86 WeakPolarHBondContact O-CB 3.34Å; A82-N86 PolarHBondContact O-N 3.47Å; E83-N86 WeakPolarHBondContact O-CB 3.22Å; E83-N86 PolarHBondContact O-N 3.09Å; F84-N86 VanDerWaalsContact C-N 3.32Å; F84-N86 PolarHBondContact O-N 2.9Å; N86-L88 PolarHBondContact O-N 2.86Å; N86-K89 WeakPolarHBondContact O-CB 3.41Å; N86-K89 PolarHBondContact O-N 3.12Å; N86-Q90 WeakPolarHBondContact O-CG 3.44Å; N86-Q90 PolarHBondContact O-N 2.91Å; N86-Q90 PolarHBondContact OD1-NE2 3.32Å
87	R	91	Very high	91.3	Very high	41 Å²	41	99.4 Å²	99.4	16%	0.155	48%	0.476	C	S	.	.	H	α-helix	trans	-61.7	-43.1	176.7	-67.9	-179.3	-174.3	-151.5	-5	112.2	E71 E83 F84 K89 Q90 I91	E71-R87 VanDerWaalsContact CD-NH2 3.3Å; E71-R87 IonicContact OE1-CZ 3.7Å; E71-R87 IonicContact OE1-NH1 3.99Å; E71-R87 PolarHBondContact OE1-NH1 2.92Å; E71-R87 IonicContact OE1-NH2 2.68Å; E71-R87 PolarHBondContact OE1-NH2 2.88Å; E71-R87 IonicContact OE2-CZ 2.67Å; E71-R87 IonicContact OE2-NH1 3.17Å; E71-R87 IonicContact OE2-NH2 2.92Å; E71-R87 PolarHBondContact OE2-NH2 3.46Å; E83-R87 WeakPolarHBondContact O-CG 3.04Å; E83-R87 PolarHBondContact O-N 3.2Å; E83-R87 IonicContact OE1-CZ 3.75Å; E83-R87 IonicContact OE1-NE 3.43Å; E83-R87 PolarHBondContact OE1-NE 3.39Å; E83-R87 IonicContact OE1-NH2 3.28Å; E83-R87 PolarHBondContact OE1-NH2 2.84Å; F84-R87 PolarHBondContact O-N 3.24Å; R87-K89 VanDerWaalsContact C-N 3.28Å; R87-K89 PolarHBondContact O-N 3.03Å; R87-Q90 PolarHBondContact O-N 3.45Å; R87-Q90 VanDerWaalsContact O-N 3.16Å; R87-I91 WeakPolarHBondContact O-CG1 3.48Å; R87-I91 PolarHBondContact O-N 3.05Å
88	L	93.4	Very high	91.6	Very high	55 Å²	55	102.6 Å²	102.6	29%	0.288	49%	0.486	S	S	.	.	H	α-helix	trans	-59.9	-39.9	176	-179.4	62.2	0	0	0	111.7	F84 Y85 N86 I91 K92	F84-L88 HydrophobicContact CE1-CD2 4.13Å; F84-L88 HydrophobicContact CZ-CD2 4.41Å; F84-L88 WeakPolarHBondContact O-CB 3.44Å; F84-L88 PolarHBondContact O-N 3.07Å; Y85-L88 HydrophobicContact CD1-CD2 4.42Å; N86-L88 PolarHBondContact O-N 2.86Å; L88-I91 PolarHBondContact O-N 3.08Å; L88-K92 HydrophobicContact CG-CD 4.44Å; L88-K92 WeakPolarHBondContact O-CG 3.21Å; L88-K92 PolarHBondContact O-N 2.96Å
89	K	95.3	Very high	91.8	Very high	126 Å²	126	100.8 Å²	100.8	55%	0.548	47%	0.474	S	S	.	.	H	α-helix	trans	-62.8	-45.5	175.3	-178	-177.3	172.8	-172.7	0	111.1	Y85 N86 R87 K92 E93	Y85-K89 WeakPolarHBondContact O-CB 3.49Å; Y85-K89 PolarHBondContact O-N 2.84Å; N86-K89 WeakPolarHBondContact O-CB 3.41Å; N86-K89 PolarHBondContact O-N 3.12Å; R87-K89 VanDerWaalsContact C-N 3.28Å; R87-K89 PolarHBondContact O-N 3.03Å; K89-K92 PolarHBondContact O-N 3.49Å; K89-E93 WeakPolarHBondContact CE-OE1 3.48Å; K89-E93 WeakPolarHBondContact O-CB 3.34Å; K89-E93 WeakPolarHBondContact O-CG 3.42Å; K89-E93 PolarHBondContact O-N 3.42Å
90	Q	92.4	Very high	92.1	Very high	77 Å²	77	101.8 Å²	101.8	36%	0.36	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-42.8	177.9	-66.7	175.4	35	0	0	112	M1 N86 R87 E93 F94	M1-Q90 HydrophobicContact CE-CB 3.58Å; M1-Q90 HydrophobicContact CE-CG 4.24Å; N86-Q90 WeakPolarHBondContact O-CG 3.44Å; N86-Q90 PolarHBondContact O-N 2.91Å; N86-Q90 PolarHBondContact OD1-NE2 3.32Å; R87-Q90 PolarHBondContact O-N 3.45Å; R87-Q90 VanDerWaalsContact O-N 3.16Å; Q90-E93 PolarHBondContact O-N 3.1Å; Q90-F94 WeakPolarHBondContact O-CB 3.27Å; Q90-F94 PolarHBondContact O-N 2.54Å
91	I	91.2	Very high	92	Very high	81 Å²	81	103.2 Å²	103.2	42%	0.415	49%	0.486	S	S	.	.	H	α-helix	trans	-60.2	-47.6	174.6	-67.9	166.5	0	0	0	110.7	R87 L88 E93 F94 H95	R87-I91 WeakPolarHBondContact O-CG1 3.48Å; R87-I91 PolarHBondContact O-N 3.05Å; L88-I91 PolarHBondContact O-N 3.08Å; I91-E93 VanDerWaalsContact C-N 3.34Å; I91-E93 PolarHBondContact O-N 3.03Å; I91-F94 WeakPolarHBondContact O-CB 3.16Å; I91-F94 PolarHBondContact O-N 2.91Å; I91-H95 PolarHBondContact O-CD2 3.43Å; I91-H95 VanDerWaalsContact O-CD2 3.23Å; I91-H95 PolarHBondContact O-N 3.14Å; I91-H95 VanDerWaalsContact O-N 3.08Å
92	K	93.8	Very high	91.7	Very high	137 Å²	137	103.5 Å²	103.5	60%	0.596	49%	0.493	S	S	*	.	H	α-helix	trans	-62.1	-40.9	177.4	-74.6	179	178.6	-177.6	0	112.3	L88 K89 F94 R96	L88-K92 HydrophobicContact CG-CD 4.44Å; L88-K92 WeakPolarHBondContact O-CG 3.21Å; L88-K92 PolarHBondContact O-N 2.96Å; K89-K92 PolarHBondContact O-N 3.49Å; K92-F94 VanDerWaalsContact C-N 3.35Å; K92-R96 WeakPolarHBondContact O-CB 3.24Å; K92-R96 PolarHBondContact O-N 2.95Å
93	E	94.6	Very high	91.4	Very high	70 Å²	70	105.9 Å²	105.9	33%	0.327	50%	0.504	S	S	.	.	H	α-helix	trans	-65.2	-38.2	176.7	-77.9	-178.1	-172.7	0	0	112.3	K89 Q90 I91 R96 K97	K89-E93 WeakPolarHBondContact CE-OE1 3.48Å; K89-E93 WeakPolarHBondContact O-CB 3.34Å; K89-E93 WeakPolarHBondContact O-CG 3.42Å; K89-E93 PolarHBondContact O-N 3.42Å; Q90-E93 PolarHBondContact O-N 3.1Å; I91-E93 VanDerWaalsContact C-N 3.34Å; I91-E93 PolarHBondContact O-N 3.03Å; E93-R96 PolarHBondContact O-N 3.4Å; E93-K97 WeakPolarHBondContact O-CG 3.46Å; E93-K97 PolarHBondContact O-N 3.27Å; E93-K97 VanDerWaalsContact O-N 3.09Å
94	F	90.9	Very high	91.2	Very high	89 Å²	89	108.1 Å²	108.1	39%	0.39	52%	0.521	S	S	.	.	H	α-helix	trans	-60.1	-58	174.3	-179.5	-93.7	0	0	0	111.1	Q90 I91 K92 R96 K97 H98 E101	Q90-F94 WeakPolarHBondContact O-CB 3.27Å; Q90-F94 PolarHBondContact O-N 2.54Å; I91-F94 WeakPolarHBondContact O-CB 3.16Å; I91-F94 PolarHBondContact O-N 2.91Å; K92-F94 VanDerWaalsContact C-N 3.35Å; F94-R96 PolarHBondContact O-N 2.99Å; F94-R96 VanDerWaalsContact O-N 3.16Å; F94-K97 PolarHBondContact O-N 3.28Å; F94-H98 AromaticContact CD2-CD2 3.71Å; F94-H98 AromaticContact CE2-CD2 3.63Å; F94-H98 AromaticContact CE2-NE2 3.97Å; F94-H98 PolarHBondContact O-CD2 2.85Å; F94-H98 VanDerWaalsContact O-CD2 3.26Å; F94-H98 PolarHBondContact O-N 3.05Å; F94-E101 WeakPolarHBondContact CZ-OE2 3.32Å
95	H	89.9	Confident	91.2	Very high	117 Å²	117	105.7 Å²	105.7	54%	0.542	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-29.9	180	-72.1	-68.9	0	0	0	113.4	I91 H98	I91-H95 PolarHBondContact O-CD2 3.43Å; I91-H95 VanDerWaalsContact O-CD2 3.23Å; I91-H95 PolarHBondContact O-N 3.14Å; I91-H95 VanDerWaalsContact O-N 3.08Å; H95-H98 CarbonylContact O-C 3.55Å; H95-H98 PolarHBondContact O-N 3.39Å
96	R	93.8	Very high	91	Very high	183 Å²	183	100.1 Å²	100.1	69%	0.691	50%	0.497	S	S	*	.	H	α-helix	trans	-67.3	-38.1	173.2	-173.5	-177.2	67.2	158.7	-1.6	112.5	K92 E93 F94	K92-R96 WeakPolarHBondContact O-CB 3.24Å; K92-R96 PolarHBondContact O-N 2.95Å; E93-R96 PolarHBondContact O-N 3.4Å; F94-R96 PolarHBondContact O-N 2.99Å; F94-R96 VanDerWaalsContact O-N 3.16Å
97	K	94.4	Very high	91	Very high	145 Å²	145	97.6 Å²	97.6	63%	0.63	49%	0.485	S	S	*	.	H	α-helix	trans	-76	-26.7	177.5	-73	178.8	-177.2	178.5	0	112.3	E93 F94 P99	E93-K97 WeakPolarHBondContact O-CG 3.46Å; E93-K97 PolarHBondContact O-N 3.27Å; E93-K97 VanDerWaalsContact O-N 3.09Å; F94-K97 PolarHBondContact O-N 3.28Å; K97-P99 WeakPolarHBondContact O-CD 3.46Å
98	H	91.7	Very high	91.1	Very high	82 Å²	82	97.7 Å²	97.7	38%	0.38	49%	0.49	S	S	.	.			trans	-123	63.1	-173.9	-58.8	-83.4	0	0	0	112.3	F94 H95 N100 E101	F94-H98 AromaticContact CD2-CD2 3.71Å; F94-H98 AromaticContact CE2-CD2 3.63Å; F94-H98 AromaticContact CE2-NE2 3.97Å; F94-H98 PolarHBondContact O-CD2 2.85Å; F94-H98 VanDerWaalsContact O-CD2 3.26Å; F94-H98 PolarHBondContact O-N 3.05Å; H95-H98 CarbonylContact O-C 3.55Å; H95-H98 PolarHBondContact O-N 3.39Å; H98-N100 VanDerWaalsContact C-N 3.28Å; H98-N100 PolarHBondContact O-N 3.44Å; H98-E101 HydrophobicContact CB-CB 3.92Å; H98-E101 WeakPolarHBondContact CB-OE2 3.25Å; H98-E101 IonicContact CG-OE2 3.3Å; H98-E101 VanDerWaalsContact CG-OE2 3.3Å; H98-E101 IonicContact ND1-OE2 3.54Å; H98-E101 PolarHBondContact O-N 2.9Å
99	P	90.2	Very high	91.1	Very high	99 Å²	99	98.8 Å²	98.8	64%	0.643	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-23.3	-174.2	28.1	-35.9	0	0	0	114.1	K97	K97-P99 WeakPolarHBondContact O-CD 3.46Å
100	N	91.3	Very high	91	Very high	149 Å²	149	93.1 Å²	93.1	80%	0.797	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	8.2	-176.5	-61.1	-22.6	0	0	0	112.7	H98 I102	H98-N100 VanDerWaalsContact C-N 3.28Å; H98-N100 PolarHBondContact O-N 3.44Å; N100-I102 PolarHBondContact O-N 2.96Å
101	E	88.1	Confident	90.9	Very high	116 Å²	116	94 Å²	94	54%	0.542	47%	0.473	S	S	.	.			trans	-75.5	116.8	178.9	-172.7	169	-176.3	0	0	109.5	F94 H98	F94-E101 WeakPolarHBondContact CZ-OE2 3.32Å; H98-E101 HydrophobicContact CB-CB 3.92Å; H98-E101 WeakPolarHBondContact CB-OE2 3.25Å; H98-E101 IonicContact CG-OE2 3.3Å; H98-E101 VanDerWaalsContact CG-OE2 3.3Å; H98-E101 IonicContact ND1-OE2 3.54Å; H98-E101 PolarHBondContact O-N 2.9Å
102	I	85.1	Confident	90.9	Very high	144 Å²	144	95.6 Å²	95.6	74%	0.738	48%	0.479	S	S	*	.			trans	-84.1	120.2	178.7	-60.4	173.9	0	0	0	107.5	N100 V104	N100-I102 PolarHBondContact O-N 2.96Å; I102-V104 PolarHBondContact O-N 3.32Å
103	C	84.1	Confident	90.7	Very high	115 Å²	115	92.2 Å²	92.2	78%	0.777	47%	0.467	S	S	*	.			trans	-72.4	115.4	169.3	-178.2	0	0	0	0	108.4	P105	C103-P105 WeakPolarHBondContact O-CD 3.48Å
104	V	86.8	Confident	90.5	Very high	102 Å²	102	90.4 Å²	90.4	62%	0.618	46%	0.46	S	S	*	.			trans	-95.1	111.3	173.4	-177.3	0	0	0	0	107.6	I102 V108	I102-V104 PolarHBondContact O-N 3.32Å; V104-V108 HydrophobicContact CG1-CB 3.85Å; V104-V108 HydrophobicContact CG1-CG1 4.11Å; V104-V108 HydrophobicContact CG1-CG2 3.91Å
105	P	90.6	Very high	90.3	Very high	69 Å²	69	92 Å²	92	45%	0.448	47%	0.466	S	S	.	.			trans	-64	149.7	175.6	-20.3	33	0	0	0	110.9	C103 S107 V108	C103-P105 WeakPolarHBondContact O-CD 3.48Å; P105-S107 PolarHBondContact O-N 3.32Å; P105-S107 VanDerWaalsContact O-N 3.12Å; P105-V108 WeakPolarHBondContact O-CB 3.29Å; P105-V108 WeakPolarHBondContact O-CG2 3.39Å; P105-V108 PolarHBondContact O-N 2.95Å
106	M	91.5	Very high	90.2	Very high	31 Å²	31	89 Å²	89	15%	0.153	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.7	176.5	-166.5	-170.7	-56.7	0	0	112.5	R10 E13 E14 V108 E109 F110	R10-M106 HydrophobicContact CB-CE 4.43Å; R10-M106 HydrophobicContact CG-CE 3.41Å; R10-M106 VanDerWaalsContact CG-CE 3.41Å; E13-M106 HydrophobicContact CB-CE 4.4Å; E13-M106 HydrophobicContact CG-CE 4.32Å; E13-M106 HydrophobicContact CG-SD 4.23Å; E14-M106 VanDerWaalsContact CA-SD 3.56Å; E14-M106 HydrophobicContact CB-CE 4.19Å; E14-M106 HydrophobicContact CB-SD 3.6Å; E14-M106 HydrophobicContact CG-SD 4.01Å; M106-V108 PolarHBondContact O-N 3.17Å; M106-V108 VanDerWaalsContact O-N 3.12Å; M106-E109 PolarHBondContact O-N 2.88Å; M106-F110 HydrophobicContact CG-CD2 4.29Å; M106-F110 HydrophobicContact CG-CE2 3.78Å; M106-F110 WeakPolarHBondContact O-CD2 3.47Å; M106-F110 HydrophobicContact SD-CE2 3.91Å
107	S	92	Very high	89.8	Confident	21 Å²	21	82.5 Å²	82.5	15%	0.147	44%	0.437	C	S	.	.	H	α-helix	trans	-56.9	-27.3	177	62.9	0	0	0	0	113.7	P105 E109 F110 E111	P105-S107 PolarHBondContact O-N 3.32Å; P105-S107 VanDerWaalsContact O-N 3.12Å; S107-E109 VanDerWaalsContact C-N 3.34Å; S107-E109 PolarHBondContact O-N 3.38Å; S107-F110 PolarHBondContact O-N 3.35Å; S107-E111 WeakPolarHBondContact O-CG 3.42Å; S107-E111 PolarHBondContact O-N 3.36Å
108	V	93.1	Very high	89.4	Confident	43 Å²	43	81.3 Å²	81.3	26%	0.261	43%	0.434	S	S	.	.	H	α-helix	trans	-62	-42.6	179.9	177.4	0	0	0	0	111	V104 P105 M106 F110 E111 E112	V104-V108 HydrophobicContact CG1-CB 3.85Å; V104-V108 HydrophobicContact CG1-CG1 4.11Å; V104-V108 HydrophobicContact CG1-CG2 3.91Å; P105-V108 WeakPolarHBondContact O-CB 3.29Å; P105-V108 WeakPolarHBondContact O-CG2 3.39Å; P105-V108 PolarHBondContact O-N 2.95Å; M106-V108 PolarHBondContact O-N 3.17Å; M106-V108 VanDerWaalsContact O-N 3.12Å; V108-F110 VanDerWaalsContact C-N 3.33Å; V108-F110 PolarHBondContact O-N 3.13Å; V108-E111 PolarHBondContact O-N 3.37Å; V108-E112 WeakPolarHBondContact O-CG 3.49Å; V108-E112 PolarHBondContact O-N 3.44Å
109	E	92.5	Very high	89	Confident	79 Å²	79	83.8 Å²	83.8	37%	0.369	45%	0.45	S	S	.	.	H	α-helix	trans	-60	-44.1	177.1	-174.5	-171.9	176.6	0	0	111.4	R49 M106 S107 E112 L113	R49-E109 IonicContact CZ-OE1 2.88Å; R49-E109 VanDerWaalsContact CZ-OE1 3.25Å; R49-E109 IonicContact CZ-OE2 3.49Å; R49-E109 IonicContact NH1-OE1 3.43Å; R49-E109 PolarHBondContact NH1-OE1 3.29Å; R49-E109 IonicContact NH1-OE2 2.72Å; R49-E109 IonicContact NH2-OE1 2.77Å; R49-E109 PolarHBondContact NH2-OE1 2.93Å; R49-E109 VanDerWaalsContact NH2-OE1 3.07Å; R49-E109 IonicContact NH2-OE2 2.77Å; R49-E109 PolarHBondContact NH2-OE2 3.15Å; M106-E109 PolarHBondContact O-N 2.88Å; S107-E109 VanDerWaalsContact C-N 3.34Å; S107-E109 PolarHBondContact O-N 3.38Å; E109-E112 WeakPolarHBondContact O-CB 2.96Å; E109-E112 PolarHBondContact O-N 3.3Å; E109-L113 WeakPolarHBondContact O-CG 3.43Å; E109-L113 PolarHBondContact O-N 3.03Å
110	F	92.9	Very high	88.7	Confident	7 Å²	7	81.3 Å²	81.3	3%	0.031	43%	0.434	C	S	.	.	H	α-helix	trans	-70.8	-32.6	178.8	-68.6	-80.6	0	0	0	112.8	E14 R17 L18 V21 M106 S107 V108 L113 L114	E14-F110 HydrophobicContact CG-CZ 4.26Å; R17-F110 HydrophobicContact CB-CD1 3.9Å; R17-F110 HydrophobicContact CB-CD2 3.49Å; R17-F110 VanDerWaalsContact CB-CD2 3.49Å; R17-F110 HydrophobicContact CB-CE1 3.69Å; R17-F110 HydrophobicContact CB-CE2 3.28Å; R17-F110 HydrophobicContact CB-CG 3.8Å; R17-F110 HydrophobicContact CB-CZ 3.39Å; R17-F110 HydrophobicContact CG-CD2 3.88Å; R17-F110 HydrophobicContact CG-CE2 3.82Å; R17-F110 HydrophobicContact CG-CG 4.5Å; R17-F110 HydrophobicContact CG-CZ 4.38Å; L18-F110 HydrophobicContact CB-CE1 4.46Å; L18-F110 HydrophobicContact CD2-CE1 3.71Å; L18-F110 HydrophobicContact CD2-CZ 4.23Å; L18-F110 HydrophobicContact CG-CE1 3.76Å; L18-F110 HydrophobicContact CG-CZ 3.95Å; V21-F110 HydrophobicContact CB-CD1 4.32Å; V21-F110 HydrophobicContact CG2-CB 3.86Å; V21-F110 HydrophobicContact CG2-CD1 3.61Å; V21-F110 HydrophobicContact CG2-CG 4.15Å; M106-F110 HydrophobicContact CG-CD2 4.29Å; M106-F110 HydrophobicContact CG-CE2 3.78Å; M106-F110 WeakPolarHBondContact O-CD2 3.47Å; M106-F110 HydrophobicContact SD-CE2 3.91Å; S107-F110 PolarHBondContact O-N 3.35Å; V108-F110 VanDerWaalsContact C-N 3.33Å; V108-F110 PolarHBondContact O-N 3.13Å; F110-L113 HydrophobicContact CD1-CD1 4.24Å; F110-L114 WeakPolarHBondContact O-CG 3.37Å; F110-L114 PolarHBondContact O-N 3.27Å
111	E	90.7	Very high	88.2	Confident	95 Å²	95	77.5 Å²	77.5	44%	0.444	42%	0.418	S	S	.	.	H	α-helix	trans	-67.2	-36.4	170.8	-73.9	172.3	-155.9	0	0	111.8	S107 V108 L114 K115	S107-E111 WeakPolarHBondContact O-CG 3.42Å; S107-E111 PolarHBondContact O-N 3.36Å; V108-E111 PolarHBondContact O-N 3.37Å; E111-L114 PolarHBondContact O-N 3.1Å; E111-K115 WeakPolarHBondContact O-CG 3.37Å; E111-K115 PolarHBondContact O-N 2.98Å
112	E	90.9	Very high	87.7	Confident	114 Å²	114	79.8 Å²	79.8	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-65.5	-40.5	174.7	-74.7	173.7	172.9	0	0	111.7	V108 E109 L114 K115 A116	V108-E112 WeakPolarHBondContact O-CG 3.49Å; V108-E112 PolarHBondContact O-N 3.44Å; E109-E112 WeakPolarHBondContact O-CB 2.96Å; E109-E112 PolarHBondContact O-N 3.3Å; E112-L114 VanDerWaalsContact C-N 3.32Å; E112-L114 PolarHBondContact O-N 3.43Å; E112-K115 PolarHBondContact O-N 3.2Å; E112-A116 WeakPolarHBondContact O-CB 3.46Å; E112-A116 PolarHBondContact O-N 2.88Å
113	L	90	Very high	87.2	Confident	67 Å²	67	80.9 Å²	80.9	35%	0.351	43%	0.431	S	S	.	.	H	α-helix	trans	-58.2	-43.1	172.9	-69.9	174.8	0	0	0	112.1	E109 F110 A116 R117	E109-L113 WeakPolarHBondContact O-CG 3.43Å; E109-L113 PolarHBondContact O-N 3.03Å; F110-L113 HydrophobicContact CD1-CD1 4.24Å; L113-A116 PolarHBondContact O-N 3.49Å; L113-R117 PolarHBondContact O-N 3.48Å; L113-R117 VanDerWaalsContact O-N 3.16Å
114	L	89.2	Confident	86.9	Confident	32 Å²	32	76.8 Å²	76.8	17%	0.168	41%	0.406	C	S	.	.	H	α-helix	trans	-66.3	-40.4	177.3	-67.8	173.6	0	0	0	112.2	V21 K24 F110 E111 E112 R117 E118	V21-L114 HydrophobicContact CG1-CD2 4.15Å; K24-L114 HydrophobicContact CB-CD2 4.45Å; K24-L114 HydrophobicContact CD-CD1 4.26Å; K24-L114 HydrophobicContact CD-CD2 4.43Å; F110-L114 WeakPolarHBondContact O-CG 3.37Å; F110-L114 PolarHBondContact O-N 3.27Å; E111-L114 PolarHBondContact O-N 3.1Å; E112-L114 VanDerWaalsContact C-N 3.32Å; E112-L114 PolarHBondContact O-N 3.43Å; L114-R117 PolarHBondContact O-N 3.48Å; L114-E118 WeakPolarHBondContact O-CG 3.49Å; L114-E118 PolarHBondContact O-N 3.13Å
115	K	88.1	Confident	86.6	Confident	122 Å²	122	75.6 Å²	75.6	53%	0.53	39%	0.393	S	S	.	.	H	α-helix	trans	-66.5	-40.6	176.4	-72.9	170.8	-173.6	164.6	0	112.2	E111 E112 R117 E118 N119	E111-K115 WeakPolarHBondContact O-CG 3.37Å; E111-K115 PolarHBondContact O-N 2.98Å; E112-K115 PolarHBondContact O-N 3.2Å; K115-R117 VanDerWaalsContact C-N 3.27Å; K115-R117 PolarHBondContact O-N 3.2Å; K115-E118 PolarHBondContact O-N 2.97Å; K115-N119 PolarHBondContact O-N 2.86Å
116	A	86.9	Confident	86.1	Confident	53 Å²	53	76.4 Å²	76.4	44%	0.438	39%	0.394	S	S	.	.	H	α-helix	trans	-64	-34	178.2	0	0	0	0	0	111.8	E112 L113 N119 P120	E112-A116 WeakPolarHBondContact O-CB 3.46Å; E112-A116 PolarHBondContact O-N 2.88Å; L113-A116 PolarHBondContact O-N 3.49Å; A116-N119 CarbonylContact O-C 3.42Å; A116-N119 VanDerWaalsContact O-C 3.31Å; A116-P120 WeakPolarHBondContact O-CA 3.39Å; A116-P120 VanDerWaalsContact O-N 3.16Å
117	R	86.4	Confident	85.9	Confident	47 Å²	47	79 Å²	79	18%	0.177	41%	0.408	C	S	.	.	H	α-helix	trans	-66.5	-43.1	171	177.1	-154.2	67.7	-174.4	-1.3	112.5	E25 T28 L113 L114 K115	E25-R117 WeakPolarHBondContact OE2-CD 3.38Å; E25-R117 IonicContact OE2-NH1 3.06Å; T28-R117 PolarHBondContact OG1-NH1 3.03Å; T28-R117 VanDerWaalsContact OG1-NH1 3.14Å; L113-R117 PolarHBondContact O-N 3.48Å; L113-R117 VanDerWaalsContact O-N 3.16Å; L114-R117 PolarHBondContact O-N 3.48Å; K115-R117 VanDerWaalsContact C-N 3.27Å; K115-R117 PolarHBondContact O-N 3.2Å
118	E	85	Confident	85.8	Confident	121 Å²	121	78.8 Å²	78.8	57%	0.565	41%	0.406	S	S	*	.	H	α-helix	trans	-71.8	-30.2	-177.8	-73.4	171.6	-170.7	0	0	113.2	L114 K115	L114-E118 WeakPolarHBondContact O-CG 3.49Å; L114-E118 PolarHBondContact O-N 3.13Å; K115-E118 PolarHBondContact O-N 2.97Å
119	N	84.1	Confident	85.8	Confident	133 Å²	133	85.2 Å²	85.2	71%	0.711	43%	0.433	S	S	*	.	S	Bend	trans	-131.8	75.4	175.6	-63.8	-64.4	0	0	0	109.4	K115 A116	K115-N119 PolarHBondContact O-N 2.86Å; A116-N119 CarbonylContact O-C 3.42Å; A116-N119 VanDerWaalsContact O-C 3.31Å
120	P	82.7	Confident	85.9	Confident	48 Å²	48	83 Å²	83	31%	0.312	42%	0.422	S	S	.	.			trans	-68.4	137.2	-178.7	29.2	-33.2	0	0	0	110	A116 A124 Q125	A116-P120 WeakPolarHBondContact O-CA 3.39Å; A116-P120 VanDerWaalsContact O-N 3.16Å; P120-A124 HydrophobicContact CB-CB 3.88Å; P120-Q125 HydrophobicContact CB-CG 3.93Å; P120-Q125 HydrophobicContact CG-CG 3.81Å
121	S	82	Confident	85.9	Confident	68 Å²	68	85.4 Å²	85.4	48%	0.476	44%	0.438	S	S	.	.			trans	-64.1	164	163.1	59	0	0	0	0	110.1	E123 A124 Q125	S121-E123 PolarHBondContact O-N 2.83Å; S121-A124 CarbonylContact O-C 3.31Å; S121-A124 WeakPolarHBondContact O-CA 3.47Å; S121-A124 PolarHBondContact O-N 2.89Å; S121-A124 WeakPolarHBondContact OG-CB 3.37Å; S121-A124 PolarHBondContact OG-N 2.96Å; S121-Q125 WeakPolarHBondContact O-CG 3.45Å; S121-Q125 PolarHBondContact O-N 2.79Å
122	E	76.3	Confident	85.8	Confident	164 Å²	164	88.6 Å²	88.6	77%	0.766	46%	0.458	S	S	*	.	H	α-helix	trans	-53.5	-39.7	173.6	-68.2	178.7	176.4	0	0	111.8	A124 Q125 N126	E122-A124 PolarHBondContact O-N 2.79Å; E122-Q125 PolarHBondContact O-N 3.09Å; E122-N126 PolarHBondContact O-N 3.15Å
123	E	75.5	Confident	85.9	Confident	168 Å²	168	87.6 Å²	87.6	79%	0.785	45%	0.453	S	S	*	.	H	α-helix	trans	-63.8	-38.9	174.6	-64.5	175.3	173.3	0	0	112.3	S121 Q125 N126	S121-E123 PolarHBondContact O-N 2.83Å; E123-Q125 VanDerWaalsContact C-N 3.32Å; E123-N126 CarbonylContact O-C 3.58Å; E123-N126 VanDerWaalsContact O-C 3.28Å; E123-N126 PolarHBondContact O-N 3.46Å
124	A	78.3	Confident	86.2	Confident	29 Å²	29	84.5 Å²	84.5	24%	0.24	44%	0.437	C	S	.	.	H	α-helix	trans	-76.1	-19.9	178.8	0	0	0	0	0	113.1	P120 S121 E122	P120-A124 HydrophobicContact CB-CB 3.88Å; S121-A124 CarbonylContact O-C 3.31Å; S121-A124 WeakPolarHBondContact O-CA 3.47Å; S121-A124 PolarHBondContact O-N 2.89Å; S121-A124 WeakPolarHBondContact OG-CB 3.37Å; S121-A124 PolarHBondContact OG-N 2.96Å; E122-A124 PolarHBondContact O-N 2.79Å
125	Q	79.2	Confident	86.3	Confident	76 Å²	76	84.2 Å²	84.2	36%	0.355	44%	0.442	S	S	.	.	H	α-helix	trans	-72.7	-31.8	171.2	-69.5	178.4	-1.6	0	0	111.7	N38 P120 S121 E122 E123	N38-Q125 PolarHBondContact ND2-O 2.68Å; P120-Q125 HydrophobicContact CB-CG 3.93Å; P120-Q125 HydrophobicContact CG-CG 3.81Å; S121-Q125 WeakPolarHBondContact O-CG 3.45Å; S121-Q125 PolarHBondContact O-N 2.79Å; E122-Q125 PolarHBondContact O-N 3.09Å; E123-Q125 VanDerWaalsContact C-N 3.32Å
126	N	81.8	Confident	86.6	Confident	87 Å²	87	79.2 Å²	79.2	47%	0.465	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	58.4	175.8	-65.9	-40	0	0	0	110.7	E122 E123 V128 Y136	E122-N126 PolarHBondContact O-N 3.15Å; E123-N126 CarbonylContact O-C 3.58Å; E123-N126 VanDerWaalsContact O-C 3.28Å; E123-N126 PolarHBondContact O-N 3.46Å; N126-V128 PolarHBondContact O-N 3.28Å; N126-Y136 HydrophobicContact CB-CE2 4.49Å
127	L	86.5	Confident	86.9	Confident	84 Å²	84	76.7 Å²	76.7	44%	0.44	40%	0.399	S	S	.	.			trans	-61	-27.6	-177.7	-169.1	64.8	0	0	0	112.4	N38 H41 R42 Y136	N38-L127 WeakPolarHBondContact OD1-CB 3.47Å; H41-L127 HydrophobicContact CB-CD2 3.57Å; H41-L127 HydrophobicContact CB-CG 4.46Å; R42-L127 HydrophobicContact CG-CD2 4.07Å; L127-Y136 PolarHBondContact N-OH 3.28Å
128	V	90.4	Very high	87.4	Confident	17 Å²	17	77.7 Å²	77.7	10%	0.103	40%	0.403	C	S	.	.	S	Bend	trans	-125.5	140.1	178.2	-177.4	0	0	0	0	110.7	H41 N126 F130 Y136 R199	H41-V128 HydrophobicContact CB-CG2 4.49Å; H41-V128 WeakPolarHBondContact CD2-CG2 3.24Å; H41-V128 WeakPolarHBondContact NE2-CG2 3.37Å; N126-V128 PolarHBondContact O-N 3.28Å; V128-F130 HydrophobicContact CB-CD2 4.37Å; V128-F130 HydrophobicContact CB-CE2 3.92Å; V128-F130 HydrophobicContact CG1-CD2 4.15Å; V128-F130 HydrophobicContact CG1-CE2 3.67Å; V128-F130 HydrophobicContact CG1-CZ 4.22Å; V128-Y136 PolarHBondContact N-OH 2.88Å; V128-Y136 WeakPolarHBondContact O-CE2 3.27Å; V128-Y136 PolarHBondContact O-OH 3.34Å; V128-R199 HydrophobicContact CG1-CB 3.78Å; V128-R199 HydrophobicContact CG1-CG 3.56Å
129	E	91.9	Very high	88	Confident	178 Å²	178	72.3 Å²	72.3	83%	0.832	38%	0.377	S	S	*	.			trans	-78.7	125	177.1	-63.3	-177.9	176.1	0	0	110.2	R199	E129-R199 VanDerWaalsContact O-CD 3.26Å; E129-R199 WeakPolarHBondContact O-CD 3.24Å; E129-R199 PolarHBondContact O-NH1 3.31Å
130	F	94.1	Very high	88.6	Confident	32 Å²	32	66.2 Å²	66.2	14%	0.14	35%	0.345	C	S	.	.			trans	-126.8	149.8	169.7	-73.9	-88.3	0	0	0	108.9	I37 V128 E134 Y136 Y196 R199 V200	I37-F130 HydrophobicContact CD1-CZ 4.23Å; I37-F130 HydrophobicContact CG2-CE2 4.2Å; I37-F130 HydrophobicContact CG2-CZ 4.41Å; V128-F130 HydrophobicContact CB-CD2 4.37Å; V128-F130 HydrophobicContact CB-CE2 3.92Å; V128-F130 HydrophobicContact CG1-CD2 4.15Å; V128-F130 HydrophobicContact CG1-CE2 3.67Å; V128-F130 HydrophobicContact CG1-CZ 4.22Å; F130-E134 WeakPolarHBondContact CA-OE2 3.42Å; F130-E134 HydrophobicContact CB-CB 4.22Å; F130-E134 HydrophobicContact CD1-CB 4.01Å; F130-E134 WeakPolarHBondContact CD1-OE2 3.39Å; F130-Y136 HydrophobicContact CD2-CD1 4.06Å; F130-Y136 AromaticContact CD2-CD2 3.83Å; F130-Y136 HydrophobicContact CD2-CD2 3.83Å; F130-Y136 HydrophobicContact CD2-CE1 4.18Å; F130-Y136 AromaticContact CD2-CE2 3.95Å; F130-Y136 HydrophobicContact CD2-CE2 3.95Å; F130-Y136 AromaticContact CD2-CG 3.88Å; F130-Y136 HydrophobicContact CD2-CG 3.88Å; F130-Y136 HydrophobicContact CE2-CD1 4.01Å; F130-Y136 AromaticContact CE2-CE1 3.97Å; F130-Y136 HydrophobicContact CE2-CE1 3.97Å; F130-Y136 HydrophobicContact CE2-CG 4.3Å; F130-Y196 HydrophobicContact CD1-CE2 4.4Å; F130-Y196 HydrophobicContact CE1-CE2 4.2Å; F130-R199 HydrophobicContact CE1-CB 3.92Å; F130-R199 HydrophobicContact CE2-CB 4.44Å; F130-R199 HydrophobicContact CZ-CB 3.66Å; F130-V200 HydrophobicContact CE1-CG2 3.75Å; F130-V200 HydrophobicContact CZ-CG2 3.87Å
131	T	93.4	Very high	89.3	Confident	59 Å²	59	66 Å²	66	36%	0.362	34%	0.341	S	S	.	.			trans	-70.8	157.4	169	77.8	0	0	0	0	109.7	E133 E134 D141	T131-E133 PolarHBondContact O-N 3.12Å; T131-E134 PolarHBondContact N-OE2 3.05Å; T131-E134 WeakPolarHBondContact O-CB 3.44Å; T131-E134 PolarHBondContact O-N 3.28Å; T131-E134 VanDerWaalsContact OG1-CG 3.3Å; T131-E134 WeakPolarHBondContact OG1-CG 3.34Å; T131-E134 PolarHBondContact OG1-N 2.9Å; T131-D141 PolarHBondContact OG1-OD2 3.1Å
132	D	89.4	Confident	90	Very high	161 Å²	161	62.8 Å²	62.8	86%	0.861	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-59.4	-36.2	177.9	-62.3	-29.6	0	0	0	111.3	E134 G135	D132-E134 VanDerWaalsContact C-N 3.31Å; D132-E134 PolarHBondContact O-N 3.41Å; D132-G135 PolarHBondContact O-N 3.18Å
133	E	92.1	Very high	90.8	Very high	94 Å²	94	59 Å²	59	44%	0.439	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-70.8	-23.8	177.2	-67.5	-65.9	168.2	0	0	113.3	T131 G135 Y139 D141 K348	T131-E133 PolarHBondContact O-N 3.12Å; E133-G135 VanDerWaalsContact C-N 3.28Å; E133-Y139 WeakPolarHBondContact O-CB 3.36Å; E133-D141 HydrophobicContact CB-CB 4.19Å; E133-K348 IonicContact OE1-NZ 3.32Å; E133-K348 IonicContact OE2-NZ 3.34Å; E133-K348 PolarHBondContact OE2-NZ 2.66Å
134	E	95.8	Very high	91.7	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-75	-18.5	175.5	-72.6	171.7	153.1	0	0	112.7	F130 T131 D132 Y136 G137 R138 Y139 D141 Y192 Y196 R199	F130-E134 WeakPolarHBondContact CA-OE2 3.42Å; F130-E134 HydrophobicContact CB-CB 4.22Å; F130-E134 HydrophobicContact CD1-CB 4.01Å; F130-E134 WeakPolarHBondContact CD1-OE2 3.39Å; T131-E134 PolarHBondContact N-OE2 3.05Å; T131-E134 WeakPolarHBondContact O-CB 3.44Å; T131-E134 PolarHBondContact O-N 3.28Å; T131-E134 VanDerWaalsContact OG1-CG 3.3Å; T131-E134 WeakPolarHBondContact OG1-CG 3.34Å; T131-E134 PolarHBondContact OG1-N 2.9Å; D132-E134 VanDerWaalsContact C-N 3.31Å; D132-E134 PolarHBondContact O-N 3.41Å; E134-Y136 VanDerWaalsContact C-N 3.31Å; E134-Y136 PolarHBondContact O-N 3.35Å; E134-G137 PolarHBondContact O-N 2.88Å; E134-R138 PolarHBondContact O-N 2.94Å; E134-Y139 VanDerWaalsContact CA-O 3.31Å; E134-Y139 WeakPolarHBondContact CA-O 3.34Å; E134-Y139 PolarHBondContact O-N 3.44Å; E134-D141 HydrophobicContact CG-CB 3.79Å; E134-Y192 WeakPolarHBondContact OE1-CE2 3.43Å; E134-Y192 PolarHBondContact OE1-OH 3.34Å; E134-Y196 HydrophobicContact CB-CE2 4.19Å; E134-Y196 HydrophobicContact CG-CD2 4.31Å; E134-Y196 HydrophobicContact CG-CE2 3.87Å; E134-Y196 WeakPolarHBondContact OE1-CD2 3.45Å; E134-R199 IonicContact OE1-CZ 3.26Å; E134-R199 IonicContact OE1-NH1 2.7Å; E134-R199 IonicContact OE1-NH2 2.91Å; E134-R199 PolarHBondContact OE1-NH2 2.98Å; E134-R199 IonicContact OE2-CZ 2.67Å; E134-R199 IonicContact OE2-NH1 3.79Å; E134-R199 PolarHBondContact OE2-NH1 3.44Å; E134-R199 IonicContact OE2-NH2 2.66Å; E134-R199 PolarHBondContact OE2-NH2 3.31Å
135	G	92.3	Very high	92.6	Very high	27 Å²	27	55.3 Å²	55.3	28%	0.278	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	43.6	177.3	0	0	0	0	0	113.2	D132 E133 G137 R138	D132-G135 PolarHBondContact O-N 3.18Å; E133-G135 VanDerWaalsContact C-N 3.28Å; G135-G137 PolarHBondContact O-N 2.99Å; G135-R138 WeakPolarHBondContact O-CB 3.42Å; G135-R138 PolarHBondContact O-N 3.23Å
136	Y	93.5	Very high	93.3	Very high	17 Å²	17	53.4 Å²	53.4	7%	0.067	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	47.7	-176.2	-145	-85.4	0	0	0	113.6	R34 I37 N38 N126 L127 V128 F130 E134	R34-Y136 HydrophobicContact CB-CD1 3.74Å; R34-Y136 HydrophobicContact CB-CE1 4.09Å; R34-Y136 HydrophobicContact CB-CG 4.27Å; R34-Y136 HydrophobicContact CG-CD1 3.69Å; R34-Y136 HydrophobicContact CG-CD2 4.5Å; R34-Y136 HydrophobicContact CG-CE1 3.6Å; R34-Y136 HydrophobicContact CG-CE2 4.42Å; R34-Y136 HydrophobicContact CG-CG 4.17Å; I37-Y136 HydrophobicContact CB-CE1 4.22Å; I37-Y136 HydrophobicContact CD1-CD1 4.17Å; I37-Y136 WeakPolarHBondContact CD1-O 3.42Å; I37-Y136 HydrophobicContact CG2-CE1 4.02Å; N38-Y136 PolarHBondContact OD1-OH 3.42Å; N126-Y136 HydrophobicContact CB-CE2 4.49Å; L127-Y136 PolarHBondContact N-OH 3.28Å; V128-Y136 PolarHBondContact N-OH 2.88Å; V128-Y136 WeakPolarHBondContact O-CE2 3.27Å; V128-Y136 PolarHBondContact O-OH 3.34Å; F130-Y136 HydrophobicContact CD2-CD1 4.06Å; F130-Y136 AromaticContact CD2-CD2 3.83Å; F130-Y136 HydrophobicContact CD2-CD2 3.83Å; F130-Y136 HydrophobicContact CD2-CE1 4.18Å; F130-Y136 AromaticContact CD2-CE2 3.95Å; F130-Y136 HydrophobicContact CD2-CE2 3.95Å; F130-Y136 AromaticContact CD2-CG 3.88Å; F130-Y136 HydrophobicContact CD2-CG 3.88Å; F130-Y136 HydrophobicContact CE2-CD1 4.01Å; F130-Y136 AromaticContact CE2-CE1 3.97Å; F130-Y136 HydrophobicContact CE2-CE1 3.97Å; F130-Y136 HydrophobicContact CE2-CG 4.3Å; E134-Y136 VanDerWaalsContact C-N 3.31Å; E134-Y136 PolarHBondContact O-N 3.35Å
137	G	95.2	Very high	93.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	8.8	177.1	0	0	0	0	0	115.2	E134 G135 Y196 Q337	E134-G137 PolarHBondContact O-N 2.88Å; G135-G137 PolarHBondContact O-N 2.99Å; G137-Y196 VanDerWaalsContact CA-OH 3.31Å; G137-Y196 WeakPolarHBondContact CA-OH 3.25Å; G137-Y196 PolarHBondContact O-OH 3.31Å; G137-Q337 WeakPolarHBondContact O-CG 3.49Å
138	R	95.5	Very high	94.1	Very high	68 Å²	68	51.7 Å²	51.7	26%	0.257	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-37.2	177.5	-169.2	174.3	-172	144.5	11.6	112.5	L33 E134 G135 L340 E370	L33-R138 HydrophobicContact CD2-CB 3.91Å; L33-R138 HydrophobicContact CD2-CG 4.48Å; E134-R138 PolarHBondContact O-N 2.94Å; G135-R138 WeakPolarHBondContact O-CB 3.42Å; G135-R138 PolarHBondContact O-N 3.23Å; R138-L340 HydrophobicContact CG-CD1 4.34Å; R138-E370 IonicContact CZ-OE1 2.75Å; R138-E370 IonicContact NH1-OE1 2.95Å; R138-E370 PolarHBondContact NH1-OE1 3Å; R138-E370 IonicContact NH2-OE1 3.96Å; R138-E370 PolarHBondContact NH2-OE1 3.01Å
139	Y	97.3	Very high	94.2	Very high	8 Å²	8	52.4 Å²	52.4	3%	0.031	26%	0.261	C	S	.	.	S	Bend	trans	-128.6	160.6	-175.2	-49.3	-60.8	0	0	0	111.1	E133 E134 Y196 L340 T341 N344	E133-Y139 WeakPolarHBondContact O-CB 3.36Å; E134-Y139 VanDerWaalsContact CA-O 3.31Å; E134-Y139 WeakPolarHBondContact CA-O 3.34Å; E134-Y139 PolarHBondContact O-N 3.44Å; Y139-Y196 VanDerWaalsContact O-CE2 3.22Å; Y139-Y196 WeakPolarHBondContact O-CE2 3.49Å; Y139-Y196 VanDerWaalsContact O-CZ 3.28Å; Y139-Y196 PolarHBondContact O-OH 3.09Å; Y139-L340 HydrophobicContact CD1-CB 3.96Å; Y139-L340 HydrophobicContact CE1-CB 3.97Å; Y139-T341 WeakPolarHBondContact CA-OG1 3.37Å; Y139-N344 HydrophobicContact CD1-CB 3.95Å; Y139-N344 HydrophobicContact CE1-CB 3.57Å
140	L	97.4	Very high	94.2	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.026	24%	0.236	C	C	.	.			trans	-98.2	128.4	172.9	-57.3	173.6	0	0	0	109.2	L142 Y192 Y196 L334 Q337 R338 T341	L140-L142 HydrophobicContact CB-CD1 4.26Å; L140-L142 HydrophobicContact CB-CD2 4.42Å; L140-L142 HydrophobicContact CB-CG 3.9Å; L140-L142 HydrophobicContact CD1-CD1 4.24Å; L140-L142 PolarHBondContact O-N 3.4Å; L140-Y192 HydrophobicContact CB-CE1 4.43Å; L140-Y192 HydrophobicContact CD2-CE1 4.39Å; L140-Y196 HydrophobicContact CD2-CD1 3.59Å; L140-Y196 HydrophobicContact CD2-CD2 4.2Å; L140-Y196 HydrophobicContact CD2-CE1 3.41Å; L140-Y196 VanDerWaalsContact CD2-CE1 3.41Å; L140-Y196 HydrophobicContact CD2-CE2 4.03Å; L140-Y196 HydrophobicContact CD2-CG 3.97Å; L140-L334 HydrophobicContact CD2-CD1 4.14Å; L140-Q337 HydrophobicContact CD2-CB 4.12Å; L140-Q337 HydrophobicContact CG-CB 4.02Å; L140-R338 HydrophobicContact CD1-CB 4.23Å; L140-T341 HydrophobicContact CB-CG2 4.39Å; L140-T341 PolarHBondContact N-OG1 3.48Å; L140-T341 VanDerWaalsContact O-CG2 3.22Å; L140-T341 WeakPolarHBondContact O-CG2 3.39Å
141	D	96.6	Very high	93.8	Very high	42 Å²	42	51.3 Å²	51.3	23%	0.225	26%	0.262	C	S	.	.			trans	-91	83.2	170.3	-172.3	-1.4	0	0	0	110.3	T131 E133 E134 H143 Y192	T131-D141 PolarHBondContact OG1-OD2 3.1Å; E133-D141 HydrophobicContact CB-CB 4.19Å; E134-D141 HydrophobicContact CG-CB 3.79Å; D141-H143 VanDerWaalsContact C-N 3.32Å; D141-H143 PolarHBondContact OD1-N 3.43Å; D141-Y192 PolarHBondContact N-OH 3.24Å
142	L	96.8	Very high	93.5	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	25%	0.25	C	C	.	.			trans	-93.1	16.6	-179.9	-60.6	177.8	0	0	0	113	L140 C145 Y146 Y160 Y163 L164 F167 L189 Y192	L140-L142 HydrophobicContact CB-CD1 4.26Å; L140-L142 HydrophobicContact CB-CD2 4.42Å; L140-L142 HydrophobicContact CB-CG 3.9Å; L140-L142 HydrophobicContact CD1-CD1 4.24Å; L140-L142 PolarHBondContact O-N 3.4Å; L142-C145 HydrophobicContact CB-CB 4.46Å; L142-C145 WeakPolarHBondContact O-CB 3.49Å; L142-C145 PolarHBondContact O-N 3.09Å; L142-Y146 WeakPolarHBondContact O-CB 3.41Å; L142-Y146 PolarHBondContact O-N 3.03Å; L142-Y160 HydrophobicContact CB-CE2 4.39Å; L142-Y160 PolarHBondContact N-OH 3.11Å; L142-Y163 HydrophobicContact CB-CE1 4.11Å; L142-L164 HydrophobicContact CB-CD2 4.15Å; L142-L164 HydrophobicContact CD1-CD2 3.77Å; L142-L164 HydrophobicContact CG-CD2 4.43Å; L142-F167 HydrophobicContact CD1-CD1 4.27Å; L142-F167 HydrophobicContact CD1-CD2 4.29Å; L142-F167 HydrophobicContact CD1-CE1 3.98Å; L142-F167 HydrophobicContact CD1-CE2 3.99Å; L142-F167 HydrophobicContact CD1-CG 4.42Å; L142-F167 HydrophobicContact CD1-CZ 3.83Å; L142-L189 HydrophobicContact CD2-CD1 3.99Å; L142-Y192 HydrophobicContact CD2-CD1 3.53Å; L142-Y192 HydrophobicContact CD2-CE1 3.48Å; L142-Y192 VanDerWaalsContact CD2-CE1 3.48Å; L142-Y192 HydrophobicContact CG-CE1 4.43Å
143	H	94.4	Very high	92.4	Very high	85 Å²	85	49.9 Å²	49.9	39%	0.394	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-44.9	-174.5	-168.6	74.8	0	0	0	112.3	D141 C145 Y146 L147	D141-H143 VanDerWaalsContact C-N 3.32Å; D141-H143 PolarHBondContact OD1-N 3.43Å; H143-C145 VanDerWaalsContact C-N 3.33Å; H143-C145 PolarHBondContact O-N 2.9Å; H143-Y146 WeakPolarHBondContact O-CB 3.21Å; H143-Y146 PolarHBondContact O-N 3.4Å; H143-Y146 VanDerWaalsContact O-N 3.17Å; H143-L147 WeakPolarHBondContact O-CG 3.44Å; H143-L147 PolarHBondContact O-N 2.96Å
144	D	94.8	Very high	90.9	Very high	116 Å²	116	48.6 Å²	48.6	62%	0.62	25%	0.249	S	C	*	.	H	α-helix	trans	-65	-39.3	177.5	-77.9	-14.6	0	0	0	111.8	Y146 L147 K148 M188	D144-Y146 VanDerWaalsContact C-N 3.32Å; D144-Y146 PolarHBondContact O-N 3.14Å; D144-L147 PolarHBondContact O-N 3.06Å; D144-K148 PolarHBondContact O-N 2.97Å; D144-M188 WeakPolarHBondContact O-CE 3.43Å
145	C	95.4	Very high	89.4	Confident	4 Å²	4	50.3 Å²	50.3	3%	0.027	26%	0.261	C	S	.	.	H	α-helix	trans	-59	-44	172.1	-68.4	0	0	0	0	111.8	L142 H143 K148 Y149 Y163 Y185 M188 L189	L142-C145 HydrophobicContact CB-CB 4.46Å; L142-C145 WeakPolarHBondContact O-CB 3.49Å; L142-C145 PolarHBondContact O-N 3.09Å; H143-C145 VanDerWaalsContact C-N 3.33Å; H143-C145 PolarHBondContact O-N 2.9Å; C145-K148 PolarHBondContact O-N 3.28Å; C145-Y149 WeakPolarHBondContact O-CB 3.49Å; C145-Y149 PolarHBondContact O-N 2.92Å; C145-Y163 WeakPolarHBondContact CB-OH 3.45Å; C145-Y185 HydrophobicContact CB-CE2 4.35Å; C145-Y185 WeakPolarHBondContact O-CE2 3.44Å; C145-M188 HydrophobicContact CB-CE 4.17Å; C145-L189 HydrophobicContact CB-CD1 4.31Å
146	Y	94.9	Very high	88.2	Confident	36 Å²	36	57 Å²	57	14%	0.141	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-47.4	174.4	163.9	-107.2	0	0	0	112.2	L142 H143 D144 K148 Y149 I150 L158 Y160 Y163	L142-Y146 WeakPolarHBondContact O-CB 3.41Å; L142-Y146 PolarHBondContact O-N 3.03Å; H143-Y146 WeakPolarHBondContact O-CB 3.21Å; H143-Y146 PolarHBondContact O-N 3.4Å; H143-Y146 VanDerWaalsContact O-N 3.17Å; D144-Y146 VanDerWaalsContact C-N 3.32Å; D144-Y146 PolarHBondContact O-N 3.14Å; Y146-K148 PolarHBondContact O-N 3.24Å; Y146-Y149 WeakPolarHBondContact O-CB 3.38Å; Y146-Y149 PolarHBondContact O-N 2.79Å; Y146-I150 HydrophobicContact CD2-CG2 3.86Å; Y146-I150 HydrophobicContact CE1-CD1 4.42Å; Y146-I150 HydrophobicContact CE1-CG2 4.47Å; Y146-I150 HydrophobicContact CE2-CG2 3.4Å; Y146-I150 VanDerWaalsContact CE2-CG2 3.4Å; Y146-I150 PolarHBondContact O-N 3.29Å; Y146-L158 WeakPolarHBondContact CE2-O 3.49Å; Y146-L158 PolarHBondContact OH-O 3.32Å; Y146-Y160 AromaticContact CD1-CD2 3.93Å; Y146-Y160 HydrophobicContact CD1-CD2 3.93Å; Y146-Y160 HydrophobicContact CD2-CD2 4.05Å; Y146-Y160 AromaticContact CG-CD2 3.61Å; Y146-Y160 HydrophobicContact CG-CD2 3.61Å; Y146-Y160 HydrophobicContact CG-CE2 4.32Å; Y146-Y163 HydrophobicContact CD2-CD1 4.08Å; Y146-Y163 HydrophobicContact CD2-CD2 4.22Å; Y146-Y163 AromaticContact CD2-CG 3.7Å; Y146-Y163 HydrophobicContact CD2-CG 3.7Å; Y146-Y163 HydrophobicContact CG-CD1 4.32Å; Y146-Y163 HydrophobicContact CG-CG 4.38Å
147	L	93.3	Very high	87.5	Confident	68 Å²	68	66.8 Å²	66.8	36%	0.356	33%	0.328	S	S	.	.	H	α-helix	trans	-59.5	-36.5	177.2	-69.1	-179.7	0	0	0	111.8	H143 D144 I150 N151	H143-L147 WeakPolarHBondContact O-CG 3.44Å; H143-L147 PolarHBondContact O-N 2.96Å; D144-L147 PolarHBondContact O-N 3.06Å; L147-I150 HydrophobicContact CD2-CD1 4.05Å; L147-I150 WeakPolarHBondContact O-CG1 3.21Å; L147-N151 PolarHBondContact O-ND2 3.11Å
148	K	92.3	Very high	87.1	Confident	67 Å²	67	68.4 Å²	68.4	29%	0.291	34%	0.336	S	S	.	.	H	α-helix	trans	-70.4	-40.3	174.1	-170.8	69.2	176.1	-177.2	0	112	D144 C145 Y146 N151 Y185 M188	D144-K148 PolarHBondContact O-N 2.97Å; C145-K148 PolarHBondContact O-N 3.28Å; Y146-K148 PolarHBondContact O-N 3.24Å; K148-N151 PolarHBondContact O-N 2.95Å; K148-Y185 HydrophobicContact CB-CD2 4.16Å; K148-Y185 HydrophobicContact CG-CD2 4.11Å; K148-M188 HydrophobicContact CB-CE 3.44Å; K148-M188 VanDerWaalsContact CB-CE 3.44Å; K148-M188 HydrophobicContact CB-SD 4.24Å; K148-M188 HydrophobicContact CG-CE 3.94Å; K148-M188 HydrophobicContact CG-SD 4.27Å
149	Y	92.1	Very high	86.9	Confident	32 Å²	32	68.9 Å²	68.9	13%	0.125	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-46.7	-180	-175.4	-95.1	0	0	0	112.5	C145 Y146 N151 L152 L158 Y163 I173 Y185	C145-Y149 WeakPolarHBondContact O-CB 3.49Å; C145-Y149 PolarHBondContact O-N 2.92Å; Y146-Y149 WeakPolarHBondContact O-CB 3.38Å; Y146-Y149 PolarHBondContact O-N 2.79Å; Y149-N151 PolarHBondContact O-N 3.15Å; Y149-N151 VanDerWaalsContact O-N 3.16Å; Y149-L152 HydrophobicContact CD2-CD1 3.83Å; Y149-L152 HydrophobicContact CE2-CD1 4.26Å; Y149-L152 HydrophobicContact CG-CD1 4.44Å; Y149-L152 VanDerWaalsContact O-CB 3.25Å; Y149-L152 WeakPolarHBondContact O-CB 3.17Å; Y149-L152 VanDerWaalsContact O-CG 3.32Å; Y149-L152 WeakPolarHBondContact O-CG 3.38Å; Y149-L152 PolarHBondContact O-N 2.91Å; Y149-L158 HydrophobicContact CD1-CD2 4.21Å; Y149-L158 HydrophobicContact CE1-CD2 3.77Å; Y149-Y163 AromaticContact CD1-CD2 3.74Å; Y149-Y163 HydrophobicContact CD1-CD2 3.74Å; Y149-Y163 HydrophobicContact CD1-CE2 4.01Å; Y149-Y163 HydrophobicContact CD2-CD2 4.47Å; Y149-Y163 AromaticContact CD2-CE2 3.98Å; Y149-Y163 HydrophobicContact CD2-CE2 3.98Å; Y149-Y163 HydrophobicContact CE1-CD2 4.29Å; Y149-Y163 AromaticContact CG-CD2 3.84Å; Y149-Y163 HydrophobicContact CG-CD2 3.84Å; Y149-Y163 AromaticContact CG-CE2 3.59Å; Y149-Y163 HydrophobicContact CG-CE2 3.59Å; Y149-I173 HydrophobicContact CE2-CD1 4.35Å; Y149-Y185 HydrophobicContact CD2-CD1 4.34Å; Y149-Y185 AromaticContact CD2-CE1 3.77Å; Y149-Y185 HydrophobicContact CD2-CE1 3.77Å; Y149-Y185 HydrophobicContact CD2-CE2 4.09Å; Y149-Y185 AromaticContact CD2-CZ 3.62Å; Y149-Y185 HydrophobicContact CE2-CE1 4.4Å; Y149-Y185 HydrophobicContact CG-CE2 4.43Å
150	I	90.8	Very high	86.7	Confident	60 Å²	60	70.4 Å²	70.4	31%	0.308	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-20.7	179.4	63	174.7	0	0	0	113.3	Y146 L147 L152 S155	Y146-I150 HydrophobicContact CD2-CG2 3.86Å; Y146-I150 HydrophobicContact CE1-CD1 4.42Å; Y146-I150 HydrophobicContact CE1-CG2 4.47Å; Y146-I150 HydrophobicContact CE2-CG2 3.4Å; Y146-I150 VanDerWaalsContact CE2-CG2 3.4Å; Y146-I150 PolarHBondContact O-N 3.29Å; L147-I150 HydrophobicContact CD2-CD1 4.05Å; L147-I150 WeakPolarHBondContact O-CG1 3.21Å; I150-L152 VanDerWaalsContact C-N 3.34Å; I150-S155 PolarHBondContact O-OG 2.94Å
151	N	86.9	Confident	86.5	Confident	126 Å²	126	71.4 Å²	71.4	67%	0.674	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.1	176.8	-77.4	-48.8	0	0	0	113	L147 K148 Y149 K153	L147-N151 PolarHBondContact O-ND2 3.11Å; K148-N151 PolarHBondContact O-N 2.95Å; Y149-N151 PolarHBondContact O-N 3.15Å; Y149-N151 VanDerWaalsContact O-N 3.16Å; N151-K153 PolarHBondContact O-N 2.86Å
152	L	86.6	Confident	86.3	Confident	21 Å²	21	72.1 Å²	72.1	11%	0.11	36%	0.361	C	S	.	.	S	Bend	trans	-66.7	133.2	173	-62.9	176.1	0	0	0	109.7	Y149 I150 A154 S155 E181 Y182 Y185	Y149-L152 HydrophobicContact CD2-CD1 3.83Å; Y149-L152 HydrophobicContact CE2-CD1 4.26Å; Y149-L152 HydrophobicContact CG-CD1 4.44Å; Y149-L152 VanDerWaalsContact O-CB 3.25Å; Y149-L152 WeakPolarHBondContact O-CB 3.17Å; Y149-L152 VanDerWaalsContact O-CG 3.32Å; Y149-L152 WeakPolarHBondContact O-CG 3.38Å; Y149-L152 PolarHBondContact O-N 2.91Å; I150-L152 VanDerWaalsContact C-N 3.34Å; L152-A154 PolarHBondContact O-N 3.43Å; L152-S155 PolarHBondContact O-N 3.49Å; L152-S155 PolarHBondContact O-OG 3.18Å; L152-S155 VanDerWaalsContact O-OG 3.13Å; L152-E181 HydrophobicContact CD2-CB 3.91Å; L152-Y182 HydrophobicContact CD1-CD2 4.04Å; L152-Y185 HydrophobicContact CD1-CD1 4.12Å; L152-Y185 HydrophobicContact CD1-CG 4.17Å
153	K	65.7	Low	86.3	Confident	170 Å²	170	72.1 Å²	72.1	74%	0.739	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	127.3	-178.7	-68.2	-175.6	179.5	179.7	0	110.2	N151	N151-K153 PolarHBondContact O-N 2.86Å
154	A	61.7	Low	86.3	Confident	67 Å²	67	68.5 Å²	68.5	55%	0.554	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	18.5	176.1	0	0	0	0	0	117.4	L152 R177	L152-A154 PolarHBondContact O-N 3.43Å; A154-R177 PolarHBondContact O-NH1 3.27Å; A154-R177 PolarHBondContact O-NH2 3.45Å; A154-R177 VanDerWaalsContact O-NH2 3.15Å
155	S	63.4	Low	86.2	Confident	36 Å²	36	65.4 Å²	65.4	25%	0.252	33%	0.332	S	S	.	.			trans	-74.1	137.8	162.3	52	0	0	0	0	110.8	I150 L152	I150-S155 PolarHBondContact O-OG 2.94Å; L152-S155 PolarHBondContact O-N 3.49Å; L152-S155 PolarHBondContact O-OG 3.18Å; L152-S155 VanDerWaalsContact O-OG 3.13Å
156	E	68	Low	86.1	Confident	168 Å²	168	67.5 Å²	67.5	79%	0.785	34%	0.343	S	S	*	.			trans	-64.2	161.3	167.4	-66.6	-179.4	171.6	0	0	109.6	L158	E156-L158 PolarHBondContact O-N 2.91Å
157	K	78.6	Confident	86.1	Confident	222 Å²	222	65.9 Å²	65.9	97%	0.965	34%	0.336	S	S	*	.			trans	-63.4	103.7	171.8	-71.8	-173.2	178	-175.1	0	108
158	L	86.7	Confident	86.1	Confident	34 Å²	34	63.8 Å²	63.8	18%	0.178	33%	0.326	C	S	.	.			trans	-104.5	135.3	178.7	-163.2	76.5	0	0	0	108	Y146 Y149 E156 T162 Y163 I166	Y146-L158 WeakPolarHBondContact CE2-O 3.49Å; Y146-L158 PolarHBondContact OH-O 3.32Å; Y149-L158 HydrophobicContact CD1-CD2 4.21Å; Y149-L158 HydrophobicContact CE1-CD2 3.77Å; E156-L158 PolarHBondContact O-N 2.91Å; L158-T162 HydrophobicContact CD1-CG2 3.41Å; L158-T162 VanDerWaalsContact CD1-CG2 3.41Å; L158-T162 HydrophobicContact CG-CG2 4.24Å; L158-Y163 HydrophobicContact CD2-CD2 4.31Å; L158-I166 HydrophobicContact CD1-CD1 3.97Å; L158-I166 HydrophobicContact CD2-CD1 3.7Å; L158-I166 HydrophobicContact CD2-CG1 4.22Å
159	D	91.3	Very high	86.1	Confident	79 Å²	79	64.1 Å²	64.1	42%	0.422	33%	0.328	S	S	.	.			trans	-83.6	167.7	169.3	64.6	9.3	0	0	0	111	I161 T162 Y163	D159-I161 PolarHBondContact O-N 3.35Å; D159-I161 WeakPolarHBondContact OD1-CG2 3.26Å; D159-T162 PolarHBondContact O-N 2.99Å; D159-T162 WeakPolarHBondContact OD1-CB 3.37Å; D159-T162 PolarHBondContact OD1-N 3.16Å; D159-T162 PolarHBondContact OD1-OG1 3.44Å; D159-Y163 PolarHBondContact O-N 3.01Å
160	Y	93.8	Very high	86.1	Confident	40 Å²	40	62.6 Å²	62.6	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-64.9	-37.9	-174.8	-177.2	-127.1	0	0	0	112.8	L142 Y146 Y163 L164 V345	L142-Y160 HydrophobicContact CB-CE2 4.39Å; L142-Y160 PolarHBondContact N-OH 3.11Å; Y146-Y160 AromaticContact CD1-CD2 3.93Å; Y146-Y160 HydrophobicContact CD1-CD2 3.93Å; Y146-Y160 HydrophobicContact CD2-CD2 4.05Å; Y146-Y160 AromaticContact CG-CD2 3.61Å; Y146-Y160 HydrophobicContact CG-CD2 3.61Å; Y146-Y160 HydrophobicContact CG-CE2 4.32Å; Y160-Y163 HydrophobicContact CD2-CD1 4.11Å; Y160-Y163 HydrophobicContact CE2-CD1 4.09Å; Y160-Y163 WeakPolarHBondContact O-CB 3.29Å; Y160-Y163 PolarHBondContact O-N 3.12Å; Y160-L164 HydrophobicContact CD1-CD1 4.18Å; Y160-L164 HydrophobicContact CD2-CG 4.46Å; Y160-L164 HydrophobicContact CE1-CD1 3.79Å; Y160-L164 HydrophobicContact CE1-CG 4.27Å; Y160-L164 HydrophobicContact CE2-CD2 4.02Å; Y160-L164 HydrophobicContact CE2-CG 4.12Å; Y160-L164 WeakPolarHBondContact O-CG 3.44Å; Y160-L164 PolarHBondContact O-N 3.29Å; Y160-V345 HydrophobicContact CD1-CG1 3.98Å; Y160-V345 HydrophobicContact CD1-CG2 4.27Å; Y160-V345 HydrophobicContact CE1-CG1 4.37Å; Y160-V345 HydrophobicContact CE1-CG2 3.82Å
161	I	93.2	Very high	86.1	Confident	25 Å²	25	64 Å²	64	13%	0.128	33%	0.326	C	S	.	.	H	α-helix	trans	-67.3	-39.4	179.5	-169.7	168.7	0	0	0	111.9	D159 Y163 L164 S165 V345 Q346	D159-I161 PolarHBondContact O-N 3.35Å; D159-I161 WeakPolarHBondContact OD1-CG2 3.26Å; I161-Y163 VanDerWaalsContact C-N 3.32Å; I161-L164 PolarHBondContact O-N 3.3Å; I161-S165 PolarHBondContact O-N 2.9Å; I161-S165 PolarHBondContact O-OG 3.28Å; I161-V345 HydrophobicContact CB-CG1 4.38Å; I161-Q346 HydrophobicContact CD1-CB 3.79Å; I161-Q346 HydrophobicContact CD1-CG 4.02Å
162	T	92.7	Very high	86.2	Confident	58 Å²	58	63.1 Å²	63.1	36%	0.356	32%	0.321	S	S	.	.	H	α-helix	trans	-67.8	-36.8	174	-50.1	0	0	0	0	110.5	L158 D159 S165 I166	L158-T162 HydrophobicContact CD1-CG2 3.41Å; L158-T162 VanDerWaalsContact CD1-CG2 3.41Å; L158-T162 HydrophobicContact CG-CG2 4.24Å; D159-T162 PolarHBondContact O-N 2.99Å; D159-T162 WeakPolarHBondContact OD1-CB 3.37Å; D159-T162 PolarHBondContact OD1-N 3.16Å; D159-T162 PolarHBondContact OD1-OG1 3.44Å; T162-S165 WeakPolarHBondContact O-CB 3.35Å; T162-S165 PolarHBondContact O-N 2.7Å; T162-S165 VanDerWaalsContact O-N 3.12Å; T162-I166 WeakPolarHBondContact O-CG1 3.39Å; T162-I166 PolarHBondContact O-N 3.45Å
163	Y	94.8	Very high	86.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-57.4	-48.4	172.1	173.1	-99.9	0	0	0	112.5	L142 C145 Y146 Y149 L158 D159 Y160 I161 S165 I166 F167 Y185	L142-Y163 HydrophobicContact CB-CE1 4.11Å; C145-Y163 WeakPolarHBondContact CB-OH 3.45Å; Y146-Y163 HydrophobicContact CD2-CD1 4.08Å; Y146-Y163 HydrophobicContact CD2-CD2 4.22Å; Y146-Y163 AromaticContact CD2-CG 3.7Å; Y146-Y163 HydrophobicContact CD2-CG 3.7Å; Y146-Y163 HydrophobicContact CG-CD1 4.32Å; Y146-Y163 HydrophobicContact CG-CG 4.38Å; Y149-Y163 AromaticContact CD1-CD2 3.74Å; Y149-Y163 HydrophobicContact CD1-CD2 3.74Å; Y149-Y163 HydrophobicContact CD1-CE2 4.01Å; Y149-Y163 HydrophobicContact CD2-CD2 4.47Å; Y149-Y163 AromaticContact CD2-CE2 3.98Å; Y149-Y163 HydrophobicContact CD2-CE2 3.98Å; Y149-Y163 HydrophobicContact CE1-CD2 4.29Å; Y149-Y163 AromaticContact CG-CD2 3.84Å; Y149-Y163 HydrophobicContact CG-CD2 3.84Å; Y149-Y163 AromaticContact CG-CE2 3.59Å; Y149-Y163 HydrophobicContact CG-CE2 3.59Å; L158-Y163 HydrophobicContact CD2-CD2 4.31Å; D159-Y163 PolarHBondContact O-N 3.01Å; Y160-Y163 HydrophobicContact CD2-CD1 4.11Å; Y160-Y163 HydrophobicContact CE2-CD1 4.09Å; Y160-Y163 WeakPolarHBondContact O-CB 3.29Å; Y160-Y163 PolarHBondContact O-N 3.12Å; I161-Y163 VanDerWaalsContact C-N 3.32Å; Y163-S165 PolarHBondContact O-N 2.91Å; Y163-S165 VanDerWaalsContact O-N 3.1Å; Y163-I166 PolarHBondContact O-N 3.02Å; Y163-F167 HydrophobicContact CD1-CB 4.42Å; Y163-F167 HydrophobicContact CD2-CB 4.13Å; Y163-F167 HydrophobicContact CE1-CB 3.95Å; Y163-F167 HydrophobicContact CE1-CG 4.49Å; Y163-F167 HydrophobicContact CE2-CB 3.62Å; Y163-F167 HydrophobicContact CG-CB 4.5Å; Y163-F167 WeakPolarHBondContact O-CB 3.41Å; Y163-F167 PolarHBondContact O-N 2.97Å; Y163-Y185 HydrophobicContact CE2-CE2 4.45Å; Y163-Y185 WeakPolarHBondContact CE2-OH 3.48Å; Y163-Y185 PolarHBondContact OH-OH 3.38Å
164	L	95.2	Very high	87.2	Confident	9 Å²	9	57.8 Å²	57.8	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-58.8	-24.2	176.7	-69.6	178.1	0	0	0	113.3	L142 Y160 I161 F167 T341 V345	L142-L164 HydrophobicContact CB-CD2 4.15Å; L142-L164 HydrophobicContact CD1-CD2 3.77Å; L142-L164 HydrophobicContact CG-CD2 4.43Å; Y160-L164 HydrophobicContact CD1-CD1 4.18Å; Y160-L164 HydrophobicContact CD2-CG 4.46Å; Y160-L164 HydrophobicContact CE1-CD1 3.79Å; Y160-L164 HydrophobicContact CE1-CG 4.27Å; Y160-L164 HydrophobicContact CE2-CD2 4.02Å; Y160-L164 HydrophobicContact CE2-CG 4.12Å; Y160-L164 WeakPolarHBondContact O-CG 3.44Å; Y160-L164 PolarHBondContact O-N 3.29Å; I161-L164 PolarHBondContact O-N 3.3Å; L164-F167 WeakPolarHBondContact O-CD1 3.41Å; L164-F167 WeakPolarHBondContact O-CE1 3.42Å; L164-T341 HydrophobicContact CD1-CG2 4.08Å; L164-T341 HydrophobicContact CD2-CG2 4.28Å; L164-V345 HydrophobicContact CD1-CB 4.07Å; L164-V345 HydrophobicContact CD1-CG1 4.3Å; L164-V345 HydrophobicContact CD1-CG2 3.79Å
165	S	93.6	Very high	88.4	Confident	51 Å²	51	58.6 Å²	58.6	36%	0.357	30%	0.295	S	S	.	.	H	α-helix	trans	-82.7	-19.7	176.5	-62.3	0	0	0	0	114.4	I161 T162 Y163 Q169 H342	I161-S165 PolarHBondContact O-N 2.9Å; I161-S165 PolarHBondContact O-OG 3.28Å; T162-S165 WeakPolarHBondContact O-CB 3.35Å; T162-S165 PolarHBondContact O-N 2.7Å; T162-S165 VanDerWaalsContact O-N 3.12Å; Y163-S165 PolarHBondContact O-N 2.91Å; Y163-S165 VanDerWaalsContact O-N 3.1Å; S165-Q169 PolarHBondContact O-NE2 3.5Å; S165-Q169 VanDerWaalsContact O-NE2 3.1Å; S165-H342 PolarHBondContact OG-CD2 2.72Å; S165-H342 PolarHBondContact OG-NE2 3.21Å; S165-H342 VanDerWaalsContact OG-NE2 3.15Å
166	I	93.2	Very high	89.3	Confident	49 Å²	49	64.5 Å²	64.5	25%	0.251	32%	0.319	S	S	.	.	H	α-helix	trans	-129.7	-5.4	-169.2	74.5	175.4	0	0	0	114.9	L158 T162 Y163 D168 Q169	L158-I166 HydrophobicContact CD1-CD1 3.97Å; L158-I166 HydrophobicContact CD2-CD1 3.7Å; L158-I166 HydrophobicContact CD2-CG1 4.22Å; T162-I166 WeakPolarHBondContact O-CG1 3.39Å; T162-I166 PolarHBondContact O-N 3.45Å; Y163-I166 PolarHBondContact O-N 3.02Å; I166-D168 PolarHBondContact O-N 2.86Å; I166-D168 VanDerWaalsContact O-N 3.14Å; I166-Q169 WeakPolarHBondContact O-CB 3.41Å; I166-Q169 PolarHBondContact O-N 3.49Å
167	F	94.1	Very high	90.2	Very high	1 Å²	1	61.9 Å²	61.9	0%	0.004	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.7	-174.9	77.9	-83.1	0	0	0	113	L142 Y163 L164 L170 L189 V331 R338	L142-F167 HydrophobicContact CD1-CD1 4.27Å; L142-F167 HydrophobicContact CD1-CD2 4.29Å; L142-F167 HydrophobicContact CD1-CE1 3.98Å; L142-F167 HydrophobicContact CD1-CE2 3.99Å; L142-F167 HydrophobicContact CD1-CG 4.42Å; L142-F167 HydrophobicContact CD1-CZ 3.83Å; Y163-F167 HydrophobicContact CD1-CB 4.42Å; Y163-F167 HydrophobicContact CD2-CB 4.13Å; Y163-F167 HydrophobicContact CE1-CB 3.95Å; Y163-F167 HydrophobicContact CE1-CG 4.49Å; Y163-F167 HydrophobicContact CE2-CB 3.62Å; Y163-F167 HydrophobicContact CG-CB 4.5Å; Y163-F167 WeakPolarHBondContact O-CB 3.41Å; Y163-F167 PolarHBondContact O-N 2.97Å; L164-F167 WeakPolarHBondContact O-CD1 3.41Å; L164-F167 WeakPolarHBondContact O-CE1 3.42Å; F167-L170 VanDerWaalsContact O-CD2 3.24Å; F167-L170 WeakPolarHBondContact O-CD2 3.44Å; F167-L189 HydrophobicContact CD2-CD1 4.3Å; F167-L189 HydrophobicContact CD2-CD2 4.08Å; F167-V331 HydrophobicContact CE2-CG2 3.68Å; F167-V331 HydrophobicContact CZ-CG1 4.49Å; F167-V331 HydrophobicContact CZ-CG2 4.07Å; F167-R338 HydrophobicContact CE1-CG 3.87Å; F167-R338 HydrophobicContact CZ-CG 4.01Å
168	D	92.6	Very high	90.7	Very high	25 Å²	25	51.6 Å²	51.6	13%	0.134	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-4.9	175.7	64.4	-13.1	0	0	0	113.4	I166 L170 Y328 V331 R338	I166-D168 PolarHBondContact O-N 2.86Å; I166-D168 VanDerWaalsContact O-N 3.14Å; D168-L170 PolarHBondContact O-N 3.42Å; D168-Y328 WeakPolarHBondContact O-CE1 3.22Å; D168-V331 HydrophobicContact CB-CB 4.36Å; D168-V331 HydrophobicContact CB-CG1 3.76Å; D168-V331 HydrophobicContact CB-CG2 4.09Å; D168-R338 IonicContact OD2-CZ 2.9Å; D168-R338 IonicContact OD2-NE 2.73Å; D168-R338 IonicContact OD2-NH1 2.7Å; D168-R338 PolarHBondContact OD2-NH1 3Å
169	Q	92.5	Very high	90.8	Very high	73 Å²	73	52.5 Å²	52.5	34%	0.341	26%	0.262	S	S	.	.			trans	-86	46	176.8	-59	179.7	13.1	0	0	111.6	S165 I166 F171 D172	S165-Q169 PolarHBondContact O-NE2 3.5Å; S165-Q169 VanDerWaalsContact O-NE2 3.1Å; I166-Q169 WeakPolarHBondContact O-CB 3.41Å; I166-Q169 PolarHBondContact O-N 3.49Å; Q169-F171 HydrophobicContact CB-CE1 4.16Å; Q169-F171 HydrophobicContact CB-CE2 4.46Å; Q169-F171 HydrophobicContact CB-CZ 3.95Å; Q169-F171 HydrophobicContact CG-CE1 4.33Å; Q169-F171 HydrophobicContact CG-CZ 4.02Å; Q169-F171 PolarHBondContact O-N 3.16Å; Q169-D172 PolarHBondContact O-N 3.49Å; Q169-D172 VanDerWaalsContact O-N 3.08Å
170	L	92.9	Very high	90.9	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-63.3	-16.3	-175.7	-55	173	0	0	0	113.3	F167 D168 D172 I173 K178 Y182 L186 E324 I327 Y328	F167-L170 VanDerWaalsContact O-CD2 3.24Å; F167-L170 WeakPolarHBondContact O-CD2 3.44Å; D168-L170 PolarHBondContact O-N 3.42Å; L170-D172 VanDerWaalsContact C-N 3.3Å; L170-I173 HydrophobicContact CD2-CD1 4.03Å; L170-I173 PolarHBondContact O-N 3.48Å; L170-K178 PolarHBondContact O-NZ 3.25Å; L170-Y182 HydrophobicContact CD2-CE2 4.49Å; L170-L186 HydrophobicContact CD1-CD2 3.81Å; L170-L186 HydrophobicContact CD2-CD2 3.91Å; L170-L186 HydrophobicContact CG-CD2 4.49Å; L170-E324 HydrophobicContact CB-CG 4.13Å; L170-E324 HydrophobicContact CD1-CB 4.13Å; L170-E324 HydrophobicContact CD1-CG 3.92Å; L170-I327 HydrophobicContact CD1-CB 4.14Å; L170-I327 HydrophobicContact CD1-CD1 3.97Å; L170-I327 HydrophobicContact CD1-CG2 3.92Å; L170-Y328 HydrophobicContact CB-CE1 3.91Å; L170-Y328 WeakPolarHBondContact CB-OH 3.12Å; L170-Y328 HydrophobicContact CD1-CE1 4.07Å; L170-Y328 HydrophobicContact CG-CE1 4.13Å
171	F	91.2	Very high	90.8	Very high	90 Å²	90	53.5 Å²	53.5	40%	0.395	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-72.5	-21.8	177.6	54.2	-99.1	0	0	0	113.1	Q169 P227 Y328	Q169-F171 HydrophobicContact CB-CE1 4.16Å; Q169-F171 HydrophobicContact CB-CE2 4.46Å; Q169-F171 HydrophobicContact CB-CZ 3.95Å; Q169-F171 HydrophobicContact CG-CE1 4.33Å; Q169-F171 HydrophobicContact CG-CZ 4.02Å; Q169-F171 PolarHBondContact O-N 3.16Å; F171-P227 HydrophobicContact CB-CB 3.76Å; F171-P227 HydrophobicContact CG-CB 4.46Å; F171-Y328 PolarHBondContact N-OH 2.96Å; F171-Y328 VanDerWaalsContact N-OH 3.13Å
172	D	88.9	Confident	90.8	Very high	106 Å²	106	52.4 Å²	52.4	57%	0.567	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-84.4	-11.4	178.1	-74.2	-25.3	0	0	0	112.9	Q169 L170 P174	Q169-D172 PolarHBondContact O-N 3.49Å; Q169-D172 VanDerWaalsContact O-N 3.08Å; L170-D172 VanDerWaalsContact C-N 3.3Å; D172-P174 VanDerWaalsContact O-CD 3.31Å; D172-P174 WeakPolarHBondContact O-CD 3.39Å
173	I	87.6	Confident	90.9	Very high	22 Å²	22	52.4 Å²	52.4	11%	0.113	27%	0.265	C	S	.	.	S	Bend	trans	-75.6	119.3	179.4	-59.9	177.7	0	0	0	109.6	Y149 L170 R177 K178 Y182	Y149-I173 HydrophobicContact CE2-CD1 4.35Å; L170-I173 HydrophobicContact CD2-CD1 4.03Å; L170-I173 PolarHBondContact O-N 3.48Å; I173-R177 HydrophobicContact CG2-CB 3.98Å; I173-K178 HydrophobicContact CG2-CG 4.23Å; I173-K178 WeakPolarHBondContact O-CE 3.47Å; I173-Y182 HydrophobicContact CD1-CD2 4.48Å; I173-Y182 HydrophobicContact CD1-CE2 3.51Å; I173-Y182 HydrophobicContact CG2-CE2 4.36Å
174	P	85.9	Confident	91	Very high	58 Å²	58	58 Å²	58	38%	0.377	29%	0.286	S	S	.	.			trans	-59.4	143.5	-179.4	-24.4	33.9	0	0	0	113	D172 E176 R177	D172-P174 VanDerWaalsContact O-CD 3.31Å; D172-P174 WeakPolarHBondContact O-CD 3.39Å; P174-E176 WeakPolarHBondContact CB-OE2 3.48Å; P174-E176 PolarHBondContact O-N 3.36Å; P174-R177 WeakPolarHBondContact O-CB 3.39Å; P174-R177 PolarHBondContact O-N 2.89Å
175	K	85.4	Confident	91	Very high	83 Å²	83	57.6 Å²	57.6	36%	0.361	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-53.7	-32.5	-178.9	-176	177.9	175.3	179.9	0	112.7	R177 K178 W229 E232	K175-R177 PolarHBondContact O-N 3.34Å; K175-K178 PolarHBondContact O-N 3.5Å; K175-W229 HydrophobicContact CD-CZ3 4.36Å; K175-W229 HydrophobicContact CG-CZ3 4.12Å; K175-E232 IonicContact NZ-OE1 3.61Å; K175-E232 PolarHBondContact NZ-OE1 3.37Å
176	E	83.5	Confident	91.1	Very high	160 Å²	160	55.1 Å²	55.1	75%	0.748	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-66.8	-24.9	178.7	-58.6	71.8	-154.5	0	0	112.9	P174	P174-E176 WeakPolarHBondContact CB-OE2 3.48Å; P174-E176 PolarHBondContact O-N 3.36Å
177	R	86.1	Confident	91.3	Very high	113 Å²	113	56.7 Å²	56.7	43%	0.426	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-87.1	-17	177.4	-62	-169.1	-176.9	-175.7	-4.7	112.9	A154 I173 P174 K175 N179	A154-R177 PolarHBondContact O-NH1 3.27Å; A154-R177 PolarHBondContact O-NH2 3.45Å; A154-R177 VanDerWaalsContact O-NH2 3.15Å; I173-R177 HydrophobicContact CG2-CB 3.98Å; P174-R177 WeakPolarHBondContact O-CB 3.39Å; P174-R177 PolarHBondContact O-N 2.89Å; K175-R177 PolarHBondContact O-N 3.34Å; R177-N179 PolarHBondContact O-N 3.3Å; R177-N179 PolarHBondContact O-ND2 3.12Å
178	K	89.6	Confident	91.5	Very high	7 Å²	7	59.5 Å²	59.5	3%	0.03	29%	0.287	C	S	.	.			trans	-75.6	60.6	179.7	-57.9	-167.4	176.8	-169.6	0	112.5	L170 I173 K175 Y182 W229 I320 E324	L170-K178 PolarHBondContact O-NZ 3.25Å; I173-K178 HydrophobicContact CG2-CG 4.23Å; I173-K178 WeakPolarHBondContact O-CE 3.47Å; K175-K178 PolarHBondContact O-N 3.5Å; K178-Y182 HydrophobicContact CB-CD1 3.73Å; K178-Y182 HydrophobicContact CB-CE1 3.97Å; K178-Y182 HydrophobicContact CD-CE1 3.91Å; K178-Y182 HydrophobicContact CG-CD1 3.84Å; K178-Y182 HydrophobicContact CG-CE1 3.61Å; K178-W229 HydrophobicContact CB-CH2 4.47Å; K178-W229 HydrophobicContact CD-CH2 3.89Å; K178-W229 HydrophobicContact CD-CZ2 3.42Å; K178-W229 VanDerWaalsContact CD-CZ2 3.42Å; K178-I320 HydrophobicContact CB-CG2 4.48Å; K178-I320 HydrophobicContact CD-CG2 4.4Å; K178-I320 WeakPolarHBondContact O-CD1 3.35Å; K178-E324 WeakPolarHBondContact CD-OE1 3.47Å; K178-E324 WeakPolarHBondContact CE-OE1 3.33Å; K178-E324 IonicContact NZ-OE1 2.81Å; K178-E324 PolarHBondContact NZ-OE1 3.28Å; K178-E324 IonicContact NZ-OE2 3.55Å; K178-E324 PolarHBondContact NZ-OE2 3.01Å
179	N	89.8	Confident	91.8	Very high	53 Å²	53	58.3 Å²	58.3	28%	0.283	28%	0.281	S	S	.	.	S	Bend	trans	-93.6	-170	-178.5	66.1	43.3	0	0	0	112.2	R177 E181 Y182 K183	R177-N179 PolarHBondContact O-N 3.3Å; R177-N179 PolarHBondContact O-ND2 3.12Å; N179-E181 VanDerWaalsContact C-N 3.35Å; N179-E181 PolarHBondContact O-N 3.35Å; N179-E181 WeakPolarHBondContact OD1-CB 3.45Å; N179-E181 PolarHBondContact OD1-N 2.88Å; N179-Y182 WeakPolarHBondContact O-CB 3.31Å; N179-Y182 PolarHBondContact O-N 3.4Å; N179-Y182 PolarHBondContact OD1-N 3.1Å; N179-K183 PolarHBondContact O-N 3.2Å
180	A	92.3	Very high	92	Very high	59 Å²	59	55.2 Å²	55.2	49%	0.488	27%	0.266	S	S	.	.	H	α-helix	trans	-64.3	-33.4	-179.6	0	0	0	0	0	114	K183 R184	A180-K183 PolarHBondContact O-N 3.16Å; A180-R184 WeakPolarHBondContact O-CG 3.33Å; A180-R184 PolarHBondContact O-N 3.37Å; A180-R184 VanDerWaalsContact O-N 3.12Å
181	E	92.2	Very high	92.2	Very high	80 Å²	80	61.7 Å²	61.7	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-69.5	-38.9	175.6	-61.9	-56.3	152.5	0	0	111.4	L152 N179 R184 Y185	L152-E181 HydrophobicContact CD2-CB 3.91Å; N179-E181 VanDerWaalsContact C-N 3.35Å; N179-E181 PolarHBondContact O-N 3.35Å; N179-E181 WeakPolarHBondContact OD1-CB 3.45Å; N179-E181 PolarHBondContact OD1-N 2.88Å; E181-R184 PolarHBondContact O-N 3.29Å; E181-R184 IonicContact OE1-CZ 3.66Å; E181-R184 IonicContact OE1-NH1 2.79Å; E181-R184 PolarHBondContact OE1-NH1 3.45Å; E181-R184 IonicContact OE2-NH1 3.32Å; E181-R184 PolarHBondContact OE2-NH1 2.99Å; E181-Y185 PolarHBondContact O-N 2.97Å
182	Y	93.6	Very high	92.6	Very high	3 Å²	3	59.3 Å²	59.3	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-61.6	-44.4	173	176.2	-108.3	0	0	0	111.4	L152 L170 I173 K178 N179 R184 Y185 L186 I320 E324	L152-Y182 HydrophobicContact CD1-CD2 4.04Å; L170-Y182 HydrophobicContact CD2-CE2 4.49Å; I173-Y182 HydrophobicContact CD1-CD2 4.48Å; I173-Y182 HydrophobicContact CD1-CE2 3.51Å; I173-Y182 HydrophobicContact CG2-CE2 4.36Å; K178-Y182 HydrophobicContact CB-CD1 3.73Å; K178-Y182 HydrophobicContact CB-CE1 3.97Å; K178-Y182 HydrophobicContact CD-CE1 3.91Å; K178-Y182 HydrophobicContact CG-CD1 3.84Å; K178-Y182 HydrophobicContact CG-CE1 3.61Å; N179-Y182 WeakPolarHBondContact O-CB 3.31Å; N179-Y182 PolarHBondContact O-N 3.4Å; N179-Y182 PolarHBondContact OD1-N 3.1Å; Y182-R184 VanDerWaalsContact C-N 3.3Å; Y182-R184 PolarHBondContact O-N 3.27Å; Y182-Y185 HydrophobicContact CD2-CD1 4.16Å; Y182-Y185 HydrophobicContact CE2-CD1 4.19Å; Y182-Y185 WeakPolarHBondContact O-CB 3.36Å; Y182-Y185 PolarHBondContact O-N 3Å; Y182-Y185 VanDerWaalsContact O-N 3.11Å; Y182-L186 HydrophobicContact CD1-CD1 4.05Å; Y182-L186 HydrophobicContact CD1-CG 4.29Å; Y182-L186 HydrophobicContact CE1-CD1 3.46Å; Y182-L186 VanDerWaalsContact CE1-CD1 3.46Å; Y182-L186 HydrophobicContact CE1-CD2 4.3Å; Y182-L186 HydrophobicContact CE1-CG 3.92Å; Y182-L186 HydrophobicContact CE2-CD2 3.95Å; Y182-L186 HydrophobicContact CE2-CG 4.19Å; Y182-L186 WeakPolarHBondContact O-CG 3.45Å; Y182-L186 PolarHBondContact O-N 2.94Å; Y182-I320 HydrophobicContact CD1-CG2 4.05Å; Y182-I320 HydrophobicContact CE1-CG2 3.76Å; Y182-E324 WeakPolarHBondContact CE1-OE1 3.22Å; Y182-E324 PolarHBondContact OH-OE1 3.25Å
183	K	94.7	Very high	93	Very high	58 Å²	58	54.2 Å²	54.2	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-56.1	-45	174.9	-171.2	-178.9	-179.5	-170.5	0	111.8	N179 A180 Y185 L186 E187 I320 L323	N179-K183 PolarHBondContact O-N 3.2Å; A180-K183 PolarHBondContact O-N 3.16Å; K183-Y185 VanDerWaalsContact C-N 3.33Å; K183-Y185 PolarHBondContact O-N 3.24Å; K183-L186 WeakPolarHBondContact O-CB 3.24Å; K183-L186 PolarHBondContact O-N 3.26Å; K183-E187 WeakPolarHBondContact CE-OE1 3.44Å; K183-E187 IonicContact NZ-OE1 3.97Å; K183-E187 WeakPolarHBondContact O-CG 3.48Å; K183-E187 PolarHBondContact O-N 2.88Å; K183-I320 HydrophobicContact CB-CG1 4.31Å; K183-I320 HydrophobicContact CD-CG1 4.31Å; K183-I320 HydrophobicContact CG-CG1 4.24Å; K183-L323 HydrophobicContact CG-CD1 3.83Å
184	R	95.4	Very high	93.4	Very high	117 Å²	117	56 Å²	56	44%	0.442	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-36.1	176.9	-69	-176.7	-164	109.6	-2.3	113.2	A180 E181 Y182 M188	A180-R184 WeakPolarHBondContact O-CG 3.33Å; A180-R184 PolarHBondContact O-N 3.37Å; A180-R184 VanDerWaalsContact O-N 3.12Å; E181-R184 PolarHBondContact O-N 3.29Å; E181-R184 IonicContact OE1-CZ 3.66Å; E181-R184 IonicContact OE1-NH1 2.79Å; E181-R184 PolarHBondContact OE1-NH1 3.45Å; E181-R184 IonicContact OE2-NH1 3.32Å; E181-R184 PolarHBondContact OE2-NH1 2.99Å; Y182-R184 VanDerWaalsContact C-N 3.3Å; Y182-R184 PolarHBondContact O-N 3.27Å; R184-M188 WeakPolarHBondContact O-CB 3.33Å; R184-M188 PolarHBondContact O-N 3.45Å; R184-M188 VanDerWaalsContact O-N 3.08Å
185	Y	95.6	Very high	93.9	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-45.7	172.3	160.9	-103.5	0	0	0	111.1	C145 K148 Y149 L152 Y163 E181 Y182 K183 M188 L189	C145-Y185 HydrophobicContact CB-CE2 4.35Å; C145-Y185 WeakPolarHBondContact O-CE2 3.44Å; K148-Y185 HydrophobicContact CB-CD2 4.16Å; K148-Y185 HydrophobicContact CG-CD2 4.11Å; Y149-Y185 HydrophobicContact CD2-CD1 4.34Å; Y149-Y185 AromaticContact CD2-CE1 3.77Å; Y149-Y185 HydrophobicContact CD2-CE1 3.77Å; Y149-Y185 HydrophobicContact CD2-CE2 4.09Å; Y149-Y185 AromaticContact CD2-CZ 3.62Å; Y149-Y185 HydrophobicContact CE2-CE1 4.4Å; Y149-Y185 HydrophobicContact CG-CE2 4.43Å; L152-Y185 HydrophobicContact CD1-CD1 4.12Å; L152-Y185 HydrophobicContact CD1-CG 4.17Å; Y163-Y185 HydrophobicContact CE2-CE2 4.45Å; Y163-Y185 WeakPolarHBondContact CE2-OH 3.48Å; Y163-Y185 PolarHBondContact OH-OH 3.38Å; E181-Y185 PolarHBondContact O-N 2.97Å; Y182-Y185 HydrophobicContact CD2-CD1 4.16Å; Y182-Y185 HydrophobicContact CE2-CD1 4.19Å; Y182-Y185 WeakPolarHBondContact O-CB 3.36Å; Y182-Y185 PolarHBondContact O-N 3Å; Y182-Y185 VanDerWaalsContact O-N 3.11Å; K183-Y185 VanDerWaalsContact C-N 3.33Å; K183-Y185 PolarHBondContact O-N 3.24Å; Y185-M188 PolarHBondContact O-N 2.93Å; Y185-L189 HydrophobicContact CE1-CD2 4.43Å; Y185-L189 WeakPolarHBondContact O-CB 3.33Å; Y185-L189 PolarHBondContact O-N 3.19Å
186	L	96.9	Very high	94.5	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-42.1	176.7	-64.7	-174.2	0	0	0	112.5	L170 Y182 K183 M188 L189 L190 I320 L323 E324 I327	L170-L186 HydrophobicContact CD1-CD2 3.81Å; L170-L186 HydrophobicContact CD2-CD2 3.91Å; L170-L186 HydrophobicContact CG-CD2 4.49Å; Y182-L186 HydrophobicContact CD1-CD1 4.05Å; Y182-L186 HydrophobicContact CD1-CG 4.29Å; Y182-L186 HydrophobicContact CE1-CD1 3.46Å; Y182-L186 VanDerWaalsContact CE1-CD1 3.46Å; Y182-L186 HydrophobicContact CE1-CD2 4.3Å; Y182-L186 HydrophobicContact CE1-CG 3.92Å; Y182-L186 HydrophobicContact CE2-CD2 3.95Å; Y182-L186 HydrophobicContact CE2-CG 4.19Å; Y182-L186 WeakPolarHBondContact O-CG 3.45Å; Y182-L186 PolarHBondContact O-N 2.94Å; K183-L186 WeakPolarHBondContact O-CB 3.24Å; K183-L186 PolarHBondContact O-N 3.26Å; L186-M188 VanDerWaalsContact C-N 3.33Å; L186-M188 PolarHBondContact O-N 2.82Å; L186-L189 PolarHBondContact O-N 3.34Å; L186-L190 WeakPolarHBondContact O-CB 3.5Å; L186-L190 PolarHBondContact O-N 3.32Å; L186-I320 HydrophobicContact CD1-CG2 3.89Å; L186-L323 HydrophobicContact CB-CB 4.23Å; L186-L323 HydrophobicContact CB-CD1 4.29Å; L186-L323 HydrophobicContact CD1-CB 4.09Å; L186-E324 HydrophobicContact CD1-CG 3.75Å; L186-I327 HydrophobicContact CB-CD1 3.99Å; L186-I327 HydrophobicContact CD2-CD1 3.63Å; L186-I327 HydrophobicContact CG-CD1 4.32Å
187	E	97.7	Very high	95.2	Very high	82 Å²	82	45.4 Å²	45.4	38%	0.383	22%	0.215	S	C	.	.	H	α-helix	trans	-59.2	-45.6	176.3	-72.7	166.2	165	0	0	110.8	K183 L190 E191 L323	K183-E187 WeakPolarHBondContact CE-OE1 3.44Å; K183-E187 IonicContact NZ-OE1 3.97Å; K183-E187 WeakPolarHBondContact O-CG 3.48Å; K183-E187 PolarHBondContact O-N 2.88Å; E187-L190 PolarHBondContact O-N 3.41Å; E187-E191 WeakPolarHBondContact O-CB 3.35Å; E187-E191 PolarHBondContact O-N 2.95Å; E187-L323 HydrophobicContact CG-CD1 3.94Å; E187-L323 HydrophobicContact CG-CD2 4.47Å
188	M	97.6	Very high	95.6	Very high	60 Å²	60	43.5 Å²	43.5	30%	0.296	21%	0.213	S	C	.	.	H	α-helix	trans	-66.8	-42.3	178.7	-168.1	-176	84	0	0	112.9	D144 C145 K148 R184 Y185 L186 Y192	D144-M188 WeakPolarHBondContact O-CE 3.43Å; C145-M188 HydrophobicContact CB-CE 4.17Å; K148-M188 HydrophobicContact CB-CE 3.44Å; K148-M188 VanDerWaalsContact CB-CE 3.44Å; K148-M188 HydrophobicContact CB-SD 4.24Å; K148-M188 HydrophobicContact CG-CE 3.94Å; K148-M188 HydrophobicContact CG-SD 4.27Å; R184-M188 WeakPolarHBondContact O-CB 3.33Å; R184-M188 PolarHBondContact O-N 3.45Å; R184-M188 VanDerWaalsContact O-N 3.08Å; Y185-M188 PolarHBondContact O-N 2.93Å; L186-M188 VanDerWaalsContact C-N 3.33Å; L186-M188 PolarHBondContact O-N 2.82Å; M188-Y192 PolarHBondContact O-N 3.35Å; M188-Y192 VanDerWaalsContact O-N 3.09Å
189	L	97.8	Very high	96	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-43.6	176	175.4	61.3	0	0	0	111	L142 C145 F167 Y185 L186 Y192 L193 I327	L142-L189 HydrophobicContact CD2-CD1 3.99Å; C145-L189 HydrophobicContact CB-CD1 4.31Å; F167-L189 HydrophobicContact CD2-CD1 4.3Å; F167-L189 HydrophobicContact CD2-CD2 4.08Å; Y185-L189 HydrophobicContact CE1-CD2 4.43Å; Y185-L189 WeakPolarHBondContact O-CB 3.33Å; Y185-L189 PolarHBondContact O-N 3.19Å; L186-L189 PolarHBondContact O-N 3.34Å; L189-Y192 PolarHBondContact O-N 3.17Å; L189-L193 HydrophobicContact CD1-CD1 3.95Å; L189-L193 HydrophobicContact CD1-CG 4.05Å; L189-L193 HydrophobicContact CG-CD1 3.94Å; L189-L193 HydrophobicContact CG-CG 4.43Å; L189-L193 WeakPolarHBondContact O-CB 3.43Å; L189-L193 VanDerWaalsContact O-CG 3.24Å; L189-L193 WeakPolarHBondContact O-CG 3.24Å; L189-L193 PolarHBondContact O-N 3Å; L189-I327 HydrophobicContact CD2-CD1 4.13Å; L189-I327 HydrophobicContact CD2-CG2 4.02Å; L189-I327 HydrophobicContact CG-CD1 4.43Å
190	L	97.7	Very high	96.3	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-64.6	-44.7	178.8	179.5	60.8	0	0	0	111.4	L186 E187 Y192 L193 Q194 L323 Q326 I327 Y330	L186-L190 WeakPolarHBondContact O-CB 3.5Å; L186-L190 PolarHBondContact O-N 3.32Å; E187-L190 PolarHBondContact O-N 3.41Å; L190-Y192 VanDerWaalsContact C-N 3.33Å; L190-Y192 PolarHBondContact O-N 3.44Å; L190-L193 PolarHBondContact O-N 3.47Å; L190-Q194 HydrophobicContact CD1-CG 3.98Å; L190-Q194 HydrophobicContact CG-CG 4.29Å; L190-Q194 WeakPolarHBondContact O-CB 3.24Å; L190-Q194 VanDerWaalsContact O-CG 3.25Å; L190-Q194 WeakPolarHBondContact O-CG 3.27Å; L190-Q194 PolarHBondContact O-N 3.35Å; L190-L323 HydrophobicContact CD2-CD2 3.66Å; L190-Q326 HydrophobicContact CD1-CB 3.69Å; L190-Q326 HydrophobicContact CD2-CB 3.99Å; L190-I327 HydrophobicContact CB-CD1 4.42Å; L190-I327 HydrophobicContact CB-CG1 4.03Å; L190-I327 HydrophobicContact CD1-CG1 4.17Å; L190-Y330 HydrophobicContact CD1-CD2 3.62Å; L190-Y330 HydrophobicContact CD1-CE2 3.84Å
191	E	97.8	Very high	96.5	Very high	137 Å²	137	43.3 Å²	43.3	64%	0.64	20%	0.199	S	C	*	.	H	α-helix	trans	-56.8	-47.2	176.2	-178.1	174	-164.6	0	0	111.2	E187 Q194 D195	E187-E191 WeakPolarHBondContact O-CB 3.35Å; E187-E191 PolarHBondContact O-N 2.95Å; E191-Q194 PolarHBondContact O-N 3.11Å; E191-D195 WeakPolarHBondContact O-CB 3.47Å; E191-D195 PolarHBondContact O-N 2.95Å
192	Y	98	Very high	96.6	Very high	39 Å²	39	40.1 Å²	40.1	15%	0.153	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-49.3	175.5	176.8	-96.9	0	0	0	112.4	E134 L140 D141 L142 M188 L189 L190 Q194 D195 Y196	E134-Y192 WeakPolarHBondContact OE1-CE2 3.43Å; E134-Y192 PolarHBondContact OE1-OH 3.34Å; L140-Y192 HydrophobicContact CB-CE1 4.43Å; L140-Y192 HydrophobicContact CD2-CE1 4.39Å; D141-Y192 PolarHBondContact N-OH 3.24Å; L142-Y192 HydrophobicContact CD2-CD1 3.53Å; L142-Y192 HydrophobicContact CD2-CE1 3.48Å; L142-Y192 VanDerWaalsContact CD2-CE1 3.48Å; L142-Y192 HydrophobicContact CG-CE1 4.43Å; M188-Y192 PolarHBondContact O-N 3.35Å; M188-Y192 VanDerWaalsContact O-N 3.09Å; L189-Y192 PolarHBondContact O-N 3.17Å; L190-Y192 VanDerWaalsContact C-N 3.33Å; L190-Y192 PolarHBondContact O-N 3.44Å; Y192-Q194 VanDerWaalsContact C-N 3.31Å; Y192-Q194 PolarHBondContact O-N 3.34Å; Y192-D195 PolarHBondContact O-N 3.26Å; Y192-Y196 WeakPolarHBondContact O-CB 3.4Å; Y192-Y196 PolarHBondContact O-N 3.25Å; Y192-Y196 WeakPolarHBondContact OH-CD2 3.44Å
193	L	97.7	Very high	96.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-35.6	-178.6	-67.8	173.1	0	0	0	112.2	L189 L190 T197 I327 Y330 V331 L334	L189-L193 HydrophobicContact CD1-CD1 3.95Å; L189-L193 HydrophobicContact CD1-CG 4.05Å; L189-L193 HydrophobicContact CG-CD1 3.94Å; L189-L193 HydrophobicContact CG-CG 4.43Å; L189-L193 WeakPolarHBondContact O-CB 3.43Å; L189-L193 VanDerWaalsContact O-CG 3.24Å; L189-L193 WeakPolarHBondContact O-CG 3.24Å; L189-L193 PolarHBondContact O-N 3Å; L190-L193 PolarHBondContact O-N 3.47Å; L193-T197 VanDerWaalsContact O-CB 3.29Å; L193-T197 WeakPolarHBondContact O-CB 3.33Å; L193-T197 PolarHBondContact O-N 3.07Å; L193-T197 PolarHBondContact O-OG1 3.49Å; L193-I327 HydrophobicContact CD1-CG2 4.04Å; L193-Y330 HydrophobicContact CB-CG 4.41Å; L193-V331 HydrophobicContact CD1-CG2 3.99Å; L193-L334 HydrophobicContact CD2-CD1 3.86Å
194	Q	96.7	Very high	96.7	Very high	58 Å²	58	42.9 Å²	42.9	27%	0.271	20%	0.201	S	C	.	.	H	α-helix	trans	-65.3	-55	175.9	-78.9	179.9	-37.3	0	0	111.2	L190 E191 Y192 Y196 T197 D198 Y330	L190-Q194 HydrophobicContact CD1-CG 3.98Å; L190-Q194 HydrophobicContact CG-CG 4.29Å; L190-Q194 WeakPolarHBondContact O-CB 3.24Å; L190-Q194 VanDerWaalsContact O-CG 3.25Å; L190-Q194 WeakPolarHBondContact O-CG 3.27Å; L190-Q194 PolarHBondContact O-N 3.35Å; E191-Q194 PolarHBondContact O-N 3.11Å; Y192-Q194 VanDerWaalsContact C-N 3.31Å; Y192-Q194 PolarHBondContact O-N 3.34Å; Q194-Y196 VanDerWaalsContact C-N 3.34Å; Q194-Y196 PolarHBondContact O-N 2.95Å; Q194-T197 PolarHBondContact O-N 3.22Å; Q194-T197 VanDerWaalsContact O-N 3.14Å; Q194-D198 PolarHBondContact O-N 3.4Å; Q194-Y330 HydrophobicContact CG-CD2 4.1Å; Q194-Y330 HydrophobicContact CG-CE1 4.1Å; Q194-Y330 HydrophobicContact CG-CE2 3.45Å; Q194-Y330 VanDerWaalsContact CG-CE2 3.45Å; Q194-Y330 VanDerWaalsContact CG-CZ 3.46Å
195	D	96.8	Very high	96.6	Very high	80 Å²	80	41 Å²	41	43%	0.428	20%	0.2	S	C	.	.	H	α-helix	trans	-56.7	-48.2	177.7	172.1	80.7	0	0	0	111.6	E191 Y192 T197 D198 R199	E191-D195 WeakPolarHBondContact O-CB 3.47Å; E191-D195 PolarHBondContact O-N 2.95Å; Y192-D195 PolarHBondContact O-N 3.26Å; D195-T197 VanDerWaalsContact C-N 3.3Å; D195-T197 PolarHBondContact O-N 2.87Å; D195-D198 PolarHBondContact O-N 3.14Å; D195-R199 WeakPolarHBondContact O-CG 3.43Å; D195-R199 PolarHBondContact O-N 3.07Å; D195-R199 IonicContact OD2-CZ 3.96Å; D195-R199 VanDerWaalsContact OD2-CZ 3.28Å; D195-R199 IonicContact OD2-NE 3.04Å; D195-R199 PolarHBondContact OD2-NE 2.98Å; D195-R199 IonicContact OD2-NH2 3.74Å; D195-R199 PolarHBondContact OD2-NH2 3.01Å
196	Y	97.7	Very high	96.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-40.9	177.4	-173.4	-85.8	0	0	0	112.2	F130 E134 G137 Y139 L140 Y192 Q194 R199 V200 L334 Q337	F130-Y196 HydrophobicContact CD1-CE2 4.4Å; F130-Y196 HydrophobicContact CE1-CE2 4.2Å; E134-Y196 HydrophobicContact CB-CE2 4.19Å; E134-Y196 HydrophobicContact CG-CD2 4.31Å; E134-Y196 HydrophobicContact CG-CE2 3.87Å; E134-Y196 WeakPolarHBondContact OE1-CD2 3.45Å; G137-Y196 VanDerWaalsContact CA-OH 3.31Å; G137-Y196 WeakPolarHBondContact CA-OH 3.25Å; G137-Y196 PolarHBondContact O-OH 3.31Å; Y139-Y196 VanDerWaalsContact O-CE2 3.22Å; Y139-Y196 WeakPolarHBondContact O-CE2 3.49Å; Y139-Y196 VanDerWaalsContact O-CZ 3.28Å; Y139-Y196 PolarHBondContact O-OH 3.09Å; L140-Y196 HydrophobicContact CD2-CD1 3.59Å; L140-Y196 HydrophobicContact CD2-CD2 4.2Å; L140-Y196 HydrophobicContact CD2-CE1 3.41Å; L140-Y196 VanDerWaalsContact CD2-CE1 3.41Å; L140-Y196 HydrophobicContact CD2-CE2 4.03Å; L140-Y196 HydrophobicContact CD2-CG 3.97Å; Y192-Y196 WeakPolarHBondContact O-CB 3.4Å; Y192-Y196 PolarHBondContact O-N 3.25Å; Y192-Y196 WeakPolarHBondContact OH-CD2 3.44Å; Q194-Y196 VanDerWaalsContact C-N 3.34Å; Q194-Y196 PolarHBondContact O-N 2.95Å; Y196-R199 PolarHBondContact O-N 3.22Å; Y196-V200 HydrophobicContact CD1-CG2 3.94Å; Y196-V200 HydrophobicContact CE1-CB 4.29Å; Y196-V200 HydrophobicContact CE1-CG2 3.44Å; Y196-V200 VanDerWaalsContact CE1-CG2 3.44Å; Y196-V200 HydrophobicContact CE2-CG2 4.33Å; Y196-V200 WeakPolarHBondContact O-CG2 3.35Å; Y196-V200 PolarHBondContact O-N 2.86Å; Y196-L334 HydrophobicContact CD1-CD1 3.87Å; Y196-L334 HydrophobicContact CD1-CD2 3.83Å; Y196-L334 HydrophobicContact CE1-CD2 3.95Å; Y196-Q337 HydrophobicContact CE1-CB 4.44Å; Y196-Q337 HydrophobicContact CE1-CG 4.04Å
197	T	97	Very high	96.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65	-41	177.3	-58.7	0	0	0	0	111.2	L193 Q194 D195 R199 V200 K201 Y330 I333 L334	L193-T197 VanDerWaalsContact O-CB 3.29Å; L193-T197 WeakPolarHBondContact O-CB 3.33Å; L193-T197 PolarHBondContact O-N 3.07Å; L193-T197 PolarHBondContact O-OG1 3.49Å; Q194-T197 PolarHBondContact O-N 3.22Å; Q194-T197 VanDerWaalsContact O-N 3.14Å; D195-T197 VanDerWaalsContact C-N 3.3Å; D195-T197 PolarHBondContact O-N 2.87Å; T197-R199 VanDerWaalsContact C-N 3.27Å; T197-R199 PolarHBondContact O-N 3.44Å; T197-V200 PolarHBondContact O-N 2.82Å; T197-K201 HydrophobicContact CG2-CB 4.48Å; T197-K201 CarbonylContact O-C 3.58Å; T197-K201 WeakPolarHBondContact O-CA 3.39Å; T197-K201 WeakPolarHBondContact O-CB 3.21Å; T197-K201 PolarHBondContact O-N 2.97Å; T197-Y330 HydrophobicContact CG2-CD1 4.2Å; T197-Y330 HydrophobicContact CG2-CE1 4.14Å; T197-Y330 WeakPolarHBondContact OG1-CD1 3.45Å; T197-I333 HydrophobicContact CG2-CG2 4.15Å; T197-L334 WeakPolarHBondContact OG1-CD1 3.46Å
198	D	95.9	Very high	96.1	Very high	72 Å²	72	52.3 Å²	52.3	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-64.3	-34.1	176.3	-73	-18.5	0	0	0	111.8	Q194 D195 P202 Q206	Q194-D198 PolarHBondContact O-N 3.4Å; D195-D198 PolarHBondContact O-N 3.14Å; D198-P202 WeakPolarHBondContact O-CA 3.47Å; D198-Q206 WeakPolarHBondContact OD1-CG 3.41Å; D198-Q206 PolarHBondContact OD1-NE2 2.89Å
199	R	96.7	Very high	95.9	Very high	31 Å²	31	50.2 Å²	50.2	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-72.5	-40.9	175.3	-70.8	-170	-74	133.8	2.5	113.2	I37 H41 V128 E129 F130 E134 D195 Y196 T197	I37-R199 WeakPolarHBondContact CG2-O 3.47Å; H41-R199 PolarHBondContact NE2-O 3.34Å; V128-R199 HydrophobicContact CG1-CB 3.78Å; V128-R199 HydrophobicContact CG1-CG 3.56Å; E129-R199 VanDerWaalsContact O-CD 3.26Å; E129-R199 WeakPolarHBondContact O-CD 3.24Å; E129-R199 PolarHBondContact O-NH1 3.31Å; F130-R199 HydrophobicContact CE1-CB 3.92Å; F130-R199 HydrophobicContact CE2-CB 4.44Å; F130-R199 HydrophobicContact CZ-CB 3.66Å; E134-R199 IonicContact OE1-CZ 3.26Å; E134-R199 IonicContact OE1-NH1 2.7Å; E134-R199 IonicContact OE1-NH2 2.91Å; E134-R199 PolarHBondContact OE1-NH2 2.98Å; E134-R199 IonicContact OE2-CZ 2.67Å; E134-R199 IonicContact OE2-NH1 3.79Å; E134-R199 PolarHBondContact OE2-NH1 3.44Å; E134-R199 IonicContact OE2-NH2 2.66Å; E134-R199 PolarHBondContact OE2-NH2 3.31Å; D195-R199 WeakPolarHBondContact O-CG 3.43Å; D195-R199 PolarHBondContact O-N 3.07Å; D195-R199 IonicContact OD2-CZ 3.96Å; D195-R199 VanDerWaalsContact OD2-CZ 3.28Å; D195-R199 IonicContact OD2-NE 3.04Å; D195-R199 PolarHBondContact OD2-NE 2.98Å; D195-R199 IonicContact OD2-NH2 3.74Å; D195-R199 PolarHBondContact OD2-NH2 3.01Å; Y196-R199 PolarHBondContact O-N 3.22Å; T197-R199 VanDerWaalsContact C-N 3.27Å; T197-R199 PolarHBondContact O-N 3.44Å
200	V	96.5	Very high	95.8	Very high	10 Å²	10	53.7 Å²	53.7	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-86.7	-29.5	-178.2	177.9	0	0	0	0	112.9	I37 F130 Y196 T197	I37-V200 HydrophobicContact CD1-CG1 4.39Å; I37-V200 HydrophobicContact CD1-CG2 4.41Å; F130-V200 HydrophobicContact CE1-CG2 3.75Å; F130-V200 HydrophobicContact CZ-CG2 3.87Å; Y196-V200 HydrophobicContact CD1-CG2 3.94Å; Y196-V200 HydrophobicContact CE1-CB 4.29Å; Y196-V200 HydrophobicContact CE1-CG2 3.44Å; Y196-V200 VanDerWaalsContact CE1-CG2 3.44Å; Y196-V200 HydrophobicContact CE2-CG2 4.33Å; Y196-V200 WeakPolarHBondContact O-CG2 3.35Å; Y196-V200 PolarHBondContact O-N 2.86Å; T197-V200 PolarHBondContact O-N 2.82Å
201	K	95.9	Very high	95.8	Very high	74 Å²	74	55 Å²	55	32%	0.322	28%	0.278	S	S	.	.			trans	-132.4	59.5	-174.4	-57.7	-170.9	178.9	-174	0	111.9	T197 L203 Q204 I333	T197-K201 HydrophobicContact CG2-CB 4.48Å; T197-K201 CarbonylContact O-C 3.58Å; T197-K201 WeakPolarHBondContact O-CA 3.39Å; T197-K201 WeakPolarHBondContact O-CB 3.21Å; T197-K201 PolarHBondContact O-N 2.97Å; K201-L203 PolarHBondContact O-N 3.44Å; K201-L203 VanDerWaalsContact O-N 3.08Å; K201-Q204 HydrophobicContact CB-CB 4.23Å; K201-Q204 VanDerWaalsContact O-CB 3.25Å; K201-Q204 WeakPolarHBondContact O-CB 3.45Å; K201-Q204 PolarHBondContact O-N 2.87Å; K201-I333 HydrophobicContact CD-CG2 3.96Å; K201-I333 PolarHBondContact NZ-O 3.1Å
202	P	95.9	Very high	95.7	Very high	13 Å²	13	53.4 Å²	53.4	8%	0.084	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.5	-175.3	28.8	-39.1	0	0	0	114.4	D40 H41 R44 D198 Q204	D40-P202 HydrophobicContact CB-CG 3.69Å; H41-P202 HydrophobicContact CB-CG 4.49Å; H41-P202 VanDerWaalsContact CE1-CB 3.46Å; H41-P202 WeakPolarHBondContact CE1-CB 3.26Å; R44-P202 HydrophobicContact CB-CB 4.18Å; R44-P202 WeakPolarHBondContact CD-O 3.41Å; R44-P202 HydrophobicContact CG-CB 4.35Å; D198-P202 WeakPolarHBondContact O-CA 3.47Å; P202-Q204 VanDerWaalsContact C-N 3.26Å; P202-Q204 PolarHBondContact O-N 3.46Å
203	L	95.4	Very high	95.6	Very high	67 Å²	67	51.8 Å²	51.8	35%	0.351	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-5.7	176.5	-62.1	178.6	0	0	0	113.3	D40 T43 R44 K201	D40-L203 HydrophobicContact CB-CD1 4.02Å; D40-L203 HydrophobicContact CB-CG 4.11Å; D40-L203 WeakPolarHBondContact OD1-CD1 3.44Å; T43-L203 HydrophobicContact CG2-CD1 4.23Å; T43-L203 HydrophobicContact CG2-CD2 3.9Å; R44-L203 HydrophobicContact CB-CD2 3.99Å; K201-L203 PolarHBondContact O-N 3.44Å; K201-L203 VanDerWaalsContact O-N 3.08Å
204	Q	94.3	Very high	95.6	Very high	52 Å²	52	56 Å²	56	24%	0.243	28%	0.282	C	S	.	.	S	Bend	trans	-76.2	128.1	176.8	-174.5	165	9.5	0	0	111	K201 P202 Q206	K201-Q204 HydrophobicContact CB-CB 4.23Å; K201-Q204 VanDerWaalsContact O-CB 3.25Å; K201-Q204 WeakPolarHBondContact O-CB 3.45Å; K201-Q204 PolarHBondContact O-N 2.87Å; P202-Q204 VanDerWaalsContact C-N 3.26Å; P202-Q204 PolarHBondContact O-N 3.46Å; Q204-Q206 PolarHBondContact O-N 3.17Å; Q204-Q206 VanDerWaalsContact O-N 3.08Å
205	D	93.5	Very high	95.6	Very high	78 Å²	78	56.3 Å²	56.3	42%	0.417	30%	0.295	S	S	.	.			trans	-76.4	99.3	175	-169.3	-25.6	0	0	0	110.5	N207 E208 L209	D205-N207 VanDerWaalsContact C-N 3.26Å; D205-N207 PolarHBondContact O-N 3.3Å; D205-N207 WeakPolarHBondContact OD1-CA 3.22Å; D205-N207 WeakPolarHBondContact OD1-CB 3.36Å; D205-N207 PolarHBondContact OD1-N 3.32Å; D205-E208 HydrophobicContact CB-CB 3.92Å; D205-E208 PolarHBondContact O-N 3.45Å; D205-E208 PolarHBondContact OD1-N 2.9Å; D205-L209 WeakPolarHBondContact O-CB 3.32Å; D205-L209 PolarHBondContact O-N 3.27Å
206	Q	90.4	Very high	95.6	Very high	35 Å²	35	55.7 Å²	55.7	16%	0.164	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-29	177.8	-62.8	-60.2	-22	0	0	113.1	D198 Q204 F210 Y330	D198-Q206 WeakPolarHBondContact OD1-CG 3.41Å; D198-Q206 PolarHBondContact OD1-NE2 2.89Å; Q204-Q206 PolarHBondContact O-N 3.17Å; Q204-Q206 VanDerWaalsContact O-N 3.08Å; Q206-F210 VanDerWaalsContact O-CB 3.29Å; Q206-F210 WeakPolarHBondContact O-CB 3.28Å; Q206-F210 PolarHBondContact O-N 2.91Å; Q206-Y330 PolarHBondContact OE1-OH 2.9Å
207	N	93.1	Very high	95.5	Very high	138 Å²	138	55.9 Å²	55.9	74%	0.738	29%	0.29	S	S	*	.	H	α-helix	trans	-72.9	-42.2	178.9	-63.7	-60.6	0	0	0	110.7	D205 L209 G211	D205-N207 VanDerWaalsContact C-N 3.26Å; D205-N207 PolarHBondContact O-N 3.3Å; D205-N207 WeakPolarHBondContact OD1-CA 3.22Å; D205-N207 WeakPolarHBondContact OD1-CB 3.36Å; D205-N207 PolarHBondContact OD1-N 3.32Å; N207-L209 VanDerWaalsContact C-N 3.35Å; N207-G211 PolarHBondContact O-N 3.09Å
208	E	95.1	Very high	95.5	Very high	146 Å²	146	58.6 Å²	58.6	68%	0.682	30%	0.303	S	S	*	.	H	α-helix	trans	-62.1	-45.5	173.3	-173	178	-178.7	0	0	110.6	D205 G211 K212	D205-E208 HydrophobicContact CB-CB 3.92Å; D205-E208 PolarHBondContact O-N 3.45Å; D205-E208 PolarHBondContact OD1-N 2.9Å; E208-G211 PolarHBondContact O-N 3.08Å; E208-K212 PolarHBondContact O-N 2.76Å
209	L	94.8	Very high	95.4	Very high	16 Å²	16	62 Å²	62	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-57.6	-54	176.1	179.4	63	0	0	0	110.9	D205 N207 G211 K212 I213 Y330 I333	D205-L209 WeakPolarHBondContact O-CB 3.32Å; D205-L209 PolarHBondContact O-N 3.27Å; N207-L209 VanDerWaalsContact C-N 3.35Å; L209-G211 VanDerWaalsContact C-N 3.3Å; L209-G211 PolarHBondContact O-N 2.96Å; L209-K212 WeakPolarHBondContact O-CB 3.38Å; L209-K212 PolarHBondContact O-N 3.42Å; L209-K212 VanDerWaalsContact O-N 3.09Å; L209-I213 HydrophobicContact CD1-CD1 4.08Å; L209-I213 HydrophobicContact CD1-CG1 4.22Å; L209-I213 HydrophobicContact CD2-CD1 4.46Å; L209-I213 HydrophobicContact CG-CD1 3.85Å; L209-I213 HydrophobicContact CG-CG1 4.36Å; L209-I213 VanDerWaalsContact O-CG1 3.27Å; L209-I213 WeakPolarHBondContact O-CG1 3.48Å; L209-I213 PolarHBondContact O-N 3.21Å; L209-Y330 HydrophobicContact CD2-CD1 4.48Å; L209-Y330 HydrophobicContact CD2-CE1 3.81Å; L209-I333 HydrophobicContact CD1-CD1 3.85Å; L209-I333 HydrophobicContact CD2-CD1 3.46Å; L209-I333 VanDerWaalsContact CD2-CD1 3.46Å; L209-I333 HydrophobicContact CG-CD1 4.31Å
210	F	95.3	Very high	95.3	Very high	74 Å²	74	64.2 Å²	64.2	33%	0.325	33%	0.325	S	S	.	.	H	α-helix	trans	-56.9	-43.8	179.5	-177.6	-91.5	0	0	0	112.1	Q206 K212 I213 Q214 F322	Q206-F210 VanDerWaalsContact O-CB 3.29Å; Q206-F210 WeakPolarHBondContact O-CB 3.28Å; Q206-F210 PolarHBondContact O-N 2.91Å; F210-K212 VanDerWaalsContact C-N 3.33Å; F210-K212 PolarHBondContact O-N 3.05Å; F210-I213 PolarHBondContact O-N 3.45Å; F210-Q214 WeakPolarHBondContact O-CB 3.25Å; F210-Q214 PolarHBondContact O-N 3.43Å; F210-F322 AromaticContact CE2-CE1 3.95Å; F210-F322 HydrophobicContact CE2-CE1 3.95Å; F210-F322 AromaticContact CE2-CZ 3.79Å; F210-F322 HydrophobicContact CE2-CZ 3.79Å; F210-F322 AromaticContact CZ-CE1 3.88Å; F210-F322 HydrophobicContact CZ-CE1 3.88Å; F210-F322 AromaticContact CZ-CZ 3.74Å; F210-F322 HydrophobicContact CZ-CZ 3.74Å
211	G	96.5	Very high	95.2	Very high	36 Å²	36	67 Å²	67	37%	0.371	33%	0.334	S	S	.	.	H	α-helix	trans	-60.2	-41.2	176.5	0	0	0	0	0	112.8	N207 E208 L209 A215	N207-G211 PolarHBondContact O-N 3.09Å; E208-G211 PolarHBondContact O-N 3.08Å; L209-G211 VanDerWaalsContact C-N 3.3Å; L209-G211 PolarHBondContact O-N 2.96Å; G211-A215 WeakPolarHBondContact O-CB 3.29Å; G211-A215 PolarHBondContact O-N 2.89Å
212	K	96.7	Very high	94.9	Very high	103 Å²	103	70 Å²	70	45%	0.448	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-49	174.3	-177	-168.2	170.4	-148.8	0	111.3	E208 L209 F210 Q214 A215 E216 E329	E208-K212 PolarHBondContact O-N 2.76Å; L209-K212 WeakPolarHBondContact O-CB 3.38Å; L209-K212 PolarHBondContact O-N 3.42Å; L209-K212 VanDerWaalsContact O-N 3.09Å; F210-K212 VanDerWaalsContact C-N 3.33Å; F210-K212 PolarHBondContact O-N 3.05Å; K212-Q214 VanDerWaalsContact C-N 3.31Å; K212-Q214 PolarHBondContact O-N 3.24Å; K212-A215 PolarHBondContact O-N 3.44Å; K212-E216 WeakPolarHBondContact CE-OE1 3.42Å; K212-E216 WeakPolarHBondContact O-CG 3.2Å; K212-E216 PolarHBondContact O-N 3.29Å; K212-E329 IonicContact NZ-OE2 3.82Å
213	I	96.2	Very high	94.7	Very high	4 Å²	4	74 Å²	74	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-57.6	-47	179.1	-61.5	174.6	0	0	0	110.1	L209 F210 E216 F217 F322 A325 Q326 E329	L209-I213 HydrophobicContact CD1-CD1 4.08Å; L209-I213 HydrophobicContact CD1-CG1 4.22Å; L209-I213 HydrophobicContact CD2-CD1 4.46Å; L209-I213 HydrophobicContact CG-CD1 3.85Å; L209-I213 HydrophobicContact CG-CG1 4.36Å; L209-I213 VanDerWaalsContact O-CG1 3.27Å; L209-I213 WeakPolarHBondContact O-CG1 3.48Å; L209-I213 PolarHBondContact O-N 3.21Å; F210-I213 PolarHBondContact O-N 3.45Å; I213-E216 PolarHBondContact O-N 3.48Å; I213-F217 WeakPolarHBondContact O-CB 3.45Å; I213-F217 PolarHBondContact O-N 3.41Å; I213-F322 HydrophobicContact CG2-CE2 4.3Å; I213-A325 HydrophobicContact CG2-CB 4.45Å; I213-Q326 HydrophobicContact CG2-CG 3.89Å; I213-E329 HydrophobicContact CD1-CB 3.64Å; I213-E329 HydrophobicContact CD1-CG 4.09Å; I213-E329 HydrophobicContact CG1-CB 3.89Å; I213-E329 HydrophobicContact CG1-CG 3.78Å; I213-E329 HydrophobicContact CG2-CG 4.44Å
214	Q	96.8	Very high	94.3	Very high	88 Å²	88	71.8 Å²	71.8	41%	0.411	36%	0.364	S	S	.	.	H	α-helix	trans	-61.1	-47.4	179.2	-172.2	176	15.8	0	0	112.1	F210 K212 E216 F217 E218 F322	F210-Q214 WeakPolarHBondContact O-CB 3.25Å; F210-Q214 PolarHBondContact O-N 3.43Å; K212-Q214 VanDerWaalsContact C-N 3.31Å; K212-Q214 PolarHBondContact O-N 3.24Å; Q214-E216 PolarHBondContact O-N 3.05Å; Q214-F217 PolarHBondContact O-N 2.98Å; Q214-E218 WeakPolarHBondContact O-CG 3.09Å; Q214-E218 PolarHBondContact O-N 3.5Å; Q214-F322 HydrophobicContact CB-CE2 4.22Å; Q214-F322 HydrophobicContact CB-CZ 4.24Å; Q214-F322 HydrophobicContact CG-CE2 4.42Å; Q214-F322 HydrophobicContact CG-CZ 4.41Å
215	A	97.1	Very high	94.2	Very high	65 Å²	65	73.7 Å²	73.7	54%	0.537	38%	0.379	S	S	.	.	H	α-helix	trans	-63	-42.7	179.4	0	0	0	0	0	112.3	G211 K212 K219	G211-A215 WeakPolarHBondContact O-CB 3.29Å; G211-A215 PolarHBondContact O-N 2.89Å; K212-A215 PolarHBondContact O-N 3.44Å; A215-K219 WeakPolarHBondContact O-CB 3.25Å; A215-K219 PolarHBondContact O-N 3.18Å
216	E	96.4	Very high	94.2	Very high	67 Å²	67	70.5 Å²	70.5	31%	0.313	36%	0.361	S	S	.	.	H	α-helix	trans	-67.6	-41.2	177	-74	-161.9	-162.7	0	0	112.7	K212 I213 Q214 K219 K220	K212-E216 WeakPolarHBondContact CE-OE1 3.42Å; K212-E216 WeakPolarHBondContact O-CG 3.2Å; K212-E216 PolarHBondContact O-N 3.29Å; I213-E216 PolarHBondContact O-N 3.48Å; Q214-E216 PolarHBondContact O-N 3.05Å; E216-K219 PolarHBondContact O-N 2.92Å; E216-K220 WeakPolarHBondContact O-CG 3.32Å; E216-K220 PolarHBondContact O-N 3Å; E216-K220 IonicContact OE2-NZ 3.59Å; E216-K220 PolarHBondContact OE2-NZ 3.06Å
217	F	96.8	Very high	94.2	Very high	4 Å²	4	71.6 Å²	71.6	2%	0.018	37%	0.372	C	S	.	.	H	α-helix	trans	-61.2	-51.8	176.6	171.7	-104.6	0	0	0	111.2	I213 Q214 K219 K220 W221 F226 K318 A321 F322 A325	I213-F217 WeakPolarHBondContact O-CB 3.45Å; I213-F217 PolarHBondContact O-N 3.41Å; Q214-F217 PolarHBondContact O-N 2.98Å; F217-K219 VanDerWaalsContact C-N 3.27Å; F217-K219 PolarHBondContact O-N 2.91Å; F217-K220 PolarHBondContact O-N 3.46Å; F217-K220 VanDerWaalsContact O-N 3.1Å; F217-W221 HydrophobicContact CE1-CB 4.38Å; F217-W221 HydrophobicContact CE1-CG 4.44Å; F217-W221 HydrophobicContact CE2-CB 4.46Å; F217-W221 HydrophobicContact CE2-CD2 4.47Å; F217-W221 AromaticContact CE2-CE3 3.94Å; F217-W221 HydrophobicContact CE2-CE3 3.94Å; F217-W221 HydrophobicContact CZ-CB 4.26Å; F217-W221 AromaticContact CZ-CD2 3.98Å; F217-W221 HydrophobicContact CZ-CD2 3.98Å; F217-W221 AromaticContact CZ-CE3 3.8Å; F217-W221 HydrophobicContact CZ-CE3 3.8Å; F217-W221 HydrophobicContact CZ-CG 4.19Å; F217-W221 HydrophobicContact CZ-CZ3 4.48Å; F217-W221 WeakPolarHBondContact O-CB 3.35Å; F217-W221 PolarHBondContact O-N 3.12Å; F217-F226 AromaticContact CD2-CD2 3.84Å; F217-F226 HydrophobicContact CD2-CD2 3.84Å; F217-F226 AromaticContact CD2-CE2 3.74Å; F217-F226 HydrophobicContact CD2-CE2 3.74Å; F217-F226 HydrophobicContact CD2-CG 4.37Å; F217-F226 HydrophobicContact CD2-CZ 4.19Å; F217-F226 HydrophobicContact CE2-CD1 4.23Å; F217-F226 HydrophobicContact CE2-CD2 4.1Å; F217-F226 HydrophobicContact CE2-CE1 4.22Å; F217-F226 HydrophobicContact CE2-CE2 4.09Å; F217-F226 HydrophobicContact CE2-CG 4.19Å; F217-F226 HydrophobicContact CE2-CZ 4.16Å; F217-K318 HydrophobicContact CE1-CG 3.98Å; F217-K318 HydrophobicContact CZ-CG 4Å; F217-A321 HydrophobicContact CE2-CB 3.78Å; F217-A321 HydrophobicContact CZ-CB 3.94Å; F217-F322 HydrophobicContact CB-CD2 4.02Å; F217-F322 HydrophobicContact CB-CE2 4.28Å; F217-F322 HydrophobicContact CD1-CB 4.22Å; F217-F322 AromaticContact CD1-CD2 3.43Å; F217-F322 HydrophobicContact CD1-CD2 3.43Å; F217-F322 VanDerWaalsContact CD1-CD2 3.43Å; F217-F322 HydrophobicContact CD1-CE2 4.2Å; F217-F322 HydrophobicContact CD1-CG 4.17Å; F217-F322 HydrophobicContact CD2-CD2 4.28Å; F217-F322 HydrophobicContact CE1-CB 3.78Å; F217-F322 AromaticContact CE1-CD2 3.9Å; F217-F322 HydrophobicContact CE1-CD2 3.9Å; F217-F322 HydrophobicContact CE1-CG 4.18Å; F217-F322 HydrophobicContact CE2-CB 4.31Å; F217-F322 AromaticContact CG-CD2 3.64Å; F217-F322 HydrophobicContact CG-CD2 3.64Å; F217-F322 HydrophobicContact CG-CE2 4.35Å; F217-F322 HydrophobicContact CZ-CB 3.83Å; F217-F322 HydrophobicContact CZ-CD2 4.5Å; F217-A325 HydrophobicContact CB-CB 4.23Å; F217-A325 HydrophobicContact CD2-CB 3.67Å; F217-A325 HydrophobicContact CE2-CB 4.43Å; F217-A325 HydrophobicContact CG-CB 4.23Å
218	E	95.8	Very high	93.9	Very high	58 Å²	58	66.3 Å²	66.3	27%	0.271	35%	0.35	S	S	.	.	H	α-helix	trans	-57.6	-43	179.7	-70.7	-66.1	171.3	0	0	111	Q214 K220 W221 E222 K318	Q214-E218 WeakPolarHBondContact O-CG 3.09Å; Q214-E218 PolarHBondContact O-N 3.5Å; E218-K220 PolarHBondContact O-N 2.72Å; E218-W221 PolarHBondContact O-N 3.27Å; E218-E222 WeakPolarHBondContact O-CB 3.35Å; E218-E222 WeakPolarHBondContact O-CG 3.41Å; E218-E222 PolarHBondContact O-N 3.26Å; E218-K318 VanDerWaalsContact OE1-CE 3.28Å; E218-K318 WeakPolarHBondContact OE1-CE 3.26Å; E218-K318 IonicContact OE1-NZ 4Å; E218-K318 PolarHBondContact OE1-NZ 3.42Å; E218-K318 WeakPolarHBondContact OE2-CE 3.29Å; E218-K318 IonicContact OE2-NZ 3.81Å; E218-K318 PolarHBondContact OE2-NZ 3.4Å
219	K	95	Very high	93.6	Very high	143 Å²	143	60.3 Å²	60.3	62%	0.622	32%	0.321	S	S	*	.	H	α-helix	trans	-60.5	-46.1	174.9	-176.1	-178	178.3	-176.2	0	112.6	A215 E216 F217 N223	A215-K219 WeakPolarHBondContact O-CB 3.25Å; A215-K219 PolarHBondContact O-N 3.18Å; E216-K219 PolarHBondContact O-N 2.92Å; F217-K219 VanDerWaalsContact C-N 3.27Å; F217-K219 PolarHBondContact O-N 2.91Å; K219-N223 WeakPolarHBondContact O-CB 3.41Å; K219-N223 VanDerWaalsContact O-CG 3.3Å; K219-N223 PolarHBondContact O-N 3.35Å; K219-N223 PolarHBondContact O-ND2 3.38Å
220	K	94.2	Very high	92.6	Very high	78 Å²	78	64.9 Å²	64.9	34%	0.339	35%	0.352	S	S	.	.	H	α-helix	trans	-68.3	-36.3	178.3	-72.1	169.4	-175.8	160.8	0	111.2	E216 F217 E218 G224 T225 F226	E216-K220 WeakPolarHBondContact O-CG 3.32Å; E216-K220 PolarHBondContact O-N 3Å; E216-K220 IonicContact OE2-NZ 3.59Å; E216-K220 PolarHBondContact OE2-NZ 3.06Å; F217-K220 PolarHBondContact O-N 3.46Å; F217-K220 VanDerWaalsContact O-N 3.1Å; E218-K220 PolarHBondContact O-N 2.72Å; K220-G224 PolarHBondContact O-N 3.41Å; K220-T225 PolarHBondContact O-N 3.17Å; K220-T225 PolarHBondContact O-OG1 3.42Å; K220-F226 HydrophobicContact CB-CB 4.24Å; K220-F226 HydrophobicContact CB-CD2 4.2Å; K220-F226 HydrophobicContact CD-CD2 4.46Å; K220-F226 PolarHBondContact O-N 3.2Å
221	W	93.5	Very high	91.3	Very high	67 Å²	67	67.4 Å²	67.4	25%	0.254	36%	0.363	S	S	.	.	H	α-helix	trans	-68.9	-49.4	-179.2	-173	-100.7	0	0	0	112.2	F217 E218 N223 G224 F226 W229 K318 A321	F217-W221 HydrophobicContact CE1-CB 4.38Å; F217-W221 HydrophobicContact CE1-CG 4.44Å; F217-W221 HydrophobicContact CE2-CB 4.46Å; F217-W221 HydrophobicContact CE2-CD2 4.47Å; F217-W221 AromaticContact CE2-CE3 3.94Å; F217-W221 HydrophobicContact CE2-CE3 3.94Å; F217-W221 HydrophobicContact CZ-CB 4.26Å; F217-W221 AromaticContact CZ-CD2 3.98Å; F217-W221 HydrophobicContact CZ-CD2 3.98Å; F217-W221 AromaticContact CZ-CE3 3.8Å; F217-W221 HydrophobicContact CZ-CE3 3.8Å; F217-W221 HydrophobicContact CZ-CG 4.19Å; F217-W221 HydrophobicContact CZ-CZ3 4.48Å; F217-W221 WeakPolarHBondContact O-CB 3.35Å; F217-W221 PolarHBondContact O-N 3.12Å; E218-W221 PolarHBondContact O-N 3.27Å; W221-N223 VanDerWaalsContact C-N 3.31Å; W221-N223 PolarHBondContact O-N 2.92Å; W221-G224 PolarHBondContact O-N 3.02Å; W221-F226 HydrophobicContact CE3-CB 4.3Å; W221-F226 HydrophobicContact CE3-CD1 4.42Å; W221-W229 HydrophobicContact CZ3-CB 3.95Å; W221-W229 HydrophobicContact CZ3-CD2 4.33Å; W221-W229 HydrophobicContact CZ3-CG 4Å; W221-K318 HydrophobicContact CD2-CG 4.23Å; W221-K318 HydrophobicContact CH2-CB 4.23Å; W221-K318 HydrophobicContact CZ2-CB 3.65Å; W221-K318 HydrophobicContact CZ2-CG 3.95Å; W221-A321 HydrophobicContact CE3-CB 3.98Å; W221-A321 HydrophobicContact CH2-CB 4.06Å; W221-A321 HydrophobicContact CZ3-CB 3.37Å
222	E	90.6	Very high	89.6	Confident	139 Å²	139	72.9 Å²	72.9	65%	0.65	38%	0.378	S	S	*	.	H	α-helix	trans	-60.5	-41.1	176.6	-72.1	179	170	0	0	111.8	E218 G224 K231	E218-E222 WeakPolarHBondContact O-CB 3.35Å; E218-E222 WeakPolarHBondContact O-CG 3.41Å; E218-E222 PolarHBondContact O-N 3.26Å; E222-G224 PolarHBondContact O-N 2.94Å; E222-K231 PolarHBondContact O-NZ 3.09Å
223	N	90.3	Very high	87.4	Confident	95 Å²	95	74.4 Å²	74.4	51%	0.508	40%	0.396	S	S	.	.	H	α-helix	trans	-71.7	-17.6	175.7	-69.8	-40.1	0	0	0	112.8	K219 W221 T225 K231	K219-N223 WeakPolarHBondContact O-CB 3.41Å; K219-N223 VanDerWaalsContact O-CG 3.3Å; K219-N223 PolarHBondContact O-N 3.35Å; K219-N223 PolarHBondContact O-ND2 3.38Å; W221-N223 VanDerWaalsContact C-N 3.31Å; W221-N223 PolarHBondContact O-N 2.92Å; N223-T225 VanDerWaalsContact C-N 3.29Å; N223-T225 HydrophobicContact CB-CG2 4.05Å; N223-K231 PolarHBondContact O-NZ 3.18Å
224	G	88.5	Confident	84.8	Confident	22 Å²	22	79.8 Å²	79.8	23%	0.227	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	27.9	-177.1	0	0	0	0	0	113.2	K220 W221 E222 K231	K220-G224 PolarHBondContact O-N 3.41Å; W221-G224 PolarHBondContact O-N 3.02Å; E222-G224 PolarHBondContact O-N 2.94Å; G224-K231 VanDerWaalsContact CA-CE 3.47Å
225	T	92.1	Very high	82.1	Confident	92 Å²	92	79.7 Å²	79.7	56%	0.564	44%	0.443	S	S	*	.			trans	-107	11	-179.2	60.5	0	0	0	0	111.6	K220 N223	K220-T225 PolarHBondContact O-N 3.17Å; K220-T225 PolarHBondContact O-OG1 3.42Å; N223-T225 VanDerWaalsContact C-N 3.29Å; N223-T225 HydrophobicContact CB-CG2 4.05Å
226	F	92	Very high	79.5	Confident	10 Å²	10	81.4 Å²	81.4	4%	0.044	46%	0.458	C	S	.	.			trans	-73.2	125.5	177.7	-170.8	-103.7	0	0	0	110.2	F217 K220 W221 W229 A321 E324 A325 Y328	F217-F226 AromaticContact CD2-CD2 3.84Å; F217-F226 HydrophobicContact CD2-CD2 3.84Å; F217-F226 AromaticContact CD2-CE2 3.74Å; F217-F226 HydrophobicContact CD2-CE2 3.74Å; F217-F226 HydrophobicContact CD2-CG 4.37Å; F217-F226 HydrophobicContact CD2-CZ 4.19Å; F217-F226 HydrophobicContact CE2-CD1 4.23Å; F217-F226 HydrophobicContact CE2-CD2 4.1Å; F217-F226 HydrophobicContact CE2-CE1 4.22Å; F217-F226 HydrophobicContact CE2-CE2 4.09Å; F217-F226 HydrophobicContact CE2-CG 4.19Å; F217-F226 HydrophobicContact CE2-CZ 4.16Å; K220-F226 HydrophobicContact CB-CB 4.24Å; K220-F226 HydrophobicContact CB-CD2 4.2Å; K220-F226 HydrophobicContact CD-CD2 4.46Å; K220-F226 PolarHBondContact O-N 3.2Å; W221-F226 HydrophobicContact CE3-CB 4.3Å; W221-F226 HydrophobicContact CE3-CD1 4.42Å; F226-W229 HydrophobicContact CD1-CB 4.27Å; F226-W229 AromaticContact CD1-CD1 3.44Å; F226-W229 VanDerWaalsContact CD1-CD1 3.44Å; F226-W229 HydrophobicContact CD1-CG 4.12Å; F226-W229 AromaticContact CE1-CD1 3.59Å; F226-W229 PolarHBondContact O-N 3.13Å; F226-A321 HydrophobicContact CD1-CB 3.93Å; F226-A321 HydrophobicContact CE1-CB 3.71Å; F226-A321 WeakPolarHBondContact CE1-O 3.44Å; F226-A321 WeakPolarHBondContact CZ-O 3.49Å; F226-E324 HydrophobicContact CE1-CB 4.43Å; F226-E324 HydrophobicContact CZ-CB 4.29Å; F226-A325 HydrophobicContact CE2-CB 3.64Å; F226-A325 HydrophobicContact CZ-CB 3.73Å; F226-Y328 HydrophobicContact CZ-CD2 4.42Å; F226-Y328 AromaticContact CZ-CE2 4Å; F226-Y328 HydrophobicContact CZ-CE2 4Å
227	P	90.7	Very high	77	Confident	59 Å²	59	85.5 Å²	85.5	38%	0.383	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	142.7	-177.1	-26.7	35.4	0	0	0	113	F171 W229	F171-P227 HydrophobicContact CB-CB 3.76Å; F171-P227 HydrophobicContact CG-CB 4.46Å; P227-W229 PolarHBondContact O-N 3.35Å
228	G	87.4	Confident	74.8	Confident	27 Å²	27	90.6 Å²	90.6	28%	0.278	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	-2	179.4	0	0	0	0	0	115.9
229	W	89	Confident	72.7	Confident	19 Å²	19	95.6 Å²	95.6	7%	0.072	54%	0.536	C	S	.	.			trans	-131.8	69.4	-177.4	-65.4	91.2	0	0	0	112.6	K175 K178 W221 F226 P227 N317 I320 A321 E324	K175-W229 HydrophobicContact CD-CZ3 4.36Å; K175-W229 HydrophobicContact CG-CZ3 4.12Å; K178-W229 HydrophobicContact CB-CH2 4.47Å; K178-W229 HydrophobicContact CD-CH2 3.89Å; K178-W229 HydrophobicContact CD-CZ2 3.42Å; K178-W229 VanDerWaalsContact CD-CZ2 3.42Å; W221-W229 HydrophobicContact CZ3-CB 3.95Å; W221-W229 HydrophobicContact CZ3-CD2 4.33Å; W221-W229 HydrophobicContact CZ3-CG 4Å; F226-W229 HydrophobicContact CD1-CB 4.27Å; F226-W229 AromaticContact CD1-CD1 3.44Å; F226-W229 VanDerWaalsContact CD1-CD1 3.44Å; F226-W229 HydrophobicContact CD1-CG 4.12Å; F226-W229 AromaticContact CE1-CD1 3.59Å; F226-W229 PolarHBondContact O-N 3.13Å; P227-W229 PolarHBondContact O-N 3.35Å; W229-N317 HydrophobicContact CE3-CB 4.11Å; W229-N317 HydrophobicContact CH2-CB 3.79Å; W229-N317 HydrophobicContact CZ3-CB 3.4Å; W229-N317 VanDerWaalsContact CZ3-CB 3.4Å; W229-N317 VanDerWaalsContact CZ3-CG 3.44Å; W229-I320 HydrophobicContact CH2-CB 4.39Å; W229-I320 HydrophobicContact CH2-CG2 4.43Å; W229-I320 HydrophobicContact CZ2-CB 3.98Å; W229-I320 HydrophobicContact CZ2-CG2 3.77Å; W229-A321 HydrophobicContact CD2-CB 4.16Å; W229-A321 HydrophobicContact CG-CB 4.12Å; W229-A321 HydrophobicContact CZ2-CB 4.31Å; W229-E324 PolarHBondContact NE1-OE2 2.76Å
230	P	73.4	Confident	70.7	Confident	112 Å²	112	93.3 Å²	93.3	73%	0.727	54%	0.544	S	S	*	.			trans	-64.6	143	-178.4	27.5	-34.3	0	0	0	112	E232	P230-E232 PolarHBondContact O-N 3.34Å
231	K	69.1	Low	69.1	Low	128 Å²	128	90.7 Å²	90.7	56%	0.557	54%	0.538	S	S	*	.			trans	-59.1	123.4	170.8	-89.8	176.4	173.3	165.5	0	109.5	E222 N223 G224 T233	E222-K231 PolarHBondContact O-NZ 3.09Å; N223-K231 PolarHBondContact O-NZ 3.18Å; G224-K231 VanDerWaalsContact CA-CE 3.47Å; K231-T233 PolarHBondContact O-N 2.85Å
232	E	60.5	Low	68.2	Low	150 Å²	150	89.3 Å²	89.3	70%	0.701	54%	0.542	S	S	*	.			trans	-61.8	101.1	172.3	-72.9	-179.4	-172.7	0	0	109	K175 P230 S234	K175-E232 IonicContact NZ-OE1 3.61Å; K175-E232 PolarHBondContact NZ-OE1 3.37Å; P230-E232 PolarHBondContact O-N 3.34Å; E232-S234 PolarHBondContact O-N 2.84Å
233	T	49	Very low	67.7	Low	135 Å²	135	89.3 Å²	89.3	83%	0.828	54%	0.541	S	S	*	.			trans	-63.2	99.9	165.8	45.2	0	0	0	0	107.4	K231 S235	K231-T233 PolarHBondContact O-N 2.85Å; T233-S235 PolarHBondContact O-N 3.4Å
234	S	43.1	Very low	67.3	Low	117 Å²	117	85.9 Å²	85.9	82%	0.818	52%	0.523	S	S	*	.			trans	-55.1	109.7	174.2	-75.7	0	0	0	0	108.9	E232 A236	E232-S234 PolarHBondContact O-N 2.84Å; S234-A236 PolarHBondContact O-N 3.26Å; S234-A236 VanDerWaalsContact O-N 3.12Å
235	S	40.4	Very low	67.1	Low	86 Å²	86	89.6 Å²	89.6	60%	0.601	54%	0.537	S	S	*	.			trans	-56.8	116.9	177.3	-179.3	0	0	0	0	109.4	T233 L237	T233-S235 PolarHBondContact O-N 3.4Å; S235-L237 PolarHBondContact O-N 2.87Å
236	A	42.2	Very low	66.8	Low	102 Å²	102	86 Å²	86	84%	0.843	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	3.3	-178.5	0	0	0	0	0	114.5	S234	S234-A236 PolarHBondContact O-N 3.26Å; S234-A236 VanDerWaalsContact O-N 3.12Å
237	L	44.2	Very low	66.3	Low	152 Å²	152	89.2 Å²	89.2	80%	0.796	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-9	-164.6	-142.7	73.4	0	0	0	115.6	S235	S235-L237 PolarHBondContact O-N 2.87Å
238	T	50	Low	65.9	Low	111 Å²	111	90.1 Å²	90.1	68%	0.681	55%	0.551	S	S	*	*	S	Bend	trans	-93.4	-2	-169.9	49.4	0	0	0	0	115.8
239	H	50.8	Low	65.8	Low	164 Å²	164	90.5 Å²	90.5	76%	0.759	55%	0.545	S	S	*	.			trans	-125.2	7.4	-171.3	-70.7	-64.6	0	0	0	116.7	G241	H239-G241 PolarHBondContact O-N 3.46Å
240	A	53.5	Low	65.6	Low	95 Å²	95	93.9 Å²	93.9	79%	0.785	57%	0.571	S	S	*	*			trans	-80.3	75.6	-174.9	0	0	0	0	0	113.5
241	G	60.8	Low	66.3	Low	22 Å²	22	90 Å²	90	23%	0.227	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-73.9	146.7	157.6	0	0	0	0	0	110.7	H239 S265	H239-G241 PolarHBondContact O-N 3.46Å; G241-S265 VanDerWaalsContact CA-O 3.26Å; G241-S265 WeakPolarHBondContact CA-O 3.22Å
242	A	75.5	Confident	67.3	Low	39 Å²	39	87 Å²	87	32%	0.322	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-96.9	124.7	175.4	0	0	0	0	0	110.5	L244 S265 A266	A242-L244 PolarHBondContact O-N 3.46Å; A242-S265 PolarHBondContact N-O 3.08Å; A242-S265 PolarHBondContact N-OG 3.4Å; A242-A266 WeakPolarHBondContact O-CA 3.5Å
243	H	78.7	Confident	68.7	Low	139 Å²	139	84.4 Å²	84.4	64%	0.644	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-60	136.1	176.2	-168.1	-83.5	0	0	0	110.8
244	L	82.2	Confident	70.6	Confident	23 Å²	23	81.7 Å²	81.7	12%	0.12	50%	0.498	C	S	.	.			trans	-116.2	121.7	175.7	-178.1	72.9	0	0	0	108.2	A242 L246 L255 L258 A266 L285	A242-L244 PolarHBondContact O-N 3.46Å; L244-L246 HydrophobicContact CD2-CD2 3.96Å; L244-L246 HydrophobicContact CG-CD2 4.27Å; L244-L246 PolarHBondContact O-N 2.98Å; L244-L255 HydrophobicContact CD2-CD2 3.77Å; L244-L258 HydrophobicContact CD1-CD1 4.13Å; L244-L258 HydrophobicContact CD2-CD1 3.59Å; L244-L258 HydrophobicContact CG-CD1 4.5Å; L244-A266 HydrophobicContact CB-CB 3.68Å; L244-A266 HydrophobicContact CD2-CB 4.31Å; L244-L285 HydrophobicContact CD2-CD2 3.78Å
245	D	84.5	Confident	72.6	Confident	99 Å²	99	76.1 Å²	76.1	53%	0.529	46%	0.459	S	S	.	.			trans	-72.1	117.8	172.5	-178.1	13.7	0	0	0	109.9	S247 F249	D245-S247 VanDerWaalsContact OD1-CB 3.23Å; D245-S247 WeakPolarHBondContact OD1-CB 3.37Å; D245-S247 PolarHBondContact OD1-N 3.31Å; D245-S247 PolarHBondContact OD1-OG 2.8Å; D245-S247 VanDerWaalsContact OD1-OG 3.12Å; D245-S247 PolarHBondContact OD2-OG 3.26Å; D245-F249 WeakPolarHBondContact O-CE2 3.44Å
246	L	85	Confident	74.9	Confident	16 Å²	16	72.9 Å²	72.9	8%	0.084	44%	0.437	C	S	.	.			trans	-86.1	-9.3	-178.8	-55.7	178.5	0	0	0	112.4	L244 A248 F249 L255 L285 K289	L244-L246 HydrophobicContact CD2-CD2 3.96Å; L244-L246 HydrophobicContact CG-CD2 4.27Å; L244-L246 PolarHBondContact O-N 2.98Å; L246-A248 PolarHBondContact O-N 2.87Å; L246-F249 PolarHBondContact O-N 2.95Å; L246-L255 HydrophobicContact CD2-CD1 3.96Å; L246-L255 HydrophobicContact CD2-CD2 3.87Å; L246-L285 HydrophobicContact CD1-CG 4.35Å; L246-L285 WeakPolarHBondContact CD1-O 3.43Å; L246-L285 HydrophobicContact CD2-CD1 4.5Å; L246-L285 HydrophobicContact CD2-CD2 4.03Å; L246-L285 HydrophobicContact CD2-CG 3.85Å; L246-K289 HydrophobicContact CB-CB 4.06Å; L246-K289 HydrophobicContact CB-CD 4.17Å; L246-K289 HydrophobicContact CB-CG 3.89Å; L246-K289 HydrophobicContact CD1-CB 4.03Å; L246-K289 WeakPolarHBondContact O-CD 3.31Å; L246-K289 WeakPolarHBondContact O-CE 3.49Å; L246-K289 PolarHBondContact O-NZ 3.3Å
247	S	82.7	Confident	77	Confident	78 Å²	78	72.7 Å²	72.7	55%	0.545	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-39.4	-176.6	74.7	0	0	0	0	112.4	D245 F249 K289	D245-S247 VanDerWaalsContact OD1-CB 3.23Å; D245-S247 WeakPolarHBondContact OD1-CB 3.37Å; D245-S247 PolarHBondContact OD1-N 3.31Å; D245-S247 PolarHBondContact OD1-OG 2.8Å; D245-S247 VanDerWaalsContact OD1-OG 3.12Å; D245-S247 PolarHBondContact OD2-OG 3.26Å; S247-F249 VanDerWaalsContact C-N 3.32Å; S247-F249 PolarHBondContact O-N 2.9Å; S247-K289 PolarHBondContact O-NZ 2.6Å
248	A	81.2	Confident	79	Confident	78 Å²	78	68.4 Å²	68.4	65%	0.645	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-13.8	-176.6	0	0	0	0	0	115.4	L246	L246-A248 PolarHBondContact O-N 2.87Å
249	F	86.5	Confident	80.7	Confident	36 Å²	36	64.3 Å²	64.3	16%	0.158	39%	0.387	C	S	.	.			trans	-102.8	122.5	-173.1	-61.3	-86.9	0	0	0	111.5	D245 L246 S247 E254 L255 L258 K289	D245-F249 WeakPolarHBondContact O-CE2 3.44Å; L246-F249 PolarHBondContact O-N 2.95Å; S247-F249 VanDerWaalsContact C-N 3.32Å; S247-F249 PolarHBondContact O-N 2.9Å; F249-E254 VanDerWaalsContact CA-OE2 3.28Å; F249-E254 WeakPolarHBondContact CA-OE2 3.37Å; F249-E254 HydrophobicContact CD1-CB 3.89Å; F249-L255 HydrophobicContact CB-CD2 4.04Å; F249-L255 HydrophobicContact CB-CG 3.98Å; F249-L255 HydrophobicContact CD1-CD2 3.74Å; F249-L255 HydrophobicContact CD1-CG 4.13Å; F249-L255 HydrophobicContact CD2-CD2 3.51Å; F249-L255 HydrophobicContact CD2-CG 4.39Å; F249-L255 HydrophobicContact CE1-CD2 4.06Å; F249-L255 HydrophobicContact CE2-CD2 3.85Å; F249-L255 HydrophobicContact CG-CD2 3.46Å; F249-L255 VanDerWaalsContact CG-CD2 3.46Å; F249-L255 HydrophobicContact CG-CG 3.9Å; F249-L255 HydrophobicContact CZ-CD2 4.12Å; F249-L258 HydrophobicContact CE1-CD1 3.92Å; F249-L258 HydrophobicContact CE1-CD2 4.12Å; F249-L258 HydrophobicContact CE1-CG 4.1Å; F249-L258 HydrophobicContact CE2-CD1 4.37Å; F249-L258 HydrophobicContact CZ-CD1 3.66Å; F249-L258 HydrophobicContact CZ-CD2 4.07Å; F249-L258 HydrophobicContact CZ-CG 4.21Å; F249-K289 PolarHBondContact O-NZ 2.65Å
250	S	84.8	Confident	82.3	Confident	89 Å²	89	60 Å²	60	62%	0.622	37%	0.369	S	S	*	.	S	Bend	trans	-83.8	-20.8	-176.8	77.7	0	0	0	0	113.5	E254	S250-E254 PolarHBondContact N-OE2 2.95Å; S250-E254 VanDerWaalsContact OG-CD 3.29Å; S250-E254 PolarHBondContact OG-OE1 2.76Å
251	S	88.4	Confident	83.8	Confident	32 Å²	32	61.6 Å²	61.6	22%	0.224	36%	0.364	C	S	.	.	S	Bend	trans	-148.5	166.5	179.8	88.9	0	0	0	0	112.3	E253 E254	S251-E253 VanDerWaalsContact C-N 3.27Å; S251-E253 WeakPolarHBondContact CB-OE2 3.11Å; S251-E253 PolarHBondContact O-N 3.36Å; S251-E253 PolarHBondContact OG-N 2.98Å; S251-E253 PolarHBondContact OG-OE2 2.71Å; S251-E254 PolarHBondContact O-N 3.33Å; S251-E254 PolarHBondContact OG-N 3.31Å
252	W	89.5	Confident	85	Confident	64 Å²	64	65.7 Å²	65.7	24%	0.242	37%	0.373	C	S	.	.	H	α-helix	trans	-71.4	-25.4	176.9	67.4	-89	0	0	0	111.7	E254 L255 A256 E279 A282 Q283 F286	W252-E254 VanDerWaalsContact C-N 3.31Å; W252-E254 PolarHBondContact O-N 3.06Å; W252-L255 WeakPolarHBondContact O-CB 3.31Å; W252-L255 PolarHBondContact O-N 3.42Å; W252-A256 HydrophobicContact CE3-CB 4.48Å; W252-A256 WeakPolarHBondContact O-CB 3.34Å; W252-A256 PolarHBondContact O-N 3.47Å; W252-E279 HydrophobicContact CH2-CB 4.32Å; W252-E279 HydrophobicContact CH2-CG 4.28Å; W252-E279 HydrophobicContact CZ3-CB 3.8Å; W252-E279 HydrophobicContact CZ3-CG 3.88Å; W252-A282 HydrophobicContact CE3-CB 4.25Å; W252-Q283 HydrophobicContact CB-CG 4.16Å; W252-Q283 HydrophobicContact CD2-CG 3.64Å; W252-Q283 HydrophobicContact CE3-CG 3.97Å; W252-Q283 HydrophobicContact CG-CG 3.71Å; W252-F286 HydrophobicContact CB-CB 3.83Å; W252-F286 HydrophobicContact CB-CD1 4.3Å; W252-F286 HydrophobicContact CB-CG 3.99Å
253	E	89.8	Confident	85.5	Confident	96 Å²	96	63.9 Å²	63.9	45%	0.449	36%	0.358	S	S	.	.	H	α-helix	trans	-62.7	-36.8	173.8	-60.5	84.3	168.4	0	0	111.4	S251 A256 S257	S251-E253 VanDerWaalsContact C-N 3.27Å; S251-E253 WeakPolarHBondContact CB-OE2 3.11Å; S251-E253 PolarHBondContact O-N 3.36Å; S251-E253 PolarHBondContact OG-N 2.98Å; S251-E253 PolarHBondContact OG-OE2 2.71Å; E253-A256 WeakPolarHBondContact O-CB 3.32Å; E253-A256 PolarHBondContact O-N 3.14Å; E253-S257 PolarHBondContact O-N 2.84Å
254	E	87.9	Confident	85.9	Confident	78 Å²	78	61.8 Å²	61.8	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-67	-39.1	172.5	-66.8	-180	-178.7	0	0	111.7	F249 S250 S251 W252 A256 S257	F249-E254 VanDerWaalsContact CA-OE2 3.28Å; F249-E254 WeakPolarHBondContact CA-OE2 3.37Å; F249-E254 HydrophobicContact CD1-CB 3.89Å; S250-E254 PolarHBondContact N-OE2 2.95Å; S250-E254 VanDerWaalsContact OG-CD 3.29Å; S250-E254 PolarHBondContact OG-OE1 2.76Å; S251-E254 PolarHBondContact O-N 3.33Å; S251-E254 PolarHBondContact OG-N 3.31Å; W252-E254 VanDerWaalsContact C-N 3.31Å; W252-E254 PolarHBondContact O-N 3.06Å; E254-A256 VanDerWaalsContact C-N 3.34Å; E254-A256 PolarHBondContact O-N 3.37Å; E254-S257 WeakPolarHBondContact O-CB 3.38Å; E254-S257 PolarHBondContact O-N 2.87Å; E254-S257 PolarHBondContact O-OG 3.37Å
255	L	87.1	Confident	86.1	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-36.1	174.5	-76.8	178	0	0	0	112.6	L244 L246 F249 W252 S257 L258 L263 A282 F286	L244-L255 HydrophobicContact CD2-CD2 3.77Å; L246-L255 HydrophobicContact CD2-CD1 3.96Å; L246-L255 HydrophobicContact CD2-CD2 3.87Å; F249-L255 HydrophobicContact CB-CD2 4.04Å; F249-L255 HydrophobicContact CB-CG 3.98Å; F249-L255 HydrophobicContact CD1-CD2 3.74Å; F249-L255 HydrophobicContact CD1-CG 4.13Å; F249-L255 HydrophobicContact CD2-CD2 3.51Å; F249-L255 HydrophobicContact CD2-CG 4.39Å; F249-L255 HydrophobicContact CE1-CD2 4.06Å; F249-L255 HydrophobicContact CE2-CD2 3.85Å; F249-L255 HydrophobicContact CG-CD2 3.46Å; F249-L255 VanDerWaalsContact CG-CD2 3.46Å; F249-L255 HydrophobicContact CG-CG 3.9Å; F249-L255 HydrophobicContact CZ-CD2 4.12Å; W252-L255 WeakPolarHBondContact O-CB 3.31Å; W252-L255 PolarHBondContact O-N 3.42Å; L255-S257 PolarHBondContact O-N 2.89Å; L255-L258 HydrophobicContact CD2-CD1 3.86Å; L255-L258 WeakPolarHBondContact O-CB 3.42Å; L255-L258 PolarHBondContact O-N 3.41Å; L255-L258 VanDerWaalsContact O-N 3.1Å; L255-L263 HydrophobicContact CB-CD2 4.25Å; L255-A282 HydrophobicContact CB-CB 4.23Å; L255-F286 HydrophobicContact CD1-CB 3.77Å; L255-F286 HydrophobicContact CD1-CD2 3.65Å; L255-F286 HydrophobicContact CD1-CG 4.2Å; L255-F286 HydrophobicContact CG-CD2 4.41Å
256	A	88.3	Confident	86.2	Confident	17 Å²	17	57.7 Å²	57.7	14%	0.14	33%	0.328	C	S	.	.	H	α-helix	trans	-57.8	-34.8	175.7	0	0	0	0	0	111.5	W252 E253 E254 L258 G259 L278 A282	W252-A256 HydrophobicContact CE3-CB 4.48Å; W252-A256 WeakPolarHBondContact O-CB 3.34Å; W252-A256 PolarHBondContact O-N 3.47Å; E253-A256 WeakPolarHBondContact O-CB 3.32Å; E253-A256 PolarHBondContact O-N 3.14Å; E254-A256 VanDerWaalsContact C-N 3.34Å; E254-A256 PolarHBondContact O-N 3.37Å; A256-L258 PolarHBondContact O-N 3.41Å; A256-L258 VanDerWaalsContact O-N 3.16Å; A256-G259 PolarHBondContact O-N 2.86Å; A256-G259 VanDerWaalsContact O-N 3.15Å; A256-L278 HydrophobicContact CB-CD2 3.4Å; A256-L278 VanDerWaalsContact CB-CD2 3.4Å; A256-L278 WeakPolarHBondContact O-CD2 3.45Å; A256-A282 HydrophobicContact CB-CB 3.99Å
257	S	86.3	Confident	86.3	Confident	98 Å²	98	56.9 Å²	56.9	69%	0.685	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.9	177.5	79.6	0	0	0	0	114.6	E253 E254 L255 G259	E253-S257 PolarHBondContact O-N 2.84Å; E254-S257 WeakPolarHBondContact O-CB 3.38Å; E254-S257 PolarHBondContact O-N 2.87Å; E254-S257 PolarHBondContact O-OG 3.37Å; L255-S257 PolarHBondContact O-N 2.89Å; S257-G259 PolarHBondContact O-N 2.99Å
258	L	85.9	Confident	86.4	Confident	63 Å²	63	57.6 Å²	57.6	33%	0.33	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-13	176.6	-61.6	175.9	0	0	0	113.7	L244 F249 L255 A256 R262	L244-L258 HydrophobicContact CD1-CD1 4.13Å; L244-L258 HydrophobicContact CD2-CD1 3.59Å; L244-L258 HydrophobicContact CG-CD1 4.5Å; F249-L258 HydrophobicContact CE1-CD1 3.92Å; F249-L258 HydrophobicContact CE1-CD2 4.12Å; F249-L258 HydrophobicContact CE1-CG 4.1Å; F249-L258 HydrophobicContact CE2-CD1 4.37Å; F249-L258 HydrophobicContact CZ-CD1 3.66Å; F249-L258 HydrophobicContact CZ-CD2 4.07Å; F249-L258 HydrophobicContact CZ-CG 4.21Å; L255-L258 HydrophobicContact CD2-CD1 3.86Å; L255-L258 WeakPolarHBondContact O-CB 3.42Å; L255-L258 PolarHBondContact O-N 3.41Å; L255-L258 VanDerWaalsContact O-N 3.1Å; A256-L258 PolarHBondContact O-N 3.41Å; A256-L258 VanDerWaalsContact O-N 3.16Å; L258-R262 HydrophobicContact CB-CB 4.09Å; L258-R262 HydrophobicContact CB-CG 4.15Å; L258-R262 HydrophobicContact CD1-CG 4.28Å
259	G	84.8	Confident	86.6	Confident	24 Å²	24	55.8 Å²	55.8	25%	0.247	31%	0.306	C	S	.	.			trans	83.2	166.9	179.5	0	0	0	0	0	114.6	A256 S257 D261 R262 L263	A256-G259 PolarHBondContact O-N 2.86Å; A256-G259 VanDerWaalsContact O-N 3.15Å; S257-G259 PolarHBondContact O-N 2.99Å; G259-D261 PolarHBondContact O-N 3.27Å; G259-R262 PolarHBondContact O-N 3.37Å; G259-L263 WeakPolarHBondContact O-CG 3.4Å; G259-L263 PolarHBondContact O-N 2.76Å
260	L	85.6	Confident	86.3	Confident	74 Å²	74	55.7 Å²	55.7	39%	0.387	31%	0.307	S	S	.	.	H	α-helix	trans	-68	-34.9	-167	-164	141.5	0	0	0	113.3	K264 L278	L260-K264 WeakPolarHBondContact O-CB 3.48Å; L260-K264 PolarHBondContact O-N 3.28Å; L260-L278 HydrophobicContact CB-CD1 4.3Å; L260-L278 HydrophobicContact CD1-CB 4.44Å
261	D	84.2	Confident	86.2	Confident	128 Å²	128	53.2 Å²	53.2	68%	0.684	30%	0.296	S	S	*	.	H	α-helix	trans	-70.7	-42.1	-179.3	-68	-52.5	0	0	0	112.4	G259 K264 S265	G259-D261 PolarHBondContact O-N 3.27Å; D261-K264 PolarHBondContact O-N 3.14Å; D261-S265 WeakPolarHBondContact O-CB 3.37Å; D261-S265 PolarHBondContact O-N 2.78Å
262	R	86.1	Confident	86	Confident	109 Å²	109	51.8 Å²	51.8	41%	0.411	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-42.9	179.1	-169.9	64.6	179.8	177.7	5.8	111.1	L258 G259 S265 A266	L258-R262 HydrophobicContact CB-CB 4.09Å; L258-R262 HydrophobicContact CB-CG 4.15Å; L258-R262 HydrophobicContact CD1-CG 4.28Å; G259-R262 PolarHBondContact O-N 3.37Å; R262-S265 PolarHBondContact O-N 3.46Å; R262-A266 WeakPolarHBondContact O-CB 3.31Å; R262-A266 PolarHBondContact O-N 3.2Å
263	L	86.7	Confident	85.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-41.5	174.9	-66.9	174.6	0	0	0	111.9	L255 G259 A266 L267 L278 R281 A282 L285	L255-L263 HydrophobicContact CB-CD2 4.25Å; G259-L263 WeakPolarHBondContact O-CG 3.4Å; G259-L263 PolarHBondContact O-N 2.76Å; L263-A266 PolarHBondContact O-N 3.23Å; L263-L267 WeakPolarHBondContact O-CB 3.37Å; L263-L267 VanDerWaalsContact O-CG 3.26Å; L263-L267 WeakPolarHBondContact O-CG 3.49Å; L263-L267 PolarHBondContact O-N 3.32Å; L263-L278 HydrophobicContact CD1-CG 4.25Å; L263-R281 HydrophobicContact CB-CB 4.22Å; L263-R281 HydrophobicContact CD1-CB 4.22Å; L263-A282 HydrophobicContact CD1-CB 3.87Å; L263-A282 HydrophobicContact CD2-CB 4.4Å; L263-L285 HydrophobicContact CD2-CD2 3.61Å
264	K	86.3	Confident	85.4	Confident	96 Å²	96	50 Å²	50	42%	0.417	28%	0.281	S	S	.	.	H	α-helix	trans	-60.7	-47.1	175.2	-175.2	-177.8	175.3	-173.1	0	111.3	L260 D261 A266 L267 L268 C274	L260-K264 WeakPolarHBondContact O-CB 3.48Å; L260-K264 PolarHBondContact O-N 3.28Å; D261-K264 PolarHBondContact O-N 3.14Å; K264-A266 PolarHBondContact O-N 2.93Å; K264-L267 PolarHBondContact O-N 3.03Å; K264-L268 HydrophobicContact CG-CD1 4.18Å; K264-L268 WeakPolarHBondContact O-CB 3.38Å; K264-L268 VanDerWaalsContact O-CG 3.29Å; K264-L268 WeakPolarHBondContact O-CG 3.32Å; K264-L268 PolarHBondContact O-N 2.96Å; K264-C274 HydrophobicContact CG-CB 4.26Å
265	S	86.1	Confident	85.2	Confident	34 Å²	34	48.4 Å²	48.4	24%	0.238	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-42.8	179.5	-169.3	0	0	0	0	112	G241 A242 D261 R262 L268 A269	G241-S265 VanDerWaalsContact CA-O 3.26Å; G241-S265 WeakPolarHBondContact CA-O 3.22Å; A242-S265 PolarHBondContact N-O 3.08Å; A242-S265 PolarHBondContact N-OG 3.4Å; D261-S265 WeakPolarHBondContact O-CB 3.37Å; D261-S265 PolarHBondContact O-N 2.78Å; R262-S265 PolarHBondContact O-N 3.46Å; S265-L268 PolarHBondContact O-N 3.46Å; S265-A269 PolarHBondContact O-N 3.04Å
266	A	86.3	Confident	85	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-68.1	-40.2	177.5	0	0	0	0	0	113.1	A242 L244 R262 L263 K264 A269 L270 L285	A242-A266 WeakPolarHBondContact O-CA 3.5Å; L244-A266 HydrophobicContact CB-CB 3.68Å; L244-A266 HydrophobicContact CD2-CB 4.31Å; R262-A266 WeakPolarHBondContact O-CB 3.31Å; R262-A266 PolarHBondContact O-N 3.2Å; L263-A266 PolarHBondContact O-N 3.23Å; K264-A266 PolarHBondContact O-N 2.93Å; A266-A269 WeakPolarHBondContact O-CB 3.3Å; A266-A269 PolarHBondContact O-N 2.7Å; A266-L270 PolarHBondContact O-N 2.61Å; A266-L285 HydrophobicContact CB-CD1 3.95Å; A266-L285 HydrophobicContact CB-CD2 3.61Å; A266-L285 HydrophobicContact CB-CG 4.46Å
267	L	88.1	Confident	85	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.1	-40.7	174.4	-73.5	169.5	0	0	0	111.8	L263 K264 A269 L270 G271 L272 R281 R284 L285	L263-L267 WeakPolarHBondContact O-CB 3.37Å; L263-L267 VanDerWaalsContact O-CG 3.26Å; L263-L267 WeakPolarHBondContact O-CG 3.49Å; L263-L267 PolarHBondContact O-N 3.32Å; K264-L267 PolarHBondContact O-N 3.03Å; L267-A269 VanDerWaalsContact C-N 3.33Å; L267-L270 CarbonylContact O-C 3.59Å; L267-L270 PolarHBondContact O-N 2.63Å; L267-G271 PolarHBondContact O-N 3.23Å; L267-L272 HydrophobicContact CB-CB 4.37Å; L267-L272 HydrophobicContact CD2-CB 3.8Å; L267-L272 HydrophobicContact CD2-CD1 3.83Å; L267-L272 HydrophobicContact CD2-CG 4.48Å; L267-L272 PolarHBondContact O-N 2.97Å; L267-R281 HydrophobicContact CD1-CB 3.82Å; L267-R281 HydrophobicContact CD1-CG 3.96Å; L267-R284 HydrophobicContact CD2-CB 4.33Å; L267-R284 HydrophobicContact CD2-CG 4.04Å; L267-L285 HydrophobicContact CD2-CB 4.01Å; L267-L285 HydrophobicContact CD2-CD1 4.1Å; L267-L285 HydrophobicContact CG-CB 4.39Å; L267-L285 HydrophobicContact CG-CD1 4.39Å
268	L	85	Confident	85.1	Confident	93 Å²	93	51 Å²	51	49%	0.487	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-40.1	173.9	-74.9	173.7	0	0	0	111.6	K264 S265 L270 G271 C274	K264-L268 HydrophobicContact CG-CD1 4.18Å; K264-L268 WeakPolarHBondContact O-CB 3.38Å; K264-L268 VanDerWaalsContact O-CG 3.29Å; K264-L268 WeakPolarHBondContact O-CG 3.32Å; K264-L268 PolarHBondContact O-N 2.96Å; S265-L268 PolarHBondContact O-N 3.46Å; L268-L270 PolarHBondContact O-N 3.14Å; L268-G271 PolarHBondContact O-N 3.26Å; L268-G271 VanDerWaalsContact O-N 3.07Å; L268-C274 VanDerWaalsContact CG-SG 3.58Å
269	A	84	Confident	85.3	Confident	40 Å²	40	53.4 Å²	53.4	33%	0.331	31%	0.31	S	S	.	.	H	α-helix	trans	-60.3	-29.9	177.4	0	0	0	0	0	112.5	S265 A266 L267	S265-A269 PolarHBondContact O-N 3.04Å; A266-A269 WeakPolarHBondContact O-CB 3.3Å; A266-A269 PolarHBondContact O-N 2.7Å; L267-A269 VanDerWaalsContact C-N 3.33Å
270	L	82.1	Confident	85.6	Confident	33 Å²	33	56.7 Å²	56.7	17%	0.173	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	1.7	178.2	-63.9	175.2	0	0	0	113.6	A266 L267 L268 L272 L285 L293	A266-L270 PolarHBondContact O-N 2.61Å; L267-L270 CarbonylContact O-C 3.59Å; L267-L270 PolarHBondContact O-N 2.63Å; L268-L270 PolarHBondContact O-N 3.14Å; L270-L272 HydrophobicContact CB-CD1 3.64Å; L270-L272 HydrophobicContact CB-CG 3.9Å; L270-L272 HydrophobicContact CD1-CD1 3.85Å; L270-L272 HydrophobicContact CG-CD1 4.42Å; L270-L272 PolarHBondContact O-N 3.49Å; L270-L285 HydrophobicContact CD1-CD1 3.78Å; L270-L293 HydrophobicContact CB-CD2 4.37Å; L270-L293 HydrophobicContact CD2-CD1 4.47Å; L270-L293 HydrophobicContact CD2-CD2 4.31Å
271	G	81	Confident	85.8	Confident	38 Å²	38	54.8 Å²	54.8	39%	0.392	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	15.5	-176.7	0	0	0	0	0	114.9	L267 L268 A302	L267-G271 PolarHBondContact O-N 3.23Å; L268-G271 PolarHBondContact O-N 3.26Å; L268-G271 VanDerWaalsContact O-N 3.07Å; G271-A302 PolarHBondContact O-N 3.35Å; G271-A302 VanDerWaalsContact O-N 3.16Å
272	L	84	Confident	86	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-85.5	155.3	-176	-64	164.7	0	0	0	111.6	L267 L270 C274 T288 L296 L300 F301	L267-L272 HydrophobicContact CB-CB 4.37Å; L267-L272 HydrophobicContact CD2-CB 3.8Å; L267-L272 HydrophobicContact CD2-CD1 3.83Å; L267-L272 HydrophobicContact CD2-CG 4.48Å; L267-L272 PolarHBondContact O-N 2.97Å; L270-L272 HydrophobicContact CB-CD1 3.64Å; L270-L272 HydrophobicContact CB-CG 3.9Å; L270-L272 HydrophobicContact CD1-CD1 3.85Å; L270-L272 HydrophobicContact CG-CD1 4.42Å; L270-L272 PolarHBondContact O-N 3.49Å; L272-C274 PolarHBondContact O-N 2.89Å; L272-C274 PolarHBondContact O-SG 2.87Å; L272-T288 HydrophobicContact CD1-CG2 3.7Å; L272-L296 HydrophobicContact CD2-CD1 4.36Å; L272-L300 WeakPolarHBondContact CA-O 3.46Å; L272-L300 HydrophobicContact CD2-CB 3.75Å; L272-F301 HydrophobicContact CD2-CD1 4.31Å; L272-F301 HydrophobicContact CD2-CE1 4.23Å; L272-F301 HydrophobicContact CD2-CZ 4.4Å
273	K	84.9	Confident	86.3	Confident	95 Å²	95	48 Å²	48	41%	0.413	28%	0.275	S	S	.	.			trans	-57.4	133.9	173.1	-72.9	172.8	178.3	170.6	0	110.2	R284 S299 L300 F301	K273-R284 VanDerWaalsContact O-CD 3.29Å; K273-R284 WeakPolarHBondContact O-CD 3.29Å; K273-R284 PolarHBondContact O-NH1 3.08Å; K273-S299 WeakPolarHBondContact CE-O 3.41Å; K273-S299 PolarHBondContact NZ-O 3.15Å; K273-L300 WeakPolarHBondContact CG-O 3.48Å; K273-L300 PolarHBondContact N-O 3.4Å; K273-F301 WeakPolarHBondContact CE-O 3.47Å
274	C	83.3	Confident	86.4	Confident	27 Å²	27	50.1 Å²	50.1	18%	0.182	28%	0.283	C	S	.	.			trans	-103.9	6.4	-178.6	-64.6	0	0	0	0	113.9	K264 L268 L272 R281	K264-C274 HydrophobicContact CG-CB 4.26Å; L268-C274 VanDerWaalsContact CG-SG 3.58Å; L272-C274 PolarHBondContact O-N 2.89Å; L272-C274 PolarHBondContact O-SG 2.87Å; C274-R281 PolarHBondContact O-NE 2.88Å; C274-R281 PolarHBondContact O-NH2 3.23Å; C274-R281 VanDerWaalsContact O-NH2 3.15Å
275	G	82	Confident	86.6	Confident	44 Å²	44	45.7 Å²	45.7	45%	0.454	26%	0.264	S	S	.	.			trans	-76.9	164.2	179.2	0	0	0	0	0	113.2	R284	G275-R284 PolarHBondContact O-NH1 3.5Å; G275-R284 PolarHBondContact O-NH2 3.2Å
276	G	84.6	Confident	86.8	Confident	37 Å²	37	46.7 Å²	46.7	38%	0.381	26%	0.264	S	S	.	.	S	Bend	trans	105.2	176.8	174.7	0	0	0	0	0	115.6	E280 R281	G276-E280 VanDerWaalsContact C-OE2 3.32Å; G276-E280 WeakPolarHBondContact CA-OE2 3.43Å; G276-R281 PolarHBondContact O-NE 2.97Å
277	T	88.4	Confident	86.9	Confident	73 Å²	73	48.8 Å²	48.8	45%	0.448	28%	0.279	S	S	.	.			trans	-63.9	164.5	174.8	70.9	0	0	0	0	110.8	E279 E280 R281	T277-E279 PolarHBondContact O-N 3.2Å; T277-E280 PolarHBondContact N-OE2 3.37Å; T277-E280 PolarHBondContact O-N 3.19Å; T277-E280 WeakPolarHBondContact OG1-CG 3.4Å; T277-E280 PolarHBondContact OG1-N 3.47Å; T277-E280 VanDerWaalsContact OG1-N 3.15Å; T277-R281 WeakPolarHBondContact O-CG 3.39Å; T277-R281 PolarHBondContact O-N 3.43Å
278	L	88	Confident	86.9	Confident	60 Å²	60	49.4 Å²	49.4	31%	0.314	28%	0.282	S	S	.	.	H	α-helix	trans	-57	-39.3	175.6	-178.7	153.2	0	0	0	111.1	A256 L260 L263 R281 A282	A256-L278 HydrophobicContact CB-CD2 3.4Å; A256-L278 VanDerWaalsContact CB-CD2 3.4Å; A256-L278 WeakPolarHBondContact O-CD2 3.45Å; L260-L278 HydrophobicContact CB-CD1 4.3Å; L260-L278 HydrophobicContact CD1-CB 4.44Å; L263-L278 HydrophobicContact CD1-CG 4.25Å; L278-R281 PolarHBondContact O-N 3.33Å; L278-A282 WeakPolarHBondContact O-CB 3.38Å; L278-A282 PolarHBondContact O-N 3.39Å
279	E	89.5	Confident	86.9	Confident	114 Å²	114	48.4 Å²	48.4	53%	0.533	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-47.9	175.2	-56	177.5	173.3	0	0	111.7	W252 T277 R281 A282 Q283	W252-E279 HydrophobicContact CH2-CB 4.32Å; W252-E279 HydrophobicContact CH2-CG 4.28Å; W252-E279 HydrophobicContact CZ3-CB 3.8Å; W252-E279 HydrophobicContact CZ3-CG 3.88Å; T277-E279 PolarHBondContact O-N 3.2Å; E279-R281 VanDerWaalsContact C-N 3.31Å; E279-R281 PolarHBondContact O-N 3.03Å; E279-A282 PolarHBondContact O-N 3.21Å; E279-Q283 WeakPolarHBondContact O-CB 3.5Å; E279-Q283 WeakPolarHBondContact O-CG 3.47Å; E279-Q283 PolarHBondContact O-N 3.45Å
280	E	90.6	Very high	86.7	Confident	93 Å²	93	50.6 Å²	50.6	44%	0.435	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-37.4	178.6	-72.4	173.1	159.7	0	0	112.2	G276 T277 R284	G276-E280 VanDerWaalsContact C-OE2 3.32Å; G276-E280 WeakPolarHBondContact CA-OE2 3.43Å; T277-E280 PolarHBondContact N-OE2 3.37Å; T277-E280 PolarHBondContact O-N 3.19Å; T277-E280 WeakPolarHBondContact OG1-CG 3.4Å; T277-E280 PolarHBondContact OG1-N 3.47Å; T277-E280 VanDerWaalsContact OG1-N 3.15Å; E280-R284 WeakPolarHBondContact O-CB 3.27Å; E280-R284 PolarHBondContact O-N 3.28Å
281	R	89.9	Confident	86.8	Confident	34 Å²	34	54.9 Å²	54.9	13%	0.128	32%	0.318	C	S	.	.	H	α-helix	trans	-69	-42.2	175.3	-68.2	-179.3	-163.5	-159.6	0.2	111.6	L263 L267 C274 G276 T277 L278 E279 R284 L285	L263-R281 HydrophobicContact CB-CB 4.22Å; L263-R281 HydrophobicContact CD1-CB 4.22Å; L267-R281 HydrophobicContact CD1-CB 3.82Å; L267-R281 HydrophobicContact CD1-CG 3.96Å; C274-R281 PolarHBondContact O-NE 2.88Å; C274-R281 PolarHBondContact O-NH2 3.23Å; C274-R281 VanDerWaalsContact O-NH2 3.15Å; G276-R281 PolarHBondContact O-NE 2.97Å; T277-R281 WeakPolarHBondContact O-CG 3.39Å; T277-R281 PolarHBondContact O-N 3.43Å; L278-R281 PolarHBondContact O-N 3.33Å; E279-R281 VanDerWaalsContact C-N 3.31Å; E279-R281 PolarHBondContact O-N 3.03Å; R281-R284 PolarHBondContact O-N 2.67Å; R281-L285 WeakPolarHBondContact O-CB 3.4Å; R281-L285 PolarHBondContact O-N 2.97Å
282	A	89.7	Confident	86.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-45.5	177.4	0	0	0	0	0	111.1	W252 L255 A256 L263 L278 E279 L285 F286	W252-A282 HydrophobicContact CE3-CB 4.25Å; L255-A282 HydrophobicContact CB-CB 4.23Å; A256-A282 HydrophobicContact CB-CB 3.99Å; L263-A282 HydrophobicContact CD1-CB 3.87Å; L263-A282 HydrophobicContact CD2-CB 4.4Å; L278-A282 WeakPolarHBondContact O-CB 3.38Å; L278-A282 PolarHBondContact O-N 3.39Å; E279-A282 PolarHBondContact O-N 3.21Å; A282-L285 PolarHBondContact O-N 3.08Å; A282-F286 VanDerWaalsContact O-CB 3.24Å; A282-F286 WeakPolarHBondContact O-CB 3.42Å; A282-F286 PolarHBondContact O-N 2.91Å
283	Q	90.7	Very high	86.2	Confident	93 Å²	93	60.5 Å²	60.5	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-62.4	-43.3	174.6	-72.4	176.6	1.9	0	0	111.9	W252 E279 F286 S287	W252-Q283 HydrophobicContact CB-CG 4.16Å; W252-Q283 HydrophobicContact CD2-CG 3.64Å; W252-Q283 HydrophobicContact CE3-CG 3.97Å; W252-Q283 HydrophobicContact CG-CG 3.71Å; E279-Q283 WeakPolarHBondContact O-CB 3.5Å; E279-Q283 WeakPolarHBondContact O-CG 3.47Å; E279-Q283 PolarHBondContact O-N 3.45Å; Q283-F286 PolarHBondContact O-N 3.42Å; Q283-S287 VanDerWaalsContact O-CB 3.32Å; Q283-S287 WeakPolarHBondContact O-CB 3.5Å; Q283-S287 PolarHBondContact O-N 3.27Å
284	R	90.1	Very high	85.8	Confident	46 Å²	46	65 Å²	65	17%	0.174	37%	0.367	C	S	.	.	H	α-helix	trans	-61.3	-46.5	176.8	-171.6	-178	-54.1	121.1	11.8	111.6	L267 K273 G275 E280 R281 S287 L300	L267-R284 HydrophobicContact CD2-CB 4.33Å; L267-R284 HydrophobicContact CD2-CG 4.04Å; K273-R284 VanDerWaalsContact O-CD 3.29Å; K273-R284 WeakPolarHBondContact O-CD 3.29Å; K273-R284 PolarHBondContact O-NH1 3.08Å; G275-R284 PolarHBondContact O-NH1 3.5Å; G275-R284 PolarHBondContact O-NH2 3.2Å; E280-R284 WeakPolarHBondContact O-CB 3.27Å; E280-R284 PolarHBondContact O-N 3.28Å; R281-R284 PolarHBondContact O-N 2.67Å; R284-S287 PolarHBondContact O-N 3.32Å; R284-S287 PolarHBondContact O-OG 2.88Å; R284-L300 HydrophobicContact CG-CD2 4.42Å
285	L	90.4	Very high	85.5	Confident	2 Å²	2	67 Å²	67	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-67.7	-41.4	177.4	-171.9	65.9	0	0	0	111.3	L244 L246 L263 A266 L267 L270 R281 A282 S287 T288	L244-L285 HydrophobicContact CD2-CD2 3.78Å; L246-L285 HydrophobicContact CD1-CG 4.35Å; L246-L285 WeakPolarHBondContact CD1-O 3.43Å; L246-L285 HydrophobicContact CD2-CD1 4.5Å; L246-L285 HydrophobicContact CD2-CD2 4.03Å; L246-L285 HydrophobicContact CD2-CG 3.85Å; L263-L285 HydrophobicContact CD2-CD2 3.61Å; A266-L285 HydrophobicContact CB-CD1 3.95Å; A266-L285 HydrophobicContact CB-CD2 3.61Å; A266-L285 HydrophobicContact CB-CG 4.46Å; L267-L285 HydrophobicContact CD2-CB 4.01Å; L267-L285 HydrophobicContact CD2-CD1 4.1Å; L267-L285 HydrophobicContact CG-CB 4.39Å; L267-L285 HydrophobicContact CG-CD1 4.39Å; L270-L285 HydrophobicContact CD1-CD1 3.78Å; R281-L285 WeakPolarHBondContact O-CB 3.4Å; R281-L285 PolarHBondContact O-N 2.97Å; A282-L285 PolarHBondContact O-N 3.08Å; L285-S287 VanDerWaalsContact C-N 3.27Å; L285-S287 PolarHBondContact O-N 2.77Å; L285-T288 PolarHBondContact O-N 2.85Å; L285-T288 PolarHBondContact O-OG1 3.39Å
286	F	90.3	Very high	85.3	Confident	56 Å²	56	65.6 Å²	65.6	25%	0.246	36%	0.363	C	S	.	.	H	α-helix	trans	-63.6	-34	176	-163.5	-105.8	0	0	0	112	W252 L255 A282 Q283 T288 K289	W252-F286 HydrophobicContact CB-CB 3.83Å; W252-F286 HydrophobicContact CB-CD1 4.3Å; W252-F286 HydrophobicContact CB-CG 3.99Å; L255-F286 HydrophobicContact CD1-CB 3.77Å; L255-F286 HydrophobicContact CD1-CD2 3.65Å; L255-F286 HydrophobicContact CD1-CG 4.2Å; L255-F286 HydrophobicContact CG-CD2 4.41Å; A282-F286 VanDerWaalsContact O-CB 3.24Å; A282-F286 WeakPolarHBondContact O-CB 3.42Å; A282-F286 PolarHBondContact O-N 2.91Å; Q283-F286 PolarHBondContact O-N 3.42Å; F286-T288 PolarHBondContact O-N 3.43Å; F286-T288 VanDerWaalsContact O-N 3.11Å; F286-K289 HydrophobicContact CD2-CD 4.43Å; F286-K289 HydrophobicContact CE2-CD 3.91Å; F286-K289 HydrophobicContact CZ-CD 4.31Å; F286-K289 WeakPolarHBondContact O-CB 3.35Å; F286-K289 PolarHBondContact O-N 2.72Å
287	S	88	Confident	84.9	Confident	44 Å²	44	68.6 Å²	68.6	31%	0.308	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-17.6	179.3	81.3	0	0	0	0	114.1	Q283 R284 L285 K291	Q283-S287 VanDerWaalsContact O-CB 3.32Å; Q283-S287 WeakPolarHBondContact O-CB 3.5Å; Q283-S287 PolarHBondContact O-N 3.27Å; R284-S287 PolarHBondContact O-N 3.32Å; R284-S287 PolarHBondContact O-OG 2.88Å; L285-S287 VanDerWaalsContact C-N 3.27Å; L285-S287 PolarHBondContact O-N 2.77Å; S287-K291 WeakPolarHBondContact O-CD 3.41Å; S287-K291 PolarHBondContact O-NZ 3.18Å
288	T	87.5	Confident	84.4	Confident	13 Å²	13	70.9 Å²	70.9	8%	0.08	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-7.7	175.1	72.2	0	0	0	0	113.3	L272 L285 F286 G290 K291 L296	L272-T288 HydrophobicContact CD1-CG2 3.7Å; L285-T288 PolarHBondContact O-N 2.85Å; L285-T288 PolarHBondContact O-OG1 3.39Å; F286-T288 PolarHBondContact O-N 3.43Å; F286-T288 VanDerWaalsContact O-N 3.11Å; T288-G290 PolarHBondContact O-N 3.43Å; T288-G290 VanDerWaalsContact O-N 3.17Å; T288-K291 PolarHBondContact O-N 3.05Å; T288-K291 VanDerWaalsContact O-N 3.1Å; T288-L296 HydrophobicContact CG2-CD1 3.54Å; T288-L296 HydrophobicContact CG2-CD2 3.85Å; T288-L296 HydrophobicContact CG2-CG 4.37Å
289	K	86.4	Confident	84	Confident	72 Å²	72	71 Å²	71	31%	0.313	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	119.9	176.1	-173.7	176.4	-179.9	169.4	0	110.1	L246 S247 F249 F286 K291	L246-K289 HydrophobicContact CB-CB 4.06Å; L246-K289 HydrophobicContact CB-CD 4.17Å; L246-K289 HydrophobicContact CB-CG 3.89Å; L246-K289 HydrophobicContact CD1-CB 4.03Å; L246-K289 WeakPolarHBondContact O-CD 3.31Å; L246-K289 WeakPolarHBondContact O-CE 3.49Å; L246-K289 PolarHBondContact O-NZ 3.3Å; S247-K289 PolarHBondContact O-NZ 2.6Å; F249-K289 PolarHBondContact O-NZ 2.65Å; F286-K289 HydrophobicContact CD2-CD 4.43Å; F286-K289 HydrophobicContact CE2-CD 3.91Å; F286-K289 HydrophobicContact CZ-CD 4.31Å; F286-K289 WeakPolarHBondContact O-CB 3.35Å; F286-K289 PolarHBondContact O-N 2.72Å; K289-K291 VanDerWaalsContact C-N 3.3Å; K289-K291 PolarHBondContact O-N 3.29Å
290	G	79.4	Confident	83.3	Confident	87 Å²	87	67.5 Å²	67.5	90%	0.897	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	7	178.7	0	0	0	0	0	115.5	T288	T288-G290 PolarHBondContact O-N 3.43Å; T288-G290 VanDerWaalsContact O-N 3.17Å
291	K	84.3	Confident	82.9	Confident	122 Å²	122	65.8 Å²	65.8	53%	0.53	37%	0.366	S	S	.	.			trans	-109.1	142.6	176	-67.1	-174.4	-171.3	164.9	0	111	S287 T288 K289 L296	S287-K291 WeakPolarHBondContact O-CD 3.41Å; S287-K291 PolarHBondContact O-NZ 3.18Å; T288-K291 PolarHBondContact O-N 3.05Å; T288-K291 VanDerWaalsContact O-N 3.1Å; K289-K291 VanDerWaalsContact C-N 3.3Å; K289-K291 PolarHBondContact O-N 3.29Å; K291-L296 HydrophobicContact CB-CD2 4.09Å; K291-L296 HydrophobicContact CD-CD2 3.98Å
292	S	77	Confident	81.9	Confident	70 Å²	70	67.2 Å²	67.2	49%	0.49	39%	0.386	S	S	.	.			trans	-73.1	149	169.4	63.7	0	0	0	0	110.2	E294 S295	S292-E294 PolarHBondContact O-N 2.97Å; S292-E294 VanDerWaalsContact O-N 3.12Å; S292-S295 PolarHBondContact N-OG 2.77Å; S292-S295 PolarHBondContact O-N 3.18Å; S292-S295 PolarHBondContact O-OG 3.02Å; S292-S295 PolarHBondContact OG-OG 2.84Å
293	L	74.6	Confident	80.6	Confident	88 Å²	88	76.3 Å²	76.3	46%	0.461	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-54.3	-31.5	178.3	-84.1	151.8	0	0	0	112.8	L270 S295 L296 F301	L270-L293 HydrophobicContact CB-CD2 4.37Å; L270-L293 HydrophobicContact CD2-CD1 4.47Å; L270-L293 HydrophobicContact CD2-CD2 4.31Å; L293-S295 VanDerWaalsContact C-N 3.34Å; L293-L296 HydrophobicContact CD2-CD1 4.32Å; L293-L296 PolarHBondContact O-N 2.84Å; L293-F301 HydrophobicContact CD2-CE1 3.83Å; L293-F301 HydrophobicContact CD2-CZ 3.91Å
294	E	76.1	Confident	78.9	Confident	189 Å²	189	77.8 Å²	77.8	88%	0.883	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-72.7	-23.6	178.5	-63.1	171.9	177.7	0	0	113.6	S292 L296	S292-E294 PolarHBondContact O-N 2.97Å; S292-E294 VanDerWaalsContact O-N 3.12Å; E294-L296 VanDerWaalsContact C-N 3.33Å
295	S	77.5	Confident	77.1	Confident	69 Å²	69	81.3 Å²	81.3	48%	0.483	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-87.3	-4.3	178.4	70	0	0	0	0	113.6	S292 L293	S292-S295 PolarHBondContact N-OG 2.77Å; S292-S295 PolarHBondContact O-N 3.18Å; S292-S295 PolarHBondContact O-OG 3.02Å; S292-S295 PolarHBondContact OG-OG 2.84Å; L293-S295 VanDerWaalsContact C-N 3.34Å
296	L	77.4	Confident	75.3	Confident	15 Å²	15	88.5 Å²	88.5	8%	0.079	50%	0.496	C	S	.	.	S	Bend	trans	-82.4	142.8	178.6	-62.5	176.5	0	0	0	110.4	L272 T288 K291 L293 E294 T298 L300 F301	L272-L296 HydrophobicContact CD2-CD1 4.36Å; T288-L296 HydrophobicContact CG2-CD1 3.54Å; T288-L296 HydrophobicContact CG2-CD2 3.85Å; T288-L296 HydrophobicContact CG2-CG 4.37Å; K291-L296 HydrophobicContact CB-CD2 4.09Å; K291-L296 HydrophobicContact CD-CD2 3.98Å; L293-L296 HydrophobicContact CD2-CD1 4.32Å; L293-L296 PolarHBondContact O-N 2.84Å; E294-L296 VanDerWaalsContact C-N 3.33Å; L296-T298 PolarHBondContact O-N 2.83Å; L296-L300 HydrophobicContact CB-CD1 4.46Å; L296-F301 HydrophobicContact CB-CE2 3.99Å; L296-F301 HydrophobicContact CB-CZ 4.29Å; L296-F301 HydrophobicContact CD1-CZ 4.33Å
297	D	77.5	Confident	73.5	Confident	100 Å²	100	90.5 Å²	90.5	54%	0.535	52%	0.517	S	S	.	.			trans	-58.6	126.3	174.5	177.2	5.5	0	0	0	110.4	S299 L300	D297-S299 PolarHBondContact O-N 2.88Å; D297-S299 WeakPolarHBondContact OD1-CB 3.15Å; D297-S299 PolarHBondContact OD1-N 3.47Å; D297-S299 PolarHBondContact OD1-OG 3.48Å; D297-S299 WeakPolarHBondContact OD2-CB 3.43Å; D297-S299 PolarHBondContact OD2-OG 3.04Å; D297-L300 HydrophobicContact CB-CD1 4.39Å; D297-L300 HydrophobicContact CB-CG 4.35Å; D297-L300 WeakPolarHBondContact O-CB 3.33Å; D297-L300 PolarHBondContact O-N 3.33Å
298	T	78.4	Confident	71.8	Confident	121 Å²	121	97 Å²	97	74%	0.742	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-51.1	-25.5	175.6	-43.6	0	0	0	0	112.3	L296 L300 F301	L296-T298 PolarHBondContact O-N 2.83Å; T298-L300 PolarHBondContact O-N 3.09Å; T298-F301 PolarHBondContact O-N 2.62Å
299	S	77.9	Confident	70.5	Confident	62 Å²	62	98.2 Å²	98.2	43%	0.434	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-64.4	-21.6	175.6	87.3	0	0	0	0	114.1	K273 D297	K273-S299 WeakPolarHBondContact CE-O 3.41Å; K273-S299 PolarHBondContact NZ-O 3.15Å; D297-S299 PolarHBondContact O-N 2.88Å; D297-S299 WeakPolarHBondContact OD1-CB 3.15Å; D297-S299 PolarHBondContact OD1-N 3.47Å; D297-S299 PolarHBondContact OD1-OG 3.48Å; D297-S299 WeakPolarHBondContact OD2-CB 3.43Å; D297-S299 PolarHBondContact OD2-OG 3.04Å
300	L	76.3	Confident	69.5	Low	41 Å²	41	98.6 Å²	98.6	22%	0.215	56%	0.563	C	S	.	*	G	3₁₀ helix	trans	-80	-20.6	-179.6	-62.9	173.7	0	0	0	113.2	L272 K273 R284 L296 D297 T298	L272-L300 WeakPolarHBondContact CA-O 3.46Å; L272-L300 HydrophobicContact CD2-CB 3.75Å; K273-L300 WeakPolarHBondContact CG-O 3.48Å; K273-L300 PolarHBondContact N-O 3.4Å; R284-L300 HydrophobicContact CG-CD2 4.42Å; L296-L300 HydrophobicContact CB-CD1 4.46Å; D297-L300 HydrophobicContact CB-CD1 4.39Å; D297-L300 HydrophobicContact CB-CG 4.35Å; D297-L300 WeakPolarHBondContact O-CB 3.33Å; D297-L300 PolarHBondContact O-N 3.33Å; T298-L300 PolarHBondContact O-N 3.09Å
301	F	80.7	Confident	69.2	Low	57 Å²	57	100.9 Å²	100.9	25%	0.25	55%	0.548	C	S	.	.	B	Isolated β-bridge	trans	-80.8	147.2	179.9	-66.9	-87.1	0	0	0	112.1	L272 K273 L293 L296 T298 K303	L272-F301 HydrophobicContact CD2-CD1 4.31Å; L272-F301 HydrophobicContact CD2-CE1 4.23Å; L272-F301 HydrophobicContact CD2-CZ 4.4Å; K273-F301 WeakPolarHBondContact CE-O 3.47Å; L293-F301 HydrophobicContact CD2-CE1 3.83Å; L293-F301 HydrophobicContact CD2-CZ 3.91Å; L296-F301 HydrophobicContact CB-CE2 3.99Å; L296-F301 HydrophobicContact CB-CZ 4.29Å; L296-F301 HydrophobicContact CD1-CZ 4.33Å; T298-F301 PolarHBondContact O-N 2.62Å; F301-K303 PolarHBondContact O-N 3.18Å
302	A	70.6	Confident	68.8	Low	65 Å²	65	104.4 Å²	104.4	54%	0.537	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-70.9	117.2	175.1	0	0	0	0	0	110	G271 N304	G271-A302 PolarHBondContact O-N 3.35Å; G271-A302 VanDerWaalsContact O-N 3.16Å; A302-N304 PolarHBondContact O-N 2.86Å
303	K	60.5	Low	69	Low	191 Å²	191	104.5 Å²	104.5	83%	0.83	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-65.8	125.5	169.5	-69.9	-175.7	176.7	-178.9	0	108.4	F301 P305	F301-K303 PolarHBondContact O-N 3.18Å; K303-P305 WeakPolarHBondContact O-CD 3.39Å
304	N	55.7	Low	69.4	Low	123 Å²	123	103.8 Å²	103.8	66%	0.658	55%	0.553	S	S	*	*			trans	-91.3	103.3	176.5	-156	3.1	0	0	0	109.6	A302 K306	A302-N304 PolarHBondContact O-N 2.86Å; N304-K306 PolarHBondContact O-N 3.31Å; N304-K306 VanDerWaalsContact O-N 3.09Å
305	P	51.9	Low	70	Confident	121 Å²	121	99.3 Å²	99.3	79%	0.786	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-4.2	-174.2	26.8	-34.3	0	0	0	114.5	K303	K303-P305 WeakPolarHBondContact O-CD 3.39Å
306	K	52.2	Low	70.6	Confident	153 Å²	153	101.6 Å²	101.6	67%	0.665	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-15	-171.3	-68.3	-168.8	175.5	-174.8	0	116.2	N304 K308 G309 T310	N304-K306 PolarHBondContact O-N 3.31Å; N304-K306 VanDerWaalsContact O-N 3.09Å; K306-K308 PolarHBondContact O-N 2.85Å; K306-G309 PolarHBondContact O-N 3.02Å; K306-T310 PolarHBondContact O-N 3.06Å; K306-T310 PolarHBondContact O-OG1 2.98Å
307	S	53.6	Low	71.2	Confident	97 Å²	97	101.9 Å²	101.9	68%	0.678	53%	0.532	S	S	*	.	H	α-helix	trans	-70.3	-29.3	-165.3	86.9	0	0	0	0	116.2
308	K	52.6	Low	72	Confident	181 Å²	181	100.1 Å²	100.1	79%	0.787	52%	0.519	S	S	*	.	H	α-helix	trans	-79.8	-32.8	178.5	-84.5	-170.1	178	-178.2	0	114	K306	K306-K308 PolarHBondContact O-N 2.85Å
309	G	59.7	Low	72.8	Confident	39 Å²	39	98.2 Å²	98.2	40%	0.402	51%	0.505	S	S	.	.	H	α-helix	trans	-69.8	-46.1	178.9	0	0	0	0	0	111.5	K306 K311 R312 D313	K306-G309 PolarHBondContact O-N 3.02Å; G309-K311 VanDerWaalsContact C-N 3.3Å; G309-K311 PolarHBondContact O-N 2.86Å; G309-R312 PolarHBondContact O-N 3.44Å; G309-D313 PolarHBondContact O-N 2.95Å; G309-D313 VanDerWaalsContact O-N 3.09Å
310	T	66.3	Low	73.6	Confident	79 Å²	79	95.3 Å²	95.3	49%	0.485	48%	0.484	S	S	.	.	H	α-helix	trans	-58.2	-39	-178.6	-51.6	0	0	0	0	112.7	K306 D313 T314	K306-T310 PolarHBondContact O-N 3.06Å; K306-T310 PolarHBondContact O-OG1 2.98Å; T310-D313 PolarHBondContact O-N 2.67Å; T310-T314 HydrophobicContact CG2-CG2 4.46Å; T310-T314 WeakPolarHBondContact O-CG2 3.41Å; T310-T314 PolarHBondContact O-N 3.24Å; T310-T314 PolarHBondContact O-OG1 3.37Å; T310-T314 VanDerWaalsContact O-OG1 3.09Å
311	K	72.1	Confident	74.5	Confident	135 Å²	135	93.4 Å²	93.4	59%	0.587	47%	0.474	S	S	*	.	H	α-helix	trans	-64.8	-43.7	179.8	-164.8	-176.8	-177.9	-160.8	0	112.8	G309 D313 T314 E315	G309-K311 VanDerWaalsContact C-N 3.3Å; G309-K311 PolarHBondContact O-N 2.86Å; K311-D313 VanDerWaalsContact C-N 3.35Å; K311-T314 WeakPolarHBondContact CA-OG1 3.5Å; K311-T314 PolarHBondContact O-N 2.92Å; K311-T314 PolarHBondContact O-OG1 3.19Å; K311-E315 WeakPolarHBondContact CE-OE1 3.37Å; K311-E315 IonicContact NZ-OE1 3.39Å; K311-E315 WeakPolarHBondContact O-CG 3.44Å; K311-E315 PolarHBondContact O-N 3.48Å
312	R	76.9	Confident	75.3	Confident	197 Å²	197	92.6 Å²	92.6	74%	0.743	47%	0.47	S	S	*	.	H	α-helix	trans	-66.6	-38.8	177.6	-73.8	-176.1	175.8	-177.9	-3	111.8	G309 T314 E315 R316	G309-R312 PolarHBondContact O-N 3.44Å; R312-T314 VanDerWaalsContact C-N 3.35Å; R312-E315 PolarHBondContact O-N 3.19Å; R312-R316 WeakPolarHBondContact O-CB 3.46Å; R312-R316 PolarHBondContact O-N 3.35Å
313	D	79.8	Confident	76.5	Confident	71 Å²	71	90.5 Å²	90.5	38%	0.38	45%	0.45	S	S	.	.	H	α-helix	trans	-65.4	-39.5	175.8	-74	-41.3	0	0	0	111.6	G309 T310 K311 R316 N317	G309-D313 PolarHBondContact O-N 2.95Å; G309-D313 VanDerWaalsContact O-N 3.09Å; T310-D313 PolarHBondContact O-N 2.67Å; K311-D313 VanDerWaalsContact C-N 3.35Å; D313-R316 IonicContact OD1-CZ 2.87Å; D313-R316 IonicContact OD1-NE 2.77Å; D313-R316 IonicContact OD1-NH2 3.24Å; D313-R316 PolarHBondContact OD1-NH2 3.46Å; D313-N317 VanDerWaalsContact O-CB 3.31Å; D313-N317 WeakPolarHBondContact O-CB 3.34Å; D313-N317 PolarHBondContact O-N 3.48Å; D313-N317 PolarHBondContact O-ND2 2.94Å; D313-N317 PolarHBondContact O-OD1 2.78Å
314	T	84.1	Confident	78.3	Confident	74 Å²	74	81.4 Å²	81.4	45%	0.454	41%	0.411	S	S	.	.	H	α-helix	trans	-66.9	-40.6	176.1	49.6	0	0	0	0	113	T310 K311 R312 N317 K318	T310-T314 HydrophobicContact CG2-CG2 4.46Å; T310-T314 WeakPolarHBondContact O-CG2 3.41Å; T310-T314 PolarHBondContact O-N 3.24Å; T310-T314 PolarHBondContact O-OG1 3.37Å; T310-T314 VanDerWaalsContact O-OG1 3.09Å; K311-T314 WeakPolarHBondContact CA-OG1 3.5Å; K311-T314 PolarHBondContact O-N 2.92Å; K311-T314 PolarHBondContact O-OG1 3.19Å; R312-T314 VanDerWaalsContact C-N 3.35Å; T314-N317 PolarHBondContact O-N 3.45Å; T314-K318 WeakPolarHBondContact O-CB 3.35Å; T314-K318 PolarHBondContact O-N 3.37Å
315	E	87.7	Confident	80.3	Confident	95 Å²	95	75.9 Å²	75.9	44%	0.444	38%	0.382	S	S	.	.	H	α-helix	trans	-64.5	-49	176.1	-74.5	168.7	-176.6	0	0	110.4	K311 R312 N317 K318 D319	K311-E315 WeakPolarHBondContact CE-OE1 3.37Å; K311-E315 IonicContact NZ-OE1 3.39Å; K311-E315 WeakPolarHBondContact O-CG 3.44Å; K311-E315 PolarHBondContact O-N 3.48Å; R312-E315 PolarHBondContact O-N 3.19Å; E315-N317 VanDerWaalsContact C-N 3.31Å; E315-N317 PolarHBondContact O-N 3.49Å; E315-K318 WeakPolarHBondContact O-CB 3.39Å; E315-K318 PolarHBondContact O-N 2.89Å; E315-K318 VanDerWaalsContact O-N 3.09Å; E315-D319 PolarHBondContact O-N 2.98Å
316	R	90	Very high	82.4	Confident	117 Å²	117	70.8 Å²	70.8	44%	0.442	35%	0.348	S	S	.	.	H	α-helix	trans	-57	-42.8	175.7	-179.8	-176.3	63.2	175.3	-6.9	112.7	R312 D313 K318 D319 I320	R312-R316 WeakPolarHBondContact O-CB 3.46Å; R312-R316 PolarHBondContact O-N 3.35Å; D313-R316 IonicContact OD1-CZ 2.87Å; D313-R316 IonicContact OD1-NE 2.77Å; D313-R316 IonicContact OD1-NH2 3.24Å; D313-R316 PolarHBondContact OD1-NH2 3.46Å; R316-K318 VanDerWaalsContact C-N 3.34Å; R316-D319 PolarHBondContact O-N 3.16Å; R316-I320 HydrophobicContact CG-CD1 4.23Å; R316-I320 WeakPolarHBondContact O-CG1 3.43Å; R316-I320 PolarHBondContact O-N 3.25Å; R316-I320 VanDerWaalsContact O-N 3.1Å
317	N	91.5	Very high	84.6	Confident	21 Å²	21	63.5 Å²	63.5	11%	0.112	32%	0.316	C	S	.	.	H	α-helix	trans	-64.9	-40.2	178.4	-70.9	-11.4	0	0	0	111.3	W229 D313 T314 E315 D319 I320 A321	W229-N317 HydrophobicContact CE3-CB 4.11Å; W229-N317 HydrophobicContact CH2-CB 3.79Å; W229-N317 HydrophobicContact CZ3-CB 3.4Å; W229-N317 VanDerWaalsContact CZ3-CB 3.4Å; W229-N317 VanDerWaalsContact CZ3-CG 3.44Å; D313-N317 VanDerWaalsContact O-CB 3.31Å; D313-N317 WeakPolarHBondContact O-CB 3.34Å; D313-N317 PolarHBondContact O-N 3.48Å; D313-N317 PolarHBondContact O-ND2 2.94Å; D313-N317 PolarHBondContact O-OD1 2.78Å; T314-N317 PolarHBondContact O-N 3.45Å; E315-N317 VanDerWaalsContact C-N 3.31Å; E315-N317 PolarHBondContact O-N 3.49Å; N317-D319 VanDerWaalsContact C-N 3.35Å; N317-I320 PolarHBondContact O-N 2.71Å; N317-A321 VanDerWaalsContact O-CB 3.31Å; N317-A321 WeakPolarHBondContact O-CB 3.4Å; N317-A321 PolarHBondContact O-N 3.34Å
318	K	93.1	Very high	86.7	Confident	62 Å²	62	61.1 Å²	61.1	27%	0.27	29%	0.292	S	S	.	.	H	α-helix	trans	-62.9	-42.4	175.3	-170.1	178.2	-178.7	-176.9	0	111.2	F217 E218 W221 T314 E315 R316 A321 F322	F217-K318 HydrophobicContact CE1-CG 3.98Å; F217-K318 HydrophobicContact CZ-CG 4Å; E218-K318 VanDerWaalsContact OE1-CE 3.28Å; E218-K318 WeakPolarHBondContact OE1-CE 3.26Å; E218-K318 IonicContact OE1-NZ 4Å; E218-K318 PolarHBondContact OE1-NZ 3.42Å; E218-K318 WeakPolarHBondContact OE2-CE 3.29Å; E218-K318 IonicContact OE2-NZ 3.81Å; E218-K318 PolarHBondContact OE2-NZ 3.4Å; W221-K318 HydrophobicContact CD2-CG 4.23Å; W221-K318 HydrophobicContact CH2-CB 4.23Å; W221-K318 HydrophobicContact CZ2-CB 3.65Å; W221-K318 HydrophobicContact CZ2-CG 3.95Å; T314-K318 WeakPolarHBondContact O-CB 3.35Å; T314-K318 PolarHBondContact O-N 3.37Å; E315-K318 WeakPolarHBondContact O-CB 3.39Å; E315-K318 PolarHBondContact O-N 2.89Å; E315-K318 VanDerWaalsContact O-N 3.09Å; R316-K318 VanDerWaalsContact C-N 3.34Å; K318-A321 PolarHBondContact O-N 3.36Å; K318-F322 WeakPolarHBondContact O-CB 3.36Å; K318-F322 PolarHBondContact O-N 3.27Å
319	D	94.6	Very high	88.8	Confident	82 Å²	82	54.4 Å²	54.4	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-61.1	-45.5	177.4	-64.7	-12.5	0	0	0	112	E315 R316 N317 F322 L323	E315-D319 PolarHBondContact O-N 2.98Å; R316-D319 PolarHBondContact O-N 3.16Å; N317-D319 VanDerWaalsContact C-N 3.35Å; D319-F322 PolarHBondContact O-N 3.17Å; D319-L323 PolarHBondContact O-N 3.36Å; D319-L323 VanDerWaalsContact O-N 3.11Å
320	I	95.2	Very high	90.6	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-64.4	-45.6	177.5	-64.8	170.8	0	0	0	110.3	K178 Y182 K183 L186 W229 R316 N317 F322 L323 E324	K178-I320 HydrophobicContact CB-CG2 4.48Å; K178-I320 HydrophobicContact CD-CG2 4.4Å; K178-I320 WeakPolarHBondContact O-CD1 3.35Å; Y182-I320 HydrophobicContact CD1-CG2 4.05Å; Y182-I320 HydrophobicContact CE1-CG2 3.76Å; K183-I320 HydrophobicContact CB-CG1 4.31Å; K183-I320 HydrophobicContact CD-CG1 4.31Å; K183-I320 HydrophobicContact CG-CG1 4.24Å; L186-I320 HydrophobicContact CD1-CG2 3.89Å; W229-I320 HydrophobicContact CH2-CB 4.39Å; W229-I320 HydrophobicContact CH2-CG2 4.43Å; W229-I320 HydrophobicContact CZ2-CB 3.98Å; W229-I320 HydrophobicContact CZ2-CG2 3.77Å; R316-I320 HydrophobicContact CG-CD1 4.23Å; R316-I320 WeakPolarHBondContact O-CG1 3.43Å; R316-I320 PolarHBondContact O-N 3.25Å; R316-I320 VanDerWaalsContact O-N 3.1Å; N317-I320 PolarHBondContact O-N 2.71Å; I320-F322 PolarHBondContact O-N 2.95Å; I320-L323 WeakPolarHBondContact O-CB 3.48Å; I320-L323 PolarHBondContact O-N 3.1Å; I320-L323 VanDerWaalsContact O-N 3.15Å; I320-E324 WeakPolarHBondContact O-CG 3.35Å; I320-E324 PolarHBondContact O-N 3.23Å
321	A	95.7	Very high	92	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-35.7	177.2	0	0	0	0	0	112.3	F217 W221 F226 W229 N317 K318 E324 A325	F217-A321 HydrophobicContact CE2-CB 3.78Å; F217-A321 HydrophobicContact CZ-CB 3.94Å; W221-A321 HydrophobicContact CE3-CB 3.98Å; W221-A321 HydrophobicContact CH2-CB 4.06Å; W221-A321 HydrophobicContact CZ3-CB 3.37Å; F226-A321 HydrophobicContact CD1-CB 3.93Å; F226-A321 HydrophobicContact CE1-CB 3.71Å; F226-A321 WeakPolarHBondContact CE1-O 3.44Å; F226-A321 WeakPolarHBondContact CZ-O 3.49Å; W229-A321 HydrophobicContact CD2-CB 4.16Å; W229-A321 HydrophobicContact CG-CB 4.12Å; W229-A321 HydrophobicContact CZ2-CB 4.31Å; N317-A321 VanDerWaalsContact O-CB 3.31Å; N317-A321 WeakPolarHBondContact O-CB 3.4Å; N317-A321 PolarHBondContact O-N 3.34Å; K318-A321 PolarHBondContact O-N 3.36Å; A321-E324 PolarHBondContact O-N 3.16Å; A321-A325 PolarHBondContact O-N 3.46Å
322	F	97	Very high	93.1	Very high	40 Å²	40	50 Å²	50	18%	0.175	23%	0.23	C	C	.	.	H	α-helix	trans	-71	-33.6	176.8	-174.1	-122.7	0	0	0	112.8	F210 I213 Q214 F217 K318 D319 I320 A325 Q326	F210-F322 AromaticContact CE2-CE1 3.95Å; F210-F322 HydrophobicContact CE2-CE1 3.95Å; F210-F322 AromaticContact CE2-CZ 3.79Å; F210-F322 HydrophobicContact CE2-CZ 3.79Å; F210-F322 AromaticContact CZ-CE1 3.88Å; F210-F322 HydrophobicContact CZ-CE1 3.88Å; F210-F322 AromaticContact CZ-CZ 3.74Å; F210-F322 HydrophobicContact CZ-CZ 3.74Å; I213-F322 HydrophobicContact CG2-CE2 4.3Å; Q214-F322 HydrophobicContact CB-CE2 4.22Å; Q214-F322 HydrophobicContact CB-CZ 4.24Å; Q214-F322 HydrophobicContact CG-CE2 4.42Å; Q214-F322 HydrophobicContact CG-CZ 4.41Å; F217-F322 HydrophobicContact CB-CD2 4.02Å; F217-F322 HydrophobicContact CB-CE2 4.28Å; F217-F322 HydrophobicContact CD1-CB 4.22Å; F217-F322 AromaticContact CD1-CD2 3.43Å; F217-F322 HydrophobicContact CD1-CD2 3.43Å; F217-F322 VanDerWaalsContact CD1-CD2 3.43Å; F217-F322 HydrophobicContact CD1-CE2 4.2Å; F217-F322 HydrophobicContact CD1-CG 4.17Å; F217-F322 HydrophobicContact CD2-CD2 4.28Å; F217-F322 HydrophobicContact CE1-CB 3.78Å; F217-F322 AromaticContact CE1-CD2 3.9Å; F217-F322 HydrophobicContact CE1-CD2 3.9Å; F217-F322 HydrophobicContact CE1-CG 4.18Å; F217-F322 HydrophobicContact CE2-CB 4.31Å; F217-F322 AromaticContact CG-CD2 3.64Å; F217-F322 HydrophobicContact CG-CD2 3.64Å; F217-F322 HydrophobicContact CG-CE2 4.35Å; F217-F322 HydrophobicContact CZ-CB 3.83Å; F217-F322 HydrophobicContact CZ-CD2 4.5Å; K318-F322 WeakPolarHBondContact O-CB 3.36Å; K318-F322 PolarHBondContact O-N 3.27Å; D319-F322 PolarHBondContact O-N 3.17Å; I320-F322 PolarHBondContact O-N 2.95Å; F322-A325 PolarHBondContact O-N 2.82Å; F322-Q326 HydrophobicContact CE2-CG 4.44Å; F322-Q326 HydrophobicContact CZ-CG 4.31Å; F322-Q326 WeakPolarHBondContact O-CG 3.19Å; F322-Q326 PolarHBondContact O-N 3.23Å; F322-Q326 VanDerWaalsContact O-N 3.14Å; F322-Q326 PolarHBondContact O-NE2 2.92Å; F322-Q326 VanDerWaalsContact O-NE2 3.15Å
323	L	97.3	Very high	94.1	Very high	22 Å²	22	42.2 Å²	42.2	12%	0.115	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-44.8	169.9	-68.8	170.7	0	0	0	111.2	K183 L186 E187 L190 D319 I320 A325 Q326 I327	K183-L323 HydrophobicContact CG-CD1 3.83Å; L186-L323 HydrophobicContact CB-CB 4.23Å; L186-L323 HydrophobicContact CB-CD1 4.29Å; L186-L323 HydrophobicContact CD1-CB 4.09Å; E187-L323 HydrophobicContact CG-CD1 3.94Å; E187-L323 HydrophobicContact CG-CD2 4.47Å; L190-L323 HydrophobicContact CD2-CD2 3.66Å; D319-L323 PolarHBondContact O-N 3.36Å; D319-L323 VanDerWaalsContact O-N 3.11Å; I320-L323 WeakPolarHBondContact O-CB 3.48Å; I320-L323 PolarHBondContact O-N 3.1Å; I320-L323 VanDerWaalsContact O-N 3.15Å; L323-A325 VanDerWaalsContact C-N 3.29Å; L323-A325 PolarHBondContact O-N 3.49Å; L323-Q326 PolarHBondContact O-N 3.37Å; L323-I327 WeakPolarHBondContact O-CG1 3.42Å; L323-I327 PolarHBondContact O-N 3.15Å
324	E	97.2	Very high	94.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.9	-42.1	175.4	-66.3	170.6	-168.2	0	0	111.4	L170 K178 Y182 L186 F226 W229 I320 A321 Q326 I327 Y328	L170-E324 HydrophobicContact CB-CG 4.13Å; L170-E324 HydrophobicContact CD1-CB 4.13Å; L170-E324 HydrophobicContact CD1-CG 3.92Å; K178-E324 WeakPolarHBondContact CD-OE1 3.47Å; K178-E324 WeakPolarHBondContact CE-OE1 3.33Å; K178-E324 IonicContact NZ-OE1 2.81Å; K178-E324 PolarHBondContact NZ-OE1 3.28Å; K178-E324 IonicContact NZ-OE2 3.55Å; K178-E324 PolarHBondContact NZ-OE2 3.01Å; Y182-E324 WeakPolarHBondContact CE1-OE1 3.22Å; Y182-E324 PolarHBondContact OH-OE1 3.25Å; L186-E324 HydrophobicContact CD1-CG 3.75Å; F226-E324 HydrophobicContact CE1-CB 4.43Å; F226-E324 HydrophobicContact CZ-CB 4.29Å; W229-E324 PolarHBondContact NE1-OE2 2.76Å; I320-E324 WeakPolarHBondContact O-CG 3.35Å; I320-E324 PolarHBondContact O-N 3.23Å; A321-E324 PolarHBondContact O-N 3.16Å; E324-Q326 VanDerWaalsContact C-N 3.34Å; E324-Q326 PolarHBondContact O-N 2.95Å; E324-I327 PolarHBondContact O-N 3.42Å; E324-Y328 HydrophobicContact CB-CE2 4.26Å; E324-Y328 VanDerWaalsContact O-CD2 3.27Å; E324-Y328 WeakPolarHBondContact O-CD2 3.47Å; E324-Y328 PolarHBondContact O-N 2.9Å
325	A	97.1	Very high	95.5	Very high	7 Å²	7	36.4 Å²	36.4	6%	0.058	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-42.3	177.7	0	0	0	0	0	112.6	I213 F217 F226 A321 F322 L323 E329	I213-A325 HydrophobicContact CG2-CB 4.45Å; F217-A325 HydrophobicContact CB-CB 4.23Å; F217-A325 HydrophobicContact CD2-CB 3.67Å; F217-A325 HydrophobicContact CE2-CB 4.43Å; F217-A325 HydrophobicContact CG-CB 4.23Å; F226-A325 HydrophobicContact CE2-CB 3.64Å; F226-A325 HydrophobicContact CZ-CB 3.73Å; A321-A325 PolarHBondContact O-N 3.46Å; F322-A325 PolarHBondContact O-N 2.82Å; L323-A325 VanDerWaalsContact C-N 3.29Å; L323-A325 PolarHBondContact O-N 3.49Å; A325-E329 WeakPolarHBondContact O-CG 3.42Å; A325-E329 PolarHBondContact O-N 2.68Å
326	Q	97.8	Very high	95.9	Very high	13 Å²	13	38.3 Å²	38.3	6%	0.061	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-44.8	176.2	-71	169.9	91.2	0	0	111.3	L190 I213 F322 L323 E324 Y328 E329 Y330	L190-Q326 HydrophobicContact CD1-CB 3.69Å; L190-Q326 HydrophobicContact CD2-CB 3.99Å; I213-Q326 HydrophobicContact CG2-CG 3.89Å; F322-Q326 HydrophobicContact CE2-CG 4.44Å; F322-Q326 HydrophobicContact CZ-CG 4.31Å; F322-Q326 WeakPolarHBondContact O-CG 3.19Å; F322-Q326 PolarHBondContact O-N 3.23Å; F322-Q326 VanDerWaalsContact O-N 3.14Å; F322-Q326 PolarHBondContact O-NE2 2.92Å; F322-Q326 VanDerWaalsContact O-NE2 3.15Å; L323-Q326 PolarHBondContact O-N 3.37Å; E324-Q326 VanDerWaalsContact C-N 3.34Å; E324-Q326 PolarHBondContact O-N 2.95Å; Q326-Y328 VanDerWaalsContact C-N 3.33Å; Q326-Y328 PolarHBondContact O-N 2.77Å; Q326-E329 PolarHBondContact O-N 3.17Å; Q326-Y330 VanDerWaalsContact O-CD2 3.25Å; Q326-Y330 WeakPolarHBondContact O-CD2 3.49Å; Q326-Y330 PolarHBondContact O-N 3.49Å; Q326-Y330 VanDerWaalsContact O-N 3.07Å
327	I	97.8	Very high	96.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-43.9	178.4	-69	162	0	0	0	111.2	L170 L186 L189 L190 L193 L323 E324 E329 Y330 V331	L170-I327 HydrophobicContact CD1-CB 4.14Å; L170-I327 HydrophobicContact CD1-CD1 3.97Å; L170-I327 HydrophobicContact CD1-CG2 3.92Å; L186-I327 HydrophobicContact CB-CD1 3.99Å; L186-I327 HydrophobicContact CD2-CD1 3.63Å; L186-I327 HydrophobicContact CG-CD1 4.32Å; L189-I327 HydrophobicContact CD2-CD1 4.13Å; L189-I327 HydrophobicContact CD2-CG2 4.02Å; L189-I327 HydrophobicContact CG-CD1 4.43Å; L190-I327 HydrophobicContact CB-CD1 4.42Å; L190-I327 HydrophobicContact CB-CG1 4.03Å; L190-I327 HydrophobicContact CD1-CG1 4.17Å; L193-I327 HydrophobicContact CD1-CG2 4.04Å; L323-I327 WeakPolarHBondContact O-CG1 3.42Å; L323-I327 PolarHBondContact O-N 3.15Å; E324-I327 PolarHBondContact O-N 3.42Å; I327-E329 VanDerWaalsContact C-N 3.25Å; I327-E329 PolarHBondContact O-N 2.87Å; I327-Y330 PolarHBondContact O-N 3.5Å; I327-V331 HydrophobicContact CG2-CG2 4.02Å; I327-V331 WeakPolarHBondContact O-CB 3.18Å; I327-V331 VanDerWaalsContact O-CG2 3.24Å; I327-V331 WeakPolarHBondContact O-CG2 2.86Å; I327-V331 PolarHBondContact O-N 2.92Å
328	Y	97.3	Very high	96.4	Very high	47 Å²	47	36.3 Å²	36.3	18%	0.184	17%	0.174	C	C	.	.	H	α-helix	trans	-57.2	-39.6	178.1	-62.6	-32.1	0	0	0	112.8	D168 L170 F171 F226 E324 Q326 E332	D168-Y328 WeakPolarHBondContact O-CE1 3.22Å; L170-Y328 HydrophobicContact CB-CE1 3.91Å; L170-Y328 WeakPolarHBondContact CB-OH 3.12Å; L170-Y328 HydrophobicContact CD1-CE1 4.07Å; L170-Y328 HydrophobicContact CG-CE1 4.13Å; F171-Y328 PolarHBondContact N-OH 2.96Å; F171-Y328 VanDerWaalsContact N-OH 3.13Å; F226-Y328 HydrophobicContact CZ-CD2 4.42Å; F226-Y328 AromaticContact CZ-CE2 4Å; F226-Y328 HydrophobicContact CZ-CE2 4Å; E324-Y328 HydrophobicContact CB-CE2 4.26Å; E324-Y328 VanDerWaalsContact O-CD2 3.27Å; E324-Y328 WeakPolarHBondContact O-CD2 3.47Å; E324-Y328 PolarHBondContact O-N 2.9Å; Q326-Y328 VanDerWaalsContact C-N 3.33Å; Q326-Y328 PolarHBondContact O-N 2.77Å; Y328-E332 WeakPolarHBondContact O-CB 3.3Å; Y328-E332 PolarHBondContact O-N 3.05Å
329	E	96.6	Very high	96.5	Very high	40 Å²	40	38.3 Å²	38.3	19%	0.187	18%	0.184	C	C	.	.	H	α-helix	trans	-74.7	-40.9	-177.8	-67.4	-85.4	151.8	0	0	111.4	K212 I213 A325 Q326 I327 E332 I333	K212-E329 IonicContact NZ-OE2 3.82Å; I213-E329 HydrophobicContact CD1-CB 3.64Å; I213-E329 HydrophobicContact CD1-CG 4.09Å; I213-E329 HydrophobicContact CG1-CB 3.89Å; I213-E329 HydrophobicContact CG1-CG 3.78Å; I213-E329 HydrophobicContact CG2-CG 4.44Å; A325-E329 WeakPolarHBondContact O-CG 3.42Å; A325-E329 PolarHBondContact O-N 2.68Å; Q326-E329 PolarHBondContact O-N 3.17Å; I327-E329 VanDerWaalsContact C-N 3.25Å; I327-E329 PolarHBondContact O-N 2.87Å; E329-E332 PolarHBondContact O-N 3.23Å; E329-I333 WeakPolarHBondContact O-CD1 2.95Å; E329-I333 VanDerWaalsContact O-CG1 3.31Å; E329-I333 WeakPolarHBondContact O-CG1 3.41Å; E329-I333 PolarHBondContact O-N 3.05Å
330	Y	97	Very high	96.6	Very high	7 Å²	7	36.4 Å²	36.4	3%	0.027	17%	0.174	C	C	.	.	H	α-helix	trans	-65.3	-39.2	173.3	-77.6	-69.3	0	0	0	112.5	L190 L193 Q194 T197 Q206 L209 Q326 I327 E332 I333 L334	L190-Y330 HydrophobicContact CD1-CD2 3.62Å; L190-Y330 HydrophobicContact CD1-CE2 3.84Å; L193-Y330 HydrophobicContact CB-CG 4.41Å; Q194-Y330 HydrophobicContact CG-CD2 4.1Å; Q194-Y330 HydrophobicContact CG-CE1 4.1Å; Q194-Y330 HydrophobicContact CG-CE2 3.45Å; Q194-Y330 VanDerWaalsContact CG-CE2 3.45Å; Q194-Y330 VanDerWaalsContact CG-CZ 3.46Å; T197-Y330 HydrophobicContact CG2-CD1 4.2Å; T197-Y330 HydrophobicContact CG2-CE1 4.14Å; T197-Y330 WeakPolarHBondContact OG1-CD1 3.45Å; Q206-Y330 PolarHBondContact OE1-OH 2.9Å; L209-Y330 HydrophobicContact CD2-CD1 4.48Å; L209-Y330 HydrophobicContact CD2-CE1 3.81Å; Q326-Y330 VanDerWaalsContact O-CD2 3.25Å; Q326-Y330 WeakPolarHBondContact O-CD2 3.49Å; Q326-Y330 PolarHBondContact O-N 3.49Å; Q326-Y330 VanDerWaalsContact O-N 3.07Å; I327-Y330 PolarHBondContact O-N 3.5Å; Y330-E332 VanDerWaalsContact C-N 3.3Å; Y330-E332 PolarHBondContact O-N 2.96Å; Y330-I333 HydrophobicContact CD1-CD1 4.49Å; Y330-I333 PolarHBondContact O-N 2.92Å; Y330-L334 WeakPolarHBondContact O-CB 3.19Å; Y330-L334 WeakPolarHBondContact O-CG 3.36Å; Y330-L334 PolarHBondContact O-N 3.03Å
331	V	96.4	Very high	96.7	Very high	6 Å²	6	36.6 Å²	36.6	4%	0.036	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-38.4	175.4	169.3	0	0	0	0	111.5	F167 D168 L193 I327 L334 G335 R338	F167-V331 HydrophobicContact CE2-CG2 3.68Å; F167-V331 HydrophobicContact CZ-CG1 4.49Å; F167-V331 HydrophobicContact CZ-CG2 4.07Å; D168-V331 HydrophobicContact CB-CB 4.36Å; D168-V331 HydrophobicContact CB-CG1 3.76Å; D168-V331 HydrophobicContact CB-CG2 4.09Å; L193-V331 HydrophobicContact CD1-CG2 3.99Å; I327-V331 HydrophobicContact CG2-CG2 4.02Å; I327-V331 WeakPolarHBondContact O-CB 3.18Å; I327-V331 VanDerWaalsContact O-CG2 3.24Å; I327-V331 WeakPolarHBondContact O-CG2 2.86Å; I327-V331 PolarHBondContact O-N 2.92Å; V331-L334 CarbonylContact O-C 3.59Å; V331-L334 PolarHBondContact O-N 3.3Å; V331-G335 WeakPolarHBondContact O-CA 3.34Å; V331-G335 PolarHBondContact O-N 2.75Å; V331-R338 VanDerWaalsContact CG1-NH1 3.34Å
332	E	96	Very high	96.6	Very high	149 Å²	149	38.6 Å²	38.6	70%	0.696	18%	0.184	S	C	*	.	H	α-helix	trans	-64.7	-44.1	174.6	-173	68	-170.2	0	0	111.3	Y328 E329 Y330 L334 G335	Y328-E332 WeakPolarHBondContact O-CB 3.3Å; Y328-E332 PolarHBondContact O-N 3.05Å; E329-E332 PolarHBondContact O-N 3.23Å; Y330-E332 VanDerWaalsContact C-N 3.3Å; Y330-E332 PolarHBondContact O-N 2.96Å; E332-L334 VanDerWaalsContact C-N 3.26Å; E332-L334 PolarHBondContact O-N 3.44Å; E332-G335 PolarHBondContact O-N 3.18Å
333	I	96.3	Very high	96.5	Very high	33 Å²	33	40.9 Å²	40.9	17%	0.169	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-35.2	177.1	-70.1	160.7	0	0	0	112.1	T197 K201 L209 E329 Y330	T197-I333 HydrophobicContact CG2-CG2 4.15Å; K201-I333 HydrophobicContact CD-CG2 3.96Å; K201-I333 PolarHBondContact NZ-O 3.1Å; L209-I333 HydrophobicContact CD1-CD1 3.85Å; L209-I333 HydrophobicContact CD2-CD1 3.46Å; L209-I333 VanDerWaalsContact CD2-CD1 3.46Å; L209-I333 HydrophobicContact CG-CD1 4.31Å; E329-I333 WeakPolarHBondContact O-CD1 2.95Å; E329-I333 VanDerWaalsContact O-CG1 3.31Å; E329-I333 WeakPolarHBondContact O-CG1 3.41Å; E329-I333 PolarHBondContact O-N 3.05Å; Y330-I333 HydrophobicContact CD1-CD1 4.49Å; Y330-I333 PolarHBondContact O-N 2.92Å
334	L	96.9	Very high	96.2	Very high	1 Å²	1	40 Å²	40	1%	0.005	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	21	-178.5	-60.9	176.3	0	0	0	112.7	L140 L193 Y196 T197 Y330 V331 E332 E336 Q337 R338	L140-L334 HydrophobicContact CD2-CD1 4.14Å; L193-L334 HydrophobicContact CD2-CD1 3.86Å; Y196-L334 HydrophobicContact CD1-CD1 3.87Å; Y196-L334 HydrophobicContact CD1-CD2 3.83Å; Y196-L334 HydrophobicContact CE1-CD2 3.95Å; T197-L334 WeakPolarHBondContact OG1-CD1 3.46Å; Y330-L334 WeakPolarHBondContact O-CB 3.19Å; Y330-L334 WeakPolarHBondContact O-CG 3.36Å; Y330-L334 PolarHBondContact O-N 3.03Å; V331-L334 CarbonylContact O-C 3.59Å; V331-L334 PolarHBondContact O-N 3.3Å; E332-L334 VanDerWaalsContact C-N 3.26Å; E332-L334 PolarHBondContact O-N 3.44Å; L334-E336 VanDerWaalsContact C-N 3.26Å; L334-E336 PolarHBondContact O-N 3.48Å; L334-Q337 PolarHBondContact O-N 2.96Å; L334-R338 WeakPolarHBondContact O-CB 3.06Å; L334-R338 PolarHBondContact O-N 2.88Å
335	G	96.5	Very high	96	Very high	22 Å²	22	41 Å²	41	23%	0.227	20%	0.197	C	C	.	.	H	α-helix	trans	-59.6	-33.3	-174	0	0	0	0	0	114.2	V331 E332 H339	V331-G335 WeakPolarHBondContact O-CA 3.34Å; V331-G335 PolarHBondContact O-N 2.75Å; E332-G335 PolarHBondContact O-N 3.18Å; G335-H339 WeakPolarHBondContact O-CB 3.33Å; G335-H339 PolarHBondContact O-N 3.24Å; G335-H339 VanDerWaalsContact O-N 3.09Å
336	E	95.7	Very high	95.7	Very high	134 Å²	134	45.7 Å²	45.7	63%	0.626	22%	0.218	S	C	*	.	H	α-helix	trans	-67.2	-52.9	175.2	-179.2	173	-164.1	0	0	111.2	L334 R338 H339 L340	L334-E336 VanDerWaalsContact C-N 3.26Å; L334-E336 PolarHBondContact O-N 3.48Å; E336-R338 VanDerWaalsContact C-N 3.28Å; E336-R338 PolarHBondContact O-N 3.01Å; E336-H339 PolarHBondContact O-N 3.34Å; E336-H339 VanDerWaalsContact O-N 3.09Å; E336-L340 HydrophobicContact CG-CD1 3.96Å; E336-L340 HydrophobicContact CG-CG 4.44Å; E336-L340 WeakPolarHBondContact O-CG 3.42Å; E336-L340 PolarHBondContact O-N 3.23Å
337	Q	97	Very high	95.2	Very high	12 Å²	12	49.6 Å²	49.6	6%	0.056	23%	0.232	C	C	.	.	H	α-helix	trans	-59.3	-40.6	177.2	-69.8	74.3	14.4	0	0	111	G137 L140 Y196 L334 H339 L340 T341	G137-Q337 WeakPolarHBondContact O-CG 3.49Å; L140-Q337 HydrophobicContact CD2-CB 4.12Å; L140-Q337 HydrophobicContact CG-CB 4.02Å; Y196-Q337 HydrophobicContact CE1-CB 4.44Å; Y196-Q337 HydrophobicContact CE1-CG 4.04Å; L334-Q337 PolarHBondContact O-N 2.96Å; Q337-H339 PolarHBondContact O-N 3.1Å; Q337-L340 PolarHBondContact O-N 3.4Å; Q337-T341 VanDerWaalsContact O-CB 3.28Å; Q337-T341 WeakPolarHBondContact O-CB 3.47Å; Q337-T341 PolarHBondContact O-N 3Å; Q337-T341 PolarHBondContact O-OG1 2.89Å
338	R	95.9	Very high	94.7	Very high	84 Å²	84	50.4 Å²	50.4	32%	0.317	24%	0.235	S	C	.	.	H	α-helix	trans	-56.6	-49	173.9	-172.2	-170.8	77.2	-157.5	-9.2	111.3	L140 F167 D168 V331 L334 E336 T341 H342	L140-R338 HydrophobicContact CD1-CB 4.23Å; F167-R338 HydrophobicContact CE1-CG 3.87Å; F167-R338 HydrophobicContact CZ-CG 4.01Å; D168-R338 IonicContact OD2-CZ 2.9Å; D168-R338 IonicContact OD2-NE 2.73Å; D168-R338 IonicContact OD2-NH1 2.7Å; D168-R338 PolarHBondContact OD2-NH1 3Å; V331-R338 VanDerWaalsContact CG1-NH1 3.34Å; L334-R338 WeakPolarHBondContact O-CB 3.06Å; L334-R338 PolarHBondContact O-N 2.88Å; E336-R338 VanDerWaalsContact C-N 3.28Å; E336-R338 PolarHBondContact O-N 3.01Å; R338-T341 PolarHBondContact O-N 2.78Å; R338-H342 PolarHBondContact O-N 3.43Å; R338-H342 VanDerWaalsContact O-N 3.14Å
339	H	95.9	Very high	94	Very high	104 Å²	104	53 Å²	53	48%	0.481	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-48.6	-179.4	-179	50.3	0	0	0	111.8	G335 E336 Q337 T341 H342 E343	G335-H339 WeakPolarHBondContact O-CB 3.33Å; G335-H339 PolarHBondContact O-N 3.24Å; G335-H339 VanDerWaalsContact O-N 3.09Å; E336-H339 PolarHBondContact O-N 3.34Å; E336-H339 VanDerWaalsContact O-N 3.09Å; Q337-H339 PolarHBondContact O-N 3.1Å; H339-T341 VanDerWaalsContact C-N 3.29Å; H339-T341 PolarHBondContact O-N 3.28Å; H339-H342 PolarHBondContact O-N 2.79Å; H339-E343 IonicContact CE1-OE1 3.15Å; H339-E343 PolarHBondContact CE1-OE1 2.98Å; H339-E343 IonicContact NE2-OE1 3.54Å; H339-E343 PolarHBondContact NE2-OE1 3.07Å; H339-E343 PolarHBondContact O-N 2.79Å
340	L	96.1	Very high	93.2	Very high	43 Å²	43	55.4 Å²	55.4	23%	0.225	28%	0.275	C	S	.	.	H	α-helix	trans	-60	-38.8	178	-70.2	175.8	0	0	0	112.1	R138 Y139 E336 Q337 E343 N344	R138-L340 HydrophobicContact CG-CD1 4.34Å; Y139-L340 HydrophobicContact CD1-CB 3.96Å; Y139-L340 HydrophobicContact CE1-CB 3.97Å; E336-L340 HydrophobicContact CG-CD1 3.96Å; E336-L340 HydrophobicContact CG-CG 4.44Å; E336-L340 WeakPolarHBondContact O-CG 3.42Å; E336-L340 PolarHBondContact O-N 3.23Å; Q337-L340 PolarHBondContact O-N 3.4Å; L340-E343 PolarHBondContact O-N 3.46Å; L340-N344 WeakPolarHBondContact O-CB 3.32Å; L340-N344 PolarHBondContact O-N 2.8Å
341	T	96.3	Very high	92.2	Very high	4 Å²	4	58.5 Å²	58.5	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-62.4	-46.4	176.1	-56.1	0	0	0	0	111.2	Y139 L140 L164 Q337 R338 H339 N344 V345	Y139-T341 WeakPolarHBondContact CA-OG1 3.37Å; L140-T341 HydrophobicContact CB-CG2 4.39Å; L140-T341 PolarHBondContact N-OG1 3.48Å; L140-T341 VanDerWaalsContact O-CG2 3.22Å; L140-T341 WeakPolarHBondContact O-CG2 3.39Å; L164-T341 HydrophobicContact CD1-CG2 4.08Å; L164-T341 HydrophobicContact CD2-CG2 4.28Å; Q337-T341 VanDerWaalsContact O-CB 3.28Å; Q337-T341 WeakPolarHBondContact O-CB 3.47Å; Q337-T341 PolarHBondContact O-N 3Å; Q337-T341 PolarHBondContact O-OG1 2.89Å; R338-T341 PolarHBondContact O-N 2.78Å; H339-T341 VanDerWaalsContact C-N 3.29Å; H339-T341 PolarHBondContact O-N 3.28Å; T341-N344 PolarHBondContact O-N 2.71Å; T341-V345 WeakPolarHBondContact O-CG2 3.24Å; T341-V345 PolarHBondContact O-N 3.35Å
342	H	95	Very high	91	Very high	43 Å²	43	62 Å²	62	20%	0.199	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-47.2	177.5	-176.7	-72.6	0	0	0	111.3	S165 R338 H339 V345 Q346	S165-H342 PolarHBondContact OG-CD2 2.72Å; S165-H342 PolarHBondContact OG-NE2 3.21Å; S165-H342 VanDerWaalsContact OG-NE2 3.15Å; R338-H342 PolarHBondContact O-N 3.43Å; R338-H342 VanDerWaalsContact O-N 3.14Å; H339-H342 PolarHBondContact O-N 2.79Å; H342-V345 PolarHBondContact O-N 2.83Å; H342-Q346 WeakPolarHBondContact O-CB 3.36Å; H342-Q346 PolarHBondContact O-N 3.27Å
343	E	93.5	Very high	89.9	Confident	88 Å²	88	57.4 Å²	57.4	41%	0.411	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-43	177.3	-69.2	-164.4	151.5	0	0	112.3	H339 L340 Q346 R347	H339-E343 IonicContact CE1-OE1 3.15Å; H339-E343 PolarHBondContact CE1-OE1 2.98Å; H339-E343 IonicContact NE2-OE1 3.54Å; H339-E343 PolarHBondContact NE2-OE1 3.07Å; H339-E343 PolarHBondContact O-N 2.79Å; L340-E343 PolarHBondContact O-N 3.46Å; E343-Q346 PolarHBondContact O-N 3.07Å; E343-R347 VanDerWaalsContact O-CB 3.26Å; E343-R347 WeakPolarHBondContact O-CB 3.32Å; E343-R347 PolarHBondContact O-N 3.37Å
344	N	92.5	Very high	88.5	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-59.8	-48.3	177.2	-176.1	41.1	0	0	0	111.3	Y139 L340 T341 Q346 R347 K348 Q363	Y139-N344 HydrophobicContact CD1-CB 3.95Å; Y139-N344 HydrophobicContact CE1-CB 3.57Å; L340-N344 WeakPolarHBondContact O-CB 3.32Å; L340-N344 PolarHBondContact O-N 2.8Å; T341-N344 PolarHBondContact O-N 2.71Å; N344-Q346 PolarHBondContact O-N 3.03Å; N344-R347 WeakPolarHBondContact O-CB 3.31Å; N344-R347 PolarHBondContact O-N 2.95Å; N344-K348 WeakPolarHBondContact O-CB 3.17Å; N344-K348 WeakPolarHBondContact O-CG 3.35Å; N344-K348 PolarHBondContact O-N 2.89Å; N344-Q363 PolarHBondContact OD1-NE2 3.42Å
345	V	91.9	Very high	87.3	Confident	20 Å²	20	67.2 Å²	67.2	12%	0.121	35%	0.346	C	S	.	.	H	α-helix	trans	-63.8	-42.1	178.1	172.2	0	0	0	0	111.3	Y160 I161 L164 T341 H342 R347 K348 Q349	Y160-V345 HydrophobicContact CD1-CG1 3.98Å; Y160-V345 HydrophobicContact CD1-CG2 4.27Å; Y160-V345 HydrophobicContact CE1-CG1 4.37Å; Y160-V345 HydrophobicContact CE1-CG2 3.82Å; I161-V345 HydrophobicContact CB-CG1 4.38Å; L164-V345 HydrophobicContact CD1-CB 4.07Å; L164-V345 HydrophobicContact CD1-CG1 4.3Å; L164-V345 HydrophobicContact CD1-CG2 3.79Å; T341-V345 WeakPolarHBondContact O-CG2 3.24Å; T341-V345 PolarHBondContact O-N 3.35Å; H342-V345 PolarHBondContact O-N 2.83Å; V345-R347 VanDerWaalsContact C-N 3.33Å; V345-R347 PolarHBondContact O-N 3.39Å; V345-K348 PolarHBondContact O-N 3.44Å; V345-Q349 WeakPolarHBondContact O-CG 3.34Å; V345-Q349 PolarHBondContact O-N 2.89Å
346	Q	91.1	Very high	85.8	Confident	106 Å²	106	70.7 Å²	70.7	50%	0.495	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-41.4	176.1	-171.8	175	2.3	0	0	111.9	I161 H342 E343 N344 Q349 A350	I161-Q346 HydrophobicContact CD1-CB 3.79Å; I161-Q346 HydrophobicContact CD1-CG 4.02Å; H342-Q346 WeakPolarHBondContact O-CB 3.36Å; H342-Q346 PolarHBondContact O-N 3.27Å; E343-Q346 PolarHBondContact O-N 3.07Å; N344-Q346 PolarHBondContact O-N 3.03Å; Q346-Q349 PolarHBondContact O-N 2.94Å; Q346-A350 PolarHBondContact O-N 2.71Å
347	R	88	Confident	84.4	Confident	94 Å²	94	70.6 Å²	70.6	36%	0.355	35%	0.352	S	S	.	.	H	α-helix	trans	-65.2	-47.7	176.5	-157	-157.6	-48.9	170.1	6.7	111.4	E343 N344 V345 Q349 A350 R351 E359	E343-R347 VanDerWaalsContact O-CB 3.26Å; E343-R347 WeakPolarHBondContact O-CB 3.32Å; E343-R347 PolarHBondContact O-N 3.37Å; N344-R347 WeakPolarHBondContact O-CB 3.31Å; N344-R347 PolarHBondContact O-N 2.95Å; V345-R347 VanDerWaalsContact C-N 3.33Å; V345-R347 PolarHBondContact O-N 3.39Å; R347-Q349 PolarHBondContact O-N 3.43Å; R347-A350 PolarHBondContact O-N 2.87Å; R347-A350 VanDerWaalsContact O-N 3.11Å; R347-R351 PolarHBondContact O-N 2.77Å; R347-E359 WeakPolarHBondContact CD-OE1 3.35Å; R347-E359 IonicContact CZ-OE1 2.68Å; R347-E359 IonicContact NH1-OE1 3.87Å; R347-E359 PolarHBondContact NH1-OE1 3.41Å
348	K	86	Confident	83	Confident	18 Å²	18	75.8 Å²	75.8	8%	0.078	38%	0.376	C	S	.	.	H	α-helix	trans	-59.6	-29.1	174.5	-74.5	-172.8	180	-171.1	0	112.5	E133 N344 V345 R356	E133-K348 IonicContact OE1-NZ 3.32Å; E133-K348 IonicContact OE2-NZ 3.34Å; E133-K348 PolarHBondContact OE2-NZ 2.66Å; N344-K348 WeakPolarHBondContact O-CB 3.17Å; N344-K348 WeakPolarHBondContact O-CG 3.35Å; N344-K348 PolarHBondContact O-N 2.89Å; V345-K348 PolarHBondContact O-N 3.44Å; K348-R356 PolarHBondContact O-NH1 3.48Å; K348-R356 PolarHBondContact O-NH2 2.77Å
349	Q	83.2	Confident	81.6	Confident	102 Å²	102	72.4 Å²	72.4	48%	0.477	36%	0.364	S	S	.	.	H	α-helix	trans	-77.8	-27.7	175.8	-76.4	-178.9	4.9	0	0	114	V345 Q346 R347 R351	V345-Q349 WeakPolarHBondContact O-CG 3.34Å; V345-Q349 PolarHBondContact O-N 2.89Å; Q346-Q349 PolarHBondContact O-N 2.94Å; R347-Q349 PolarHBondContact O-N 3.43Å; Q349-R351 VanDerWaalsContact C-N 3.33Å
350	A	79.7	Confident	80.1	Confident	89 Å²	89	71.6 Å²	71.6	74%	0.736	36%	0.361	S	S	*	.	H	α-helix	trans	-81.2	-14.6	-179.8	0	0	0	0	0	113.6	Q346 R347	Q346-A350 PolarHBondContact O-N 2.71Å; R347-A350 PolarHBondContact O-N 2.87Å; R347-A350 VanDerWaalsContact O-N 3.11Å
351	R	76.1	Confident	78.5	Confident	73 Å²	73	76.5 Å²	76.5	28%	0.275	38%	0.382	S	S	.	.	S	Bend	trans	-84.1	151	-175.1	-81	-174.9	154.4	98.1	-1.9	114.2	R347 Q349 E355 E359	R347-R351 PolarHBondContact O-N 2.77Å; Q349-R351 VanDerWaalsContact C-N 3.33Å; R351-E355 HydrophobicContact CB-CB 4.02Å; R351-E355 WeakPolarHBondContact CD-O 3.35Å; R351-E355 HydrophobicContact CG-CB 3.96Å; R351-E355 PolarHBondContact NE-O 2.85Å; R351-E359 IonicContact CZ-OE1 3.82Å; R351-E359 IonicContact CZ-OE2 3.75Å; R351-E359 IonicContact NE-OE1 2.75Å; R351-E359 IonicContact NE-OE2 2.7Å; R351-E359 PolarHBondContact NE-OE2 2.95Å; R351-E359 IonicContact NH1-OE1 2.75Å; R351-E359 PolarHBondContact NH1-OE1 3.33Å; R351-E359 IonicContact NH1-OE2 2.9Å; R351-E359 PolarHBondContact NH1-OE2 3.44Å; R351-E359 IonicContact NH2-OE1 3.25Å; R351-E359 PolarHBondContact NH2-OE1 3.24Å; R351-E359 IonicContact NH2-OE2 3.91Å
352	T	71.5	Confident	76.8	Confident	80 Å²	80	81.3 Å²	81.3	49%	0.491	40%	0.404	S	S	.	.			trans	-74	166.1	165.9	61.7	0	0	0	0	110.9	E354 E355 R356	T352-E354 PolarHBondContact O-N 2.83Å; T352-E355 PolarHBondContact N-OE2 3.02Å; T352-E355 PolarHBondContact O-N 3.4Å; T352-E355 VanDerWaalsContact OG1-CG 3.32Å; T352-E355 WeakPolarHBondContact OG1-CG 3.32Å; T352-E355 PolarHBondContact OG1-OE2 2.89Å; T352-R356 PolarHBondContact O-N 3.09Å
353	G	72.9	Confident	75	Confident	52 Å²	52	80.9 Å²	80.9	54%	0.536	40%	0.403	S	S	.	.	H	α-helix	trans	-58.8	-43.6	-177.2	0	0	0	0	0	113.6	R356 E357	G353-R356 WeakPolarHBondContact O-CB 3.33Å; G353-R356 PolarHBondContact O-N 3.29Å; G353-E357 PolarHBondContact O-N 2.92Å
354	E	66.1	Low	73.3	Confident	153 Å²	153	82.4 Å²	82.4	72%	0.715	41%	0.412	S	S	*	.	H	α-helix	trans	-64.5	-43.6	178.9	-66.4	174.4	171.2	0	0	111.6	T352 R356 E357 E358	T352-E354 PolarHBondContact O-N 2.83Å; E354-R356 PolarHBondContact O-N 3.36Å; E354-E357 PolarHBondContact O-N 3.07Å; E354-E358 PolarHBondContact O-N 3.37Å; E354-E358 VanDerWaalsContact O-N 3.16Å
355	E	72.5	Confident	71.4	Confident	87 Å²	87	84.9 Å²	84.9	41%	0.407	43%	0.43	S	S	.	.	H	α-helix	trans	-65.7	-20.1	177	-68.8	168.7	154.5	0	0	113.2	R351 T352 E359	R351-E355 HydrophobicContact CB-CB 4.02Å; R351-E355 WeakPolarHBondContact CD-O 3.35Å; R351-E355 HydrophobicContact CG-CB 3.96Å; R351-E355 PolarHBondContact NE-O 2.85Å; T352-E355 PolarHBondContact N-OE2 3.02Å; T352-E355 PolarHBondContact O-N 3.4Å; T352-E355 VanDerWaalsContact OG1-CG 3.32Å; T352-E355 WeakPolarHBondContact OG1-CG 3.32Å; T352-E355 PolarHBondContact OG1-OE2 2.89Å; E355-E359 PolarHBondContact O-N 2.87Å
356	R	64.9	Low	69.3	Low	94 Å²	94	87.6 Å²	87.6	36%	0.355	44%	0.441	S	S	.	.	H	α-helix	trans	-78.1	-43.3	176.8	-167.7	-168.6	-136	90.5	3.9	110.8	K348 T352 G353 E354 E359 E360	K348-R356 PolarHBondContact O-NH1 3.48Å; K348-R356 PolarHBondContact O-NH2 2.77Å; T352-R356 PolarHBondContact O-N 3.09Å; G353-R356 WeakPolarHBondContact O-CB 3.33Å; G353-R356 PolarHBondContact O-N 3.29Å; E354-R356 PolarHBondContact O-N 3.36Å; R356-E359 PolarHBondContact O-N 2.94Å; R356-E360 WeakPolarHBondContact O-CG 3.42Å; R356-E360 PolarHBondContact O-N 3.25Å; R356-E360 VanDerWaalsContact O-N 3.1Å
357	E	66.4	Low	67.4	Low	132 Å²	132	83.9 Å²	83.9	62%	0.617	43%	0.427	S	S	*	.	H	α-helix	trans	-65.3	-44.5	178.3	-68.1	176.2	-174.7	0	0	110.9	G353 E354 E359 E360 E361	G353-E357 PolarHBondContact O-N 2.92Å; E354-E357 PolarHBondContact O-N 3.07Å; E357-E359 VanDerWaalsContact C-N 3.29Å; E357-E359 PolarHBondContact O-N 3.45Å; E357-E360 PolarHBondContact O-N 2.89Å; E357-E361 PolarHBondContact O-N 3.17Å; E357-E361 VanDerWaalsContact O-N 3.16Å
358	E	67.5	Low	65.6	Low	121 Å²	121	85.5 Å²	85.5	57%	0.565	44%	0.439	S	S	*	.	H	α-helix	trans	-59.5	-38.4	175.7	-70.9	179.3	173.6	0	0	112.1	E354 E361 E362	E354-E358 PolarHBondContact O-N 3.37Å; E354-E358 VanDerWaalsContact O-N 3.16Å; E358-E361 PolarHBondContact O-N 2.76Å; E358-E362 WeakPolarHBondContact O-CB 3.23Å; E358-E362 WeakPolarHBondContact O-CG 3.33Å; E358-E362 PolarHBondContact O-N 2.88Å
359	E	67.4	Low	63.7	Low	13 Å²	13	88.2 Å²	88.2	6%	0.061	46%	0.46	C	S	.	.	H	α-helix	trans	-73.2	-32.5	178.7	-118.6	-161.4	177.9	0	0	113.7	R347 R351 E355 R356 E357 E361 E362 Q363	R347-E359 WeakPolarHBondContact CD-OE1 3.35Å; R347-E359 IonicContact CZ-OE1 2.68Å; R347-E359 IonicContact NH1-OE1 3.87Å; R347-E359 PolarHBondContact NH1-OE1 3.41Å; R351-E359 IonicContact CZ-OE1 3.82Å; R351-E359 IonicContact CZ-OE2 3.75Å; R351-E359 IonicContact NE-OE1 2.75Å; R351-E359 IonicContact NE-OE2 2.7Å; R351-E359 PolarHBondContact NE-OE2 2.95Å; R351-E359 IonicContact NH1-OE1 2.75Å; R351-E359 PolarHBondContact NH1-OE1 3.33Å; R351-E359 IonicContact NH1-OE2 2.9Å; R351-E359 PolarHBondContact NH1-OE2 3.44Å; R351-E359 IonicContact NH2-OE1 3.25Å; R351-E359 PolarHBondContact NH2-OE1 3.24Å; R351-E359 IonicContact NH2-OE2 3.91Å; E355-E359 PolarHBondContact O-N 2.87Å; R356-E359 PolarHBondContact O-N 2.94Å; E357-E359 VanDerWaalsContact C-N 3.29Å; E357-E359 PolarHBondContact O-N 3.45Å; E359-E361 VanDerWaalsContact C-N 3.28Å; E359-E362 PolarHBondContact O-N 2.94Å; E359-Q363 VanDerWaalsContact O-CB 3.29Å; E359-Q363 WeakPolarHBondContact O-CB 3.23Å; E359-Q363 VanDerWaalsContact O-CG 3.27Å; E359-Q363 WeakPolarHBondContact O-CG 3.23Å; E359-Q363 PolarHBondContact O-N 3.42Å
360	E	64.4	Low	62.2	Low	87 Å²	87	87.7 Å²	87.7	41%	0.407	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-38.5	174.2	-74.9	170.1	-166.7	0	0	110	R356 E357 I364	R356-E360 WeakPolarHBondContact O-CG 3.42Å; R356-E360 PolarHBondContact O-N 3.25Å; R356-E360 VanDerWaalsContact O-N 3.1Å; E357-E360 PolarHBondContact O-N 2.89Å; E360-I364 WeakPolarHBondContact O-CD1 3.5Å; E360-I364 WeakPolarHBondContact O-CG1 3.24Å; E360-I364 PolarHBondContact O-N 2.92Å
361	E	61.4	Low	60.7	Low	146 Å²	146	86.8 Å²	86.8	68%	0.682	44%	0.44	S	S	*	.	H	α-helix	trans	-67.8	-43.3	171.6	-67.2	-175	175.7	0	0	112.3	E357 E358 E359 I364 S365	E357-E361 PolarHBondContact O-N 3.17Å; E357-E361 VanDerWaalsContact O-N 3.16Å; E358-E361 PolarHBondContact O-N 2.76Å; E359-E361 VanDerWaalsContact C-N 3.28Å; E361-I364 PolarHBondContact O-N 3.35Å; E361-S365 PolarHBondContact O-N 3.07Å
362	E	60.2	Low	59.3	Low	105 Å²	105	91.3 Å²	91.3	49%	0.491	47%	0.465	S	S	.	.	H	α-helix	trans	-66.3	-40	177.7	-77	-178.7	170.2	0	0	112.1	E358 E359 I364 S365 E366	E358-E362 WeakPolarHBondContact O-CB 3.23Å; E358-E362 WeakPolarHBondContact O-CG 3.33Å; E358-E362 PolarHBondContact O-N 2.88Å; E359-E362 PolarHBondContact O-N 2.94Å; E362-I364 VanDerWaalsContact C-N 3.29Å; E362-I364 PolarHBondContact O-N 2.94Å; E362-S365 CarbonylContact O-C 3.24Å; E362-S365 WeakPolarHBondContact O-CA 3.44Å; E362-S365 PolarHBondContact O-N 3.32Å; E362-S365 PolarHBondContact O-OG 2.99Å; E362-E366 PolarHBondContact O-N 3.34Å
363	Q	58.8	Low	58.2	Low	35 Å²	35	96.3 Å²	96.3	16%	0.164	48%	0.482	C	S	.	.	H	α-helix	trans	-61.5	-36.6	179.1	-82.1	-177.2	6	0	0	112.3	N344 E359 S365 S367	N344-Q363 PolarHBondContact OD1-NE2 3.42Å; E359-Q363 VanDerWaalsContact O-CB 3.29Å; E359-Q363 WeakPolarHBondContact O-CB 3.23Å; E359-Q363 VanDerWaalsContact O-CG 3.27Å; E359-Q363 WeakPolarHBondContact O-CG 3.23Å; E359-Q363 PolarHBondContact O-N 3.42Å; Q363-S365 VanDerWaalsContact C-N 3.29Å; Q363-S365 PolarHBondContact O-N 3.19Å; Q363-S367 PolarHBondContact O-N 3.35Å
364	I	56.8	Low	57	Low	119 Å²	119	100.9 Å²	100.9	61%	0.61	50%	0.495	S	S	*	.	H	α-helix	trans	-61	-42.9	172.1	-64.3	164.4	0	0	0	109.5	E360 E361 E362 S367	E360-I364 WeakPolarHBondContact O-CD1 3.5Å; E360-I364 WeakPolarHBondContact O-CG1 3.24Å; E360-I364 PolarHBondContact O-N 2.92Å; E361-I364 PolarHBondContact O-N 3.35Å; E362-I364 VanDerWaalsContact C-N 3.29Å; E362-I364 PolarHBondContact O-N 2.94Å; I364-S367 PolarHBondContact O-OG 3.24Å
365	S	52	Low	56.3	Low	56 Å²	56	101.2 Å²	101.2	39%	0.392	50%	0.496	S	S	.	.	H	α-helix	trans	-77.5	-33.6	-179.7	83.3	0	0	0	0	115	E361 E362 Q363 S367 E368 S369	E361-S365 PolarHBondContact O-N 3.07Å; E362-S365 CarbonylContact O-C 3.24Å; E362-S365 WeakPolarHBondContact O-CA 3.44Å; E362-S365 PolarHBondContact O-N 3.32Å; E362-S365 PolarHBondContact O-OG 2.99Å; Q363-S365 VanDerWaalsContact C-N 3.29Å; Q363-S365 PolarHBondContact O-N 3.19Å; S365-S367 VanDerWaalsContact C-N 3.29Å; S365-S367 PolarHBondContact O-N 2.87Å; S365-E368 WeakPolarHBondContact O-CA 3.49Å; S365-E368 WeakPolarHBondContact O-CB 3.25Å; S365-E368 PolarHBondContact O-N 3.02Å; S365-S369 PolarHBondContact O-N 3.35Å; S365-S369 PolarHBondContact O-OG 2.9Å
366	E	49.3	Very low	55.4	Low	77 Å²	77	105.5 Å²	105.5	36%	0.36	52%	0.52	S	S	.	.	H	α-helix	trans	-68	-34.4	178	-80.2	-168.4	159	0	0	109.8	E362 E368 S369	E362-E366 PolarHBondContact O-N 3.34Å; E366-E368 PolarHBondContact O-N 3.08Å; E366-S369 PolarHBondContact O-N 3.42Å; E366-S369 VanDerWaalsContact O-N 3.1Å
367	S	50.8	Low	54.9	Low	29 Å²	29	104.1 Å²	104.1	20%	0.203	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-18.3	171.6	81	0	0	0	0	113.4	R34 Q363 I364 S365	R34-S367 PolarHBondContact NH2-OG 3.49Å; Q363-S367 PolarHBondContact O-N 3.35Å; I364-S367 PolarHBondContact O-OG 3.24Å; S365-S367 VanDerWaalsContact C-N 3.29Å; S365-S367 PolarHBondContact O-N 2.87Å
368	E	50.9	Low	54.9	Low	127 Å²	127	107.4 Å²	107.4	59%	0.593	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-8.9	179.7	-57.9	-170.1	161	0	0	114.6	R34 S365 E366	R34-E368 IonicContact NH1-OE1 3.95Å; S365-E368 WeakPolarHBondContact O-CA 3.49Å; S365-E368 WeakPolarHBondContact O-CB 3.25Å; S365-E368 PolarHBondContact O-N 3.02Å; E366-E368 PolarHBondContact O-N 3.08Å
369	S	45.7	Very low	55.3	Low	76 Å²	76	103.3 Å²	103.3	53%	0.531	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.8	25.2	-162.8	61.6	0	0	0	0	118.6	S365 E366 D371	S365-S369 PolarHBondContact O-N 3.35Å; S365-S369 PolarHBondContact O-OG 2.9Å; E366-S369 PolarHBondContact O-N 3.42Å; E366-S369 VanDerWaalsContact O-N 3.1Å; S369-D371 PolarHBondContact O-N 3.27Å
370	E	51.2	Low	55.5	Low	91 Å²	91	107.3 Å²	107.3	43%	0.425	54%	0.537	S	S	.	.			trans	-67	3.9	-177.9	-77	-173.6	156.5	0	0	117.6	R138	R138-E370 IonicContact CZ-OE1 2.75Å; R138-E370 IonicContact NH1-OE1 2.95Å; R138-E370 PolarHBondContact NH1-OE1 3Å; R138-E370 IonicContact NH2-OE1 3.96Å; R138-E370 PolarHBondContact NH2-OE1 3.01Å
371	D	47.4	Very low	55.7	Low	69 Å²	69	110 Å²	110	37%	0.369	55%	0.547	S	S	.	.			trans	-122.7	28.1	-154.5	-133.8	21.8	0	0	0	117.9	K29 S31 S369	K29-D371 IonicContact NZ-OD2 2.61Å; K29-D371 PolarHBondContact NZ-OD2 3.34Å; S31-D371 WeakPolarHBondContact CA-OD2 3.43Å; S31-D371 WeakPolarHBondContact CB-OD2 3.44Å; S369-D371 PolarHBondContact O-N 3.27Å
372	E	47	Very low	56.2	Low	169 Å²	169	108.8 Å²	108.8	79%	0.79	55%	0.545	S	S	*	.	S	Bend	trans	-97.4	-8.5	173.7	-77.5	-162.4	170.7	0	0	116.2
373	E	49.1	Very low	57.1	Low	184 Å²	184	104.7 Å²	104.7	86%	0.86	53%	0.527	S	S	*	.	S	Bend	trans	-100.8	-1.6	-167.6	-71.2	-160.4	153.7	0	0	117.7
374	N	46.9	Very low	57.9	Low	149 Å²	149	105.1 Å²	105.1	80%	0.797	53%	0.532	S	S	*	.			trans	-120.6	11.9	-170.3	-73.9	-46.5	0	0	0	117.9
375	E	51.6	Low	59	Low	159 Å²	159	103.7 Å²	103.7	74%	0.743	53%	0.525	S	S	*	.	S	Bend	trans	-89.6	120.3	164	-73.7	-165.5	166.9	0	0	111	I377	E375-I377 VanDerWaalsContact C-N 3.29Å; E375-I377 PolarHBondContact O-N 3.44Å
376	I	53.9	Low	60.1	Low	177 Å²	177	102.1 Å²	102.1	91%	0.908	52%	0.518	S	S	*	.			trans	-67.9	87	177	-56.5	172.1	0	0	0	109.3	Y378	I376-Y378 PolarHBondContact O-N 2.92Å
377	I	54.6	Low	61.4	Low	66 Å²	66	110.2 Å²	110.2	34%	0.338	55%	0.545	S	S	.	.			trans	-68.6	125	175.8	-65.4	142.9	0	0	0	109.3	E375 N379 L385 G389 P391	E375-I377 VanDerWaalsContact C-N 3.29Å; E375-I377 PolarHBondContact O-N 3.44Å; I377-N379 PolarHBondContact O-N 2.98Å; I377-L385 HydrophobicContact CD1-CD1 4.04Å; I377-L385 HydrophobicContact CG2-CD2 4.45Å; I377-G389 WeakPolarHBondContact CD1-O 3.49Å; I377-P391 HydrophobicContact CG2-CG 4.19Å
378	Y	66.9	Low	62.8	Low	201 Å²	201	112.6 Å²	112.6	79%	0.788	56%	0.556	S	S	*	*			trans	-62.8	96.8	178.6	-178.3	-103.2	0	0	0	111.4	I376 P380	I376-Y378 PolarHBondContact O-N 2.92Å; Y378-P380 HydrophobicContact CD1-CG 4.2Å; Y378-P380 HydrophobicContact CE1-CB 4.44Å; Y378-P380 HydrophobicContact CE1-CG 3.68Å; Y378-P380 WeakPolarHBondContact O-CD 3.13Å
379	N	75.2	Confident	63.8	Low	35 Å²	35	107.6 Å²	107.6	19%	0.187	54%	0.538	C	S	.	.			trans	-123.1	70.5	-176.2	-172.7	6.7	0	0	0	112.2	I377 K381 N382 L383 P391	I377-N379 PolarHBondContact O-N 2.98Å; N379-K381 PolarHBondContact O-N 3.45Å; N379-N382 PolarHBondContact O-N 3.5Å; N379-N382 PolarHBondContact OD1-N 3.22Å; N379-L383 PolarHBondContact ND2-N 3.24Å; N379-L383 PolarHBondContact ND2-O 3.09Å; N379-L383 PolarHBondContact OD1-N 3.06Å; N379-P391 HydrophobicContact CB-CG 3.81Å
380	P	70.9	Confident	65.4	Low	97 Å²	97	110.3 Å²	110.3	63%	0.63	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-15	-171.5	26	-35.9	0	0	0	114.7	Y378	Y378-P380 HydrophobicContact CD1-CG 4.2Å; Y378-P380 HydrophobicContact CE1-CB 4.44Å; Y378-P380 HydrophobicContact CE1-CG 3.68Å; Y378-P380 WeakPolarHBondContact O-CD 3.13Å
381	K	69.7	Low	66.8	Low	142 Å²	142	108 Å²	108	62%	0.617	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	4.4	175.4	-71.7	-174.9	178.8	177.8	0	113.3	N379 L383	N379-K381 PolarHBondContact O-N 3.45Å; K381-L383 HydrophobicContact CB-CD1 3.98Å; K381-L383 HydrophobicContact CB-CD2 4.46Å; K381-L383 HydrophobicContact CB-CG 3.8Å; K381-L383 HydrophobicContact CD-CD1 4.44Å; K381-L383 PolarHBondContact O-N 3.26Å
382	N	70.4	Confident	68.5	Low	122 Å²	122	105.7 Å²	105.7	65%	0.652	52%	0.521	S	S	*	.			trans	47.1	43.2	-177.5	-150.3	8.9	0	0	0	112.6	N379	N379-N382 PolarHBondContact O-N 3.5Å; N379-N382 PolarHBondContact OD1-N 3.22Å
383	L	80.5	Confident	70.2	Confident	19 Å²	19	101 Å²	101	10%	0.099	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-76.6	147.2	179.5	-65.6	167.7	0	0	0	109.7	N379 K381 P391 Y394 Y397	N379-L383 PolarHBondContact ND2-N 3.24Å; N379-L383 PolarHBondContact ND2-O 3.09Å; N379-L383 PolarHBondContact OD1-N 3.06Å; K381-L383 HydrophobicContact CB-CD1 3.98Å; K381-L383 HydrophobicContact CB-CD2 4.46Å; K381-L383 HydrophobicContact CB-CG 3.8Å; K381-L383 HydrophobicContact CD-CD1 4.44Å; K381-L383 PolarHBondContact O-N 3.26Å; L383-P391 HydrophobicContact CB-CB 4.2Å; L383-Y394 HydrophobicContact CD1-CD2 4.43Å; L383-Y394 HydrophobicContact CD2-CD2 3.92Å; L383-Y397 HydrophobicContact CD2-CD1 3.8Å; L383-Y397 HydrophobicContact CD2-CD2 4.14Å; L383-Y397 HydrophobicContact CD2-CE1 4.26Å; L383-Y397 HydrophobicContact CD2-CG 3.74Å
384	P	74	Confident	71.8	Confident	43 Å²	43	97.5 Å²	97.5	28%	0.279	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-53.8	143.2	173.6	-24.3	34.6	0	0	0	111.3	I392 Y397 L402	P384-I392 HydrophobicContact CB-CD1 4.04Å; P384-I392 HydrophobicContact CB-CG1 4.45Å; P384-I392 HydrophobicContact CG-CD1 4.15Å; P384-I392 WeakPolarHBondContact O-CG1 3.47Å; P384-I392 WeakPolarHBondContact O-CG2 3.45Å; P384-I392 PolarHBondContact O-N 3.13Å; P384-Y397 HydrophobicContact CG-CD2 3.99Å; P384-Y397 HydrophobicContact CG-CE2 4.11Å; P384-L402 HydrophobicContact CG-CD1 4.23Å
385	L	80	Confident	73.8	Confident	89 Å²	89	98.1 Å²	98.1	47%	0.466	48%	0.476	S	S	.	.	B	Isolated β-bridge	trans	-79.4	142.5	175.5	-57.1	178.9	0	0	0	109.6	I377 K390 P391	I377-L385 HydrophobicContact CD1-CD1 4.04Å; I377-L385 HydrophobicContact CG2-CD2 4.45Å; L385-K390 CarbonylContact C-O 3.57Å; L385-K390 WeakPolarHBondContact CA-O 3.36Å; L385-P391 HydrophobicContact CD2-CB 4.38Å; L385-P391 HydrophobicContact CD2-CG 3.93Å
386	G	76.3	Confident	75.3	Confident	23 Å²	23	92.9 Å²	92.9	24%	0.237	45%	0.453	C	S	.	.			trans	-77.8	-178.5	172	0	0	0	0	0	111.6	D388 G389 K390	G386-D388 PolarHBondContact O-N 3.46Å; G386-D388 VanDerWaalsContact O-N 3.15Å; G386-G389 PolarHBondContact O-N 3.38Å; G386-G389 VanDerWaalsContact O-N 3.13Å; G386-K390 PolarHBondContact N-O 3.42Å
387	W	77	Confident	76.7	Confident	247 Å²	247	86.2 Å²	86.2	94%	0.936	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-9.2	173.2	64.1	-87.8	0	0	0	113.4
388	D	78.6	Confident	78.2	Confident	80 Å²	80	88.2 Å²	88.2	43%	0.428	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	9.6	176.4	67.2	-22.8	0	0	0	112.8	G386 K390	G386-D388 PolarHBondContact O-N 3.46Å; G386-D388 VanDerWaalsContact O-N 3.15Å; D388-K390 PolarHBondContact O-N 3.16Å; D388-K390 VanDerWaalsContact O-N 3.11Å; D388-K390 PolarHBondContact OD1-N 3.36Å; D388-K390 VanDerWaalsContact OD1-N 3.12Å
389	G	73.2	Confident	79.1	Confident	22 Å²	22	84.3 Å²	84.3	23%	0.227	42%	0.415	C	S	.	.	S	Bend	trans	68.7	1.3	-175	0	0	0	0	0	114.4	I377 G386	I377-G389 WeakPolarHBondContact CD1-O 3.49Å; G386-G389 PolarHBondContact O-N 3.38Å; G386-G389 VanDerWaalsContact O-N 3.13Å
390	K	79.8	Confident	79.4	Confident	133 Å²	133	87 Å²	87	58%	0.578	43%	0.426	S	S	*	.	S	Bend	trans	-98.8	150.8	-177.9	-64.2	174.3	-173.4	164	0	111.2	L385 G386 D388 I392	L385-K390 CarbonylContact C-O 3.57Å; L385-K390 WeakPolarHBondContact CA-O 3.36Å; G386-K390 PolarHBondContact N-O 3.42Å; D388-K390 PolarHBondContact O-N 3.16Å; D388-K390 VanDerWaalsContact O-N 3.11Å; D388-K390 PolarHBondContact OD1-N 3.36Å; D388-K390 VanDerWaalsContact OD1-N 3.12Å; K390-I392 PolarHBondContact O-N 3.11Å
391	P	80.7	Confident	80.1	Confident	42 Å²	42	82.7 Å²	82.7	27%	0.273	40%	0.4	S	S	.	.	B	Isolated β-bridge	trans	-58.3	125.9	177.1	-23.5	33.9	0	0	0	111.6	I377 N379 L383 L385	I377-P391 HydrophobicContact CG2-CG 4.19Å; N379-P391 HydrophobicContact CB-CG 3.81Å; L383-P391 HydrophobicContact CB-CB 4.2Å; L385-P391 HydrophobicContact CD2-CB 4.38Å; L385-P391 HydrophobicContact CD2-CG 3.93Å
392	I	81.8	Confident	80.8	Confident	21 Å²	21	78 Å²	78	11%	0.108	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-58.9	146.7	-179.1	65.4	179	0	0	0	111.1	P384 K390 Y394 Y397 L402	P384-I392 HydrophobicContact CB-CD1 4.04Å; P384-I392 HydrophobicContact CB-CG1 4.45Å; P384-I392 HydrophobicContact CG-CD1 4.15Å; P384-I392 WeakPolarHBondContact O-CG1 3.47Å; P384-I392 WeakPolarHBondContact O-CG2 3.45Å; P384-I392 PolarHBondContact O-N 3.13Å; K390-I392 PolarHBondContact O-N 3.11Å; I392-Y394 PolarHBondContact O-N 3.34Å; I392-Y397 HydrophobicContact CD1-CD2 4.4Å; I392-L402 HydrophobicContact CD1-CD1 3.73Å
393	P	83.8	Confident	81.4	Confident	69 Å²	69	75.8 Å²	75.8	45%	0.448	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-53.8	136.5	174.7	-27.3	34.9	0	0	0	112.4	W395 L396 Y397	P393-W395 HydrophobicContact CB-CG 4.48Å; P393-W395 PolarHBondContact O-N 3.49Å; P393-W395 VanDerWaalsContact O-N 3.09Å; P393-L396 HydrophobicContact CB-CB 4.41Å; P393-L396 WeakPolarHBondContact O-CA 3.33Å; P393-L396 WeakPolarHBondContact O-CB 3.25Å; P393-L396 PolarHBondContact O-N 2.95Å; P393-Y397 PolarHBondContact O-N 2.78Å; P393-Y397 VanDerWaalsContact O-N 3.13Å
394	Y	82.9	Confident	81.8	Confident	111 Å²	111	78.4 Å²	78.4	44%	0.435	38%	0.382	S	S	.	.	H	α-helix	trans	-57.3	-30.2	-175.1	-176.4	-109	0	0	0	114.3	L383 I392 Y397 K398	L383-Y394 HydrophobicContact CD1-CD2 4.43Å; L383-Y394 HydrophobicContact CD2-CD2 3.92Å; I392-Y394 PolarHBondContact O-N 3.34Å; Y394-Y397 HydrophobicContact CD2-CD1 4.29Å; Y394-Y397 HydrophobicContact CE2-CD1 4.23Å; Y394-Y397 WeakPolarHBondContact O-CB 3.1Å; Y394-K398 HydrophobicContact CE1-CD 4.01Å; Y394-K398 VanDerWaalsContact CE1-CE 3.45Å; Y394-K398 HydrophobicContact CE1-CG 4.49Å; Y394-K398 VanDerWaalsContact CZ-CE 3.46Å; Y394-K398 PolarHBondContact O-N 2.88Å; Y394-K398 VanDerWaalsContact O-N 3.16Å; Y394-K398 WeakPolarHBondContact OH-CE 3.46Å; Y394-K398 PolarHBondContact OH-NZ 3.12Å
395	W	87.1	Confident	82.6	Confident	163 Å²	163	80.8 Å²	80.8	62%	0.617	39%	0.393	S	S	*	.	H	α-helix	trans	-71.3	-33.6	174.9	69.4	-91.1	0	0	0	112	P393 K398 L399	P393-W395 HydrophobicContact CB-CG 4.48Å; P393-W395 PolarHBondContact O-N 3.49Å; P393-W395 VanDerWaalsContact O-N 3.09Å; W395-K398 PolarHBondContact O-N 3.24Å; W395-L399 HydrophobicContact CE3-CB 4.49Å; W395-L399 HydrophobicContact CE3-CD2 4.13Å; W395-L399 HydrophobicContact CZ3-CD2 3.7Å; W395-L399 WeakPolarHBondContact O-CB 3.39Å; W395-L399 PolarHBondContact O-N 3.11Å
396	L	84.5	Confident	83.2	Confident	48 Å²	48	80.1 Å²	80.1	25%	0.251	39%	0.385	S	S	.	.	H	α-helix	trans	-66.1	-43	174.6	-136	98.5	0	0	0	110.2	P393 K398 L399 H400	P393-L396 HydrophobicContact CB-CB 4.41Å; P393-L396 WeakPolarHBondContact O-CA 3.33Å; P393-L396 WeakPolarHBondContact O-CB 3.25Å; P393-L396 PolarHBondContact O-N 2.95Å; L396-K398 VanDerWaalsContact C-N 3.32Å; L396-K398 PolarHBondContact O-N 2.8Å; L396-L399 PolarHBondContact O-N 3.13Å; L396-H400 PolarHBondContact O-CD2 3.24Å; L396-H400 PolarHBondContact O-N 3.15Å
397	Y	82.5	Confident	84.1	Confident	37 Å²	37	83.5 Å²	83.5	15%	0.145	40%	0.398	C	S	.	.	H	α-helix	trans	-55.6	-45.7	173.7	176.4	-108.2	0	0	0	112	L383 P384 I392 P393 Y394 L402 N403	L383-Y397 HydrophobicContact CD2-CD1 3.8Å; L383-Y397 HydrophobicContact CD2-CD2 4.14Å; L383-Y397 HydrophobicContact CD2-CE1 4.26Å; L383-Y397 HydrophobicContact CD2-CG 3.74Å; P384-Y397 HydrophobicContact CG-CD2 3.99Å; P384-Y397 HydrophobicContact CG-CE2 4.11Å; I392-Y397 HydrophobicContact CD1-CD2 4.4Å; P393-Y397 PolarHBondContact O-N 2.78Å; P393-Y397 VanDerWaalsContact O-N 3.13Å; Y394-Y397 HydrophobicContact CD2-CD1 4.29Å; Y394-Y397 HydrophobicContact CE2-CD1 4.23Å; Y394-Y397 WeakPolarHBondContact O-CB 3.1Å; Y397-L402 HydrophobicContact CD2-CB 3.36Å; Y397-L402 HydrophobicContact CD2-CD1 4.19Å; Y397-L402 HydrophobicContact CD2-CG 4.41Å; Y397-L402 VanDerWaalsContact CE2-C 3.4Å; Y397-L402 HydrophobicContact CE2-CB 3.42Å; Y397-L402 VanDerWaalsContact CE2-CB 3.42Å; Y397-L402 WeakPolarHBondContact CE2-O 3.48Å; Y397-L402 HydrophobicContact CG-CB 4.27Å; Y397-L402 VanDerWaalsContact CZ-O 3.32Å; Y397-L402 WeakPolarHBondContact O-CB 3.43Å; Y397-L402 PolarHBondContact O-N 2.98Å; Y397-L402 PolarHBondContact OH-O 3.32Å; Y397-L402 VanDerWaalsContact OH-O 3.05Å; Y397-N403 HydrophobicContact CD1-CB 4.14Å; Y397-N403 HydrophobicContact CE1-CB 3.5Å; Y397-N403 VanDerWaalsContact CE1-CB 3.5Å; Y397-N403 WeakPolarHBondContact OH-CA 3.46Å
398	K	85.6	Confident	85	Confident	108 Å²	108	71.8 Å²	71.8	47%	0.47	35%	0.353	S	S	.	.	H	α-helix	trans	-71	-40.8	174.4	-77	-169.4	172.8	180	0	113.5	Y394 W395 L396 H400 G401	Y394-K398 HydrophobicContact CE1-CD 4.01Å; Y394-K398 VanDerWaalsContact CE1-CE 3.45Å; Y394-K398 HydrophobicContact CE1-CG 4.49Å; Y394-K398 VanDerWaalsContact CZ-CE 3.46Å; Y394-K398 PolarHBondContact O-N 2.88Å; Y394-K398 VanDerWaalsContact O-N 3.16Å; Y394-K398 WeakPolarHBondContact OH-CE 3.46Å; Y394-K398 PolarHBondContact OH-NZ 3.12Å; W395-K398 PolarHBondContact O-N 3.24Å; L396-K398 VanDerWaalsContact C-N 3.32Å; L396-K398 PolarHBondContact O-N 2.8Å; K398-H400 PolarHBondContact O-N 3.39Å; K398-G401 PolarHBondContact O-N 3.14Å; K398-G401 VanDerWaalsContact O-N 3.11Å
399	L	85.8	Confident	85.8	Confident	120 Å²	120	71.6 Å²	71.6	63%	0.628	35%	0.35	S	S	*	.	H	α-helix	trans	-63.1	-42.8	-177.4	179.4	65.3	0	0	0	111.6	W395 L396 G401	W395-L399 HydrophobicContact CE3-CB 4.49Å; W395-L399 HydrophobicContact CE3-CD2 4.13Å; W395-L399 HydrophobicContact CZ3-CD2 3.7Å; W395-L399 WeakPolarHBondContact O-CB 3.39Å; W395-L399 PolarHBondContact O-N 3.11Å; L396-L399 PolarHBondContact O-N 3.13Å; L399-G401 PolarHBondContact O-N 3.37Å
400	H	83.2	Confident	86.9	Confident	90 Å²	90	71.1 Å²	71.1	42%	0.417	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	2.3	176.9	-70.1	-60.1	0	0	0	113.7	L396 K398 L402	L396-H400 PolarHBondContact O-CD2 3.24Å; L396-H400 PolarHBondContact O-N 3.15Å; K398-H400 PolarHBondContact O-N 3.39Å; H400-L402 HydrophobicContact CB-CD1 4.25Å; H400-L402 HydrophobicContact CB-CG 4.08Å; H400-L402 PolarHBondContact O-N 2.94Å
401	G	84.5	Confident	87.6	Confident	8 Å²	8	65.2 Å²	65.2	8%	0.082	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	18.1	179.2	0	0	0	0	0	113.9	K398 L399 N403 I404 G418	K398-G401 PolarHBondContact O-N 3.14Å; K398-G401 VanDerWaalsContact O-N 3.11Å; L399-G401 PolarHBondContact O-N 3.37Å; G401-N403 PolarHBondContact O-N 3.27Å; G401-N403 VanDerWaalsContact O-N 3.1Å; G401-I404 WeakPolarHBondContact O-CB 3.25Å; G401-I404 PolarHBondContact O-N 3.48Å; G401-G418 WeakPolarHBondContact O-CA 3.26Å
402	L	84.7	Confident	88.1	Confident	44 Å²	44	66.5 Å²	66.5	23%	0.23	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-9.5	179.9	-64.7	170.5	0	0	0	112.6	P384 I392 Y397 H400 I404	P384-L402 HydrophobicContact CG-CD1 4.23Å; I392-L402 HydrophobicContact CD1-CD1 3.73Å; Y397-L402 HydrophobicContact CD2-CB 3.36Å; Y397-L402 HydrophobicContact CD2-CD1 4.19Å; Y397-L402 HydrophobicContact CD2-CG 4.41Å; Y397-L402 VanDerWaalsContact CE2-C 3.4Å; Y397-L402 HydrophobicContact CE2-CB 3.42Å; Y397-L402 VanDerWaalsContact CE2-CB 3.42Å; Y397-L402 WeakPolarHBondContact CE2-O 3.48Å; Y397-L402 HydrophobicContact CG-CB 4.27Å; Y397-L402 VanDerWaalsContact CZ-O 3.32Å; Y397-L402 WeakPolarHBondContact O-CB 3.43Å; Y397-L402 PolarHBondContact O-N 2.98Å; Y397-L402 PolarHBondContact OH-O 3.32Å; Y397-L402 VanDerWaalsContact OH-O 3.05Å; H400-L402 HydrophobicContact CB-CD1 4.25Å; H400-L402 HydrophobicContact CB-CG 4.08Å; H400-L402 PolarHBondContact O-N 2.94Å; L402-I404 VanDerWaalsContact C-N 3.32Å
403	N	82.2	Confident	88.6	Confident	75 Å²	75	70.8 Å²	70.8	40%	0.401	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-4.8	169.7	70.1	-65.8	0	0	0	114.2	Y397 G401	Y397-N403 HydrophobicContact CD1-CB 4.14Å; Y397-N403 HydrophobicContact CE1-CB 3.5Å; Y397-N403 VanDerWaalsContact CE1-CB 3.5Å; Y397-N403 WeakPolarHBondContact OH-CA 3.46Å; G401-N403 PolarHBondContact O-N 3.27Å; G401-N403 VanDerWaalsContact O-N 3.1Å
404	I	88.9	Confident	89	Confident	73 Å²	73	72.7 Å²	72.7	37%	0.374	36%	0.36	S	S	.	.			trans	-103	127.3	178.8	-54.1	175.2	0	0	0	107.9	G401 L402 Y406 G418	G401-I404 WeakPolarHBondContact O-CB 3.25Å; G401-I404 PolarHBondContact O-N 3.48Å; L402-I404 VanDerWaalsContact C-N 3.32Å; I404-Y406 HydrophobicContact CB-CE2 4.19Å; I404-Y406 HydrophobicContact CG2-CD2 4.34Å; I404-Y406 HydrophobicContact CG2-CE1 4.44Å; I404-Y406 HydrophobicContact CG2-CE2 3.67Å; I404-G418 PolarHBondContact O-N 2.94Å
405	N	91	Very high	89.5	Confident	94 Å²	94	70.2 Å²	70.2	50%	0.503	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.7	-179.5	-68.8	-19.7	0	0	0	109.6	T415	N405-T415 HydrophobicContact CB-CG2 3.61Å
406	Y	93.5	Very high	89.7	Confident	74 Å²	74	63 Å²	63	29%	0.29	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.9	174.3	-62.1	-89.8	0	0	0	109.2	I404 T415 Y416 P419 F422	I404-Y406 HydrophobicContact CB-CE2 4.19Å; I404-Y406 HydrophobicContact CG2-CD2 4.34Å; I404-Y406 HydrophobicContact CG2-CE1 4.44Å; I404-Y406 HydrophobicContact CG2-CE2 3.67Å; Y406-T415 CarbonylContact O-C 3.53Å; Y406-T415 WeakPolarHBondContact O-CA 3.44Å; Y406-Y416 PolarHBondContact N-O 3.47Å; Y406-Y416 PolarHBondContact O-N 3.28Å; Y406-P419 HydrophobicContact CE2-CB 4.46Å; Y406-P419 HydrophobicContact CE2-CG 4.18Å; Y406-F422 VanDerWaalsContact CB-CG 3.46Å; Y406-F422 AromaticContact CD1-CD1 3.94Å; Y406-F422 HydrophobicContact CD1-CD1 3.94Å; Y406-F422 HydrophobicContact CD1-CD2 4.49Å; Y406-F422 HydrophobicContact CD1-CE1 4.14Å; Y406-F422 HydrophobicContact CD1-CG 4.1Å; Y406-F422 HydrophobicContact CD1-CZ 4.47Å; Y406-F422 HydrophobicContact CD2-CB 3.78Å; Y406-F422 HydrophobicContact CD2-CD1 4.47Å; Y406-F422 HydrophobicContact CD2-CG 4.05Å; Y406-F422 HydrophobicContact CE1-CD1 4.48Å; Y406-F422 HydrophobicContact CG-CB 3.88Å; Y406-F422 AromaticContact CG-CD1 3.93Å; Y406-F422 HydrophobicContact CG-CD1 3.93Å; Y406-F422 AromaticContact CG-CD2 3.92Å; Y406-F422 HydrophobicContact CG-CD2 3.92Å; Y406-F422 HydrophobicContact CG-CE1 4.46Å; Y406-F422 HydrophobicContact CG-CE2 4.43Å; Y406-F422 AromaticContact CG-CG 3.62Å; Y406-F422 HydrophobicContact CG-CG 3.62Å
407	N	94.6	Very high	89.9	Confident	95 Å²	95	66.9 Å²	66.9	51%	0.508	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	142.6	179.5	-63.1	-19	0	0	0	110.1	T415	N407-T415 WeakPolarHBondContact OD1-CB 3.31Å; N407-T415 WeakPolarHBondContact OD1-CG2 3.23Å; N407-T415 PolarHBondContact OD1-OG1 2.88Å
408	C	95.9	Very high	90.2	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	116.1	174.2	-174.5	0	0	0	0	110.2	C411 N413 Y414 Y416 H425 T450	C408-C411 HydrophobicContact CB-CB 4Å; C408-C411 PolarHBondContact O-N 3.34Å; C408-C411 VanDerWaalsContact SG-SG 3.67Å; C408-N413 VanDerWaalsContact O-CA 3.24Å; C408-N413 WeakPolarHBondContact O-CA 3.39Å; C408-N413 PolarHBondContact O-N 3.35Å; C408-Y414 PolarHBondContact N-O 3.09Å; C408-Y414 VanDerWaalsContact N-O 3.14Å; C408-Y414 PolarHBondContact O-N 3.02Å; C408-Y416 HydrophobicContact CB-CD2 4.47Å; C408-Y416 HydrophobicContact CB-CE2 4.08Å; C408-H425 PolarHBondContact SG-NE2 2.75Å; C408-T450 HydrophobicContact CB-CG2 4.31Å
409	E	96.1	Very high	90.4	Very high	77 Å²	77	62.5 Å²	62.5	36%	0.36	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-40.8	-178.1	-164.9	-170.2	-180	0	0	110.9	C411 G412 N413 T450 Q451 I452	E409-C411 PolarHBondContact O-N 3.36Å; E409-G412 PolarHBondContact O-N 3.11Å; E409-N413 WeakPolarHBondContact CA-OD1 3.42Å; E409-T450 VanDerWaalsContact CB-O 3.24Å; E409-T450 WeakPolarHBondContact CB-O 3.17Å; E409-T450 PolarHBondContact N-O 3.33Å; E409-Q451 VanDerWaalsContact OE2-CA 3.26Å; E409-Q451 WeakPolarHBondContact OE2-CA 3.45Å; E409-I452 HydrophobicContact CB-CG1 4.32Å; E409-I452 HydrophobicContact CG-CD1 3.87Å; E409-I452 HydrophobicContact CG-CG1 3.94Å; E409-I452 PolarHBondContact OE2-N 3.49Å
410	I	94.8	Very high	90.6	Very high	12 Å²	12	64.8 Å²	64.8	6%	0.062	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.6	176.2	-63	163.6	0	0	0	111.9	G412 M435 L438 V449 T450 I452 A455	I410-G412 VanDerWaalsContact C-N 3.28Å; I410-G412 PolarHBondContact O-N 3.44Å; I410-M435 HydrophobicContact CD1-SD 3.99Å; I410-M435 HydrophobicContact CG2-CG 4.12Å; I410-M435 HydrophobicContact CG2-SD 4.09Å; I410-L438 HydrophobicContact CG1-CD1 4.36Å; I410-V449 HydrophobicContact CD1-CG1 4.38Å; I410-V449 WeakPolarHBondContact CD1-O 3.49Å; I410-T450 PolarHBondContact N-O 2.9Å; I410-I452 HydrophobicContact CG1-CG1 4.02Å; I410-A455 HydrophobicContact CD1-CB 4.08Å
411	C	94.7	Very high	90.9	Very high	9 Å²	9	62 Å²	62	6%	0.061	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	16.9	176.8	-66.2	0	0	0	0	113.9	C408 E409 Y414 Y416 R430	C408-C411 HydrophobicContact CB-CB 4Å; C408-C411 PolarHBondContact O-N 3.34Å; C408-C411 VanDerWaalsContact SG-SG 3.67Å; E409-C411 PolarHBondContact O-N 3.36Å; C411-Y414 WeakPolarHBondContact O-CB 3.31Å; C411-Y416 HydrophobicContact CB-CE2 4.34Å; C411-Y416 PolarHBondContact SG-OH 2.91Å; C411-Y416 VanDerWaalsContact SG-OH 3.4Å; C411-R430 HydrophobicContact CB-CG 4Å
412	G	92.1	Very high	91.3	Very high	68 Å²	68	63 Å²	63	70%	0.701	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	36.8	-175.9	0	0	0	0	0	113.2	E409 I410 Y414	E409-G412 PolarHBondContact O-N 3.11Å; I410-G412 VanDerWaalsContact C-N 3.28Å; I410-G412 PolarHBondContact O-N 3.44Å; G412-Y414 PolarHBondContact O-N 2.89Å
413	N	92.3	Very high	91.7	Very high	111 Å²	111	66.1 Å²	66.1	59%	0.594	34%	0.341	S	S	*	.	S	Bend	trans	58.1	29.1	-173.7	-73.7	-38.8	0	0	0	114.2	C408 E409	C408-N413 VanDerWaalsContact O-CA 3.24Å; C408-N413 WeakPolarHBondContact O-CA 3.39Å; C408-N413 PolarHBondContact O-N 3.35Å; E409-N413 WeakPolarHBondContact CA-OD1 3.42Å
414	Y	92.1	Very high	92.2	Very high	110 Å²	110	70.7 Å²	70.7	43%	0.431	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	138.2	175.6	-170.8	-95.3	0	0	0	111.4	C408 C411 G412 Y416	C408-Y414 PolarHBondContact N-O 3.09Å; C408-Y414 VanDerWaalsContact N-O 3.14Å; C408-Y414 PolarHBondContact O-N 3.02Å; C411-Y414 WeakPolarHBondContact O-CB 3.31Å; G412-Y414 PolarHBondContact O-N 2.89Å; Y414-Y416 HydrophobicContact CD1-CD1 4.1Å; Y414-Y416 AromaticContact CD1-CD2 3.91Å; Y414-Y416 HydrophobicContact CD1-CD2 3.91Å; Y414-Y416 AromaticContact CD1-CE1 3.79Å; Y414-Y416 HydrophobicContact CD1-CE1 3.79Å; Y414-Y416 AromaticContact CD1-CE2 3.6Å; Y414-Y416 HydrophobicContact CD1-CE2 3.6Å; Y414-Y416 HydrophobicContact CD1-CG 4.15Å; Y414-Y416 AromaticContact CD1-CZ 3.53Å; Y414-Y416 AromaticContact CE1-CD1 3.98Å; Y414-Y416 HydrophobicContact CE1-CD1 3.98Å; Y414-Y416 AromaticContact CE1-CE1 3.82Å; Y414-Y416 HydrophobicContact CE1-CE1 3.82Å; Y414-Y416 HydrophobicContact CE1-CE2 4.42Å; Y414-Y416 HydrophobicContact CE1-CG 4.35Å; Y414-Y416 HydrophobicContact CG-CE2 4.48Å
415	T	92.8	Very high	92.4	Very high	59 Å²	59	67.2 Å²	67.2	36%	0.362	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118	-179.7	-58.9	0	0	0	0	111.1	N405 Y406 N407	N405-T415 HydrophobicContact CB-CG2 3.61Å; Y406-T415 CarbonylContact O-C 3.53Å; Y406-T415 WeakPolarHBondContact O-CA 3.44Å; N407-T415 WeakPolarHBondContact OD1-CB 3.31Å; N407-T415 WeakPolarHBondContact OD1-CG2 3.23Å; N407-T415 PolarHBondContact OD1-OG1 2.88Å
416	Y	91.7	Very high	92.6	Very high	12 Å²	12	63.6 Å²	63.6	5%	0.047	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	134.2	173	-64.6	-87.6	0	0	0	110.6	Y406 C408 C411 Y414 F422 H425	Y406-Y416 PolarHBondContact N-O 3.47Å; Y406-Y416 PolarHBondContact O-N 3.28Å; C408-Y416 HydrophobicContact CB-CD2 4.47Å; C408-Y416 HydrophobicContact CB-CE2 4.08Å; C411-Y416 HydrophobicContact CB-CE2 4.34Å; C411-Y416 PolarHBondContact SG-OH 2.91Å; C411-Y416 VanDerWaalsContact SG-OH 3.4Å; Y414-Y416 HydrophobicContact CD1-CD1 4.1Å; Y414-Y416 AromaticContact CD1-CD2 3.91Å; Y414-Y416 HydrophobicContact CD1-CD2 3.91Å; Y414-Y416 AromaticContact CD1-CE1 3.79Å; Y414-Y416 HydrophobicContact CD1-CE1 3.79Å; Y414-Y416 AromaticContact CD1-CE2 3.6Å; Y414-Y416 HydrophobicContact CD1-CE2 3.6Å; Y414-Y416 HydrophobicContact CD1-CG 4.15Å; Y414-Y416 AromaticContact CD1-CZ 3.53Å; Y414-Y416 AromaticContact CE1-CD1 3.98Å; Y414-Y416 HydrophobicContact CE1-CD1 3.98Å; Y414-Y416 AromaticContact CE1-CE1 3.82Å; Y414-Y416 HydrophobicContact CE1-CE1 3.82Å; Y414-Y416 HydrophobicContact CE1-CE2 4.42Å; Y414-Y416 HydrophobicContact CE1-CG 4.35Å; Y414-Y416 HydrophobicContact CG-CE2 4.48Å; Y416-F422 HydrophobicContact CD2-CD2 4.3Å; Y416-H425 HydrophobicContact CD1-CB 3.84Å; Y416-H425 HydrophobicContact CD2-CB 4.38Å; Y416-H425 HydrophobicContact CE1-CB 3.3Å; Y416-H425 HydrophobicContact CE2-CB 3.91Å; Y416-H425 AromaticContact CE2-CD2 3.49Å; Y416-H425 VanDerWaalsContact CE2-CD2 3.49Å; Y416-H425 WeakPolarHBondContact CE2-CD2 3.35Å; Y416-H425 AromaticContact CE2-CG 3.66Å; Y416-H425 HydrophobicContact CG-CB 4.35Å; Y416-H425 AromaticContact CZ-CD2 3.65Å; Y416-H425 AromaticContact CZ-CG 3.62Å
417	R	88.7	Confident	92.5	Very high	129 Å²	129	64.2 Å²	64.2	49%	0.487	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.6	178.5	-66.7	-173.6	-179.6	178.9	1.7	110.7	A421	R417-A421 WeakPolarHBondContact O-CB 3.27Å
418	G	89.3	Confident	92.4	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.01	32%	0.323	C	S	.	.	S	Bend	trans	83.9	158.3	175	0	0	0	0	0	115.8	G401 I404 K420 A421 F422	G401-G418 WeakPolarHBondContact O-CA 3.26Å; I404-G418 PolarHBondContact O-N 2.94Å; G418-K420 VanDerWaalsContact C-N 3.34Å; G418-K420 PolarHBondContact O-N 3.34Å; G418-A421 PolarHBondContact O-N 3.29Å; G418-F422 PolarHBondContact O-N 2.95Å; G418-F422 VanDerWaalsContact O-N 3.15Å
419	P	90.5	Very high	92.3	Very high	52 Å²	52	70.4 Å²	70.4	34%	0.338	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-33.9	-170.5	-21.8	32.8	0	0	0	113.8	Y406 F422 Q423	Y406-P419 HydrophobicContact CE2-CB 4.46Å; Y406-P419 HydrophobicContact CE2-CG 4.18Å; P419-F422 PolarHBondContact O-N 2.92Å; P419-Q423 WeakPolarHBondContact O-CB 3.17Å; P419-Q423 WeakPolarHBondContact O-CG 3.17Å; P419-Q423 PolarHBondContact O-N 2.98Å
420	K	88.6	Confident	92.1	Very high	167 Å²	167	72 Å²	72	73%	0.726	36%	0.356	S	S	*	.	H	α-helix	trans	-66.9	-48.2	-179.3	-74.4	-170.3	176.1	-174.2	0	112.1	G418 F422 Q423 R424	G418-K420 VanDerWaalsContact C-N 3.34Å; G418-K420 PolarHBondContact O-N 3.34Å; K420-F422 VanDerWaalsContact C-N 3.3Å; K420-F422 PolarHBondContact O-N 3.11Å; K420-Q423 PolarHBondContact O-N 3.34Å; K420-R424 PolarHBondContact O-N 3.34Å
421	A	89.2	Confident	92.1	Very high	32 Å²	32	71.4 Å²	71.4	26%	0.264	35%	0.353	S	S	.	.	H	α-helix	trans	-61.6	-43	176.2	0	0	0	0	0	110.6	R417 G418 Q423 R424 H425	R417-A421 WeakPolarHBondContact O-CB 3.27Å; G418-A421 PolarHBondContact O-N 3.29Å; A421-Q423 VanDerWaalsContact C-N 3.32Å; A421-Q423 PolarHBondContact O-N 2.95Å; A421-R424 PolarHBondContact O-N 3.48Å; A421-H425 PolarHBondContact O-N 3.21Å
422	F	93.7	Very high	92	Very high	29 Å²	29	72 Å²	72	13%	0.127	36%	0.359	C	S	.	.	H	α-helix	trans	-68.1	-24	175.7	-176.3	-103.5	0	0	0	114	Y406 Y416 G418 P419 K420 H425 F426 T450	Y406-F422 VanDerWaalsContact CB-CG 3.46Å; Y406-F422 AromaticContact CD1-CD1 3.94Å; Y406-F422 HydrophobicContact CD1-CD1 3.94Å; Y406-F422 HydrophobicContact CD1-CD2 4.49Å; Y406-F422 HydrophobicContact CD1-CE1 4.14Å; Y406-F422 HydrophobicContact CD1-CG 4.1Å; Y406-F422 HydrophobicContact CD1-CZ 4.47Å; Y406-F422 HydrophobicContact CD2-CB 3.78Å; Y406-F422 HydrophobicContact CD2-CD1 4.47Å; Y406-F422 HydrophobicContact CD2-CG 4.05Å; Y406-F422 HydrophobicContact CE1-CD1 4.48Å; Y406-F422 HydrophobicContact CG-CB 3.88Å; Y406-F422 AromaticContact CG-CD1 3.93Å; Y406-F422 HydrophobicContact CG-CD1 3.93Å; Y406-F422 AromaticContact CG-CD2 3.92Å; Y406-F422 HydrophobicContact CG-CD2 3.92Å; Y406-F422 HydrophobicContact CG-CE1 4.46Å; Y406-F422 HydrophobicContact CG-CE2 4.43Å; Y406-F422 AromaticContact CG-CG 3.62Å; Y406-F422 HydrophobicContact CG-CG 3.62Å; Y416-F422 HydrophobicContact CD2-CD2 4.3Å; G418-F422 PolarHBondContact O-N 2.95Å; G418-F422 VanDerWaalsContact O-N 3.15Å; P419-F422 PolarHBondContact O-N 2.92Å; K420-F422 VanDerWaalsContact C-N 3.3Å; K420-F422 PolarHBondContact O-N 3.11Å; F422-H425 AromaticContact CD2-CE1 3.51Å; F422-H425 AromaticContact CD2-ND1 3.68Å; F422-H425 AromaticContact CE2-CE1 3.4Å; F422-H425 VanDerWaalsContact CE2-CE1 3.4Å; F422-H425 WeakPolarHBondContact CE2-CE1 3.49Å; F422-H425 PolarHBondContact O-CE1 2.92Å; F422-H425 VanDerWaalsContact O-CE1 3.28Å; F422-H425 PolarHBondContact O-ND1 3.38Å; F422-F426 HydrophobicContact CE1-CE2 4.25Å; F422-F426 HydrophobicContact CE1-CZ 4.27Å; F422-F426 HydrophobicContact CZ-CE2 4.42Å; F422-F426 HydrophobicContact CZ-CZ 4.05Å; F422-F426 WeakPolarHBondContact O-CE2 3.45Å; F422-T450 HydrophobicContact CE2-CG2 3.78Å; F422-T450 HydrophobicContact CZ-CG2 3.5Å
423	Q	92.8	Very high	92.1	Very high	109 Å²	109	72.6 Å²	72.6	51%	0.509	34%	0.343	S	S	.	.	H	α-helix	trans	-79.6	-38.4	171.8	-80.5	-67.2	-34.5	0	0	111.7	P419 K420 A421 H425 N448	P419-Q423 WeakPolarHBondContact O-CB 3.17Å; P419-Q423 WeakPolarHBondContact O-CG 3.17Å; P419-Q423 PolarHBondContact O-N 2.98Å; K420-Q423 PolarHBondContact O-N 3.34Å; A421-Q423 VanDerWaalsContact C-N 3.32Å; A421-Q423 PolarHBondContact O-N 2.95Å; Q423-H425 VanDerWaalsContact C-N 3.33Å; Q423-H425 PolarHBondContact O-N 3.49Å; Q423-N448 PolarHBondContact NE2-OD1 3.23Å; Q423-N448 VanDerWaalsContact NE2-OD1 3.09Å
424	R	92	Very high	92.2	Very high	172 Å²	172	67.8 Å²	67.8	65%	0.649	32%	0.32	S	S	*	.	H	α-helix	trans	-67.7	-32.7	179.8	-164.8	174.7	66.3	179.6	1.1	112.6	K420 A421 F426 A427 E428	K420-R424 PolarHBondContact O-N 3.34Å; A421-R424 PolarHBondContact O-N 3.48Å; R424-F426 PolarHBondContact O-N 2.75Å; R424-A427 PolarHBondContact O-N 2.66Å; R424-E428 HydrophobicContact CG-CG 4.4Å; R424-E428 IonicContact CZ-OE1 3.61Å; R424-E428 IonicContact NE-OE1 3.53Å; R424-E428 PolarHBondContact NE-OE1 3.47Å; R424-E428 IonicContact NH2-OE1 3.93Å; R424-E428 PolarHBondContact NH2-OE1 2.93Å
425	H	94.8	Very high	92.4	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-59.3	-25.6	-172.8	93.1	-78	0	0	0	115.3	C408 Y416 A421 F422 Q423 A427 E428 H431	C408-H425 PolarHBondContact SG-NE2 2.75Å; Y416-H425 HydrophobicContact CD1-CB 3.84Å; Y416-H425 HydrophobicContact CD2-CB 4.38Å; Y416-H425 HydrophobicContact CE1-CB 3.3Å; Y416-H425 HydrophobicContact CE2-CB 3.91Å; Y416-H425 AromaticContact CE2-CD2 3.49Å; Y416-H425 VanDerWaalsContact CE2-CD2 3.49Å; Y416-H425 WeakPolarHBondContact CE2-CD2 3.35Å; Y416-H425 AromaticContact CE2-CG 3.66Å; Y416-H425 HydrophobicContact CG-CB 4.35Å; Y416-H425 AromaticContact CZ-CD2 3.65Å; Y416-H425 AromaticContact CZ-CG 3.62Å; A421-H425 PolarHBondContact O-N 3.21Å; F422-H425 AromaticContact CD2-CE1 3.51Å; F422-H425 AromaticContact CD2-ND1 3.68Å; F422-H425 AromaticContact CE2-CE1 3.4Å; F422-H425 VanDerWaalsContact CE2-CE1 3.4Å; F422-H425 WeakPolarHBondContact CE2-CE1 3.49Å; F422-H425 PolarHBondContact O-CE1 2.92Å; F422-H425 VanDerWaalsContact O-CE1 3.28Å; F422-H425 PolarHBondContact O-ND1 3.38Å; Q423-H425 VanDerWaalsContact C-N 3.33Å; Q423-H425 PolarHBondContact O-N 3.49Å; H425-A427 PolarHBondContact O-N 3.47Å; H425-E428 PolarHBondContact O-N 3.44Å; H425-H431 AromaticContact CD2-ND1 3.68Å; H425-H431 AromaticContact NE2-ND1 3.52Å; H425-H431 WeakPolarHBondContact O-CB 3.43Å
426	F	94.6	Very high	92.4	Very high	18 Å²	18	67.8 Å²	67.8	8%	0.079	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-61.9	-26.1	177.3	-67.7	-69.1	0	0	0	112.9	F422 R424 H431 N442 N448 V449 T450	F422-F426 HydrophobicContact CE1-CE2 4.25Å; F422-F426 HydrophobicContact CE1-CZ 4.27Å; F422-F426 HydrophobicContact CZ-CE2 4.42Å; F422-F426 HydrophobicContact CZ-CZ 4.05Å; F422-F426 WeakPolarHBondContact O-CE2 3.45Å; R424-F426 PolarHBondContact O-N 2.75Å; F426-H431 AromaticContact CD1-CE1 3.66Å; F426-H431 AromaticContact CD1-NE2 3.65Å; F426-H431 AromaticContact CE1-CE1 3.86Å; F426-N442 PolarHBondContact O-ND2 2.86Å; F426-N448 HydrophobicContact CZ-CB 4.5Å; F426-V449 WeakPolarHBondContact CE1-O 3.36Å; F426-T450 HydrophobicContact CE1-CG2 4.37Å; F426-T450 HydrophobicContact CZ-CG2 4.18Å
427	A	91.8	Very high	92.5	Very high	87 Å²	87	71.6 Å²	71.6	72%	0.719	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-96.9	-9.4	174.7	0	0	0	0	0	113.2	R424 H425	R424-A427 PolarHBondContact O-N 2.66Å; H425-A427 PolarHBondContact O-N 3.47Å
428	E	92	Very high	92.7	Very high	54 Å²	54	68.3 Å²	68.3	25%	0.252	33%	0.332	S	S	.	.	S	Bend	trans	-77.4	153.4	-178.7	-68.8	174.8	-179.8	0	0	111.5	R424 H425 R430 H431 A432	R424-E428 HydrophobicContact CG-CG 4.4Å; R424-E428 IonicContact CZ-OE1 3.61Å; R424-E428 IonicContact NE-OE1 3.53Å; R424-E428 PolarHBondContact NE-OE1 3.47Å; R424-E428 IonicContact NH2-OE1 3.93Å; R424-E428 PolarHBondContact NH2-OE1 2.93Å; H425-E428 PolarHBondContact O-N 3.44Å; E428-R430 VanDerWaalsContact C-N 3.25Å; E428-R430 PolarHBondContact O-N 3.13Å; E428-R430 VanDerWaalsContact O-N 3.14Å; E428-H431 PolarHBondContact O-N 3.05Å; E428-A432 PolarHBondContact O-N 2.85Å; E428-A432 VanDerWaalsContact O-N 3.12Å
429	W	93.3	Very high	92.9	Very high	170 Å²	170	70.6 Å²	70.6	64%	0.644	36%	0.356	S	S	*	.	H	α-helix	trans	-51.8	-40.2	-176.7	167.6	91.2	0	0	0	113.5	H431 A432 H433	W429-H431 PolarHBondContact O-N 3.21Å; W429-A432 PolarHBondContact O-N 3.32Å; W429-H433 HydrophobicContact CZ2-CB 4.32Å; W429-H433 VanDerWaalsContact O-CB 3.24Å; W429-H433 WeakPolarHBondContact O-CB 3.27Å; W429-H433 PolarHBondContact O-N 3.17Å
430	R	92.6	Very high	93	Very high	110 Å²	110	68.3 Å²	68.3	42%	0.415	34%	0.341	S	S	.	.	H	α-helix	trans	-61	-43.3	-176.4	-171.7	-178.6	-63.6	-87.4	-2.4	112	C411 E428 G434	C411-R430 HydrophobicContact CB-CG 4Å; E428-R430 VanDerWaalsContact C-N 3.25Å; E428-R430 PolarHBondContact O-N 3.13Å; E428-R430 VanDerWaalsContact O-N 3.14Å; R430-G434 PolarHBondContact O-N 3.36Å
431	H	94.8	Very high	93.1	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-72.7	-42.8	177.6	-167.2	88.7	0	0	0	110.9	H425 F426 E428 W429 H433 G434 M435 V449	H425-H431 AromaticContact CD2-ND1 3.68Å; H425-H431 AromaticContact NE2-ND1 3.52Å; H425-H431 WeakPolarHBondContact O-CB 3.43Å; F426-H431 AromaticContact CD1-CE1 3.66Å; F426-H431 AromaticContact CD1-NE2 3.65Å; F426-H431 AromaticContact CE1-CE1 3.86Å; E428-H431 PolarHBondContact O-N 3.05Å; W429-H431 PolarHBondContact O-N 3.21Å; H431-H433 VanDerWaalsContact C-N 3.28Å; H431-H433 PolarHBondContact O-N 2.95Å; H431-G434 PolarHBondContact O-N 2.87Å; H431-M435 WeakPolarHBondContact O-CG 3.41Å; H431-M435 PolarHBondContact O-N 3.4Å; H431-V449 PolarHBondContact CE1-O 3.5Å
432	A	93.4	Very high	93.2	Very high	22 Å²	22	64.9 Å²	64.9	18%	0.182	33%	0.33	C	S	.	.	H	α-helix	trans	-59.4	-39.1	176.3	0	0	0	0	0	112.4	E428 W429 R436 N442	E428-A432 PolarHBondContact O-N 2.85Å; E428-A432 VanDerWaalsContact O-N 3.12Å; W429-A432 PolarHBondContact O-N 3.32Å; A432-R436 WeakPolarHBondContact O-CB 3.19Å; A432-R436 PolarHBondContact O-N 2.67Å; A432-N442 HydrophobicContact CB-CB 4.37Å
433	H	93.5	Very high	93.1	Very high	80 Å²	80	66.2 Å²	66.2	37%	0.37	34%	0.34	S	S	.	.	H	α-helix	trans	-67.7	-45.4	175.3	-173.5	75.8	0	0	0	111.4	W429 H431 M435 R436 C437	W429-H433 HydrophobicContact CZ2-CB 4.32Å; W429-H433 VanDerWaalsContact O-CB 3.24Å; W429-H433 WeakPolarHBondContact O-CB 3.27Å; W429-H433 PolarHBondContact O-N 3.17Å; H431-H433 VanDerWaalsContact C-N 3.28Å; H431-H433 PolarHBondContact O-N 2.95Å; H433-M435 VanDerWaalsContact C-N 3.32Å; H433-M435 PolarHBondContact O-N 3.31Å; H433-R436 WeakPolarHBondContact O-CB 3.43Å; H433-R436 PolarHBondContact O-N 2.91Å; H433-R436 VanDerWaalsContact O-N 3.1Å; H433-C437 PolarHBondContact O-N 3Å; H433-C437 PolarHBondContact O-SG 3.02Å; H433-C437 VanDerWaalsContact O-SG 3.35Å
434	G	94.7	Very high	93.1	Very high	11 Å²	11	65.5 Å²	65.5	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-56	-45.8	173.8	0	0	0	0	0	112.5	R430 H431 R436 C437 L438	R430-G434 PolarHBondContact O-N 3.36Å; H431-G434 PolarHBondContact O-N 2.87Å; G434-R436 VanDerWaalsContact C-N 3.35Å; G434-R436 PolarHBondContact O-N 2.96Å; G434-C437 PolarHBondContact O-N 3.18Å; G434-L438 WeakPolarHBondContact O-CG 3.21Å; G434-L438 PolarHBondContact O-N 3.37Å; G434-L438 VanDerWaalsContact O-N 3.16Å
435	M	95.4	Very high	93	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-61.3	-41.4	174.8	-69.5	-63.4	-76.4	0	0	112.3	I410 H431 H433 L438 G439 I440 N442 F446 A455	I410-M435 HydrophobicContact CD1-SD 3.99Å; I410-M435 HydrophobicContact CG2-CG 4.12Å; I410-M435 HydrophobicContact CG2-SD 4.09Å; H431-M435 WeakPolarHBondContact O-CG 3.41Å; H431-M435 PolarHBondContact O-N 3.4Å; H433-M435 VanDerWaalsContact C-N 3.32Å; H433-M435 PolarHBondContact O-N 3.31Å; M435-L438 PolarHBondContact O-N 3.24Å; M435-G439 PolarHBondContact O-N 3.27Å; M435-I440 CarbonylContact C-O 3.28Å; M435-I440 VanDerWaalsContact C-O 3.24Å; M435-I440 HydrophobicContact CE-CB 3.8Å; M435-I440 HydrophobicContact CE-CG2 3.41Å; M435-I440 VanDerWaalsContact CE-CG2 3.41Å; M435-I440 PolarHBondContact O-N 3.09Å; M435-N442 HydrophobicContact CB-CB 4.24Å; M435-N442 HydrophobicContact CG-CB 4.47Å; M435-F446 HydrophobicContact CE-CB 3.69Å; M435-F446 HydrophobicContact CE-CD1 3.59Å; M435-F446 HydrophobicContact CE-CD2 3.78Å; M435-F446 HydrophobicContact CE-CE1 4.15Å; M435-F446 HydrophobicContact CE-CE2 4.32Å; M435-F446 HydrophobicContact CE-CG 3.39Å; M435-F446 HydrophobicContact CE-CZ 4.48Å; M435-A455 HydrophobicContact SD-CB 4.42Å
436	R	93.4	Very high	93	Very high	167 Å²	167	62.8 Å²	62.8	63%	0.63	35%	0.347	S	S	*	.	H	α-helix	trans	-63.8	-41.3	176.6	-168.5	-177.1	-63.2	144.9	1.4	112.1	A432 H433 G434 L438 G439	A432-R436 WeakPolarHBondContact O-CB 3.19Å; A432-R436 PolarHBondContact O-N 2.67Å; H433-R436 WeakPolarHBondContact O-CB 3.43Å; H433-R436 PolarHBondContact O-N 2.91Å; H433-R436 VanDerWaalsContact O-N 3.1Å; G434-R436 VanDerWaalsContact C-N 3.35Å; G434-R436 PolarHBondContact O-N 2.96Å; R436-L438 PolarHBondContact O-N 2.9Å; R436-G439 PolarHBondContact O-N 3.42Å
437	C	93.3	Very high	92.8	Very high	92 Å²	92	64.3 Å²	64.3	62%	0.622	36%	0.363	S	S	*	.	H	α-helix	trans	-62.5	-31.3	174.9	-69.2	0	0	0	0	112.7	H433 G434 G439	H433-C437 PolarHBondContact O-N 3Å; H433-C437 PolarHBondContact O-SG 3.02Å; H433-C437 VanDerWaalsContact O-SG 3.35Å; G434-C437 PolarHBondContact O-N 3.18Å; C437-G439 VanDerWaalsContact C-N 3.27Å; C437-G439 PolarHBondContact O-N 3.18Å
438	L	93.1	Very high	92.8	Very high	60 Å²	60	65 Å²	65	31%	0.314	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-4.6	173.6	-63.2	173	0	0	0	113.4	I410 G434 M435 R436 I440 I452	I410-L438 HydrophobicContact CG1-CD1 4.36Å; G434-L438 WeakPolarHBondContact O-CG 3.21Å; G434-L438 PolarHBondContact O-N 3.37Å; G434-L438 VanDerWaalsContact O-N 3.16Å; M435-L438 PolarHBondContact O-N 3.24Å; R436-L438 PolarHBondContact O-N 2.9Å; L438-I440 VanDerWaalsContact C-N 3.32Å; L438-I440 HydrophobicContact CB-CD1 4.03Å; L438-I440 HydrophobicContact CB-CG1 4Å; L438-I440 HydrophobicContact CD1-CD1 4.5Å; L438-I452 HydrophobicContact CD1-CG1 4.35Å; L438-I452 HydrophobicContact CD1-CG2 4.03Å; L438-I452 HydrophobicContact CD2-CG2 3.71Å
439	G	92.6	Very high	92.9	Very high	50 Å²	50	63.5 Å²	63.5	52%	0.515	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	27.7	-175.1	0	0	0	0	0	113.6	M435 R436 C437 W459	M435-G439 PolarHBondContact O-N 3.27Å; R436-G439 PolarHBondContact O-N 3.42Å; C437-G439 VanDerWaalsContact C-N 3.27Å; C437-G439 PolarHBondContact O-N 3.18Å; G439-W459 PolarHBondContact O-NE1 3.16Å
440	I	93.6	Very high	92.9	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.021	33%	0.328	C	S	.	.			trans	-115.2	124.7	-179.4	-50.7	178.1	0	0	0	109	M435 L438 N442 F446 A455 V456 W459	M435-I440 CarbonylContact C-O 3.28Å; M435-I440 VanDerWaalsContact C-O 3.24Å; M435-I440 HydrophobicContact CE-CB 3.8Å; M435-I440 HydrophobicContact CE-CG2 3.41Å; M435-I440 VanDerWaalsContact CE-CG2 3.41Å; M435-I440 PolarHBondContact O-N 3.09Å; L438-I440 VanDerWaalsContact C-N 3.32Å; L438-I440 HydrophobicContact CB-CD1 4.03Å; L438-I440 HydrophobicContact CB-CG1 4Å; L438-I440 HydrophobicContact CD1-CD1 4.5Å; I440-N442 PolarHBondContact O-N 3.47Å; I440-F446 HydrophobicContact CG2-CD1 4.32Å; I440-F446 HydrophobicContact CG2-CD2 4.18Å; I440-F446 HydrophobicContact CG2-CE1 3.68Å; I440-F446 HydrophobicContact CG2-CE2 3.51Å; I440-F446 HydrophobicContact CG2-CZ 3.23Å; I440-A455 HydrophobicContact CD1-CB 3.93Å; I440-V456 HydrophobicContact CD1-CG2 4.3Å; I440-W459 HydrophobicContact CB-CG 4.41Å; I440-W459 HydrophobicContact CD1-CB 3.98Å; I440-W459 HydrophobicContact CD1-CG 4.36Å; I440-W459 HydrophobicContact CG1-CB 4.09Å; I440-W459 HydrophobicContact CG1-CG 3.92Å; I440-W459 HydrophobicContact CG2-CB 4.06Å; I440-W459 HydrophobicContact CG2-CD2 3.96Å; I440-W459 HydrophobicContact CG2-CE3 4.21Å; I440-W459 HydrophobicContact CG2-CG 3.93Å
441	P	91.8	Very high	93.1	Very high	64 Å²	64	56.3 Å²	56.3	42%	0.416	33%	0.33	S	S	.	.			trans	-64.5	128.6	174	-20.6	32.8	0	0	0	111.6	T443 W459	P441-T443 HydrophobicContact CB-CG2 4.17Å; P441-T443 PolarHBondContact O-N 3.44Å; P441-W459 HydrophobicContact CG-CH2 3.63Å; P441-W459 HydrophobicContact CG-CZ2 3.96Å; P441-W459 HydrophobicContact CG-CZ3 4.26Å
442	N	91.1	Very high	93.1	Very high	63 Å²	63	59 Å²	59	34%	0.337	34%	0.343	S	S	.	.			trans	-70.8	100.2	175	-170	12.3	0	0	0	109.8	F426 A432 M435 I440	F426-N442 PolarHBondContact O-ND2 2.86Å; A432-N442 HydrophobicContact CB-CB 4.37Å; M435-N442 HydrophobicContact CB-CB 4.24Å; M435-N442 HydrophobicContact CG-CB 4.47Å; I440-N442 PolarHBondContact O-N 3.47Å
443	T	91.6	Very high	93.2	Very high	57 Å²	57	64.8 Å²	64.8	35%	0.35	37%	0.366	S	S	.	.			trans	-130.9	162.8	-177.7	55.8	0	0	0	0	109.5	P441 H445 F446	P441-T443 HydrophobicContact CB-CG2 4.17Å; P441-T443 PolarHBondContact O-N 3.44Å; T443-H445 PolarHBondContact O-N 3.24Å; T443-F446 PolarHBondContact O-N 3.41Å; T443-F446 WeakPolarHBondContact OG1-CD2 3.49Å
444	A	91.3	Very high	93.3	Very high	94 Å²	94	64.7 Å²	64.7	78%	0.777	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-55.2	-22.6	-178.2	0	0	0	0	0	114.3	F446 A447	A444-F446 PolarHBondContact O-N 2.75Å; A444-A447 WeakPolarHBondContact O-CB 3.46Å; A444-A447 PolarHBondContact O-N 3.05Å
445	H	91.1	Very high	93.3	Very high	114 Å²	114	64.2 Å²	64.2	53%	0.528	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-59.6	-26.6	174.1	-60.2	-62.5	0	0	0	113.7	T443 L458 L462	T443-H445 PolarHBondContact O-N 3.24Å; H445-L458 WeakPolarHBondContact O-CD2 3.25Å; H445-L462 HydrophobicContact CB-CD1 3.94Å
446	F	93.3	Very high	93.2	Very high	1 Å²	1	67.6 Å²	67.6	0%	0.004	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-97.6	6.9	-178.2	-62.1	-82.4	0	0	0	113.1	M435 I440 T443 A444 N448 V449 L458 W459 L462	M435-F446 HydrophobicContact CE-CB 3.69Å; M435-F446 HydrophobicContact CE-CD1 3.59Å; M435-F446 HydrophobicContact CE-CD2 3.78Å; M435-F446 HydrophobicContact CE-CE1 4.15Å; M435-F446 HydrophobicContact CE-CE2 4.32Å; M435-F446 HydrophobicContact CE-CG 3.39Å; M435-F446 HydrophobicContact CE-CZ 4.48Å; I440-F446 HydrophobicContact CG2-CD1 4.32Å; I440-F446 HydrophobicContact CG2-CD2 4.18Å; I440-F446 HydrophobicContact CG2-CE1 3.68Å; I440-F446 HydrophobicContact CG2-CE2 3.51Å; I440-F446 HydrophobicContact CG2-CZ 3.23Å; T443-F446 PolarHBondContact O-N 3.41Å; T443-F446 WeakPolarHBondContact OG1-CD2 3.49Å; A444-F446 PolarHBondContact O-N 2.75Å; F446-N448 PolarHBondContact O-N 3.42Å; F446-V449 WeakPolarHBondContact O-CB 3.35Å; F446-V449 PolarHBondContact O-N 3.31Å; F446-V449 VanDerWaalsContact O-N 3.08Å; F446-L458 HydrophobicContact CD1-CD2 3.79Å; F446-L458 HydrophobicContact CD1-CG 4.41Å; F446-L458 HydrophobicContact CE1-CB 4.04Å; F446-L458 HydrophobicContact CE1-CD2 3.83Å; F446-L458 HydrophobicContact CE1-CG 3.94Å; F446-W459 HydrophobicContact CE1-CB 4.28Å; F446-W459 HydrophobicContact CE2-CE3 4.26Å; F446-W459 HydrophobicContact CZ-CB 4Å; F446-W459 HydrophobicContact CZ-CD2 4.44Å; F446-W459 AromaticContact CZ-CE3 3.89Å; F446-W459 HydrophobicContact CZ-CE3 3.89Å; F446-L462 HydrophobicContact CE2-CD1 4.12Å; F446-L462 HydrophobicContact CZ-CD1 3.89Å
447	A	90.8	Very high	93.3	Very high	49 Å²	49	62.4 Å²	62.4	41%	0.405	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	134.3	173.4	0	0	0	0	0	110.5	A444 V449	A444-A447 WeakPolarHBondContact O-CB 3.46Å; A444-A447 PolarHBondContact O-N 3.05Å; A447-V449 VanDerWaalsContact C-N 3.28Å; A447-V449 PolarHBondContact O-N 2.83Å
448	N	92.1	Very high	93.3	Very high	103 Å²	103	60.6 Å²	60.6	55%	0.551	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	6.8	-173.4	-50.7	-62.7	0	0	0	116.2	Q423 F426 F446	Q423-N448 PolarHBondContact NE2-OD1 3.23Å; Q423-N448 VanDerWaalsContact NE2-OD1 3.09Å; F426-N448 HydrophobicContact CZ-CB 4.5Å; F446-N448 PolarHBondContact O-N 3.42Å
449	V	93.7	Very high	93.4	Very high	21 Å²	21	60.1 Å²	60.1	13%	0.127	35%	0.351	C	S	.	.			trans	-89.7	114.9	173	-176.3	0	0	0	0	109.4	I410 F426 H431 F446 A447 D454 A455 L458	I410-V449 HydrophobicContact CD1-CG1 4.38Å; I410-V449 WeakPolarHBondContact CD1-O 3.49Å; F426-V449 WeakPolarHBondContact CE1-O 3.36Å; H431-V449 PolarHBondContact CE1-O 3.5Å; F446-V449 WeakPolarHBondContact O-CB 3.35Å; F446-V449 PolarHBondContact O-N 3.31Å; F446-V449 VanDerWaalsContact O-N 3.08Å; A447-V449 VanDerWaalsContact C-N 3.28Å; A447-V449 PolarHBondContact O-N 2.83Å; V449-D454 HydrophobicContact CG1-CB 3.89Å; V449-A455 HydrophobicContact CG1-CB 3.84Å; V449-L458 HydrophobicContact CG2-CD2 4.19Å
450	T	94	Very high	93.4	Very high	32 Å²	32	60.1 Å²	60.1	20%	0.196	35%	0.346	C	S	.	.			trans	-110.6	-24.6	179.7	52.8	0	0	0	0	114.4	C408 E409 I410 F422 F426	C408-T450 HydrophobicContact CB-CG2 4.31Å; E409-T450 VanDerWaalsContact CB-O 3.24Å; E409-T450 WeakPolarHBondContact CB-O 3.17Å; E409-T450 PolarHBondContact N-O 3.33Å; I410-T450 PolarHBondContact N-O 2.9Å; F422-T450 HydrophobicContact CE2-CG2 3.78Å; F422-T450 HydrophobicContact CZ-CG2 3.5Å; F426-T450 HydrophobicContact CE1-CG2 4.37Å; F426-T450 HydrophobicContact CZ-CG2 4.18Å
451	Q	95.9	Very high	93.4	Very high	98 Å²	98	66.5 Å²	66.5	46%	0.458	37%	0.374	S	S	.	.			trans	-87.6	141.1	-179.4	-65.3	-176	71	0	0	110.8	E409 D454 A455	E409-Q451 VanDerWaalsContact OE2-CA 3.26Å; E409-Q451 WeakPolarHBondContact OE2-CA 3.45Å; Q451-D454 HydrophobicContact CB-CB 4.2Å; Q451-D454 PolarHBondContact NE2-OD2 3.38Å; Q451-D454 PolarHBondContact O-N 2.95Å; Q451-A455 PolarHBondContact O-N 3.07Å
452	I	94.7	Very high	93.4	Very high	55 Å²	55	64.4 Å²	64.4	28%	0.282	36%	0.359	S	S	.	.	H	α-helix	trans	-67.3	-40.9	-178.9	-65.6	174.3	0	0	0	110.5	E409 I410 L438 D454 A455 V456	E409-I452 HydrophobicContact CB-CG1 4.32Å; E409-I452 HydrophobicContact CG-CD1 3.87Å; E409-I452 HydrophobicContact CG-CG1 3.94Å; E409-I452 PolarHBondContact OE2-N 3.49Å; I410-I452 HydrophobicContact CG1-CG1 4.02Å; L438-I452 HydrophobicContact CD1-CG1 4.35Å; L438-I452 HydrophobicContact CD1-CG2 4.03Å; L438-I452 HydrophobicContact CD2-CG2 3.71Å; I452-D454 PolarHBondContact O-N 3.13Å; I452-A455 PolarHBondContact O-N 3.05Å; I452-V456 HydrophobicContact CG2-CG2 4.39Å; I452-V456 WeakPolarHBondContact O-CG2 3.34Å; I452-V456 PolarHBondContact O-N 3.44Å
453	E	95.8	Very high	93.3	Very high	144 Å²	144	66.9 Å²	66.9	67%	0.673	37%	0.367	S	S	*	.	H	α-helix	trans	-61.5	-42.1	179.5	-174.2	174.4	-173.3	0	0	112.4	V456 S457	E453-V456 PolarHBondContact O-N 3.29Å; E453-S457 VanDerWaalsContact O-CB 3.29Å; E453-S457 WeakPolarHBondContact O-CB 3.46Å; E453-S457 PolarHBondContact O-N 3.46Å; E453-S457 PolarHBondContact O-OG 3.49Å
454	D	95.5	Very high	93.2	Very high	79 Å²	79	70.3 Å²	70.3	42%	0.422	38%	0.382	S	S	.	.	H	α-helix	trans	-64.5	-43.1	177.3	-72.5	-25.1	0	0	0	111.2	V449 Q451 I452 S457 L458	V449-D454 HydrophobicContact CG1-CB 3.89Å; Q451-D454 HydrophobicContact CB-CB 4.2Å; Q451-D454 PolarHBondContact NE2-OD2 3.38Å; Q451-D454 PolarHBondContact O-N 2.95Å; I452-D454 PolarHBondContact O-N 3.13Å; D454-S457 PolarHBondContact O-N 3.23Å; D454-L458 VanDerWaalsContact O-CB 3.27Å; D454-L458 WeakPolarHBondContact O-CB 3.49Å; D454-L458 PolarHBondContact O-N 2.89Å
455	A	95	Very high	93.1	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-46.6	178.4	0	0	0	0	0	111.7	I410 M435 I440 V449 Q451 I452 L458 W459	I410-A455 HydrophobicContact CD1-CB 4.08Å; M435-A455 HydrophobicContact SD-CB 4.42Å; I440-A455 HydrophobicContact CD1-CB 3.93Å; V449-A455 HydrophobicContact CG1-CB 3.84Å; Q451-A455 PolarHBondContact O-N 3.07Å; I452-A455 PolarHBondContact O-N 3.05Å; A455-L458 PolarHBondContact O-N 3.25Å; A455-W459 WeakPolarHBondContact O-CB 3.37Å; A455-W459 PolarHBondContact O-N 2.88Å
456	V	94.6	Very high	92.9	Very high	73 Å²	73	72 Å²	72	44%	0.442	37%	0.372	S	S	.	.	H	α-helix	trans	-63.8	-43.5	178.3	174.3	0	0	0	0	111	I440 I452 E453 W459 A460	I440-V456 HydrophobicContact CD1-CG2 4.3Å; I452-V456 HydrophobicContact CG2-CG2 4.39Å; I452-V456 WeakPolarHBondContact O-CG2 3.34Å; I452-V456 PolarHBondContact O-N 3.44Å; E453-V456 PolarHBondContact O-N 3.29Å; V456-W459 PolarHBondContact O-N 3.35Å; V456-A460 PolarHBondContact O-N 2.91Å
457	S	94.7	Very high	92.4	Very high	57 Å²	57	74.5 Å²	74.5	40%	0.399	39%	0.393	S	S	.	.	H	α-helix	trans	-64.1	-42.6	178.6	-64.5	0	0	0	0	112.4	E453 D454 A460 K461	E453-S457 VanDerWaalsContact O-CB 3.29Å; E453-S457 WeakPolarHBondContact O-CB 3.46Å; E453-S457 PolarHBondContact O-N 3.46Å; E453-S457 PolarHBondContact O-OG 3.49Å; D454-S457 PolarHBondContact O-N 3.23Å; S457-A460 PolarHBondContact O-N 2.88Å; S457-K461 WeakPolarHBondContact O-CG 3.42Å; S457-K461 PolarHBondContact O-N 2.91Å; S457-K461 VanDerWaalsContact O-N 3.16Å
458	L	93.8	Very high	92	Very high	55 Å²	55	76.8 Å²	76.8	29%	0.288	41%	0.406	S	S	.	.	H	α-helix	trans	-66.2	-41.3	176.4	-179	59.8	0	0	0	111.3	H445 F446 V449 D454 A455 A460 K461 L462	H445-L458 WeakPolarHBondContact O-CD2 3.25Å; F446-L458 HydrophobicContact CD1-CD2 3.79Å; F446-L458 HydrophobicContact CD1-CG 4.41Å; F446-L458 HydrophobicContact CE1-CB 4.04Å; F446-L458 HydrophobicContact CE1-CD2 3.83Å; F446-L458 HydrophobicContact CE1-CG 3.94Å; V449-L458 HydrophobicContact CG2-CD2 4.19Å; D454-L458 VanDerWaalsContact O-CB 3.27Å; D454-L458 WeakPolarHBondContact O-CB 3.49Å; D454-L458 PolarHBondContact O-N 2.89Å; A455-L458 PolarHBondContact O-N 3.25Å; L458-A460 PolarHBondContact O-N 3.45Å; L458-K461 PolarHBondContact O-N 3.46Å; L458-L462 HydrophobicContact CD1-CD1 4.46Å; L458-L462 HydrophobicContact CD1-CG 4.44Å; L458-L462 HydrophobicContact CG-CD1 4.15Å; L458-L462 WeakPolarHBondContact O-CG 3.48Å; L458-L462 PolarHBondContact O-N 3.39Å
459	W	94.4	Very high	91.5	Very high	49 Å²	49	79.4 Å²	79.4	19%	0.186	42%	0.415	C	S	.	.	H	α-helix	trans	-64.1	-39.9	177.3	-176.4	-134.4	0	0	0	112.7	G439 I440 P441 F446 A455 V456 K461 L462 K463	G439-W459 PolarHBondContact O-NE1 3.16Å; I440-W459 HydrophobicContact CB-CG 4.41Å; I440-W459 HydrophobicContact CD1-CB 3.98Å; I440-W459 HydrophobicContact CD1-CG 4.36Å; I440-W459 HydrophobicContact CG1-CB 4.09Å; I440-W459 HydrophobicContact CG1-CG 3.92Å; I440-W459 HydrophobicContact CG2-CB 4.06Å; I440-W459 HydrophobicContact CG2-CD2 3.96Å; I440-W459 HydrophobicContact CG2-CE3 4.21Å; I440-W459 HydrophobicContact CG2-CG 3.93Å; P441-W459 HydrophobicContact CG-CH2 3.63Å; P441-W459 HydrophobicContact CG-CZ2 3.96Å; P441-W459 HydrophobicContact CG-CZ3 4.26Å; F446-W459 HydrophobicContact CE1-CB 4.28Å; F446-W459 HydrophobicContact CE2-CE3 4.26Å; F446-W459 HydrophobicContact CZ-CB 4Å; F446-W459 HydrophobicContact CZ-CD2 4.44Å; F446-W459 AromaticContact CZ-CE3 3.89Å; F446-W459 HydrophobicContact CZ-CE3 3.89Å; A455-W459 WeakPolarHBondContact O-CB 3.37Å; A455-W459 PolarHBondContact O-N 2.88Å; V456-W459 PolarHBondContact O-N 3.35Å; W459-K461 VanDerWaalsContact C-N 3.35Å; W459-K461 PolarHBondContact O-N 3.26Å; W459-L462 HydrophobicContact CE3-CB 4.27Å; W459-L462 HydrophobicContact CE3-CD1 4.48Å; W459-L462 PolarHBondContact O-N 3.48Å; W459-K463 HydrophobicContact CD2-CD 4.41Å; W459-K463 HydrophobicContact CD2-CG 4.24Å; W459-K463 HydrophobicContact CZ2-CD 4.34Å; W459-K463 HydrophobicContact CZ2-CG 4.21Å; W459-K463 VanDerWaalsContact NE1-CE 3.26Å; W459-K463 WeakPolarHBondContact O-CB 3.34Å; W459-K463 PolarHBondContact O-N 3.17Å
460	A	93.5	Very high	90.8	Very high	50 Å²	50	87.6 Å²	87.6	41%	0.413	44%	0.444	S	S	.	.	H	α-helix	trans	-60.2	-44.5	173.8	0	0	0	0	0	111.6	V456 S457 L458 K463 L464	V456-A460 PolarHBondContact O-N 2.91Å; S457-A460 PolarHBondContact O-N 2.88Å; L458-A460 PolarHBondContact O-N 3.45Å; A460-K463 PolarHBondContact O-N 3.26Å; A460-L464 WeakPolarHBondContact O-CG 3.17Å; A460-L464 PolarHBondContact O-N 3.12Å; A460-L464 VanDerWaalsContact O-N 3.12Å
461	K	93.3	Very high	90.1	Very high	138 Å²	138	92.5 Å²	92.5	60%	0.6	46%	0.459	S	S	*	.	H	α-helix	trans	-62.4	-45.7	175.5	-71.7	175.7	-176.4	173.5	0	112.3	S457 L458 W459 K463 L464 Q465	S457-K461 WeakPolarHBondContact O-CG 3.42Å; S457-K461 PolarHBondContact O-N 2.91Å; S457-K461 VanDerWaalsContact O-N 3.16Å; L458-K461 PolarHBondContact O-N 3.46Å; W459-K461 VanDerWaalsContact C-N 3.35Å; W459-K461 PolarHBondContact O-N 3.26Å; K461-K463 PolarHBondContact O-N 3.12Å; K461-L464 PolarHBondContact O-N 3.19Å; K461-Q465 PolarHBondContact O-N 2.94Å
462	L	90.9	Very high	89.1	Confident	20 Å²	20	92.6 Å²	92.6	11%	0.105	46%	0.46	C	S	.	.	H	α-helix	trans	-64.7	-38.7	178.8	-75.5	171.4	0	0	0	112.4	H445 F446 L458 W459 Q465 K466	H445-L462 HydrophobicContact CB-CD1 3.94Å; F446-L462 HydrophobicContact CE2-CD1 4.12Å; F446-L462 HydrophobicContact CZ-CD1 3.89Å; L458-L462 HydrophobicContact CD1-CD1 4.46Å; L458-L462 HydrophobicContact CD1-CG 4.44Å; L458-L462 HydrophobicContact CG-CD1 4.15Å; L458-L462 WeakPolarHBondContact O-CG 3.48Å; L458-L462 PolarHBondContact O-N 3.39Å; W459-L462 HydrophobicContact CE3-CB 4.27Å; W459-L462 HydrophobicContact CE3-CD1 4.48Å; W459-L462 PolarHBondContact O-N 3.48Å; L462-Q465 PolarHBondContact O-N 3.12Å; L462-K466 WeakPolarHBondContact O-CB 3.47Å; L462-K466 PolarHBondContact O-N 2.9Å
463	K	90.2	Very high	88.3	Confident	116 Å²	116	92.3 Å²	92.3	50%	0.504	46%	0.461	S	S	.	.	H	α-helix	trans	-61.6	-43.1	174	-85.6	179.8	164.8	169.3	0	111.7	W459 A460 K461 A467	W459-K463 HydrophobicContact CD2-CD 4.41Å; W459-K463 HydrophobicContact CD2-CG 4.24Å; W459-K463 HydrophobicContact CZ2-CD 4.34Å; W459-K463 HydrophobicContact CZ2-CG 4.21Å; W459-K463 VanDerWaalsContact NE1-CE 3.26Å; W459-K463 WeakPolarHBondContact O-CB 3.34Å; W459-K463 PolarHBondContact O-N 3.17Å; A460-K463 PolarHBondContact O-N 3.26Å; K461-K463 PolarHBondContact O-N 3.12Å; K463-A467 VanDerWaalsContact O-CB 3.22Å; K463-A467 WeakPolarHBondContact O-CB 3.43Å; K463-A467 PolarHBondContact O-N 3.05Å
464	L	89.9	Confident	87.2	Confident	128 Å²	128	90 Å²	90	67%	0.67	45%	0.453	S	S	*	.	H	α-helix	trans	-64.3	-45.7	177.3	-72.1	170.3	0	0	0	111.7	A460 K461 A467 S468	A460-L464 WeakPolarHBondContact O-CG 3.17Å; A460-L464 PolarHBondContact O-N 3.12Å; A460-L464 VanDerWaalsContact O-N 3.12Å; K461-L464 PolarHBondContact O-N 3.19Å; L464-A467 PolarHBondContact O-N 2.72Å; L464-S468 PolarHBondContact O-N 2.89Å; L464-S468 PolarHBondContact O-OG 3.12Å
465	Q	89.2	Confident	86.3	Confident	114 Å²	114	89.9 Å²	89.9	53%	0.533	46%	0.456	S	S	.	.	H	α-helix	trans	-61.5	-47.7	177.1	-75.5	-179.1	-29.7	0	0	112.1	K461 L462 A467 S468 E469	K461-Q465 PolarHBondContact O-N 2.94Å; L462-Q465 PolarHBondContact O-N 3.12Å; Q465-A467 VanDerWaalsContact C-N 3.31Å; Q465-A467 PolarHBondContact O-N 3.11Å; Q465-S468 WeakPolarHBondContact CA-OG 3.47Å; Q465-S468 PolarHBondContact O-N 3.05Å; Q465-S468 PolarHBondContact O-OG 2.74Å; Q465-E469 WeakPolarHBondContact O-CG 3.35Å; Q465-E469 PolarHBondContact O-N 3.23Å; Q465-E469 VanDerWaalsContact O-N 3.13Å
466	K	84.9	Confident	85.5	Confident	129 Å²	129	94.7 Å²	94.7	56%	0.561	48%	0.478	S	S	*	.	H	α-helix	trans	-64.6	-34	176.8	-76.1	-170	176	-174.3	0	113	L462 S468 E469 R470	L462-K466 WeakPolarHBondContact O-CB 3.47Å; L462-K466 PolarHBondContact O-N 2.9Å; K466-S468 VanDerWaalsContact C-N 3.34Å; K466-E469 PolarHBondContact O-N 3.27Å; K466-R470 WeakPolarHBondContact O-CB 3.33Å; K466-R470 PolarHBondContact O-N 2.77Å; K466-R470 VanDerWaalsContact O-N 3.17Å
467	A	83.1	Confident	84.9	Confident	54 Å²	54	94.1 Å²	94.1	45%	0.446	47%	0.471	S	S	.	.	H	α-helix	trans	-68.7	-33.5	176	0	0	0	0	0	112.2	K463 L464 Q465	K463-A467 VanDerWaalsContact O-CB 3.22Å; K463-A467 WeakPolarHBondContact O-CB 3.43Å; K463-A467 PolarHBondContact O-N 3.05Å; L464-A467 PolarHBondContact O-N 2.72Å; Q465-A467 VanDerWaalsContact C-N 3.31Å; Q465-A467 PolarHBondContact O-N 3.11Å
468	S	82.4	Confident	84.4	Confident	97 Å²	97	98.8 Å²	98.8	68%	0.678	49%	0.486	S	S	*	.	H	α-helix	trans	-74.5	-24.4	174.4	54.7	0	0	0	0	114.1	L464 Q465 K466	L464-S468 PolarHBondContact O-N 2.89Å; L464-S468 PolarHBondContact O-OG 3.12Å; Q465-S468 WeakPolarHBondContact CA-OG 3.47Å; Q465-S468 PolarHBondContact O-N 3.05Å; Q465-S468 PolarHBondContact O-OG 2.74Å; K466-S468 VanDerWaalsContact C-N 3.34Å
469	E	81.9	Confident	84	Confident	158 Å²	158	100 Å²	100	74%	0.738	49%	0.488	S	S	*	.	H	α-helix	trans	-88.4	-16.4	177.8	-70.4	173.7	179.4	0	0	113.3	Q465 K466 W471	Q465-E469 WeakPolarHBondContact O-CG 3.35Å; Q465-E469 PolarHBondContact O-N 3.23Å; Q465-E469 VanDerWaalsContact O-N 3.13Å; K466-E469 PolarHBondContact O-N 3.27Å; E469-W471 PolarHBondContact O-N 2.67Å
470	R	79	Confident	83.6	Confident	193 Å²	193	104 Å²	104	73%	0.728	51%	0.509	S	S	*	.	S	Bend	trans	-81.1	110.9	-177	-174.7	178.8	-177.6	-179	1	110.3	K466 Q472	K466-R470 WeakPolarHBondContact O-CB 3.33Å; K466-R470 PolarHBondContact O-N 2.77Å; K466-R470 VanDerWaalsContact O-N 3.17Å; R470-Q472 WeakPolarHBondContact O-CG 3.45Å; R470-Q472 PolarHBondContact O-N 3.29Å
471	W	79.1	Confident	83.1	Confident	135 Å²	135	102.9 Å²	102.9	51%	0.511	50%	0.495	S	S	.	.			trans	-50.7	123.1	170.7	-174	79.1	0	0	0	110.9	E469 P473 E477	E469-W471 PolarHBondContact O-N 2.67Å; W471-P473 HydrophobicContact CE3-CB 4.16Å; W471-P473 HydrophobicContact CE3-CG 3.79Å; W471-P473 HydrophobicContact CH2-CB 3.6Å; W471-P473 HydrophobicContact CH2-CG 4.11Å; W471-P473 HydrophobicContact CZ2-CB 4.47Å; W471-P473 HydrophobicContact CZ3-CB 3.42Å; W471-P473 VanDerWaalsContact CZ3-CB 3.42Å; W471-P473 HydrophobicContact CZ3-CG 3.38Å; W471-P473 WeakPolarHBondContact O-CD 3.42Å; W471-E477 HydrophobicContact CH2-CB 3.81Å; W471-E477 HydrophobicContact CH2-CG 4.02Å; W471-E477 HydrophobicContact CZ2-CB 3.74Å; W471-E477 HydrophobicContact CZ2-CG 4.17Å
472	Q	75.5	Confident	82.6	Confident	101 Å²	101	101 Å²	101	47%	0.472	50%	0.5	S	S	.	.			trans	-105.6	103.1	179.3	-64.1	-172.2	20.9	0	0	110.5	R470 D474 T475 E476	R470-Q472 WeakPolarHBondContact O-CG 3.45Å; R470-Q472 PolarHBondContact O-N 3.29Å; Q472-D474 PolarHBondContact O-N 2.87Å; Q472-D474 VanDerWaalsContact O-N 3.13Å; Q472-T475 VanDerWaalsContact CB-OG1 3.29Å; Q472-T475 WeakPolarHBondContact CB-OG1 3.44Å; Q472-T475 PolarHBondContact O-N 3.47Å; Q472-T475 PolarHBondContact O-OG1 3.12Å; Q472-E476 PolarHBondContact N-OE1 2.92Å; Q472-E476 WeakPolarHBondContact O-CB 3.31Å; Q472-E476 PolarHBondContact O-N 3.01Å
473	P	77.4	Confident	82.1	Confident	48 Å²	48	104.6 Å²	104.6	31%	0.312	53%	0.526	S	S	.	.	H	α-helix	trans	-53.9	-38.1	-176.2	-9.5	6.4	0	0	0	113.6	W471 T475 E477	W471-P473 HydrophobicContact CE3-CB 4.16Å; W471-P473 HydrophobicContact CE3-CG 3.79Å; W471-P473 HydrophobicContact CH2-CB 3.6Å; W471-P473 HydrophobicContact CH2-CG 4.11Å; W471-P473 HydrophobicContact CZ2-CB 4.47Å; W471-P473 HydrophobicContact CZ3-CB 3.42Å; W471-P473 VanDerWaalsContact CZ3-CB 3.42Å; W471-P473 HydrophobicContact CZ3-CG 3.38Å; W471-P473 WeakPolarHBondContact O-CD 3.42Å; P473-T475 PolarHBondContact O-N 3.43Å; P473-E477 HydrophobicContact CB-CB 4.4Å; P473-E477 WeakPolarHBondContact O-CA 3.34Å; P473-E477 WeakPolarHBondContact O-CB 3.45Å; P473-E477 PolarHBondContact O-N 3.12Å
474	D	73.3	Confident	81.8	Confident	95 Å²	95	100.9 Å²	100.9	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-63.7	-27.9	-177.4	-65.6	-19.9	0	0	0	113.4	Q472 K490	Q472-D474 PolarHBondContact O-N 2.87Å; Q472-D474 VanDerWaalsContact O-N 3.13Å; D474-K490 HydrophobicContact CB-CB 4.38Å; D474-K490 WeakPolarHBondContact O-CB 3.45Å; D474-K490 PolarHBondContact O-N 2.92Å
475	T	77.4	Confident	81.5	Confident	78 Å²	78	99.2 Å²	99.2	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-107.5	-30.7	-176.5	8.8	0	0	0	0	113.6	Q472 P473 N488	Q472-T475 VanDerWaalsContact CB-OG1 3.29Å; Q472-T475 WeakPolarHBondContact CB-OG1 3.44Å; Q472-T475 PolarHBondContact O-N 3.47Å; Q472-T475 PolarHBondContact O-OG1 3.12Å; P473-T475 PolarHBondContact O-N 3.43Å; T475-N488 WeakPolarHBondContact O-CB 3.43Å
476	E	77.4	Confident	81.3	Confident	101 Å²	101	97.9 Å²	97.9	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-109.9	-13.3	-171.8	-63.2	176.9	-124.3	0	0	113.4	Q472	Q472-E476 PolarHBondContact N-OE1 2.92Å; Q472-E476 WeakPolarHBondContact O-CB 3.31Å; Q472-E476 PolarHBondContact O-N 3.01Å
477	E	81.7	Confident	81.4	Confident	61 Å²	61	93.2 Å²	93.2	29%	0.285	49%	0.494	S	S	.	.			trans	-83.5	118.7	172.8	-161	172.2	-150.5	0	0	109.7	W471 P473 Y479 N488 K489	W471-E477 HydrophobicContact CH2-CB 3.81Å; W471-E477 HydrophobicContact CH2-CG 4.02Å; W471-E477 HydrophobicContact CZ2-CB 3.74Å; W471-E477 HydrophobicContact CZ2-CG 4.17Å; P473-E477 HydrophobicContact CB-CB 4.4Å; P473-E477 WeakPolarHBondContact O-CA 3.34Å; P473-E477 WeakPolarHBondContact O-CB 3.45Å; P473-E477 PolarHBondContact O-N 3.12Å; E477-Y479 HydrophobicContact CB-CE2 4.46Å; E477-Y479 HydrophobicContact CG-CD2 4.39Å; E477-Y479 HydrophobicContact CG-CE2 3.83Å; E477-N488 CarbonylContact O-C 3.45Å; E477-N488 WeakPolarHBondContact O-CA 3.36Å; E477-K489 HydrophobicContact CB-CB 4.31Å; E477-K489 PolarHBondContact O-N 3.29Å; E477-K489 WeakPolarHBondContact OE2-CD 3.35Å; E477-K489 IonicContact OE2-NZ 2.73Å; E477-K489 PolarHBondContact OE2-NZ 3.48Å
478	E	85.3	Confident	81.7	Confident	154 Å²	154	93 Å²	93	72%	0.72	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.8	-177.2	-71.6	-176.8	172.5	0	0	111.1	V486	E478-V486 HydrophobicContact CB-CG1 3.63Å; E478-V486 HydrophobicContact CG-CG1 3.83Å
479	Y	84.3	Confident	81.8	Confident	82 Å²	82	90.4 Å²	90.4	32%	0.322	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.6	175.2	-81.2	-109	0	0	0	109.7	E477 V486 V487 K489 Y492	E477-Y479 HydrophobicContact CB-CE2 4.46Å; E477-Y479 HydrophobicContact CG-CD2 4.39Å; E477-Y479 HydrophobicContact CG-CE2 3.83Å; Y479-V486 WeakPolarHBondContact O-CA 3.34Å; Y479-V487 PolarHBondContact N-O 2.99Å; Y479-V487 PolarHBondContact O-N 3.44Å; Y479-K489 HydrophobicContact CD2-CB 3.84Å; Y479-K489 HydrophobicContact CD2-CG 4.17Å; Y479-K489 HydrophobicContact CE2-CB 3.74Å; Y479-K489 HydrophobicContact CE2-CD 4.17Å; Y479-K489 HydrophobicContact CE2-CG 3.67Å; Y479-Y492 AromaticContact CD1-CD1 3.96Å; Y479-Y492 HydrophobicContact CD1-CD1 3.96Å; Y479-Y492 HydrophobicContact CD1-CE1 4.09Å; Y479-Y492 HydrophobicContact CD1-CG 4.21Å; Y479-Y492 HydrophobicContact CG-CD1 4.28Å; Y479-Y492 HydrophobicContact CG-CD2 4.43Å; Y479-Y492 HydrophobicContact CG-CG 4.11Å
480	E	85.5	Confident	82	Confident	133 Å²	133	89 Å²	89	62%	0.621	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.9	177.3	-164.9	177.3	174.7	0	0	110.2	G484 N485 Y492	E480-G484 WeakPolarHBondContact OE1-CA 3.43Å; E480-N485 WeakPolarHBondContact CA-O 3.03Å; E480-Y492 WeakPolarHBondContact O-CE2 3.4Å
481	D	83.1	Confident	82.3	Confident	26 Å²	26	82.5 Å²	82.5	14%	0.139	44%	0.436	C	S	.	.			trans	-79.2	174.4	174	72.2	17.8	0	0	0	113.3	S483 G484 N485 L501	D481-S483 PolarHBondContact O-N 2.99Å; D481-S483 VanDerWaalsContact O-N 3.12Å; D481-S483 VanDerWaalsContact OD1-CA 3.22Å; D481-S483 WeakPolarHBondContact OD1-CA 3.4Å; D481-S483 WeakPolarHBondContact OD1-CB 3.3Å; D481-S483 PolarHBondContact OD1-N 3.02Å; D481-G484 PolarHBondContact O-N 3.21Å; D481-G484 VanDerWaalsContact O-N 3.09Å; D481-G484 PolarHBondContact OD1-N 3.33Å; D481-N485 PolarHBondContact N-O 2.88Å; D481-N485 PolarHBondContact OD1-N 3.42Å; D481-N485 PolarHBondContact OD1-ND2 3.46Å; D481-N485 WeakPolarHBondContact OD2-CB 3.47Å; D481-N485 PolarHBondContact OD2-ND2 3.36Å; D481-L501 HydrophobicContact CB-CD2 3.52Å
482	S	82.4	Confident	82.7	Confident	98 Å²	98	78.7 Å²	78.7	69%	0.685	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-12.7	177.1	54.6	0	0	0	0	113.9	L501	S482-L501 PolarHBondContact OG-OXT 3.48Å; S482-L501 VanDerWaalsContact OG-OXT 3.07Å
483	S	82	Confident	83.3	Confident	96 Å²	96	77.7 Å²	77.7	67%	0.671	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	1.4	177.6	-59.3	0	0	0	0	113.3	D481	D481-S483 PolarHBondContact O-N 2.99Å; D481-S483 VanDerWaalsContact O-N 3.12Å; D481-S483 VanDerWaalsContact OD1-CA 3.22Å; D481-S483 WeakPolarHBondContact OD1-CA 3.4Å; D481-S483 WeakPolarHBondContact OD1-CB 3.3Å; D481-S483 PolarHBondContact OD1-N 3.02Å
484	G	82.3	Confident	83.8	Confident	38 Å²	38	78.5 Å²	78.5	39%	0.392	42%	0.419	S	S	.	.	S	Bend	trans	81.9	13.1	-179.4	0	0	0	0	0	115.3	E480 D481	E480-G484 WeakPolarHBondContact OE1-CA 3.43Å; D481-G484 PolarHBondContact O-N 3.21Å; D481-G484 VanDerWaalsContact O-N 3.09Å; D481-G484 PolarHBondContact OD1-N 3.33Å
485	N	84.2	Confident	84.6	Confident	92 Å²	92	76.1 Å²	76.1	49%	0.492	41%	0.406	S	S	.	.			trans	-84.8	134.9	175	-49.9	-64.1	0	0	0	110.5	E480 D481	E480-N485 WeakPolarHBondContact CA-O 3.03Å; D481-N485 PolarHBondContact N-O 2.88Å; D481-N485 PolarHBondContact OD1-N 3.42Å; D481-N485 PolarHBondContact OD1-ND2 3.46Å; D481-N485 WeakPolarHBondContact OD2-CB 3.47Å; D481-N485 PolarHBondContact OD2-ND2 3.36Å
486	V	85.9	Confident	85	Confident	86 Å²	86	79.1 Å²	79.1	52%	0.521	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.4	176.6	-176.7	0	0	0	0	109.7	E478 Y479	E478-V486 HydrophobicContact CB-CG1 3.63Å; E478-V486 HydrophobicContact CG-CG1 3.83Å; Y479-V486 WeakPolarHBondContact O-CA 3.34Å
487	V	86.8	Confident	85.6	Confident	31 Å²	31	83.4 Å²	83.4	19%	0.188	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	151.9	177	-69.8	0	0	0	0	109.7	Y479 T491 Y492	Y479-V487 PolarHBondContact N-O 2.99Å; Y479-V487 PolarHBondContact O-N 3.44Å; V487-T491 HydrophobicContact CB-CG2 4.24Å; V487-T491 HydrophobicContact CG1-CG2 4.31Å; V487-Y492 HydrophobicContact CG2-CD2 3.92Å; V487-Y492 HydrophobicContact CG2-CG 4.38Å
488	N	88.6	Confident	86	Confident	50 Å²	50	86.9 Å²	86.9	27%	0.267	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	154.4	172.7	65.3	32.9	0	0	0	110.8	T475 E477 K490 T491 Y492	T475-N488 WeakPolarHBondContact O-CB 3.43Å; E477-N488 CarbonylContact O-C 3.45Å; E477-N488 WeakPolarHBondContact O-CA 3.36Å; N488-K490 VanDerWaalsContact C-N 3.26Å; N488-K490 PolarHBondContact O-N 3.16Å; N488-T491 PolarHBondContact O-N 3.08Å; N488-T491 WeakPolarHBondContact OD1-CB 3.18Å; N488-T491 PolarHBondContact OD1-N 3.26Å; N488-T491 PolarHBondContact OD1-OG1 2.97Å; N488-Y492 PolarHBondContact O-N 3.04Å
489	K	85.2	Confident	86	Confident	43 Å²	43	82.6 Å²	82.6	19%	0.187	44%	0.437	C	S	.	.	H	α-helix	trans	-48.8	-44.7	-178	-177.4	-173.7	-156.9	152.3	0	113.6	E477 Y479 T491 Y492 E493	E477-K489 HydrophobicContact CB-CB 4.31Å; E477-K489 PolarHBondContact O-N 3.29Å; E477-K489 WeakPolarHBondContact OE2-CD 3.35Å; E477-K489 IonicContact OE2-NZ 2.73Å; E477-K489 PolarHBondContact OE2-NZ 3.48Å; Y479-K489 HydrophobicContact CD2-CB 3.84Å; Y479-K489 HydrophobicContact CD2-CG 4.17Å; Y479-K489 HydrophobicContact CE2-CB 3.74Å; Y479-K489 HydrophobicContact CE2-CD 4.17Å; Y479-K489 HydrophobicContact CE2-CG 3.67Å; K489-T491 PolarHBondContact O-N 3.44Å; K489-Y492 WeakPolarHBondContact O-CB 3.13Å; K489-Y492 PolarHBondContact O-N 3.32Å; K489-E493 PolarHBondContact O-N 2.92Å
490	K	85.6	Confident	85.8	Confident	127 Å²	127	84 Å²	84	55%	0.552	45%	0.45	S	S	*	.	H	α-helix	trans	-60.2	-46.6	179.7	-176.7	178.1	178.9	-179.5	0	111.7	D474 N488 Y492 E493 D494	D474-K490 HydrophobicContact CB-CB 4.38Å; D474-K490 WeakPolarHBondContact O-CB 3.45Å; D474-K490 PolarHBondContact O-N 2.92Å; N488-K490 VanDerWaalsContact C-N 3.26Å; N488-K490 PolarHBondContact O-N 3.16Å; K490-Y492 VanDerWaalsContact C-N 3.34Å; K490-E493 PolarHBondContact O-N 3.37Å; K490-D494 WeakPolarHBondContact O-CB 3.41Å; K490-D494 PolarHBondContact O-N 3.23Å
491	T	86.3	Confident	85.3	Confident	58 Å²	58	81.3 Å²	81.3	36%	0.356	44%	0.439	S	S	.	.	H	α-helix	trans	-65.6	-40.8	178.1	-53.3	0	0	0	0	110.4	V487 N488 K489 D494 L495	V487-T491 HydrophobicContact CB-CG2 4.24Å; V487-T491 HydrophobicContact CG1-CG2 4.31Å; N488-T491 PolarHBondContact O-N 3.08Å; N488-T491 WeakPolarHBondContact OD1-CB 3.18Å; N488-T491 PolarHBondContact OD1-N 3.26Å; N488-T491 PolarHBondContact OD1-OG1 2.97Å; K489-T491 PolarHBondContact O-N 3.44Å; T491-D494 PolarHBondContact O-N 3Å; T491-L495 HydrophobicContact CG2-CD1 3.89Å; T491-L495 HydrophobicContact CG2-CG 4.24Å; T491-L495 WeakPolarHBondContact O-CB 3.37Å; T491-L495 WeakPolarHBondContact O-CG 3.48Å; T491-L495 PolarHBondContact O-N 3.19Å
492	Y	87.6	Confident	85.5	Confident	55 Å²	55	84.1 Å²	84.1	22%	0.216	45%	0.454	C	S	.	.	H	α-helix	trans	-59.7	-48.1	175.1	-171.9	-91	0	0	0	111.9	Y479 E480 V487 N488 K489 K490 L495 K496 L501	Y479-Y492 AromaticContact CD1-CD1 3.96Å; Y479-Y492 HydrophobicContact CD1-CD1 3.96Å; Y479-Y492 HydrophobicContact CD1-CE1 4.09Å; Y479-Y492 HydrophobicContact CD1-CG 4.21Å; Y479-Y492 HydrophobicContact CG-CD1 4.28Å; Y479-Y492 HydrophobicContact CG-CD2 4.43Å; Y479-Y492 HydrophobicContact CG-CG 4.11Å; E480-Y492 WeakPolarHBondContact O-CE2 3.4Å; V487-Y492 HydrophobicContact CG2-CD2 3.92Å; V487-Y492 HydrophobicContact CG2-CG 4.38Å; N488-Y492 PolarHBondContact O-N 3.04Å; K489-Y492 WeakPolarHBondContact O-CB 3.13Å; K489-Y492 PolarHBondContact O-N 3.32Å; K490-Y492 VanDerWaalsContact C-N 3.34Å; Y492-L495 PolarHBondContact O-N 3.48Å; Y492-K496 HydrophobicContact CE1-CD 4.36Å; Y492-K496 VanDerWaalsContact O-CB 3.24Å; Y492-K496 WeakPolarHBondContact O-CB 3.34Å; Y492-K496 PolarHBondContact O-N 3.49Å; Y492-L501 HydrophobicContact CD1-CD1 4.2Å; Y492-L501 HydrophobicContact CD2-CD1 3.62Å; Y492-L501 HydrophobicContact CE1-CD1 4.21Å; Y492-L501 HydrophobicContact CE2-CD1 3.65Å; Y492-L501 HydrophobicContact CG-CD1 3.9Å; Y492-L501 WeakPolarHBondContact O-CD1 3.38Å
493	E	87	Confident	85.6	Confident	79 Å²	79	83.3 Å²	83.3	37%	0.369	44%	0.442	S	S	.	.	H	α-helix	trans	-65	-39.3	177.8	-74.3	-166.6	-174.9	0	0	112.7	K489 K490 K496 R497	K489-E493 PolarHBondContact O-N 2.92Å; K490-E493 PolarHBondContact O-N 3.37Å; E493-K496 WeakPolarHBondContact O-CB 3.08Å; E493-K496 PolarHBondContact O-N 3.16Å; E493-R497 WeakPolarHBondContact O-CB 3.43Å; E493-R497 VanDerWaalsContact O-CG 3.28Å; E493-R497 WeakPolarHBondContact O-CG 3.49Å; E493-R497 PolarHBondContact O-N 2.95Å; E493-R497 IonicContact OE2-NH2 2.77Å
494	D	88.6	Confident	85.8	Confident	65 Å²	65	82.6 Å²	82.6	35%	0.348	43%	0.429	S	S	.	.	H	α-helix	trans	-66.1	-44.7	176.6	-81	-16.2	0	0	0	111.3	K490 T491 K496 R497 Q498	K490-D494 WeakPolarHBondContact O-CB 3.41Å; K490-D494 PolarHBondContact O-N 3.23Å; T491-D494 PolarHBondContact O-N 3Å; D494-K496 VanDerWaalsContact C-N 3.32Å; D494-K496 PolarHBondContact O-N 3.05Å; D494-R497 PolarHBondContact O-N 3.26Å; D494-Q498 WeakPolarHBondContact O-CB 3.39Å; D494-Q498 VanDerWaalsContact O-CG 3.28Å; D494-Q498 WeakPolarHBondContact O-CG 3.33Å; D494-Q498 PolarHBondContact O-N 2.95Å
495	L	88.4	Confident	86	Confident	45 Å²	45	85.2 Å²	85.2	24%	0.236	43%	0.431	C	S	.	.	H	α-helix	trans	-63.2	-39.6	174.6	-69.2	169.5	0	0	0	111.1	T491 Y492 Q498 G499 L500 L501	T491-L495 HydrophobicContact CG2-CD1 3.89Å; T491-L495 HydrophobicContact CG2-CG 4.24Å; T491-L495 WeakPolarHBondContact O-CB 3.37Å; T491-L495 WeakPolarHBondContact O-CG 3.48Å; T491-L495 PolarHBondContact O-N 3.19Å; Y492-L495 PolarHBondContact O-N 3.48Å; L495-Q498 PolarHBondContact O-N 3.44Å; L495-G499 PolarHBondContact O-N 3.31Å; L495-G499 VanDerWaalsContact O-N 3.11Å; L495-L500 HydrophobicContact CB-CB 4.46Å; L495-L500 HydrophobicContact CD2-CB 4.07Å; L495-L500 HydrophobicContact CD2-CD1 3.92Å; L495-L500 PolarHBondContact O-N 3.09Å; L495-L501 HydrophobicContact CB-CD1 3.72Å; L495-L501 HydrophobicContact CB-CD2 4.07Å; L495-L501 HydrophobicContact CB-CG 3.59Å; L495-L501 HydrophobicContact CD1-CD2 4.17Å
496	K	87.3	Confident	86.1	Confident	142 Å²	142	84.8 Å²	84.8	62%	0.617	43%	0.428	S	S	*	.	H	α-helix	trans	-62.1	-43.4	174.4	-170.6	175.5	-179	176.2	0	111.7	Y492 E493 D494 Q498 G499 L501	Y492-K496 HydrophobicContact CE1-CD 4.36Å; Y492-K496 VanDerWaalsContact O-CB 3.24Å; Y492-K496 WeakPolarHBondContact O-CB 3.34Å; Y492-K496 PolarHBondContact O-N 3.49Å; E493-K496 WeakPolarHBondContact O-CB 3.08Å; E493-K496 PolarHBondContact O-N 3.16Å; D494-K496 VanDerWaalsContact C-N 3.32Å; D494-K496 PolarHBondContact O-N 3.05Å; K496-Q498 VanDerWaalsContact C-N 3.33Å; K496-G499 PolarHBondContact O-N 2.88Å; K496-L501 HydrophobicContact CB-CD1 4.02Å
497	R	89.8	Confident	86.2	Confident	191 Å²	191	84.7 Å²	84.7	72%	0.721	42%	0.421	S	S	*	.	H	α-helix	trans	-67.4	-32.4	177.1	-75.7	175.2	-170.1	179	8.8	112.6	E493 D494 G499	E493-R497 WeakPolarHBondContact O-CB 3.43Å; E493-R497 VanDerWaalsContact O-CG 3.28Å; E493-R497 WeakPolarHBondContact O-CG 3.49Å; E493-R497 PolarHBondContact O-N 2.95Å; E493-R497 IonicContact OE2-NH2 2.77Å; D494-R497 PolarHBondContact O-N 3.26Å; R497-G499 VanDerWaalsContact C-N 3.26Å
498	Q	90.1	Very high	86.1	Confident	134 Å²	134	88.6 Å²	88.6	63%	0.626	44%	0.438	S	S	*	.	H	α-helix	trans	-78.9	-8.2	175.3	-68.5	174.8	30.1	0	0	113.2	D494 L495 K496 L500	D494-Q498 WeakPolarHBondContact O-CB 3.39Å; D494-Q498 VanDerWaalsContact O-CG 3.28Å; D494-Q498 WeakPolarHBondContact O-CG 3.33Å; D494-Q498 PolarHBondContact O-N 2.95Å; L495-Q498 PolarHBondContact O-N 3.44Å; K496-Q498 VanDerWaalsContact C-N 3.33Å; Q498-L500 HydrophobicContact CB-CD1 3.87Å; Q498-L500 HydrophobicContact CB-CG 3.98Å
499	G	84.9	Confident	85.9	Confident	64 Å²	64	91.5 Å²	91.5	66%	0.66	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	28.2	-177.6	0	0	0	0	0	113.5	L495 K496 R497	L495-G499 PolarHBondContact O-N 3.31Å; L495-G499 VanDerWaalsContact O-N 3.11Å; K496-G499 PolarHBondContact O-N 2.88Å; R497-G499 VanDerWaalsContact C-N 3.26Å
500	L	80.6	Confident	86	Confident	112 Å²	112	95.6 Å²	95.6	59%	0.586	47%	0.473	S	S	*	.			trans	-99.1	7	-177.9	-65.3	172.6	0	0	0	113.5	L495 Q498	L495-L500 HydrophobicContact CB-CB 4.46Å; L495-L500 HydrophobicContact CD2-CB 4.07Å; L495-L500 HydrophobicContact CD2-CD1 3.92Å; L495-L500 PolarHBondContact O-N 3.09Å; Q498-L500 HydrophobicContact CB-CD1 3.87Å; Q498-L500 HydrophobicContact CB-CG 3.98Å
501	L	75.5	Confident	86	Confident	75 Å²	75	92.7 Å²	92.7	39%	0.393	47%	0.466	S	S	.	.			trans	-120	0	-178.9	-68.3	179.4	0	0	0	113.7	D481 S482 Y492 L495 K496	D481-L501 HydrophobicContact CB-CD2 3.52Å; S482-L501 PolarHBondContact OG-OXT 3.48Å; S482-L501 VanDerWaalsContact OG-OXT 3.07Å; Y492-L501 HydrophobicContact CD1-CD1 4.2Å; Y492-L501 HydrophobicContact CD2-CD1 3.62Å; Y492-L501 HydrophobicContact CE1-CD1 4.21Å; Y492-L501 HydrophobicContact CE2-CD1 3.65Å; Y492-L501 HydrophobicContact CG-CD1 3.9Å; Y492-L501 WeakPolarHBondContact O-CD1 3.38Å; L495-L501 HydrophobicContact CB-CD1 3.72Å; L495-L501 HydrophobicContact CB-CD2 4.07Å; L495-L501 HydrophobicContact CB-CG 3.59Å; L495-L501 HydrophobicContact CD1-CD2 4.17Å; K496-L501 HydrophobicContact CB-CD1 4.02Å

Retrieved 501 of 501 residues in 89.3 ms (Link to these results)

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