A0A087X843_POEFO Loading...

Rap guanine nucleotide exchange factor 5

AlphaFold DB , UniProt , Accession A0A087X843, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 408 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	72.8	Confident	85.9	Confident	102 Å²	102	89.9 Å²	89.9	50%	0.502	42%	0.423	S	S	.	.				0	-61.2	0	-66	-56.3	-83.7	0	0	112.7	T3 L4 Y5 F25 L29	M1-T3 VanDerWaalsContact C-N 3.3Å; M1-T3 PolarHBondContact O-N 2.94Å; M1-L4 PolarHBondContact O-N 2.84Å; M1-L4 VanDerWaalsContact O-N 3.12Å; M1-Y5 PolarHBondContact O-N 2.81Å; M1-F25 HydrophobicContact CB-CZ 4.36Å; M1-F25 HydrophobicContact CE-CD2 4.26Å; M1-F25 HydrophobicContact CE-CE1 3.98Å; M1-F25 HydrophobicContact CE-CE2 3.36Å; M1-F25 HydrophobicContact CE-CZ 3.21Å; M1-F25 WeakPolarHBondContact O-CE1 3.36Å; M1-F25 HydrophobicContact SD-CE2 4.03Å; M1-F25 HydrophobicContact SD-CZ 3.59Å; M1-F25 VanDerWaalsContact SD-CZ 3.59Å; M1-L29 HydrophobicContact CB-CD2 4.31Å
2	K	80.8	Confident	86.4	Confident	132 Å²	132	85.5 Å²	85.5	57%	0.574	40%	0.404	S	S	*	.	H	α-helix	trans	-55.8	-42.2	177.8	-66.2	-177.9	179.8	-172.6	0	113	Y5 R6 L29 H33	K2-Y5 PolarHBondContact O-N 3Å; K2-R6 PolarHBondContact O-N 2.64Å; K2-R6 VanDerWaalsContact O-N 3.16Å; K2-L29 HydrophobicContact CG-CD2 4.03Å; K2-H33 WeakPolarHBondContact CE-CE1 3.44Å; K2-H33 WeakPolarHBondContact CE-NE2 3.48Å; K2-H33 PolarHBondContact NZ-NE2 3.1Å
3	T	85.7	Confident	86.4	Confident	82 Å²	82	95.2 Å²	95.2	50%	0.503	44%	0.437	S	S	.	.	H	α-helix	trans	-64.2	-43.4	174.8	-38.3	0	0	0	0	112.7	M1 Y5 R6 Y7	M1-T3 VanDerWaalsContact C-N 3.3Å; M1-T3 PolarHBondContact O-N 2.94Å; T3-Y5 VanDerWaalsContact C-N 3.35Å; T3-Y5 PolarHBondContact O-N 3.07Å; T3-R6 WeakPolarHBondContact O-CB 3.32Å; T3-R6 PolarHBondContact O-N 3.25Å; T3-R6 VanDerWaalsContact O-N 3.15Å; T3-Y7 HydrophobicContact CG2-CD2 4.21Å; T3-Y7 HydrophobicContact CG2-CE2 3.56Å; T3-Y7 WeakPolarHBondContact O-CD2 3.4Å; T3-Y7 PolarHBondContact O-N 3.29Å; T3-Y7 VanDerWaalsContact O-N 3.08Å
4	L	86.1	Confident	86.8	Confident	88 Å²	88	98.6 Å²	98.6	46%	0.461	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-40	177.4	-177.6	62.7	0	0	0	111.6	M1 R6 Y7 V8 F25	M1-L4 PolarHBondContact O-N 2.84Å; M1-L4 VanDerWaalsContact O-N 3.12Å; L4-R6 VanDerWaalsContact C-N 3.29Å; L4-R6 PolarHBondContact O-N 3.24Å; L4-Y7 PolarHBondContact O-N 3.25Å; L4-V8 HydrophobicContact CD1-CG2 4.36Å; L4-V8 HydrophobicContact CG-CG2 4.46Å; L4-V8 VanDerWaalsContact O-CG2 3.31Å; L4-V8 WeakPolarHBondContact O-CG2 3.39Å; L4-V8 PolarHBondContact O-N 3.07Å; L4-F25 HydrophobicContact CB-CZ 4.09Å; L4-F25 HydrophobicContact CD2-CE2 3.85Å; L4-F25 HydrophobicContact CD2-CZ 3.85Å; L4-F25 HydrophobicContact CG-CE2 4.35Å; L4-F25 HydrophobicContact CG-CZ 4.07Å
5	Y	86.2	Confident	87.3	Confident	53 Å²	53	99.3 Å²	99.3	21%	0.208	46%	0.455	C	S	.	.	H	α-helix	trans	-59	-41.8	172.7	176	-98.7	0	0	0	112.3	M1 K2 T3 V8 L9 L22 F25 Q26 L29	M1-Y5 PolarHBondContact O-N 2.81Å; K2-Y5 PolarHBondContact O-N 3Å; T3-Y5 VanDerWaalsContact C-N 3.35Å; T3-Y5 PolarHBondContact O-N 3.07Å; Y5-V8 PolarHBondContact O-N 3.43Å; Y5-L9 HydrophobicContact CE1-CD2 4.18Å; Y5-L9 VanDerWaalsContact O-CB 3.23Å; Y5-L9 WeakPolarHBondContact O-CB 3.36Å; Y5-L9 PolarHBondContact O-N 3.21Å; Y5-L22 HydrophobicContact CD2-CD1 3.52Å; Y5-L22 HydrophobicContact CD2-CG 4.34Å; Y5-L22 HydrophobicContact CE2-CD1 3.49Å; Y5-L22 VanDerWaalsContact CE2-CD1 3.49Å; Y5-L22 HydrophobicContact CE2-CD2 4.35Å; Y5-L22 HydrophobicContact CE2-CG 3.86Å; Y5-L22 HydrophobicContact CG-CD1 4.37Å; Y5-F25 AromaticContact CD2-CD1 3.73Å; Y5-F25 HydrophobicContact CD2-CD1 3.73Å; Y5-F25 HydrophobicContact CD2-CE1 4.48Å; Y5-F25 HydrophobicContact CG-CD1 4.2Å; Y5-Q26 HydrophobicContact CE2-CB 4.05Å; Y5-Q26 HydrophobicContact CE2-CG 4.26Å; Y5-L29 HydrophobicContact CD1-CD1 4.3Å; Y5-L29 HydrophobicContact CD2-CD1 3.7Å; Y5-L29 HydrophobicContact CE2-CD1 4.43Å; Y5-L29 HydrophobicContact CG-CD1 3.59Å
6	R	85.8	Confident	87.5	Confident	134 Å²	134	98.9 Å²	98.9	51%	0.506	47%	0.465	S	S	.	.	H	α-helix	trans	-63	-44.6	178.8	-158.5	-174	77.2	-163.6	-3.4	111.1	K2 T3 L4 L9 E10	K2-R6 PolarHBondContact O-N 2.64Å; K2-R6 VanDerWaalsContact O-N 3.16Å; T3-R6 WeakPolarHBondContact O-CB 3.32Å; T3-R6 PolarHBondContact O-N 3.25Å; T3-R6 VanDerWaalsContact O-N 3.15Å; L4-R6 VanDerWaalsContact C-N 3.29Å; L4-R6 PolarHBondContact O-N 3.24Å; R6-L9 WeakPolarHBondContact O-CB 3.38Å; R6-L9 PolarHBondContact O-N 3.01Å; R6-E10 WeakPolarHBondContact CG-OE1 3.47Å; R6-E10 IonicContact CZ-OE1 3.25Å; R6-E10 IonicContact NE-OE1 3.7Å; R6-E10 PolarHBondContact NE-OE1 2.86Å; R6-E10 VanDerWaalsContact O-CG 3.31Å; R6-E10 WeakPolarHBondContact O-CG 3.42Å; R6-E10 PolarHBondContact O-N 3.4Å
7	Y	88.9	Confident	87.7	Confident	115 Å²	115	98.9 Å²	98.9	45%	0.451	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-46.1	176.3	-63.9	-42.8	0	0	0	112.6	T3 L4 L9 E10 D11	T3-Y7 HydrophobicContact CG2-CD2 4.21Å; T3-Y7 HydrophobicContact CG2-CE2 3.56Å; T3-Y7 WeakPolarHBondContact O-CD2 3.4Å; T3-Y7 PolarHBondContact O-N 3.29Å; T3-Y7 VanDerWaalsContact O-N 3.08Å; L4-Y7 PolarHBondContact O-N 3.25Å; Y7-L9 PolarHBondContact O-N 3.18Å; Y7-E10 PolarHBondContact O-N 3.37Å; Y7-E10 VanDerWaalsContact O-N 3.08Å; Y7-D11 WeakPolarHBondContact O-CB 3.23Å; Y7-D11 PolarHBondContact O-N 3.14Å
8	V	87.6	Confident	87.9	Confident	27 Å²	27	95.9 Å²	95.9	16%	0.164	46%	0.464	C	S	.	.	H	α-helix	trans	-62.3	-32.7	176.6	178.6	0	0	0	0	111.6	L4 Y5 L12 L18 L22	L4-V8 HydrophobicContact CD1-CG2 4.36Å; L4-V8 HydrophobicContact CG-CG2 4.46Å; L4-V8 VanDerWaalsContact O-CG2 3.31Å; L4-V8 WeakPolarHBondContact O-CG2 3.39Å; L4-V8 PolarHBondContact O-N 3.07Å; Y5-V8 PolarHBondContact O-N 3.43Å; V8-L12 PolarHBondContact O-N 3.36Å; V8-L18 HydrophobicContact CG1-CB 4.39Å; V8-L18 HydrophobicContact CG1-CD1 4.44Å; V8-L22 HydrophobicContact CB-CD1 4.03Å; V8-L22 HydrophobicContact CG1-CB 4.29Å; V8-L22 HydrophobicContact CG1-CD1 3.77Å
9	L	88.3	Confident	88	Confident	83 Å²	83	96.3 Å²	96.3	44%	0.435	47%	0.465	S	S	.	.	H	α-helix	trans	-70.4	-38.4	174.7	178.5	66.4	0	0	0	112.3	Y5 R6 Y7 L12 L22	Y5-L9 HydrophobicContact CE1-CD2 4.18Å; Y5-L9 VanDerWaalsContact O-CB 3.23Å; Y5-L9 WeakPolarHBondContact O-CB 3.36Å; Y5-L9 PolarHBondContact O-N 3.21Å; R6-L9 WeakPolarHBondContact O-CB 3.38Å; R6-L9 PolarHBondContact O-N 3.01Å; Y7-L9 PolarHBondContact O-N 3.18Å; L9-L12 HydrophobicContact CD1-CD1 4.08Å; L9-L22 HydrophobicContact CB-CD1 4.23Å; L9-L22 HydrophobicContact CB-CD2 4.4Å; L9-L22 HydrophobicContact CD1-CD2 3.67Å
10	E	90.6	Very high	88.1	Confident	103 Å²	103	99.6 Å²	99.6	48%	0.481	48%	0.477	S	S	.	.	H	α-helix	trans	-66.2	-42	174.4	-72.6	164.7	-163.3	0	0	110.5	R6 Y7 L12	R6-E10 WeakPolarHBondContact CG-OE1 3.47Å; R6-E10 IonicContact CZ-OE1 3.25Å; R6-E10 IonicContact NE-OE1 3.7Å; R6-E10 PolarHBondContact NE-OE1 2.86Å; R6-E10 VanDerWaalsContact O-CG 3.31Å; R6-E10 WeakPolarHBondContact O-CG 3.42Å; R6-E10 PolarHBondContact O-N 3.4Å; Y7-E10 PolarHBondContact O-N 3.37Å; Y7-E10 VanDerWaalsContact O-N 3.08Å; E10-L12 PolarHBondContact O-N 3.13Å
11	D	92.4	Very high	87.9	Confident	70 Å²	70	99.5 Å²	99.5	37%	0.374	48%	0.48	S	S	.	.	H	α-helix	trans	-70.9	-14.2	-179.1	-66.7	-17.3	0	0	0	113.8	Y7 Y13 E14 F15 L18	Y7-D11 WeakPolarHBondContact O-CB 3.23Å; Y7-D11 PolarHBondContact O-N 3.14Å; D11-Y13 PolarHBondContact O-N 3.1Å; D11-E14 PolarHBondContact O-N 3.07Å; D11-E14 VanDerWaalsContact O-N 3.14Å; D11-F15 HydrophobicContact CB-CD2 4.32Å; D11-F15 PolarHBondContact O-N 2.91Å; D11-L18 HydrophobicContact CB-CD1 4.05Å
12	L	92	Very high	88.6	Confident	37 Å²	37	95.4 Å²	95.4	19%	0.194	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.9	179	-91.9	171	0	0	0	113.7	V8 L9 E10 E14 F15 L18 E19 L22	V8-L12 PolarHBondContact O-N 3.36Å; L9-L12 HydrophobicContact CD1-CD1 4.08Å; E10-L12 PolarHBondContact O-N 3.13Å; L12-E14 VanDerWaalsContact C-N 3.32Å; L12-F15 CarbonylContact O-C 3.54Å; L12-L18 HydrophobicContact CD2-CB 3.94Å; L12-E19 HydrophobicContact CD2-CB 3.95Å; L12-E19 VanDerWaalsContact CD2-N 3.33Å; L12-L22 HydrophobicContact CD1-CB 4.33Å; L12-L22 HydrophobicContact CD1-CD2 3.35Å; L12-L22 HydrophobicContact CD1-CG 4.32Å
13	Y	86.8	Confident	88.8	Confident	212 Å²	212	94.1 Å²	94.1	83%	0.831	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-39.3	177.6	-178.8	-98.6	0	0	0	111.3	D11	D11-Y13 PolarHBondContact O-N 3.1Å
14	E	92.1	Very high	88.8	Confident	142 Å²	142	94.7 Å²	94.7	66%	0.664	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-30.4	179.1	-64.1	-171.2	175.9	0	0	112.5	D11 L12 P16	D11-E14 PolarHBondContact O-N 3.07Å; D11-E14 VanDerWaalsContact O-N 3.14Å; L12-E14 VanDerWaalsContact C-N 3.32Å; E14-P16 WeakPolarHBondContact O-CD 3.4Å
15	F	92.9	Very high	88.6	Confident	110 Å²	110	92 Å²	92	48%	0.482	44%	0.435	S	S	.	.			trans	-127.9	78.1	-176.6	-55.2	-78.4	0	0	0	112.2	D11 L12 S17 L18	D11-F15 HydrophobicContact CB-CD2 4.32Å; D11-F15 PolarHBondContact O-N 2.91Å; L12-F15 CarbonylContact O-C 3.54Å; F15-S17 PolarHBondContact O-N 3.38Å; F15-L18 HydrophobicContact CB-CD1 3.8Å; F15-L18 HydrophobicContact CB-CG 4.01Å; F15-L18 WeakPolarHBondContact O-CB 3.25Å; F15-L18 PolarHBondContact O-N 3.13Å
16	P	90.9	Very high	88.5	Confident	93 Å²	93	92.7 Å²	92.7	60%	0.604	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-58.6	-22.1	-179.3	-26.5	35.1	0	0	0	114.7	E14 L18 E19	E14-P16 WeakPolarHBondContact O-CD 3.4Å; P16-L18 PolarHBondContact O-N 3.29Å; P16-L18 VanDerWaalsContact O-N 3.16Å; P16-E19 WeakPolarHBondContact O-CB 3.18Å; P16-E19 PolarHBondContact O-N 3.33Å
17	S	92	Very high	88.4	Confident	98 Å²	98	91.4 Å²	91.4	69%	0.685	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-61.2	-20.4	176.2	53.3	0	0	0	0	113.8	F15 E19	F15-S17 PolarHBondContact O-N 3.38Å; S17-E19 PolarHBondContact O-N 3.19Å
18	L	90.7	Very high	87.9	Confident	45 Å²	45	89.9 Å²	89.9	24%	0.236	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-73.9	-7.6	178.7	-64.1	176.6	0	0	0	113.6	V8 D11 L12 F15 P16 K20 D21 L22	V8-L18 HydrophobicContact CG1-CB 4.39Å; V8-L18 HydrophobicContact CG1-CD1 4.44Å; D11-L18 HydrophobicContact CB-CD1 4.05Å; L12-L18 HydrophobicContact CD2-CB 3.94Å; F15-L18 HydrophobicContact CB-CD1 3.8Å; F15-L18 HydrophobicContact CB-CG 4.01Å; F15-L18 WeakPolarHBondContact O-CB 3.25Å; F15-L18 PolarHBondContact O-N 3.13Å; P16-L18 PolarHBondContact O-N 3.29Å; P16-L18 VanDerWaalsContact O-N 3.16Å; L18-K20 PolarHBondContact O-N 3.03Å; L18-D21 PolarHBondContact O-N 3.05Å; L18-L22 PolarHBondContact O-N 3.14Å
19	E	90.4	Very high	87.4	Confident	104 Å²	104	89.6 Å²	89.6	49%	0.486	44%	0.435	S	S	.	.	H	α-helix	trans	-59.2	-37.6	-174.3	-165.6	-163.4	161.5	0	0	112	L12 P16 S17 K23	L12-E19 HydrophobicContact CD2-CB 3.95Å; L12-E19 VanDerWaalsContact CD2-N 3.33Å; P16-E19 WeakPolarHBondContact O-CB 3.18Å; P16-E19 PolarHBondContact O-N 3.33Å; S17-E19 PolarHBondContact O-N 3.19Å; E19-K23 WeakPolarHBondContact O-CG 3.35Å; E19-K23 PolarHBondContact O-N 3.41Å; E19-K23 VanDerWaalsContact O-N 3.12Å; E19-K23 VanDerWaalsContact OE1-CE 3.23Å; E19-K23 WeakPolarHBondContact OE1-CE 3.46Å; E19-K23 IonicContact OE1-NZ 3.76Å; E19-K23 PolarHBondContact OE1-NZ 2.94Å
20	K	88.3	Confident	86.6	Confident	161 Å²	161	93.6 Å²	93.6	70%	0.7	44%	0.444	S	S	*	.	H	α-helix	trans	-65.7	-43.7	177.3	-172.4	179.5	177.1	-176	0	111.5	L18 K23 E24	L18-K20 PolarHBondContact O-N 3.03Å; K20-K23 PolarHBondContact O-N 3.44Å; K20-E24 PolarHBondContact O-N 3.23Å
21	D	85.4	Confident	85.1	Confident	99 Å²	99	97.1 Å²	97.1	53%	0.529	45%	0.454	S	S	.	.	H	α-helix	trans	-71.1	-36.9	-179.3	-62.1	-44.4	0	0	0	111.4	L18 K23 E24 F25	L18-D21 PolarHBondContact O-N 3.05Å; D21-K23 PolarHBondContact O-N 2.85Å; D21-E24 PolarHBondContact O-N 3.43Å; D21-F25 WeakPolarHBondContact O-CB 3.38Å; D21-F25 PolarHBondContact O-N 2.92Å
22	L	86.6	Confident	83.3	Confident	15 Å²	15	101.1 Å²	101.1	8%	0.079	46%	0.463	C	S	.	.	H	α-helix	trans	-62.3	-42	174	-170.4	79	0	0	0	111.4	Y5 V8 L9 L12 L18 E24 F25 Q26	Y5-L22 HydrophobicContact CD2-CD1 3.52Å; Y5-L22 HydrophobicContact CD2-CG 4.34Å; Y5-L22 HydrophobicContact CE2-CD1 3.49Å; Y5-L22 VanDerWaalsContact CE2-CD1 3.49Å; Y5-L22 HydrophobicContact CE2-CD2 4.35Å; Y5-L22 HydrophobicContact CE2-CG 3.86Å; Y5-L22 HydrophobicContact CG-CD1 4.37Å; V8-L22 HydrophobicContact CB-CD1 4.03Å; V8-L22 HydrophobicContact CG1-CB 4.29Å; V8-L22 HydrophobicContact CG1-CD1 3.77Å; L9-L22 HydrophobicContact CB-CD1 4.23Å; L9-L22 HydrophobicContact CB-CD2 4.4Å; L9-L22 HydrophobicContact CD1-CD2 3.67Å; L12-L22 HydrophobicContact CD1-CB 4.33Å; L12-L22 HydrophobicContact CD1-CD2 3.35Å; L12-L22 HydrophobicContact CD1-CG 4.32Å; L18-L22 PolarHBondContact O-N 3.14Å; L22-E24 VanDerWaalsContact C-N 3.33Å; L22-E24 PolarHBondContact O-N 3.49Å; L22-F25 PolarHBondContact O-N 3.46Å; L22-Q26 WeakPolarHBondContact O-CB 3.34Å; L22-Q26 PolarHBondContact O-N 3.31Å
23	K	86.1	Confident	81.4	Confident	106 Å²	106	102.6 Å²	102.6	46%	0.461	47%	0.469	S	S	.	.	H	α-helix	trans	-60.2	-42.4	175.9	-75.8	172.2	-174.6	167.1	0	111.6	E19 K20 D21 Q26 K27	E19-K23 WeakPolarHBondContact O-CG 3.35Å; E19-K23 PolarHBondContact O-N 3.41Å; E19-K23 VanDerWaalsContact O-N 3.12Å; E19-K23 VanDerWaalsContact OE1-CE 3.23Å; E19-K23 WeakPolarHBondContact OE1-CE 3.46Å; E19-K23 IonicContact OE1-NZ 3.76Å; E19-K23 PolarHBondContact OE1-NZ 2.94Å; K20-K23 PolarHBondContact O-N 3.44Å; D21-K23 PolarHBondContact O-N 2.85Å; K23-Q26 PolarHBondContact O-N 3.24Å; K23-K27 WeakPolarHBondContact O-CG 3.5Å; K23-K27 PolarHBondContact O-N 2.98Å; K23-K27 VanDerWaalsContact O-N 3.12Å
24	E	84.7	Confident	79.3	Confident	93 Å²	93	97.1 Å²	97.1	44%	0.435	46%	0.458	S	S	.	.	H	α-helix	trans	-66.4	-41.2	173.9	-72.1	-56.6	138.9	0	0	112.1	K20 D21 L22 Q26 K27 L28	K20-E24 PolarHBondContact O-N 3.23Å; D21-E24 PolarHBondContact O-N 3.43Å; L22-E24 VanDerWaalsContact C-N 3.33Å; L22-E24 PolarHBondContact O-N 3.49Å; E24-Q26 VanDerWaalsContact C-N 3.31Å; E24-Q26 PolarHBondContact O-N 2.81Å; E24-K27 WeakPolarHBondContact O-CB 3.46Å; E24-K27 PolarHBondContact O-N 3.14Å; E24-K27 IonicContact OE1-NZ 3.67Å; E24-K27 PolarHBondContact OE1-NZ 2.85Å; E24-K27 IonicContact OE2-NZ 3.32Å; E24-L28 WeakPolarHBondContact O-CG 3.27Å; E24-L28 PolarHBondContact O-N 3.49Å
25	F	82.9	Confident	76.7	Confident	31 Å²	31	94.1 Å²	94.1	14%	0.136	45%	0.449	C	S	.	.	H	α-helix	trans	-62.9	-37.9	176.5	-154.4	-89.3	0	0	0	112.2	M1 L4 Y5 D21 L22 L28 L29	M1-F25 HydrophobicContact CB-CZ 4.36Å; M1-F25 HydrophobicContact CE-CD2 4.26Å; M1-F25 HydrophobicContact CE-CE1 3.98Å; M1-F25 HydrophobicContact CE-CE2 3.36Å; M1-F25 HydrophobicContact CE-CZ 3.21Å; M1-F25 WeakPolarHBondContact O-CE1 3.36Å; M1-F25 HydrophobicContact SD-CE2 4.03Å; M1-F25 HydrophobicContact SD-CZ 3.59Å; M1-F25 VanDerWaalsContact SD-CZ 3.59Å; L4-F25 HydrophobicContact CB-CZ 4.09Å; L4-F25 HydrophobicContact CD2-CE2 3.85Å; L4-F25 HydrophobicContact CD2-CZ 3.85Å; L4-F25 HydrophobicContact CG-CE2 4.35Å; L4-F25 HydrophobicContact CG-CZ 4.07Å; Y5-F25 AromaticContact CD2-CD1 3.73Å; Y5-F25 HydrophobicContact CD2-CD1 3.73Å; Y5-F25 HydrophobicContact CD2-CE1 4.48Å; Y5-F25 HydrophobicContact CG-CD1 4.2Å; D21-F25 WeakPolarHBondContact O-CB 3.38Å; D21-F25 PolarHBondContact O-N 2.92Å; L22-F25 PolarHBondContact O-N 3.46Å; F25-L28 PolarHBondContact O-N 2.88Å; F25-L29 HydrophobicContact CD1-CD1 3.63Å; F25-L29 HydrophobicContact CD1-CG 4.14Å; F25-L29 HydrophobicContact CE1-CD1 3.72Å; F25-L29 HydrophobicContact CE1-CG 4.1Å; F25-L29 PolarHBondContact O-N 2.95Å
26	Q	82.8	Confident	73.8	Confident	68 Å²	68	94.7 Å²	94.7	32%	0.318	46%	0.457	S	S	.	.	H	α-helix	trans	-65.8	-40.8	175.6	-163.2	-177.9	16.7	0	0	111.5	Y5 L22 K23 E24 L28 L29 R30	Y5-Q26 HydrophobicContact CE2-CB 4.05Å; Y5-Q26 HydrophobicContact CE2-CG 4.26Å; L22-Q26 WeakPolarHBondContact O-CB 3.34Å; L22-Q26 PolarHBondContact O-N 3.31Å; K23-Q26 PolarHBondContact O-N 3.24Å; E24-Q26 VanDerWaalsContact C-N 3.31Å; E24-Q26 PolarHBondContact O-N 2.81Å; Q26-L28 VanDerWaalsContact C-N 3.3Å; Q26-L28 PolarHBondContact O-N 2.96Å; Q26-L29 PolarHBondContact O-N 3.14Å; Q26-R30 WeakPolarHBondContact O-CG 3.34Å; Q26-R30 PolarHBondContact O-N 2.91Å
27	K	83.7	Confident	70.9	Confident	108 Å²	108	96 Å²	96	47%	0.47	46%	0.459	S	S	.	.	H	α-helix	trans	-59	-42.9	172.2	-69.8	172.4	-172.1	173.3	0	111	K23 E24 R31	K23-K27 WeakPolarHBondContact O-CG 3.5Å; K23-K27 PolarHBondContact O-N 2.98Å; K23-K27 VanDerWaalsContact O-N 3.12Å; E24-K27 WeakPolarHBondContact O-CB 3.46Å; E24-K27 PolarHBondContact O-N 3.14Å; E24-K27 IonicContact OE1-NZ 3.67Å; E24-K27 PolarHBondContact OE1-NZ 2.85Å; E24-K27 IonicContact OE2-NZ 3.32Å; K27-R31 WeakPolarHBondContact O-CG 3.32Å; K27-R31 PolarHBondContact O-N 3.48Å
28	L	78.4	Confident	67.7	Low	83 Å²	83	96.4 Å²	96.4	44%	0.435	46%	0.461	S	S	.	.	H	α-helix	trans	-66.7	-40.1	177.8	-68.7	172.6	0	0	0	112.9	E24 F25 Q26 R31 R32	E24-L28 WeakPolarHBondContact O-CG 3.27Å; E24-L28 PolarHBondContact O-N 3.49Å; F25-L28 PolarHBondContact O-N 2.88Å; Q26-L28 VanDerWaalsContact C-N 3.3Å; Q26-L28 PolarHBondContact O-N 2.96Å; L28-R31 PolarHBondContact O-N 2.85Å; L28-R32 PolarHBondContact O-N 3.23Å
29	L	77.2	Confident	64.8	Low	20 Å²	20	99.8 Å²	99.8	11%	0.105	49%	0.485	C	S	.	.	H	α-helix	trans	-67.7	-38.4	176.7	-87.6	167.2	0	0	0	113	M1 K2 Y5 F25 Q26 R32 H33	M1-L29 HydrophobicContact CB-CD2 4.31Å; K2-L29 HydrophobicContact CG-CD2 4.03Å; Y5-L29 HydrophobicContact CD1-CD1 4.3Å; Y5-L29 HydrophobicContact CD2-CD1 3.7Å; Y5-L29 HydrophobicContact CE2-CD1 4.43Å; Y5-L29 HydrophobicContact CG-CD1 3.59Å; F25-L29 HydrophobicContact CD1-CD1 3.63Å; F25-L29 HydrophobicContact CD1-CG 4.14Å; F25-L29 HydrophobicContact CE1-CD1 3.72Å; F25-L29 HydrophobicContact CE1-CG 4.1Å; F25-L29 PolarHBondContact O-N 2.95Å; Q26-L29 PolarHBondContact O-N 3.14Å; L29-R32 PolarHBondContact O-N 2.8Å; L29-H33 PolarHBondContact O-N 2.66Å; L29-H33 PolarHBondContact O-ND1 3Å
30	R	70.9	Confident	62.2	Low	167 Å²	167	100.7 Å²	100.7	63%	0.63	50%	0.5	S	S	*	.	H	α-helix	trans	-64.7	-41.2	175.6	-76.6	-176	178.1	178.1	1.4	111.7	Q26 R32 H33 T34	Q26-R30 WeakPolarHBondContact O-CG 3.34Å; Q26-R30 PolarHBondContact O-N 2.91Å; R30-R32 PolarHBondContact O-N 2.84Å; R30-H33 PolarHBondContact O-N 2.8Å; R30-T34 PolarHBondContact O-N 2.98Å; R30-T34 PolarHBondContact O-OG1 2.74Å
31	R	61	Low	59.5	Low	178 Å²	178	100.6 Å²	100.6	67%	0.672	51%	0.507	S	S	*	.	H	α-helix	trans	-60.5	-25	174.1	-73.9	175.6	-179.7	-175.4	1.1	113.7	K27 L28 T34 V35	K27-R31 WeakPolarHBondContact O-CG 3.32Å; K27-R31 PolarHBondContact O-N 3.48Å; L28-R31 PolarHBondContact O-N 2.85Å; R31-T34 PolarHBondContact O-OG1 2.92Å; R31-T34 VanDerWaalsContact O-OG1 3.12Å; R31-V35 WeakPolarHBondContact O-CG2 3.29Å
32	R	54.5	Low	57	Low	154 Å²	154	103 Å²	103	58%	0.581	52%	0.515	S	S	*	.	H	α-helix	trans	-87.9	-36.7	175.3	-74.2	-167.6	-175.7	-151.2	2.3	113.4	L28 L29 R30 T34 V35 D36	L28-R32 PolarHBondContact O-N 3.23Å; L29-R32 PolarHBondContact O-N 2.8Å; R30-R32 PolarHBondContact O-N 2.84Å; R32-T34 VanDerWaalsContact C-N 3.29Å; R32-T34 PolarHBondContact O-N 2.57Å; R32-V35 WeakPolarHBondContact O-CA 3.46Å; R32-V35 WeakPolarHBondContact O-CB 3.35Å; R32-V35 PolarHBondContact O-N 3.4Å; R32-D36 PolarHBondContact O-N 2.85Å
33	H	50.4	Low	54.5	Low	68 Å²	68	110.7 Å²	110.7	32%	0.315	55%	0.548	S	S	.	.	H	α-helix	trans	-63.4	-35.2	176.4	-78.4	83.4	0	0	0	112.3	K2 L29 R30 V35 D36 D37	K2-H33 WeakPolarHBondContact CE-CE1 3.44Å; K2-H33 WeakPolarHBondContact CE-NE2 3.48Å; K2-H33 PolarHBondContact NZ-NE2 3.1Å; L29-H33 PolarHBondContact O-N 2.66Å; L29-H33 PolarHBondContact O-ND1 3Å; R30-H33 PolarHBondContact O-N 2.8Å; H33-V35 PolarHBondContact O-N 3.04Å; H33-D36 PolarHBondContact O-N 3.01Å; H33-D37 WeakPolarHBondContact O-CB 3.45Å; H33-D37 PolarHBondContact O-N 3.33Å
34	T	43.2	Very low	51.6	Low	96 Å²	96	111.5 Å²	111.5	59%	0.589	57%	0.567	S	S	*	*	H	α-helix	trans	-66.4	-13.9	171.6	52.5	0	0	0	0	114.2	R30 R31 R32	R30-T34 PolarHBondContact O-N 2.98Å; R30-T34 PolarHBondContact O-OG1 2.74Å; R31-T34 PolarHBondContact O-OG1 2.92Å; R31-T34 VanDerWaalsContact O-OG1 3.12Å; R32-T34 VanDerWaalsContact C-N 3.29Å; R32-T34 PolarHBondContact O-N 2.57Å
35	V	38.6	Very low	49.3	Very low	79 Å²	79	116.4 Å²	116.4	48%	0.479	59%	0.587	S	S	.	*	H	α-helix	trans	-95.1	-29	176.1	176.3	0	0	0	0	111.2	R31 R32 H33	R31-V35 WeakPolarHBondContact O-CG2 3.29Å; R32-V35 WeakPolarHBondContact O-CA 3.46Å; R32-V35 WeakPolarHBondContact O-CB 3.35Å; R32-V35 PolarHBondContact O-N 3.4Å; H33-V35 PolarHBondContact O-N 3.04Å
36	D	32.1	Very low	46.6	Very low	122 Å²	122	124 Å²	124	65%	0.652	62%	0.623	S	S	*	*	H	α-helix	trans	-92.6	-19.7	-179.7	-73.1	-29.6	0	0	0	113.8	R32 H33 C38	R32-D36 PolarHBondContact O-N 2.85Å; H33-D36 PolarHBondContact O-N 3.01Å; D36-C38 PolarHBondContact O-N 3.11Å
37	D	29.1	Very low	44.3	Very low	122 Å²	122	126.7 Å²	126.7	65%	0.652	64%	0.644	S	S	*	*			trans	-93	69.3	178.9	-72.2	-41.1	0	0	0	112.6	H33	H33-D37 WeakPolarHBondContact O-CB 3.45Å; H33-D37 PolarHBondContact O-N 3.33Å
38	C	25.4	Very low	41.7	Very low	106 Å²	106	132.3 Å²	132.3	72%	0.716	66%	0.664	S	S	*	*			trans	-101.2	110.7	151.2	-87.7	0	0	0	0	107.8	D36	D36-C38 PolarHBondContact O-N 3.11Å
39	P	29.8	Very low	39.2	Very low	115 Å²	115	136.8 Å²	136.8	75%	0.747	68%	0.682	S	S	*	*			trans	-80.2	146.2	179	30.4	-30.1	0	0	0	111
40	P	35	Very low	37	Very low	124 Å²	124	144.7 Å²	144.7	81%	0.805	72%	0.719	S	S	*	*			trans	-66.7	143.8	153.1	31.4	-29.4	0	0	0	107.8
41	N	31.5	Very low	34.8	Very low	158 Å²	158	145.7 Å²	145.7	85%	0.845	73%	0.733	S	S	*	*	S	Bend	trans	-32.9	140.6	-176.3	-110	-27.8	0	0	0	117.3
42	Q	32.9	Very low	33.5	Very low	150 Å²	150	142.2 Å²	142.2	70%	0.701	74%	0.736	S	S	*	*			trans	90.9	117.8	152.7	-75.5	-171.1	22.6	0	0	122.6
43	K	34	Very low	32.3	Very low	177 Å²	177	143.1 Å²	143.1	77%	0.77	75%	0.751	S	S	*	*			trans	69.5	105.6	139.8	-64	177.7	-175.4	173.9	0	118.5
44	S	25.4	Very low	31.6	Very low	122 Å²	122	149 Å²	149	85%	0.853	78%	0.776	S	S	*	*				-178	147.4	109.4	46.5	0	0	0	0	111.8
45	K	36.4	Very low	30.9	Very low	197 Å²	197	152.6 Å²	152.6	86%	0.857	79%	0.786	S	S	*	*			trans	-59.4	139.1	176.1	-68.6	170.7	172.1	176.9	0	110.5
46	Q	27.1	Very low	30.3	Very low	191 Å²	191	155.2 Å²	155.2	89%	0.893	80%	0.798	S	S	*	*				-165.5	131.3	129.4	-105.6	165.3	27.1	0	0	112.7
47	T	34.2	Very low	30.2	Very low	124 Å²	124	155.1 Å²	155.1	76%	0.761	81%	0.806	S	S	*	*			trans	-63.3	133.1	177.6	-32.9	0	0	0	0	111.4
48	Y	28.1	Very low	30.2	Very low	226 Å²	226	157.3 Å²	157.3	89%	0.886	82%	0.817	S	S	*	*			trans	-149.3	139.8	145.4	-100.7	-76.8	0	0	0	111.6
49	Q	26.6	Very low	30.3	Very low	176 Å²	176	161 Å²	161	82%	0.822	82%	0.824	S	S	*	*			trans	-68.7	157.2	-160.6	-79.9	163.7	-43	0	0	116.8
50	Q	31.3	Very low	30.3	Very low	187 Å²	187	162.6 Å²	162.6	87%	0.874	83%	0.825	S	S	*	*			trans	-44.5	136.8	164	-68.5	172.3	-36.1	0	0	114.4
51	M	24.5	Very low	30.6	Very low	188 Å²	188	168.1 Å²	168.1	93%	0.926	83%	0.83	S	S	*	*			trans	-134.1	114	140.2	-80.8	-71.6	-84.8	0	0	108.1
52	S	34.3	Very low	30.6	Very low	104 Å²	104	165.4 Å²	165.4	73%	0.727	82%	0.815	S	S	*	*			trans	-76.4	123.2	175.8	173.5	0	0	0	0	110.1
53	L	29.1	Very low	30.5	Very low	174 Å²	174	161.1 Å²	161.1	91%	0.911	80%	0.802	S	S	*	*			trans	-141.7	111.7	153.1	-80.6	173.7	0	0	0	108.5
54	K	34.7	Very low	31.1	Very low	190 Å²	190	157 Å²	157	83%	0.826	79%	0.794	S	S	*	*			trans	-55.9	131.8	162.9	-80.4	174.1	169.5	177.3	0	108.6
55	E	29.3	Very low	32	Very low	173 Å²	173	155.1 Å²	155.1	81%	0.808	79%	0.785	S	S	*	*			trans	-178.5	120.1	132.8	-100.1	166.1	-175.6	0	0	113
56	N	24.5	Very low	32.4	Very low	134 Å²	134	151.2 Å²	151.2	72%	0.717	77%	0.774	S	S	*	*			trans	63.2	87.7	142.1	-58.2	-18.1	0	0	0	120.2	L58	N56-L58 PolarHBondContact O-N 2.66Å
57	S	30.7	Very low	33.9	Very low	120 Å²	120	148.5 Å²	148.5	84%	0.839	76%	0.761	S	S	*	*				35.2	69.3	121.5	-41.6	0	0	0	0	118.3
58	L	28.8	Very low	35.6	Very low	167 Å²	167	148.2 Å²	148.2	87%	0.874	75%	0.746	S	S	*	*			trans	-132.2	121.8	151.6	-75.9	170.2	0	0	0	107.9	N56 L60	N56-L58 PolarHBondContact O-N 2.66Å; L58-L60 PolarHBondContact O-N 3.42Å
59	Q	27.8	Very low	37.9	Very low	185 Å²	185	140.5 Å²	140.5	86%	0.864	72%	0.718	S	S	*	*			trans	-45.4	122.9	-170.2	-70.5	172.2	-19.7	0	0	112.5	R61	Q59-R61 PolarHBondContact O-N 3.43Å
60	L	29.9	Very low	40.6	Very low	147 Å²	147	133 Å²	133	77%	0.77	68%	0.684	S	S	*	*			trans	-56.8	113.9	175	-162.9	74.6	0	0	0	109.1	L58 N62	L58-L60 PolarHBondContact O-N 3.42Å; L60-N62 PolarHBondContact O-N 3.11Å; L60-N62 VanDerWaalsContact O-N 3.1Å
61	R	42.6	Very low	43.3	Very low	241 Å²	241	124.9 Å²	124.9	91%	0.909	65%	0.646	S	S	*	*			trans	-73.1	98.3	172.5	-159.5	-179.1	-165.1	-177.6	4.2	107.3	Q59	Q59-R61 PolarHBondContact O-N 3.43Å
62	N	30.5	Very low	46.4	Very low	100 Å²	100	116.1 Å²	116.1	54%	0.535	60%	0.604	S	S	.	*			trans	-68.9	149.4	174.2	-69.1	-21.1	0	0	0	110.5	L60	L60-N62 PolarHBondContact O-N 3.11Å; L60-N62 VanDerWaalsContact O-N 3.1Å
63	S	31.7	Very low	49.1	Very low	61 Å²	61	112.9 Å²	112.9	43%	0.427	58%	0.581	S	S	.	*			trans	-58	157.5	-172.4	-69.7	0	0	0	0	115.6
64	P	45	Very low	52.1	Low	91 Å²	91	104.6 Å²	104.6	59%	0.591	54%	0.538	S	S	*	.	S	Bend	trans	-111	2	-142.4	24.7	-7	0	0	0	118.1
65	A	44.4	Very low	54.9	Low	81 Å²	81	97.5 Å²	97.5	67%	0.669	51%	0.506	S	S	*	.	S	Bend	trans	-89.6	-43.8	-178.3	0	0	0	0	0	113.4
66	D	45.4	Very low	57.9	Low	116 Å²	116	89.4 Å²	89.4	62%	0.62	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-23.6	-169.7	-129.4	18.6	0	0	0	113.8	A89	D66-A89 WeakPolarHBondContact OD1-CB 3.5Å
67	Q	58.3	Low	61.1	Low	133 Å²	133	83.3 Å²	83.3	62%	0.621	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	10.2	179	-71.9	-173.9	-12.6	0	0	113.5	E69	Q67-E69 PolarHBondContact O-N 2.92Å; Q67-E69 VanDerWaalsContact O-N 3.11Å
68	R	70.3	Confident	63.9	Low	119 Å²	119	80.8 Å²	80.8	45%	0.449	42%	0.417	S	S	.	.			trans	-65.4	118.2	178.5	-174.9	170.4	169.6	-170.3	-12.9	109	V70 H87 A88	R68-V70 HydrophobicContact CG-CG1 4.44Å; R68-V70 PolarHBondContact O-N 3.39Å; R68-H87 WeakPolarHBondContact O-CA 3.08Å; R68-A88 PolarHBondContact O-N 2.99Å
69	E	77.4	Confident	66.9	Low	64 Å²	64	73.1 Å²	73.1	30%	0.299	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	130.7	172.5	-67.7	-172	143.9	0	0	109.3	Q67 H85 T86 S186 L187	Q67-E69 PolarHBondContact O-N 2.92Å; Q67-E69 VanDerWaalsContact O-N 3.11Å; E69-H85 IonicContact OE1-CE1 3.87Å; E69-H85 IonicContact OE2-CE1 3.94Å; E69-T86 CarbonylContact C-O 3.57Å; E69-T86 WeakPolarHBondContact CA-O 3.49Å; E69-S186 PolarHBondContact OE1-OG 3.45Å; E69-S186 PolarHBondContact OE2-OG 3.46Å; E69-L187 HydrophobicContact CB-CD2 4.3Å
70	V	82.9	Confident	70	Confident	19 Å²	19	64.3 Å²	64.3	12%	0.115	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153.2	-177	-65.1	0	0	0	0	109.9	R68 T86 A88 Y131	R68-V70 HydrophobicContact CG-CG1 4.44Å; R68-V70 PolarHBondContact O-N 3.39Å; V70-T86 HydrophobicContact CG2-CG2 3.91Å; V70-T86 PolarHBondContact N-O 3.14Å; V70-T86 PolarHBondContact O-N 3.41Å; V70-T86 VanDerWaalsContact O-O 3.13Å; V70-A88 HydrophobicContact CG1-CB 4.33Å; V70-Y131 HydrophobicContact CB-CE1 4.38Å; V70-Y131 HydrophobicContact CB-CE2 4.25Å; V70-Y131 HydrophobicContact CG2-CD2 4.02Å; V70-Y131 HydrophobicContact CG2-CE1 4.38Å; V70-Y131 HydrophobicContact CG2-CE2 3.4Å; V70-Y131 VanDerWaalsContact CG2-CE2 3.4Å
71	I	87	Confident	73.1	Confident	15 Å²	15	58 Å²	58	8%	0.077	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.7	173.4	-65.8	169.9	0	0	0	108.4	S83 Y131 V215 Q218 R219 E222	I71-S83 VanDerWaalsContact CG2-OG 3.27Å; I71-S83 WeakPolarHBondContact CG2-OG 3.38Å; I71-Y131 PolarHBondContact O-OH 2.9Å; I71-V215 HydrophobicContact CD1-CG1 3.72Å; I71-V215 HydrophobicContact CG1-CG1 3.96Å; I71-Q218 HydrophobicContact CD1-CB 4.24Å; I71-Q218 HydrophobicContact CD1-CG 4.02Å; I71-Q218 VanDerWaalsContact CG2-NE2 3.33Å; I71-R219 HydrophobicContact CD1-CB 4.13Å; I71-E222 WeakPolarHBondContact CG2-OE1 3.27Å
72	C	89.1	Confident	75.5	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.027	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	115.5	179.5	-169.9	0	0	0	0	109.9	S83 V84 T86 Y131 L141	C72-S83 CarbonylContact O-C 3.52Å; C72-S83 WeakPolarHBondContact O-CA 3.13Å; C72-V84 HydrophobicContact CB-CB 4.22Å; C72-V84 PolarHBondContact N-O 3.23Å; C72-V84 PolarHBondContact O-N 3.16Å; C72-T86 HydrophobicContact CB-CG2 4.46Å; C72-Y131 WeakPolarHBondContact CA-OH 3.47Å; C72-Y131 HydrophobicContact CB-CE2 4.18Å; C72-Y131 WeakPolarHBondContact CB-OH 3.41Å; C72-Y131 PolarHBondContact N-OH 2.91Å; C72-Y131 VanDerWaalsContact N-OH 3.08Å; C72-L141 VanDerWaalsContact SG-CD2 3.54Å
73	C	91.4	Very high	78.5	Confident	37 Å²	37	41.9 Å²	41.9	25%	0.25	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	109.4	176.8	-56.7	0	0	0	0	109.4	Y81	C73-Y81 HydrophobicContact CB-CD2 3.59Å; C73-Y81 HydrophobicContact CB-CE2 3.84Å; C73-Y81 HydrophobicContact CB-CG 4.34Å; C73-Y81 VanDerWaalsContact SG-CE2 3.55Å
74	V	93.1	Very high	81.4	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	110.4	177	-170.7	0	0	0	0	109.6	V76 Y81 L82 L95 L99 L112 L141 A143	V74-V76 PolarHBondContact O-N 3.08Å; V74-Y81 CarbonylContact O-C 3.3Å; V74-Y81 WeakPolarHBondContact O-CA 3.2Å; V74-Y81 VanDerWaalsContact O-CB 3.28Å; V74-Y81 WeakPolarHBondContact O-CB 3.48Å; V74-L82 PolarHBondContact N-O 3.29Å; V74-L82 PolarHBondContact O-N 3.37Å; V74-L95 HydrophobicContact CG2-CD1 3.98Å; V74-L95 HydrophobicContact CG2-CD2 3.71Å; V74-L95 HydrophobicContact CG2-CG 4.09Å; V74-L99 HydrophobicContact CB-CD1 4.46Å; V74-L99 HydrophobicContact CB-CD2 4.13Å; V74-L99 HydrophobicContact CG1-CD1 3.92Å; V74-L99 HydrophobicContact CG1-CD2 4.15Å; V74-L99 HydrophobicContact CG2-CD1 4.45Å; V74-L112 HydrophobicContact CG1-CD2 3.83Å; V74-L141 HydrophobicContact CG1-CG 4.37Å; V74-L141 HydrophobicContact CG2-CD2 3.83Å; V74-L141 HydrophobicContact CG2-CG 4.27Å; V74-A143 HydrophobicContact CG1-CB 3.78Å
75	Y	92.9	Very high	83.5	Confident	41 Å²	41	35 Å²	35	16%	0.161	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	130.1	176.1	-75	-89.8	0	0	0	110.5	S80 Y81 K140 L141 V142 A143 D392	Y75-S80 WeakPolarHBondContact CA-O 3.35Å; Y75-Y81 HydrophobicContact CE1-CD1 4.31Å; Y75-K140 HydrophobicContact CD2-CB 4.08Å; Y75-K140 HydrophobicContact CD2-CD 4.29Å; Y75-K140 HydrophobicContact CD2-CG 4.47Å; Y75-K140 HydrophobicContact CE2-CB 4.18Å; Y75-K140 HydrophobicContact CE2-CD 3.91Å; Y75-K140 HydrophobicContact CE2-CG 4.1Å; Y75-L141 PolarHBondContact N-O 3.15Å; Y75-V142 CarbonylContact O-C 3.36Å; Y75-V142 WeakPolarHBondContact O-CA 3.43Å; Y75-A143 PolarHBondContact O-N 2.8Å; Y75-D392 WeakPolarHBondContact CE1-OD2 3.48Å; Y75-D392 PolarHBondContact OH-OD2 2.88Å
76	V	92.6	Very high	85.6	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.012	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	-16.5	-178.9	-63	0	0	0	0	111.9	V74 S80 L82 L99 L103 A143 L152	V74-V76 PolarHBondContact O-N 3.08Å; V76-S80 PolarHBondContact N-O 3.41Å; V76-L82 HydrophobicContact CG1-CB 4.48Å; V76-L99 HydrophobicContact CG1-CD2 4.14Å; V76-L103 HydrophobicContact CB-CD1 4.27Å; V76-L103 HydrophobicContact CG1-CD1 3.8Å; V76-L103 HydrophobicContact CG1-CD2 4.4Å; V76-L103 HydrophobicContact CG2-CD2 4.49Å; V76-A143 HydrophobicContact CG1-CB 4.46Å; V76-L152 HydrophobicContact CB-CD1 4.45Å; V76-L152 HydrophobicContact CG2-CD1 4.15Å; V76-L152 WeakPolarHBondContact O-CB 3.37Å; V76-L152 PolarHBondContact O-N 3.29Å; V76-L152 VanDerWaalsContact O-N 3.15Å
77	S	91.1	Very high	87.4	Confident	6 Å²	6	30.1 Å²	30.1	4%	0.042	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	174.5	167.7	73	0	0	0	0	109.1	D79 S80 L152	S77-D79 WeakPolarHBondContact CB-OD1 3.44Å; S77-D79 PolarHBondContact O-N 3.12Å; S77-D79 PolarHBondContact OG-N 2.83Å; S77-D79 PolarHBondContact OG-OD1 3.24Å; S77-S80 PolarHBondContact N-O 3.31Å; S77-S80 VanDerWaalsContact O-O 3.12Å; S77-S80 WeakPolarHBondContact OG-CB 3.06Å; S77-S80 PolarHBondContact OG-N 2.79Å; S77-S80 PolarHBondContact OG-OG 3.21Å; S77-L152 WeakPolarHBondContact CB-O 3.14Å
78	P	89.1	Confident	88.6	Confident	67 Å²	67	24.8 Å²	24.8	44%	0.435	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.4	175.6	-28.9	38.9	0	0	0	114.9	E150 P154	P78-E150 VanDerWaalsContact CD-OE2 3.25Å; P78-E150 WeakPolarHBondContact CD-OE2 3.39Å; P78-E150 WeakPolarHBondContact CG-OE2 3.47Å; P78-P154 HydrophobicContact CG-CG 4.09Å
79	D	91.6	Very high	89.2	Confident	7 Å²	7	20.6 Å²	20.6	4%	0.037	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	6.2	-170.3	57.9	-8.5	0	0	0	113.7	S77 L155 I391 N393 T396	S77-D79 WeakPolarHBondContact CB-OD1 3.44Å; S77-D79 PolarHBondContact O-N 3.12Å; S77-D79 PolarHBondContact OG-N 2.83Å; S77-D79 PolarHBondContact OG-OD1 3.24Å; D79-L155 PolarHBondContact OD1-N 2.99Å; D79-L155 VanDerWaalsContact OD1-N 3.11Å; D79-L155 PolarHBondContact OD2-N 3.01Å; D79-I391 WeakPolarHBondContact O-CA 3.26Å; D79-I391 WeakPolarHBondContact O-CG2 3.18Å; D79-N393 HydrophobicContact CB-CB 4.26Å; D79-T396 HydrophobicContact CB-CG2 3.99Å; D79-T396 WeakPolarHBondContact CB-OG1 3.46Å; D79-T396 WeakPolarHBondContact OD2-CG2 3.38Å; D79-T396 PolarHBondContact OD2-OG1 3.18Å
80	S	93.6	Very high	89.7	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	153.2	178.4	76.6	0	0	0	0	114.2	Y75 V76 S77 H389 I390	Y75-S80 WeakPolarHBondContact CA-O 3.35Å; V76-S80 PolarHBondContact N-O 3.41Å; S77-S80 PolarHBondContact N-O 3.31Å; S77-S80 VanDerWaalsContact O-O 3.12Å; S77-S80 WeakPolarHBondContact OG-CB 3.06Å; S77-S80 PolarHBondContact OG-N 2.79Å; S77-S80 PolarHBondContact OG-OG 3.21Å; S80-H389 PolarHBondContact OG-NE2 3.01Å; S80-I390 CarbonylContact C-O 3.57Å; S80-I390 WeakPolarHBondContact CA-O 3.42Å; S80-I390 VanDerWaalsContact CB-O 3.3Å; S80-I390 WeakPolarHBondContact CB-O 3.13Å
81	Y	94.2	Very high	90.1	Very high	14 Å²	14	19.3 Å²	19.3	6%	0.055	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	156	177.7	69.2	-82.2	0	0	0	111.7	C73 V74 Y75 Q225 I390 D392	C73-Y81 HydrophobicContact CB-CD2 3.59Å; C73-Y81 HydrophobicContact CB-CE2 3.84Å; C73-Y81 HydrophobicContact CB-CG 4.34Å; C73-Y81 VanDerWaalsContact SG-CE2 3.55Å; V74-Y81 CarbonylContact O-C 3.3Å; V74-Y81 WeakPolarHBondContact O-CA 3.2Å; V74-Y81 VanDerWaalsContact O-CB 3.28Å; V74-Y81 WeakPolarHBondContact O-CB 3.48Å; Y75-Y81 HydrophobicContact CE1-CD1 4.31Å; Y81-Q225 PolarHBondContact OH-OE1 3.22Å; Y81-I390 HydrophobicContact CD1-CB 4.25Å; Y81-I390 HydrophobicContact CD1-CG2 4.33Å; Y81-I390 HydrophobicContact CE1-CB 3.72Å; Y81-I390 HydrophobicContact CE1-CG2 3.46Å; Y81-I390 VanDerWaalsContact CE1-CG2 3.46Å; Y81-I390 HydrophobicContact CE2-CB 4.2Å; Y81-I390 HydrophobicContact CE2-CD1 4.1Å; Y81-I390 PolarHBondContact N-O 3.32Å; Y81-I390 PolarHBondContact O-N 3.13Å; Y81-D392 HydrophobicContact CD1-CB 4.38Å; Y81-D392 HydrophobicContact CE1-CB 3.82Å
82	L	93.9	Very high	90.3	Very high	3 Å²	3	18.6 Å²	18.6	2%	0.016	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	116.7	164.6	-166.1	75.4	0	0	0	108.5	V74 V76 V84 I98 L99 K102 L388 H389	V74-L82 PolarHBondContact N-O 3.29Å; V74-L82 PolarHBondContact O-N 3.37Å; V76-L82 HydrophobicContact CG1-CB 4.48Å; L82-V84 HydrophobicContact CD2-CG2 3.79Å; L82-V84 HydrophobicContact CG-CG2 4Å; L82-I98 HydrophobicContact CD2-CG2 4.39Å; L82-L99 HydrophobicContact CB-CD2 3.87Å; L82-L99 HydrophobicContact CD2-CD2 3.51Å; L82-L99 HydrophobicContact CD2-CG 4.31Å; L82-L99 HydrophobicContact CG-CD2 4.32Å; L82-K102 HydrophobicContact CD1-CB 4.31Å; L82-K102 HydrophobicContact CD1-CG 4.42Å; L82-K102 HydrophobicContact CD2-CB 4.03Å; L82-K102 HydrophobicContact CD2-CG 4.18Å; L82-L388 CarbonylContact C-O 3.59Å; L82-L388 WeakPolarHBondContact CA-O 2.84Å; L82-H389 HydrophobicContact CD1-CB 4.2Å
83	S	94.1	Very high	90.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	122.2	167.7	175.6	0	0	0	0	109.5	I71 C72 E222 Y387 L388	I71-S83 VanDerWaalsContact CG2-OG 3.27Å; I71-S83 WeakPolarHBondContact CG2-OG 3.38Å; C72-S83 CarbonylContact O-C 3.52Å; C72-S83 WeakPolarHBondContact O-CA 3.13Å; S83-E222 VanDerWaalsContact CB-OE1 3.25Å; S83-E222 WeakPolarHBondContact CB-OE1 3.47Å; S83-E222 PolarHBondContact OG-OE1 2.89Å; S83-E222 PolarHBondContact OG-OE2 3.04Å; S83-Y387 CarbonylContact O-C 3.59Å; S83-Y387 VanDerWaalsContact O-CA 3.23Å; S83-Y387 WeakPolarHBondContact O-CA 3.39Å; S83-L388 PolarHBondContact N-O 3.25Å; S83-L388 PolarHBondContact O-N 3.48Å
84	V	92.2	Very high	90.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110	-177.2	175.9	0	0	0	0	109.4	C72 L82 T86 L95 I98 Y387	C72-V84 HydrophobicContact CB-CB 4.22Å; C72-V84 PolarHBondContact N-O 3.23Å; C72-V84 PolarHBondContact O-N 3.16Å; L82-V84 HydrophobicContact CD2-CG2 3.79Å; L82-V84 HydrophobicContact CG-CG2 4Å; V84-T86 HydrophobicContact CG1-CG2 4.44Å; V84-L95 HydrophobicContact CB-CD1 4.11Å; V84-L95 HydrophobicContact CG1-CD1 3.98Å; V84-L95 HydrophobicContact CG2-CD1 3.88Å; V84-I98 HydrophobicContact CG1-CD1 4.16Å; V84-I98 HydrophobicContact CG1-CG2 4.41Å; V84-I98 HydrophobicContact CG2-CG2 4.16Å; V84-Y387 HydrophobicContact CB-CD1 4.2Å; V84-Y387 HydrophobicContact CG1-CD1 3.76Å; V84-Y387 HydrophobicContact CG1-CE1 3.73Å; V84-Y387 HydrophobicContact CG2-CD1 4.11Å
85	H	89.2	Confident	90.3	Very high	7 Å²	7	26.1 Å²	26.1	3%	0.032	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	113.4	174.6	-172.8	-78.1	0	0	0	110.9	E69 L183 L187 H386	E69-H85 IonicContact OE1-CE1 3.87Å; E69-H85 IonicContact OE2-CE1 3.94Å; H85-L183 VanDerWaalsContact CE1-CD1 3.43Å; H85-L183 WeakPolarHBondContact CE1-CD1 3.32Å; H85-L187 WeakPolarHBondContact NE2-CD2 3.31Å; H85-H386 PolarHBondContact N-O 2.91Å; H85-H386 AromaticContact ND1-CE1 3.87Å; H85-H386 AromaticContact ND1-ND1 3.7Å; H85-H386 PolarHBondContact O-ND1 3.39Å
86	T	87.9	Confident	90.2	Very high	20 Å²	20	25 Å²	25	12%	0.123	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	-169.2	-168.2	-167.1	0	0	0	0	111.7	E69 V70 C72 V84 L90	E69-T86 CarbonylContact C-O 3.57Å; E69-T86 WeakPolarHBondContact CA-O 3.49Å; V70-T86 HydrophobicContact CG2-CG2 3.91Å; V70-T86 PolarHBondContact N-O 3.14Å; V70-T86 PolarHBondContact O-N 3.41Å; V70-T86 VanDerWaalsContact O-O 3.13Å; C72-T86 HydrophobicContact CB-CG2 4.46Å; V84-T86 HydrophobicContact CG1-CG2 4.44Å; T86-L90 HydrophobicContact CG2-CB 4.1Å; T86-L90 HydrophobicContact CG2-CD2 3.66Å; T86-L90 HydrophobicContact CG2-CG 4.42Å
87	H	84.4	Confident	90.2	Very high	74 Å²	74	31.1 Å²	31.1	34%	0.343	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	156.7	173.2	56.2	67.5	0	0	0	112.2	R68 A89 L90	R68-H87 WeakPolarHBondContact O-CA 3.08Å; H87-A89 PolarHBondContact ND1-N 3.24Å; H87-A89 PolarHBondContact O-N 3.19Å; H87-A89 VanDerWaalsContact O-N 3.14Å; H87-L90 PolarHBondContact ND1-N 3.19Å; H87-L90 WeakPolarHBondContact O-CB 3.35Å; H87-L90 PolarHBondContact O-N 3.11Å; H87-L90 VanDerWaalsContact O-N 3.16Å
88	A	82.4	Confident	90.1	Very high	22 Å²	22	31.1 Å²	31.1	18%	0.182	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-29.5	-178	0	0	0	0	0	114.1	R68 V70 L90 C129	R68-A88 PolarHBondContact O-N 2.99Å; V70-A88 HydrophobicContact CG1-CB 4.33Å; A88-L90 PolarHBondContact O-N 3.29Å; A88-C129 PolarHBondContact O-SG 3.07Å
89	A	84.2	Confident	90.2	Very high	31 Å²	31	27.9 Å²	27.9	26%	0.256	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	9.8	179.7	0	0	0	0	0	115.4	D66 H87 E91	D66-A89 WeakPolarHBondContact OD1-CB 3.5Å; H87-A89 PolarHBondContact ND1-N 3.24Å; H87-A89 PolarHBondContact O-N 3.19Å; H87-A89 VanDerWaalsContact O-N 3.14Å; A89-E91 PolarHBondContact O-N 3.32Å
90	L	87.5	Confident	90.1	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.132	C	C	.	.			trans	-63.7	125.3	-174.5	-173.6	71.2	0	0	0	111.3	T86 H87 A88 E94 L95 V130	T86-L90 HydrophobicContact CG2-CB 4.1Å; T86-L90 HydrophobicContact CG2-CD2 3.66Å; T86-L90 HydrophobicContact CG2-CG 4.42Å; H87-L90 PolarHBondContact ND1-N 3.19Å; H87-L90 WeakPolarHBondContact O-CB 3.35Å; H87-L90 PolarHBondContact O-N 3.11Å; H87-L90 VanDerWaalsContact O-N 3.16Å; A88-L90 PolarHBondContact O-N 3.29Å; L90-E94 HydrophobicContact CD1-CB 3.74Å; L90-E94 HydrophobicContact CD1-CG 3.64Å; L90-E94 WeakPolarHBondContact CD1-OE2 3.47Å; L90-L95 HydrophobicContact CD2-CB 3.91Å; L90-L95 HydrophobicContact CD2-CD1 4.06Å; L90-L95 HydrophobicContact CD2-CG 4.41Å; L90-V130 WeakPolarHBondContact O-CG2 3.43Å; L90-V130 PolarHBondContact O-N 2.8Å
91	E	90.9	Very high	89.8	Confident	55 Å²	55	33.1 Å²	33.1	26%	0.257	16%	0.159	S	C	.	.	B	Isolated β-bridge	trans	-80.7	147.8	175	-64.8	-173.1	-139.9	0	0	111.8	A89 R93 E94 L95	A89-E91 PolarHBondContact O-N 3.32Å; E91-R93 VanDerWaalsContact C-N 3.27Å; E91-R93 HydrophobicContact CB-CG 4.2Å; E91-R93 VanDerWaalsContact CD-CZ 3.47Å; E91-R93 PolarHBondContact O-N 3.07Å; E91-R93 IonicContact OE1-CZ 3.52Å; E91-R93 IonicContact OE1-NH1 3.92Å; E91-R93 IonicContact OE1-NH2 2.81Å; E91-R93 PolarHBondContact OE1-NH2 3.12Å; E91-R93 IonicContact OE2-CZ 2.83Å; E91-R93 IonicContact OE2-NE 3.54Å; E91-R93 IonicContact OE2-NH1 2.64Å; E91-R93 PolarHBondContact OE2-NH1 3.19Å; E91-R93 IonicContact OE2-NH2 3Å; E91-R93 PolarHBondContact OE2-NH2 3.36Å; E91-E94 PolarHBondContact O-N 3.14Å; E91-L95 PolarHBondContact O-N 3.18Å
92	A	90.3	Very high	89.5	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-54.5	-38.6	179	0	0	0	0	0	113.2	E94 L95 L96 L112 L124 Q125 D128	A92-E94 VanDerWaalsContact C-N 3.32Å; A92-E94 PolarHBondContact O-N 2.95Å; A92-L95 PolarHBondContact O-N 2.81Å; A92-L96 WeakPolarHBondContact O-CG 3.45Å; A92-L96 PolarHBondContact O-N 3.43Å; A92-L112 HydrophobicContact CB-CD1 3.96Å; A92-L112 WeakPolarHBondContact O-CD1 3.48Å; A92-L124 HydrophobicContact CB-CB 4.36Å; A92-Q125 WeakPolarHBondContact CB-O 3.43Å; A92-D128 PolarHBondContact N-O 3.28Å
93	R	91.7	Very high	89.1	Confident	128 Å²	128	36.1 Å²	36.1	48%	0.483	17%	0.174	S	C	.	.	H	α-helix	trans	-60	-39.9	175.9	69.8	175.9	-173.9	-110.6	-16.3	113.1	E91 L96 R97 P126	E91-R93 VanDerWaalsContact C-N 3.27Å; E91-R93 HydrophobicContact CB-CG 4.2Å; E91-R93 VanDerWaalsContact CD-CZ 3.47Å; E91-R93 PolarHBondContact O-N 3.07Å; E91-R93 IonicContact OE1-CZ 3.52Å; E91-R93 IonicContact OE1-NH1 3.92Å; E91-R93 IonicContact OE1-NH2 2.81Å; E91-R93 PolarHBondContact OE1-NH2 3.12Å; E91-R93 IonicContact OE2-CZ 2.83Å; E91-R93 IonicContact OE2-NE 3.54Å; E91-R93 IonicContact OE2-NH1 2.64Å; E91-R93 PolarHBondContact OE2-NH1 3.19Å; E91-R93 IonicContact OE2-NH2 3Å; E91-R93 PolarHBondContact OE2-NH2 3.36Å; R93-L96 PolarHBondContact O-N 3.23Å; R93-R97 PolarHBondContact O-N 3.15Å; R93-P126 HydrophobicContact CB-CB 4.04Å; R93-P126 WeakPolarHBondContact CB-O 3.43Å; R93-P126 PolarHBondContact N-O 3.46Å
94	E	91.3	Very high	88.8	Confident	71 Å²	71	42.1 Å²	42.1	33%	0.332	21%	0.206	S	C	.	.	H	α-helix	trans	-72.4	-38	-178.1	-174.4	174.7	178.8	0	0	110.5	L90 E91 A92 R97 I98	L90-E94 HydrophobicContact CD1-CB 3.74Å; L90-E94 HydrophobicContact CD1-CG 3.64Å; L90-E94 WeakPolarHBondContact CD1-OE2 3.47Å; E91-E94 PolarHBondContact O-N 3.14Å; A92-E94 VanDerWaalsContact C-N 3.32Å; A92-E94 PolarHBondContact O-N 2.95Å; E94-R97 WeakPolarHBondContact O-CB 3.21Å; E94-R97 PolarHBondContact O-N 2.68Å; E94-I98 HydrophobicContact CG-CD1 4.45Å; E94-I98 WeakPolarHBondContact O-CG1 3.34Å; E94-I98 PolarHBondContact O-N 3.18Å
95	L	91.3	Very high	88.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-42.9	173.6	-174.1	54.6	0	0	0	111.9	V74 V84 L90 E91 A92 R97 I98 L99 L112 V130 L141	V74-L95 HydrophobicContact CG2-CD1 3.98Å; V74-L95 HydrophobicContact CG2-CD2 3.71Å; V74-L95 HydrophobicContact CG2-CG 4.09Å; V84-L95 HydrophobicContact CB-CD1 4.11Å; V84-L95 HydrophobicContact CG1-CD1 3.98Å; V84-L95 HydrophobicContact CG2-CD1 3.88Å; L90-L95 HydrophobicContact CD2-CB 3.91Å; L90-L95 HydrophobicContact CD2-CD1 4.06Å; L90-L95 HydrophobicContact CD2-CG 4.41Å; E91-L95 PolarHBondContact O-N 3.18Å; A92-L95 PolarHBondContact O-N 2.81Å; L95-R97 VanDerWaalsContact C-N 3.34Å; L95-R97 PolarHBondContact O-N 3.49Å; L95-I98 PolarHBondContact O-N 2.82Å; L95-L99 HydrophobicContact CG-CD1 4.11Å; L95-L99 WeakPolarHBondContact O-CD1 3.41Å; L95-L99 VanDerWaalsContact O-CG 3.27Å; L95-L99 WeakPolarHBondContact O-CG 3.5Å; L95-L99 PolarHBondContact O-N 2.88Å; L95-L112 HydrophobicContact CB-CD1 4.02Å; L95-L112 HydrophobicContact CD2-CD1 3.83Å; L95-L112 HydrophobicContact CG-CD1 4.03Å; L95-V130 HydrophobicContact CD2-CG1 4.3Å; L95-V130 HydrophobicContact CD2-CG2 3.81Å; L95-L141 HydrophobicContact CD2-CD2 3.9Å
96	L	91.8	Very high	88.4	Confident	17 Å²	17	47.5 Å²	47.5	9%	0.089	24%	0.239	C	C	.	.	H	α-helix	trans	-59.4	-42.6	173.8	-79	172.5	0	0	0	112.3	A92 R93 I98 L99 G100 E107 M110 L112	A92-L96 WeakPolarHBondContact O-CG 3.45Å; A92-L96 PolarHBondContact O-N 3.43Å; R93-L96 PolarHBondContact O-N 3.23Å; L96-I98 VanDerWaalsContact C-N 3.34Å; L96-I98 PolarHBondContact O-N 3.29Å; L96-L99 PolarHBondContact O-N 2.83Å; L96-G100 PolarHBondContact O-N 2.82Å; L96-E107 HydrophobicContact CB-CG 4.1Å; L96-M110 HydrophobicContact CD2-CB 3.9Å; L96-L112 HydrophobicContact CD2-CD1 4.36Å; L96-L112 HydrophobicContact CD2-CD2 4.29Å; L96-L112 HydrophobicContact CD2-CG 3.78Å; L96-L112 HydrophobicContact CG-CD1 3.95Å; L96-L112 HydrophobicContact CG-CG 3.88Å
97	R	90.8	Very high	88.3	Confident	131 Å²	131	50.9 Å²	50.9	49%	0.494	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-42.3	175.4	-168	-174.4	71.9	112.1	-1.6	112.2	R93 E94 L95 G100 L101	R93-R97 PolarHBondContact O-N 3.15Å; E94-R97 WeakPolarHBondContact O-CB 3.21Å; E94-R97 PolarHBondContact O-N 2.68Å; L95-R97 VanDerWaalsContact C-N 3.34Å; L95-R97 PolarHBondContact O-N 3.49Å; R97-G100 PolarHBondContact O-N 3.37Å; R97-L101 VanDerWaalsContact O-CG 3.32Å; R97-L101 WeakPolarHBondContact O-CG 3.36Å; R97-L101 PolarHBondContact O-N 3.48Å; R97-L101 VanDerWaalsContact O-N 3.14Å
98	I	90.7	Very high	88.3	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-62.6	-45.5	175.9	-68.7	164.6	0	0	0	110.4	L82 V84 E94 L95 L96 L101 K102 Y387	L82-I98 HydrophobicContact CD2-CG2 4.39Å; V84-I98 HydrophobicContact CG1-CD1 4.16Å; V84-I98 HydrophobicContact CG1-CG2 4.41Å; V84-I98 HydrophobicContact CG2-CG2 4.16Å; E94-I98 HydrophobicContact CG-CD1 4.45Å; E94-I98 WeakPolarHBondContact O-CG1 3.34Å; E94-I98 PolarHBondContact O-N 3.18Å; L95-I98 PolarHBondContact O-N 2.82Å; L96-I98 VanDerWaalsContact C-N 3.34Å; L96-I98 PolarHBondContact O-N 3.29Å; I98-L101 PolarHBondContact O-N 3.44Å; I98-K102 PolarHBondContact O-N 3.43Å; I98-K102 VanDerWaalsContact O-N 3.1Å; I98-Y387 HydrophobicContact CD1-CE1 3.96Å; I98-Y387 HydrophobicContact CG1-CE1 4.39Å; I98-Y387 HydrophobicContact CG1-CE2 4.33Å; I98-Y387 HydrophobicContact CG2-CD1 3.69Å; I98-Y387 HydrophobicContact CG2-CD2 3.73Å; I98-Y387 HydrophobicContact CG2-CE1 3.76Å; I98-Y387 HydrophobicContact CG2-CE2 3.78Å; I98-Y387 HydrophobicContact CG2-CG 3.7Å
99	L	90.4	Very high	88.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.6	-46.4	178.2	-70.2	160.7	0	0	0	111.3	V74 V76 L82 L95 L96 L101 K102 L103 L112 A143	V74-L99 HydrophobicContact CB-CD1 4.46Å; V74-L99 HydrophobicContact CB-CD2 4.13Å; V74-L99 HydrophobicContact CG1-CD1 3.92Å; V74-L99 HydrophobicContact CG1-CD2 4.15Å; V74-L99 HydrophobicContact CG2-CD1 4.45Å; V76-L99 HydrophobicContact CG1-CD2 4.14Å; L82-L99 HydrophobicContact CB-CD2 3.87Å; L82-L99 HydrophobicContact CD2-CD2 3.51Å; L82-L99 HydrophobicContact CD2-CG 4.31Å; L82-L99 HydrophobicContact CG-CD2 4.32Å; L95-L99 HydrophobicContact CG-CD1 4.11Å; L95-L99 WeakPolarHBondContact O-CD1 3.41Å; L95-L99 VanDerWaalsContact O-CG 3.27Å; L95-L99 WeakPolarHBondContact O-CG 3.5Å; L95-L99 PolarHBondContact O-N 2.88Å; L96-L99 PolarHBondContact O-N 2.83Å; L99-L101 PolarHBondContact O-N 3.26Å; L99-K102 PolarHBondContact O-N 3.47Å; L99-K102 VanDerWaalsContact O-N 3.13Å; L99-L103 WeakPolarHBondContact O-CB 3.31Å; L99-L103 WeakPolarHBondContact O-CG 3.49Å; L99-L103 PolarHBondContact O-N 3.44Å; L99-L112 HydrophobicContact CD1-CD2 3.77Å; L99-A143 HydrophobicContact CD1-CB 4.1Å
100	G	89.6	Confident	88.7	Confident	8 Å²	8	56.4 Å²	56.4	8%	0.082	27%	0.273	C	S	.	.	H	α-helix	trans	-60.2	-45.4	179.8	0	0	0	0	0	112.3	L96 R97 K102 D104 K105	L96-G100 PolarHBondContact O-N 2.82Å; R97-G100 PolarHBondContact O-N 3.37Å; G100-K102 VanDerWaalsContact C-N 3.3Å; G100-K102 PolarHBondContact O-N 2.79Å; G100-D104 WeakPolarHBondContact O-CA 3.37Å; G100-D104 PolarHBondContact O-N 2.89Å; G100-K105 CarbonylContact C-O 3.58Å; G100-K105 VanDerWaalsContact CA-O 3.23Å; G100-K105 WeakPolarHBondContact CA-O 3.29Å; G100-K105 PolarHBondContact O-N 3.16Å
101	L	87.6	Confident	88.9	Confident	109 Å²	109	57.4 Å²	57.4	57%	0.571	28%	0.279	S	S	*	.	H	α-helix	trans	-62.1	-35.6	175.9	-71.4	171.7	0	0	0	113	R97 I98 L99	R97-L101 VanDerWaalsContact O-CG 3.32Å; R97-L101 WeakPolarHBondContact O-CG 3.36Å; R97-L101 PolarHBondContact O-N 3.48Å; R97-L101 VanDerWaalsContact O-N 3.14Å; I98-L101 PolarHBondContact O-N 3.44Å; L99-L101 PolarHBondContact O-N 3.26Å
102	K	86.9	Confident	89	Confident	55 Å²	55	54.9 Å²	54.9	24%	0.239	27%	0.267	C	S	.	.	H	α-helix	trans	-82.7	-37.1	-178.4	-81.1	-54.4	-156.9	-178.8	0	114.1	L82 I98 L99 G100 A383 Y387	L82-K102 HydrophobicContact CD1-CB 4.31Å; L82-K102 HydrophobicContact CD1-CG 4.42Å; L82-K102 HydrophobicContact CD2-CB 4.03Å; L82-K102 HydrophobicContact CD2-CG 4.18Å; I98-K102 PolarHBondContact O-N 3.43Å; I98-K102 VanDerWaalsContact O-N 3.1Å; L99-K102 PolarHBondContact O-N 3.47Å; L99-K102 VanDerWaalsContact O-N 3.13Å; G100-K102 VanDerWaalsContact C-N 3.3Å; G100-K102 PolarHBondContact O-N 2.79Å; K102-A383 WeakPolarHBondContact CE-O 3.41Å; K102-A383 VanDerWaalsContact NZ-C 3.27Å; K102-A383 PolarHBondContact NZ-O 3.38Å; K102-Y387 VanDerWaalsContact CE-CB 3.43Å; K102-Y387 HydrophobicContact CG-CD2 4.32Å
103	L	86.8	Confident	89	Confident	25 Å²	25	54.8 Å²	54.8	13%	0.131	27%	0.267	C	S	.	.	H	α-helix	trans	-87.2	-10.9	-179.7	-61.6	177.7	0	0	0	112.8	V76 L99 K105 M110 I151 L152	V76-L103 HydrophobicContact CB-CD1 4.27Å; V76-L103 HydrophobicContact CG1-CD1 3.8Å; V76-L103 HydrophobicContact CG1-CD2 4.4Å; V76-L103 HydrophobicContact CG2-CD2 4.49Å; L99-L103 WeakPolarHBondContact O-CB 3.31Å; L99-L103 WeakPolarHBondContact O-CG 3.49Å; L99-L103 PolarHBondContact O-N 3.44Å; L103-K105 VanDerWaalsContact C-N 3.3Å; L103-K105 HydrophobicContact CB-CB 4.39Å; L103-K105 HydrophobicContact CB-CG 3.92Å; L103-M110 HydrophobicContact CD1-SD 4.35Å; L103-I151 HydrophobicContact CD1-CG2 4.4Å; L103-L152 HydrophobicContact CD2-CD1 4.36Å
104	D	87.1	Confident	88.9	Confident	126 Å²	126	50.1 Å²	50.1	67%	0.674	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	42.1	-173.4	-153.8	42.1	0	0	0	111.6	G100	G100-D104 WeakPolarHBondContact O-CA 3.37Å; G100-D104 PolarHBondContact O-N 2.89Å
105	K	86.7	Confident	88.7	Confident	67 Å²	67	47.9 Å²	47.9	29%	0.291	24%	0.244	S	C	.	.			trans	-123.5	149.6	-179.6	-59.8	-71.8	-179	174.7	0	109.3	G100 L103 M110 I151 E160	G100-K105 CarbonylContact C-O 3.58Å; G100-K105 VanDerWaalsContact CA-O 3.23Å; G100-K105 WeakPolarHBondContact CA-O 3.29Å; G100-K105 PolarHBondContact O-N 3.16Å; L103-K105 VanDerWaalsContact C-N 3.3Å; L103-K105 HydrophobicContact CB-CB 4.39Å; L103-K105 HydrophobicContact CB-CG 3.92Å; K105-M110 HydrophobicContact CB-CE 4.27Å; K105-M110 HydrophobicContact CB-SD 4.04Å; K105-I151 HydrophobicContact CG-CG2 4.47Å; K105-E160 IonicContact NZ-OE1 3.7Å; K105-E160 IonicContact NZ-OE2 3.02Å; K105-E160 PolarHBondContact NZ-OE2 3.32Å; K105-E160 VanDerWaalsContact NZ-OE2 3.14Å
106	A	87	Confident	88.4	Confident	53 Å²	53	49.4 Å²	49.4	44%	0.438	25%	0.254	S	S	.	.			trans	-69.4	139.2	178.9	0	0	0	0	0	110.9	E108 D109 M110	A106-E108 PolarHBondContact O-N 3.16Å; A106-D109 PolarHBondContact O-N 3.21Å; A106-M110 WeakPolarHBondContact O-CE 3.39Å
107	E	85.1	Confident	87.8	Confident	91 Å²	91	56 Å²	56	43%	0.425	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-58.7	-36.4	178.3	-171.3	178.5	150.7	0	0	111.6	L96 D109 M110	L96-E107 HydrophobicContact CB-CG 4.1Å; E107-D109 PolarHBondContact O-N 3.1Å; E107-M110 PolarHBondContact O-N 2.87Å
108	E	83.9	Confident	87.4	Confident	149 Å²	149	54.5 Å²	54.5	70%	0.696	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-65.9	-23.8	-177	-58.7	-176.9	-171.2	0	0	113.6	A106 M110 R146	A106-E108 PolarHBondContact O-N 3.16Å; E108-M110 VanDerWaalsContact C-N 3.35Å; E108-R146 VanDerWaalsContact O-CZ 3.31Å; E108-R146 PolarHBondContact O-NE 2.79Å; E108-R146 PolarHBondContact O-NH2 2.83Å
109	D	85.2	Confident	86.9	Confident	88 Å²	88	56.4 Å²	56.4	47%	0.471	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-85.9	-8.9	-177.2	-66	-24.3	0	0	0	112.8	A106 E107 H145	A106-D109 PolarHBondContact O-N 3.21Å; E107-D109 PolarHBondContact O-N 3.1Å; D109-H145 WeakPolarHBondContact O-CA 3.47Å; D109-H145 PolarHBondContact O-ND1 2.95Å
110	M	90.6	Very high	86.6	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.025	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146.6	-172.9	-57.8	-179.4	-72	0	0	111.8	L96 L103 K105 A106 E107 E108 C144 I151	L96-M110 HydrophobicContact CD2-CB 3.9Å; L103-M110 HydrophobicContact CD1-SD 4.35Å; K105-M110 HydrophobicContact CB-CE 4.27Å; K105-M110 HydrophobicContact CB-SD 4.04Å; A106-M110 WeakPolarHBondContact O-CE 3.39Å; E107-M110 PolarHBondContact O-N 2.87Å; E108-M110 VanDerWaalsContact C-N 3.35Å; M110-C144 CarbonylContact C-O 3.56Å; M110-C144 WeakPolarHBondContact CA-O 3.43Å; M110-I151 HydrophobicContact CB-CD1 4.13Å; M110-I151 HydrophobicContact CG-CD1 3.65Å; M110-I151 HydrophobicContact CG-CG1 4.35Å; M110-I151 HydrophobicContact SD-CD1 3.75Å
111	V	91.9	Very high	86.5	Confident	21 Å²	21	67.2 Å²	67.2	13%	0.127	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	152.9	171.8	-62.9	0	0	0	0	109.2	M123 A143 C144 H145 R146	V111-M123 HydrophobicContact CB-CE 4.02Å; V111-M123 HydrophobicContact CG1-CE 3.96Å; V111-M123 HydrophobicContact CG2-CE 3.96Å; V111-A143 WeakPolarHBondContact O-CA 3.38Å; V111-C144 WeakPolarHBondContact CG2-O 3.49Å; V111-C144 PolarHBondContact N-O 2.85Å; V111-C144 PolarHBondContact O-N 3.08Å; V111-H145 WeakPolarHBondContact CG2-O 3.39Å; V111-R146 HydrophobicContact CG1-CG 3.83Å
112	L	92.2	Very high	86.5	Confident	2 Å²	2	68.9 Å²	68.9	1%	0.01	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	135.8	173.1	-69.9	171.8	0	0	0	109.9	V74 A92 L95 L96 L99 L124 L141 A143	V74-L112 HydrophobicContact CG1-CD2 3.83Å; A92-L112 HydrophobicContact CB-CD1 3.96Å; A92-L112 WeakPolarHBondContact O-CD1 3.48Å; L95-L112 HydrophobicContact CB-CD1 4.02Å; L95-L112 HydrophobicContact CD2-CD1 3.83Å; L95-L112 HydrophobicContact CG-CD1 4.03Å; L96-L112 HydrophobicContact CD2-CD1 4.36Å; L96-L112 HydrophobicContact CD2-CD2 4.29Å; L96-L112 HydrophobicContact CD2-CG 3.78Å; L96-L112 HydrophobicContact CG-CD1 3.95Å; L96-L112 HydrophobicContact CG-CG 3.88Å; L99-L112 HydrophobicContact CD1-CD2 3.77Å; L112-L124 HydrophobicContact CB-CB 4.22Å; L112-L124 HydrophobicContact CB-CD1 4.06Å; L112-L124 HydrophobicContact CB-CG 4.38Å; L112-L124 PolarHBondContact O-N 2.86Å; L112-L141 HydrophobicContact CB-CD1 4.41Å; L112-L141 HydrophobicContact CD2-CD1 4.5Å; L112-A143 HydrophobicContact CD2-CB 4.14Å
113	A	90.1	Very high	86.6	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.6	174.7	0	0	0	0	0	111	R122 V142	A113-R122 CarbonylContact C-O 3.55Å; A113-R122 WeakPolarHBondContact CA-O 3.36Å; A113-V142 PolarHBondContact N-O 3.22Å; A113-V142 PolarHBondContact O-N 3.4Å
114	V	89.1	Confident	86.6	Confident	29 Å²	29	69.8 Å²	69.8	18%	0.176	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.9	169.5	-179.9	0	0	0	0	108.1	R121 R122 L124 L135 L141	V114-R121 WeakPolarHBondContact O-CA 3.43Å; V114-R122 PolarHBondContact N-O 2.85Å; V114-R122 PolarHBondContact O-N 2.87Å; V114-L124 HydrophobicContact CG2-CD1 4.25Å; V114-L124 HydrophobicContact CG2-CD2 4.02Å; V114-L124 HydrophobicContact CG2-CG 4.3Å; V114-L135 HydrophobicContact CG2-CD2 4.09Å; V114-L141 HydrophobicContact CG2-CD1 4.04Å
115	V	87.8	Confident	86.7	Confident	25 Å²	25	69.3 Å²	69.3	15%	0.152	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112.6	178.5	-173.9	0	0	0	0	108.9	E120 R121 G139 K140 V142	V115-E120 WeakPolarHBondContact CA-O 3.5Å; V115-R121 HydrophobicContact CG1-CG 4.41Å; V115-R121 HydrophobicContact CG2-CG 3.94Å; V115-G139 CarbonylContact O-C 3.49Å; V115-G139 VanDerWaalsContact O-C 3.28Å; V115-G139 WeakPolarHBondContact O-CA 3.22Å; V115-K140 PolarHBondContact N-O 3.28Å; V115-K140 PolarHBondContact O-N 3.1Å; V115-V142 HydrophobicContact CB-CG2 4.37Å; V115-V142 HydrophobicContact CG2-CB 4.16Å; V115-V142 HydrophobicContact CG2-CG2 3.48Å; V115-V142 VanDerWaalsContact CG2-CG2 3.48Å
116	S	85	Confident	86.7	Confident	32 Å²	32	69.5 Å²	69.5	22%	0.224	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	168.8	178.4	68.6	0	0	0	0	112	T118 G119 E120	S116-T118 PolarHBondContact O-N 2.7Å; S116-T118 PolarHBondContact OG-N 3.49Å; S116-T118 PolarHBondContact OG-OG1 3.34Å; S116-G119 PolarHBondContact O-N 3.2Å; S116-E120 PolarHBondContact N-O 3.42Å; S116-E120 WeakPolarHBondContact OG-CB 3.34Å; S116-E120 PolarHBondContact OG-N 3.26Å; S116-E120 VanDerWaalsContact OG-N 3.17Å; S116-E120 PolarHBondContact OG-O 3.48Å
117	H	79.9	Confident	86.7	Confident	154 Å²	154	70.9 Å²	70.9	71%	0.713	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.8	174	65.7	-85.2	0	0	0	113.7	G119	H117-G119 VanDerWaalsContact C-N 3.29Å
118	T	82	Confident	86.8	Confident	100 Å²	100	68.7 Å²	68.7	61%	0.613	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-3.8	174.4	59	0	0	0	0	112.9	S116 E120	S116-T118 PolarHBondContact O-N 2.7Å; S116-T118 PolarHBondContact OG-N 3.49Å; S116-T118 PolarHBondContact OG-OG1 3.34Å; T118-E120 VanDerWaalsContact C-N 3.34Å
119	G	80.8	Confident	86.8	Confident	46 Å²	46	63.6 Å²	63.6	47%	0.474	34%	0.34	S	S	.	.			trans	86.6	-0.3	-178	0	0	0	0	0	114.5	S116 H117 R121	S116-G119 PolarHBondContact O-N 3.2Å; H117-G119 VanDerWaalsContact C-N 3.29Å; G119-R121 PolarHBondContact O-N 3.36Å
120	E	84.1	Confident	86.6	Confident	141 Å²	141	60.1 Å²	60.1	66%	0.659	32%	0.322	S	S	*	.			trans	-67	131.1	175.4	-171.1	-176.1	173	0	0	110.4	V115 S116 T118	V115-E120 WeakPolarHBondContact CA-O 3.5Å; S116-E120 PolarHBondContact N-O 3.42Å; S116-E120 WeakPolarHBondContact OG-CB 3.34Å; S116-E120 PolarHBondContact OG-N 3.26Å; S116-E120 VanDerWaalsContact OG-N 3.17Å; S116-E120 PolarHBondContact OG-O 3.48Å; T118-E120 VanDerWaalsContact C-N 3.34Å
121	R	86.4	Confident	85.6	Confident	93 Å²	93	63.4 Å²	63.4	35%	0.351	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.2	-179.5	-52.6	-164.9	175.2	-178.9	-2.3	110.3	V114 V115 G119 L148	V114-R121 WeakPolarHBondContact O-CA 3.43Å; V115-R121 HydrophobicContact CG1-CG 4.41Å; V115-R121 HydrophobicContact CG2-CG 3.94Å; G119-R121 PolarHBondContact O-N 3.36Å; R121-L148 PolarHBondContact NH1-O 3.22Å
122	R	87.1	Confident	84.2	Confident	145 Å²	145	64.5 Å²	64.5	55%	0.547	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	118.7	173	-179.3	179.4	174.5	-174.6	-1.8	110	A113 V114	A113-R122 CarbonylContact C-O 3.55Å; A113-R122 WeakPolarHBondContact CA-O 3.36Å; V114-R122 PolarHBondContact N-O 2.85Å; V114-R122 PolarHBondContact O-N 2.87Å
123	M	88.9	Confident	82.2	Confident	85 Å²	85	72.8 Å²	72.8	42%	0.419	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	140.6	176.2	-64.9	176.4	67.6	0	0	111.4	V111 L148	V111-M123 HydrophobicContact CB-CE 4.02Å; V111-M123 HydrophobicContact CG1-CE 3.96Å; V111-M123 HydrophobicContact CG2-CE 3.96Å; M123-L148 HydrophobicContact CG-CD2 3.9Å; M123-L148 HydrophobicContact SD-CD2 3.99Å
124	L	88.1	Confident	80.2	Confident	14 Å²	14	76.8 Å²	76.8	7%	0.073	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-91.1	140	172.6	-59.6	-176	0	0	0	110.3	A92 L112 V114 D128 L135 L141	A92-L124 HydrophobicContact CB-CB 4.36Å; L112-L124 HydrophobicContact CB-CB 4.22Å; L112-L124 HydrophobicContact CB-CD1 4.06Å; L112-L124 HydrophobicContact CB-CG 4.38Å; L112-L124 PolarHBondContact O-N 2.86Å; V114-L124 HydrophobicContact CG2-CD1 4.25Å; V114-L124 HydrophobicContact CG2-CD2 4.02Å; V114-L124 HydrophobicContact CG2-CG 4.3Å; L124-D128 HydrophobicContact CB-CB 4.5Å; L124-L135 HydrophobicContact CD2-CD1 3.93Å; L124-L135 HydrophobicContact CD2-CD2 3.45Å; L124-L135 VanDerWaalsContact CD2-CD2 3.45Å; L124-L135 HydrophobicContact CD2-CG 4.36Å; L124-L141 HydrophobicContact CD1-CD1 3.77Å
125	Q	88.4	Confident	78.3	Confident	115 Å²	115	76.6 Å²	76.6	54%	0.537	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-77	150.8	168.9	-61.5	-60	-39.3	0	0	110	A92 S127 D128	A92-Q125 WeakPolarHBondContact CB-O 3.43Å; Q125-S127 PolarHBondContact O-N 3.19Å; Q125-S127 VanDerWaalsContact O-N 3.07Å; Q125-D128 PolarHBondContact N-OD2 3.11Å; Q125-D128 VanDerWaalsContact O-CB 3.32Å; Q125-D128 WeakPolarHBondContact O-CB 3.37Å; Q125-D128 PolarHBondContact O-N 3.31Å
126	P	86.2	Confident	76.5	Confident	71 Å²	71	79.1 Å²	79.1	46%	0.461	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.7	-178.9	-27.1	35.1	0	0	0	114.9	R93	R93-P126 HydrophobicContact CB-CB 4.04Å; R93-P126 WeakPolarHBondContact CB-O 3.43Å; R93-P126 PolarHBondContact N-O 3.46Å
127	S	87.7	Confident	74.9	Confident	83 Å²	83	83.3 Å²	83.3	58%	0.58	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.9	177.3	54.5	0	0	0	0	114.4	Q125	Q125-S127 PolarHBondContact O-N 3.19Å; Q125-S127 VanDerWaalsContact O-N 3.07Å
128	D	86.6	Confident	73.7	Confident	45 Å²	45	83.6 Å²	83.6	24%	0.241	45%	0.451	C	S	.	.			trans	-70.7	136.5	-178.8	-69.5	-16.6	0	0	0	110.2	A92 L124 Q125 L135	A92-D128 PolarHBondContact N-O 3.28Å; L124-D128 HydrophobicContact CB-CB 4.5Å; Q125-D128 PolarHBondContact N-OD2 3.11Å; Q125-D128 VanDerWaalsContact O-CB 3.32Å; Q125-D128 WeakPolarHBondContact O-CB 3.37Å; Q125-D128 PolarHBondContact O-N 3.31Å; D128-L135 HydrophobicContact CB-CD1 4.46Å
129	C	85.8	Confident	73.2	Confident	42 Å²	42	80.1 Å²	80.1	28%	0.284	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-76.9	125.5	169.4	179.6	0	0	0	0	109.6	A88 Y131 S132 L135	A88-C129 PolarHBondContact O-SG 3.07Å; C129-Y131 PolarHBondContact O-N 2.92Å; C129-S132 WeakPolarHBondContact O-CB 3.4Å; C129-S132 PolarHBondContact O-N 3.47Å; C129-L135 WeakPolarHBondContact O-CD1 3.36Å
130	V	79.9	Confident	73.5	Confident	15 Å²	15	83.8 Å²	83.8	9%	0.091	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31	-173.7	177.7	0	0	0	0	112.2	L90 L95 L141	L90-V130 WeakPolarHBondContact O-CG2 3.43Å; L90-V130 PolarHBondContact O-N 2.8Å; L95-V130 HydrophobicContact CD2-CG1 4.3Å; L95-V130 HydrophobicContact CD2-CG2 3.81Å; V130-L141 HydrophobicContact CG1-CD2 3.58Å
131	Y	70.5	Confident	73.8	Confident	73 Å²	73	78 Å²	78	29%	0.286	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	16.7	-177.8	-66.7	-85.4	0	0	0	114.3	V70 I71 C72 C129	V70-Y131 HydrophobicContact CB-CE1 4.38Å; V70-Y131 HydrophobicContact CB-CE2 4.25Å; V70-Y131 HydrophobicContact CG2-CD2 4.02Å; V70-Y131 HydrophobicContact CG2-CE1 4.38Å; V70-Y131 HydrophobicContact CG2-CE2 3.4Å; V70-Y131 VanDerWaalsContact CG2-CE2 3.4Å; I71-Y131 PolarHBondContact O-OH 2.9Å; C72-Y131 WeakPolarHBondContact CA-OH 3.47Å; C72-Y131 HydrophobicContact CB-CE2 4.18Å; C72-Y131 WeakPolarHBondContact CB-OH 3.41Å; C72-Y131 PolarHBondContact N-OH 2.91Å; C72-Y131 VanDerWaalsContact N-OH 3.08Å; C129-Y131 PolarHBondContact O-N 2.92Å
132	S	62.2	Low	74	Confident	44 Å²	44	74.5 Å²	74.5	31%	0.308	40%	0.4	S	S	.	.			trans	-52.3	142.7	176.9	-179.9	0	0	0	0	111.5	C129 S134 L135 T136	C129-S132 WeakPolarHBondContact O-CB 3.4Å; C129-S132 PolarHBondContact O-N 3.47Å; S132-S134 PolarHBondContact O-N 3.44Å; S132-S134 VanDerWaalsContact O-N 3.09Å; S132-S134 PolarHBondContact OG-OG 3.23Å; S132-L135 CarbonylContact O-C 3.45Å; S132-L135 VanDerWaalsContact O-CA 3.29Å; S132-L135 WeakPolarHBondContact O-CA 3.38Å; S132-L135 WeakPolarHBondContact O-CB 3.45Å; S132-L135 PolarHBondContact O-N 3.32Å; S132-T136 PolarHBondContact O-N 3.09Å
133	E	50.1	Low	74.3	Confident	177 Å²	177	67.6 Å²	67.6	83%	0.827	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-55.5	-29	177.4	-69.6	-175.4	168.1	0	0	112.5	L135 T136	E133-L135 PolarHBondContact O-N 2.86Å; E133-T136 PolarHBondContact O-OG1 3.38Å
134	S	46.8	Very low	74.4	Confident	84 Å²	84	63.6 Å²	63.6	59%	0.587	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-71.9	-7.4	172.6	62.8	0	0	0	0	115	S132	S132-S134 PolarHBondContact O-N 3.44Å; S132-S134 VanDerWaalsContact O-N 3.09Å; S132-S134 PolarHBondContact OG-OG 3.23Å
135	L	50.9	Low	74.5	Confident	24 Å²	24	65.6 Å²	65.6	13%	0.126	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-127.9	0.9	-174.5	-77.3	160.8	0	0	0	112.6	V114 L124 D128 C129 S132 E133	V114-L135 HydrophobicContact CG2-CD2 4.09Å; L124-L135 HydrophobicContact CD2-CD1 3.93Å; L124-L135 HydrophobicContact CD2-CD2 3.45Å; L124-L135 VanDerWaalsContact CD2-CD2 3.45Å; L124-L135 HydrophobicContact CD2-CG 4.36Å; D128-L135 HydrophobicContact CB-CD1 4.46Å; C129-L135 WeakPolarHBondContact O-CD1 3.36Å; S132-L135 CarbonylContact O-C 3.45Å; S132-L135 VanDerWaalsContact O-CA 3.29Å; S132-L135 WeakPolarHBondContact O-CA 3.38Å; S132-L135 WeakPolarHBondContact O-CB 3.45Å; S132-L135 PolarHBondContact O-N 3.32Å; E133-L135 PolarHBondContact O-N 2.86Å
136	T	48.7	Very low	74.3	Confident	78 Å²	78	68 Å²	68	48%	0.479	37%	0.368	S	S	.	.			trans	-58	152.3	178.8	48.3	0	0	0	0	112.9	S132 E133 Q138	S132-T136 PolarHBondContact O-N 3.09Å; E133-T136 PolarHBondContact O-OG1 3.38Å; T136-Q138 PolarHBondContact O-N 2.92Å
137	P	51.6	Low	74.2	Confident	121 Å²	121	70 Å²	70	79%	0.786	37%	0.374	S	S	*	.	S	Bend		-85.8	69.3	-128.7	35.9	-38.3	0	0	0	113.6	G139	P137-G139 VanDerWaalsContact C-N 3.26Å
138	Q	55.7	Low	74	Confident	160 Å²	160	69 Å²	69	75%	0.748	36%	0.362	S	S	*	.	S	Bend	trans	-86.7	2.5	167.8	-64.1	-168	6.6	0	0	113.2	T136	T136-Q138 PolarHBondContact O-N 2.92Å
139	G	71.1	Confident	73.9	Confident	26 Å²	26	70 Å²	70	27%	0.268	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	162.8	-175.3	0	0	0	0	0	114.2	V115 P137	V115-G139 CarbonylContact O-C 3.49Å; V115-G139 VanDerWaalsContact O-C 3.28Å; V115-G139 WeakPolarHBondContact O-CA 3.22Å; P137-G139 VanDerWaalsContact C-N 3.26Å
140	K	86.1	Confident	73.9	Confident	123 Å²	123	72 Å²	72	54%	0.535	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	129.5	175.2	-65.7	-175.4	177.7	-171.3	0	109.7	Y75 V115 V142	Y75-K140 HydrophobicContact CD2-CB 4.08Å; Y75-K140 HydrophobicContact CD2-CD 4.29Å; Y75-K140 HydrophobicContact CD2-CG 4.47Å; Y75-K140 HydrophobicContact CE2-CB 4.18Å; Y75-K140 HydrophobicContact CE2-CD 3.91Å; Y75-K140 HydrophobicContact CE2-CG 4.1Å; V115-K140 PolarHBondContact N-O 3.28Å; V115-K140 PolarHBondContact O-N 3.1Å; K140-V142 HydrophobicContact CB-CG2 4.47Å
141	L	90.8	Very high	74.2	Confident	19 Å²	19	71.8 Å²	71.8	10%	0.099	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126.3	171.2	-175.6	62.2	0	0	0	109.2	C72 V74 Y75 L95 L112 V114 L124 V130	C72-L141 VanDerWaalsContact SG-CD2 3.54Å; V74-L141 HydrophobicContact CG1-CG 4.37Å; V74-L141 HydrophobicContact CG2-CD2 3.83Å; V74-L141 HydrophobicContact CG2-CG 4.27Å; Y75-L141 PolarHBondContact N-O 3.15Å; L95-L141 HydrophobicContact CD2-CD2 3.9Å; L112-L141 HydrophobicContact CB-CD1 4.41Å; L112-L141 HydrophobicContact CD2-CD1 4.5Å; V114-L141 HydrophobicContact CG2-CD1 4.04Å; L124-L141 HydrophobicContact CD1-CD1 3.77Å; V130-L141 HydrophobicContact CG1-CD2 3.58Å
142	V	91.8	Very high	75	Confident	21 Å²	21	69 Å²	69	13%	0.127	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.7	-175.3	-176.9	0	0	0	0	108.9	Y75 A113 V115 K140	Y75-V142 CarbonylContact O-C 3.36Å; Y75-V142 WeakPolarHBondContact O-CA 3.43Å; A113-V142 PolarHBondContact N-O 3.22Å; A113-V142 PolarHBondContact O-N 3.4Å; V115-V142 HydrophobicContact CB-CG2 4.37Å; V115-V142 HydrophobicContact CG2-CB 4.16Å; V115-V142 HydrophobicContact CG2-CG2 3.48Å; V115-V142 VanDerWaalsContact CG2-CG2 3.48Å; K140-V142 HydrophobicContact CB-CG2 4.47Å
143	A	92.3	Very high	76.2	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123	164.2	0	0	0	0	0	108.5	V74 Y75 V76 L99 V111 L112 I151	V74-A143 HydrophobicContact CG1-CB 3.78Å; Y75-A143 PolarHBondContact O-N 2.8Å; V76-A143 HydrophobicContact CG1-CB 4.46Å; L99-A143 HydrophobicContact CD1-CB 4.1Å; V111-A143 WeakPolarHBondContact O-CA 3.38Å; L112-A143 HydrophobicContact CD2-CB 4.14Å; A143-I151 HydrophobicContact CB-CD1 3.41Å; A143-I151 VanDerWaalsContact CB-CD1 3.41Å; A143-I151 VanDerWaalsContact O-CD1 3.29Å; A143-I151 WeakPolarHBondContact O-CD1 3.25Å; A143-I151 WeakPolarHBondContact O-CG1 3.42Å
144	C	91.5	Very high	78.1	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	168.2	-179.3	50.4	0	0	0	0	110.7	M110 V111 T149	M110-C144 CarbonylContact C-O 3.56Å; M110-C144 WeakPolarHBondContact CA-O 3.43Å; V111-C144 WeakPolarHBondContact CG2-O 3.49Å; V111-C144 PolarHBondContact N-O 2.85Å; V111-C144 PolarHBondContact O-N 3.08Å; C144-T149 CarbonylContact C-O 3.46Å; C144-T149 WeakPolarHBondContact CA-O 3.35Å; C144-T149 WeakPolarHBondContact CB-O 3.23Å
145	H	89.5	Confident	80.1	Confident	57 Å²	57	59.4 Å²	59.4	26%	0.264	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	165.2	166.4	-72.8	-63.7	0	0	0	111.3	D109 V111 D147 L148 T149	D109-H145 WeakPolarHBondContact O-CA 3.47Å; D109-H145 PolarHBondContact O-ND1 2.95Å; V111-H145 WeakPolarHBondContact CG2-O 3.39Å; H145-D147 WeakPolarHBondContact CB-OD1 3.29Å; H145-D147 PolarHBondContact O-N 3.3Å; H145-L148 WeakPolarHBondContact O-CA 3.12Å; H145-L148 PolarHBondContact O-N 2.84Å; H145-T149 WeakPolarHBondContact CB-OG1 3.48Å; H145-T149 PolarHBondContact CD2-OG1 2.79Å; H145-T149 PolarHBondContact N-O 2.81Å
146	R	85.1	Confident	81.7	Confident	166 Å²	166	59.3 Å²	59.3	63%	0.626	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-27.6	179.9	-68.5	-171.4	-175.1	-157.7	4	113.8	E108 V111 L148	E108-R146 VanDerWaalsContact O-CZ 3.31Å; E108-R146 PolarHBondContact O-NE 2.79Å; E108-R146 PolarHBondContact O-NH2 2.83Å; V111-R146 HydrophobicContact CG1-CG 3.83Å; R146-L148 PolarHBondContact O-N 2.95Å
147	D	84.5	Confident	83.5	Confident	111 Å²	111	61 Å²	61	59%	0.594	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	8.3	174.2	66.3	-6.7	0	0	0	113.2	H145 T149	H145-D147 WeakPolarHBondContact CB-OD1 3.29Å; H145-D147 PolarHBondContact O-N 3.3Å; D147-T149 PolarHBondContact O-N 3.44Å; D147-T149 WeakPolarHBondContact OD1-CB 3Å; D147-T149 WeakPolarHBondContact OD1-CG2 3.46Å; D147-T149 PolarHBondContact OD1-N 2.65Å; D147-T149 PolarHBondContact OD1-OG1 3.27Å; D147-T149 WeakPolarHBondContact OD2-CG2 3.48Å; D147-T149 PolarHBondContact OD2-OG1 3.17Å
148	L	82.1	Confident	85.1	Confident	63 Å²	63	55.7 Å²	55.7	33%	0.33	29%	0.286	S	S	.	.	S	Bend	trans	65.1	16.2	-176.7	-53	174.5	0	0	0	114.3	R121 M123 H145 R146	R121-L148 PolarHBondContact NH1-O 3.22Å; M123-L148 HydrophobicContact CG-CD2 3.9Å; M123-L148 HydrophobicContact SD-CD2 3.99Å; H145-L148 WeakPolarHBondContact O-CA 3.12Å; H145-L148 PolarHBondContact O-N 2.84Å; R146-L148 PolarHBondContact O-N 2.95Å
149	T	85.6	Confident	86.2	Confident	67 Å²	67	52 Å²	52	41%	0.411	28%	0.282	S	S	.	.			trans	-76.4	155.2	169.1	62.7	0	0	0	0	111.3	C144 H145 D147	C144-T149 CarbonylContact C-O 3.46Å; C144-T149 WeakPolarHBondContact CA-O 3.35Å; C144-T149 WeakPolarHBondContact CB-O 3.23Å; H145-T149 WeakPolarHBondContact CB-OG1 3.48Å; H145-T149 PolarHBondContact CD2-OG1 2.79Å; H145-T149 PolarHBondContact N-O 2.81Å; D147-T149 PolarHBondContact O-N 3.44Å; D147-T149 WeakPolarHBondContact OD1-CB 3Å; D147-T149 WeakPolarHBondContact OD1-CG2 3.46Å; D147-T149 PolarHBondContact OD1-N 2.65Å; D147-T149 PolarHBondContact OD1-OG1 3.27Å; D147-T149 WeakPolarHBondContact OD2-CG2 3.48Å; D147-T149 PolarHBondContact OD2-OG1 3.17Å
150	E	85.5	Confident	86.7	Confident	84 Å²	84	55.6 Å²	55.6	39%	0.393	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-69.1	140.8	-179.4	-65.1	172.3	176.5	0	0	110.9	P78	P78-E150 VanDerWaalsContact CD-OE2 3.25Å; P78-E150 WeakPolarHBondContact CD-OE2 3.39Å; P78-E150 WeakPolarHBondContact CG-OE2 3.47Å
151	I	86.6	Confident	86.5	Confident	9 Å²	9	50.4 Å²	50.4	5%	0.046	27%	0.27	C	S	.	.	S	Bend	trans	-68.6	-39.2	-179.4	-66.1	170.5	0	0	0	111.1	L103 K105 M110 A143	L103-I151 HydrophobicContact CD1-CG2 4.4Å; K105-I151 HydrophobicContact CG-CG2 4.47Å; M110-I151 HydrophobicContact CB-CD1 4.13Å; M110-I151 HydrophobicContact CG-CD1 3.65Å; M110-I151 HydrophobicContact CG-CG1 4.35Å; M110-I151 HydrophobicContact SD-CD1 3.75Å; A143-I151 HydrophobicContact CB-CD1 3.41Å; A143-I151 VanDerWaalsContact CB-CD1 3.41Å; A143-I151 VanDerWaalsContact O-CD1 3.29Å; A143-I151 WeakPolarHBondContact O-CD1 3.25Å; A143-I151 WeakPolarHBondContact O-CG1 3.42Å
152	L	85.7	Confident	86	Confident	14 Å²	14	53.2 Å²	53.2	7%	0.073	29%	0.292	C	S	.	.	S	Bend	trans	-123.7	137.9	176.8	-63	174.6	0	0	0	109.4	V76 S77 L103	V76-L152 HydrophobicContact CB-CD1 4.45Å; V76-L152 HydrophobicContact CG2-CD1 4.15Å; V76-L152 WeakPolarHBondContact O-CB 3.37Å; V76-L152 PolarHBondContact O-N 3.29Å; V76-L152 VanDerWaalsContact O-N 3.15Å; S77-L152 WeakPolarHBondContact CB-O 3.14Å; L103-L152 HydrophobicContact CD2-CD1 4.36Å
153	P	88.6	Confident	85.5	Confident	60 Å²	60	63 Å²	63	39%	0.39	33%	0.326	S	S	.	.			trans	-64.4	169.4	167.6	31.3	-35.6	0	0	0	110.2	L155 C158	P153-L155 PolarHBondContact O-N 3.11Å; P153-C158 HydrophobicContact CG-CB 4.04Å
154	P	88.7	Confident	85.1	Confident	43 Å²	43	66.4 Å²	66.4	28%	0.279	34%	0.339	S	S	.	.			trans	-44	131.7	167.7	-28.1	33.9	0	0	0	111.2	P78 T156 D157 C158	P78-P154 HydrophobicContact CG-CG 4.09Å; P154-T156 PolarHBondContact O-N 2.95Å; P154-T156 VanDerWaalsContact O-N 3.12Å; P154-D157 PolarHBondContact O-N 3.27Å; P154-C158 PolarHBondContact O-N 3.39Å; P154-C158 VanDerWaalsContact O-N 3.14Å
155	L	89.2	Confident	84.7	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.01	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-62.4	-27.3	-171.8	-71.1	-177.1	0	0	0	112.3	D79 P153 D157 C158 L161 M233 I391 L400	D79-L155 PolarHBondContact OD1-N 2.99Å; D79-L155 VanDerWaalsContact OD1-N 3.11Å; D79-L155 PolarHBondContact OD2-N 3.01Å; P153-L155 PolarHBondContact O-N 3.11Å; L155-D157 PolarHBondContact O-N 2.6Å; L155-C158 HydrophobicContact CD2-CB 4.48Å; L155-C158 PolarHBondContact O-N 3.31Å; L155-L161 HydrophobicContact CB-CD1 4.45Å; L155-L161 HydrophobicContact CD2-CD2 4.32Å; L155-L161 WeakPolarHBondContact O-CD1 3.17Å; L155-M233 HydrophobicContact CD1-CG 4.5Å; L155-M233 HydrophobicContact CD1-SD 3.92Å; L155-I391 HydrophobicContact CD1-CD1 3.51Å; L155-I391 HydrophobicContact CD1-CG1 3.55Å; L155-L400 HydrophobicContact CB-CD1 4.42Å
156	T	85.9	Confident	84.7	Confident	22 Å²	22	68.2 Å²	68.2	14%	0.135	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-57.7	-34.5	172.4	45.1	0	0	0	0	112.4	P154 T396 E399 L400 K403	P154-T156 PolarHBondContact O-N 2.95Å; P154-T156 VanDerWaalsContact O-N 3.12Å; T156-T396 HydrophobicContact CG2-CG2 4.07Å; T156-E399 HydrophobicContact CG2-CB 3.78Å; T156-E399 WeakPolarHBondContact CG2-OE2 3.07Å; T156-L400 HydrophobicContact CG2-CD2 4.36Å; T156-L400 HydrophobicContact CG2-CG 4.25Å; T156-K403 VanDerWaalsContact C-NZ 3.34Å; T156-K403 PolarHBondContact O-NZ 2.73Å
157	D	85.7	Confident	84.9	Confident	113 Å²	113	65.2 Å²	65.2	60%	0.604	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-105.9	3.2	-175.7	-59.3	-27.6	0	0	0	112.8	P154 L155 A159 K403	P154-D157 PolarHBondContact O-N 3.27Å; L155-D157 PolarHBondContact O-N 2.6Å; D157-A159 PolarHBondContact O-N 2.88Å; D157-A159 VanDerWaalsContact O-N 3.12Å; D157-K403 IonicContact OD1-NZ 3.4Å; D157-K403 PolarHBondContact OD1-NZ 2.82Å
158	C	84.4	Confident	85.4	Confident	10 Å²	10	60.3 Å²	60.3	7%	0.068	32%	0.318	C	S	.	.			trans	-77.2	99.2	-176.9	-174.4	0	0	0	0	112.1	P153 P154 L155 E160 L161	P153-C158 HydrophobicContact CG-CB 4.04Å; P154-C158 PolarHBondContact O-N 3.39Å; P154-C158 VanDerWaalsContact O-N 3.14Å; L155-C158 HydrophobicContact CD2-CB 4.48Å; L155-C158 PolarHBondContact O-N 3.31Å; C158-E160 PolarHBondContact O-N 3.12Å; C158-L161 HydrophobicContact CB-CD1 4.32Å; C158-L161 HydrophobicContact CB-CG 4.04Å; C158-L161 WeakPolarHBondContact O-CB 3.28Å; C158-L161 PolarHBondContact O-N 3.01Å
159	A	80.3	Confident	86	Confident	82 Å²	82	59.4 Å²	59.4	68%	0.678	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-60.3	-25.3	175.3	0	0	0	0	0	113.3	D157 L161 S162	D157-A159 PolarHBondContact O-N 2.88Å; D157-A159 VanDerWaalsContact O-N 3.12Å; A159-L161 PolarHBondContact O-N 2.76Å; A159-S162 PolarHBondContact O-N 2.79Å; A159-S162 PolarHBondContact O-OG 3.19Å
160	E	80.6	Confident	86.3	Confident	102 Å²	102	59.6 Å²	59.6	48%	0.477	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-66.2	-20.7	179.3	-56.2	-170.6	170.3	0	0	112.8	K105 C158 S162 R163 R164	K105-E160 IonicContact NZ-OE1 3.7Å; K105-E160 IonicContact NZ-OE2 3.02Å; K105-E160 PolarHBondContact NZ-OE2 3.32Å; K105-E160 VanDerWaalsContact NZ-OE2 3.14Å; C158-E160 PolarHBondContact O-N 3.12Å; E160-S162 PolarHBondContact O-N 2.67Å; E160-S162 VanDerWaalsContact O-N 3.14Å; E160-R163 PolarHBondContact O-N 3.28Å; E160-R164 PolarHBondContact O-N 2.9Å; E160-R164 VanDerWaalsContact O-N 3.13Å
161	L	82.9	Confident	86.8	Confident	14 Å²	14	56.2 Å²	56.2	7%	0.073	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-56.8	-32	177.7	-74.6	-178.9	0	0	0	113.1	L155 C158 A159 R163 R164 M233 M235 L400	L155-L161 HydrophobicContact CB-CD1 4.45Å; L155-L161 HydrophobicContact CD2-CD2 4.32Å; L155-L161 WeakPolarHBondContact O-CD1 3.17Å; C158-L161 HydrophobicContact CB-CD1 4.32Å; C158-L161 HydrophobicContact CB-CG 4.04Å; C158-L161 WeakPolarHBondContact O-CB 3.28Å; C158-L161 PolarHBondContact O-N 3.01Å; A159-L161 PolarHBondContact O-N 2.76Å; L161-R163 VanDerWaalsContact C-N 3.25Å; L161-R163 PolarHBondContact O-N 3.09Å; L161-R164 WeakPolarHBondContact O-CB 3.5Å; L161-R164 PolarHBondContact O-N 2.79Å; L161-M233 HydrophobicContact CD2-CB 4.07Å; L161-M233 HydrophobicContact CD2-CG 4.08Å; L161-M233 HydrophobicContact CD2-SD 4.37Å; L161-M235 HydrophobicContact CB-CG 4.2Å; L161-M235 HydrophobicContact CB-SD 3.91Å; L161-L400 HydrophobicContact CD1-CD2 4.2Å
162	S	79.6	Confident	87.2	Confident	78 Å²	78	60.1 Å²	60.1	55%	0.545	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-65.7	-29.6	178.4	63.9	0	0	0	0	113	A159 E160 M235	A159-S162 PolarHBondContact O-N 2.79Å; A159-S162 PolarHBondContact O-OG 3.19Å; E160-S162 PolarHBondContact O-N 2.67Å; E160-S162 VanDerWaalsContact O-N 3.14Å; S162-M235 WeakPolarHBondContact CA-SD 3.48Å; S162-M235 PolarHBondContact N-SD 2.87Å
163	R	81.7	Confident	87.7	Confident	226 Å²	226	60.2 Å²	60.2	85%	0.853	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-10.7	-178	-63.9	-179.5	177.9	174.6	-1	112.7	E160 L161	E160-R163 PolarHBondContact O-N 3.28Å; L161-R163 VanDerWaalsContact C-N 3.25Å; L161-R163 PolarHBondContact O-N 3.09Å
164	R	82.9	Confident	88	Confident	71 Å²	71	62 Å²	62	27%	0.268	33%	0.334	S	S	.	.			trans	-58.6	127.4	-177.1	-175.4	173.8	171.7	157.2	-6.5	111.6	E160 L161 E230 M233 H389	E160-R164 PolarHBondContact O-N 2.9Å; E160-R164 VanDerWaalsContact O-N 3.13Å; L161-R164 WeakPolarHBondContact O-CB 3.5Å; L161-R164 PolarHBondContact O-N 2.79Å; R164-E230 IonicContact NH2-OE1 2.92Å; R164-M233 PolarHBondContact NH1-SD 2.87Å; R164-H389 PolarHBondContact NH1-CE1 3.19Å; R164-H389 PolarHBondContact NH1-ND1 3.14Å; R164-H389 PolarHBondContact NH2-ND1 3.3Å
165	P	83.2	Confident	88.2	Confident	70 Å²	70	61 Å²	61	46%	0.455	33%	0.326	S	S	.	.			trans	-71.7	134.7	175.3	28.3	-33.3	0	0	0	110.8	R167	P165-R167 VanDerWaalsContact C-N 3.33Å; P165-R167 HydrophobicContact CB-CG 4.33Å; P165-R167 HydrophobicContact CG-CG 4.33Å; P165-R167 PolarHBondContact O-N 3.17Å; P165-R167 VanDerWaalsContact O-N 3.13Å
166	V	89.8	Confident	88.6	Confident	25 Å²	25	60.9 Å²	60.9	15%	0.152	33%	0.326	C	S	.	.			trans	-89.2	73.7	175.4	-169.7	0	0	0	0	109	L168 L169 K239 L243	V166-L168 PolarHBondContact O-N 3.46Å; V166-L169 HydrophobicContact CB-CD1 4.03Å; V166-L169 HydrophobicContact CB-CG 4.3Å; V166-L169 HydrophobicContact CG1-CD1 3.81Å; V166-L169 HydrophobicContact CG1-CG 3.71Å; V166-L169 PolarHBondContact O-N 2.88Å; V166-L169 VanDerWaalsContact O-N 3.15Å; V166-K239 HydrophobicContact CG2-CB 4.45Å; V166-K239 HydrophobicContact CG2-CD 4.01Å; V166-L243 HydrophobicContact CG1-CD1 3.63Å; V166-L243 HydrophobicContact CG1-CD2 3.56Å; V166-L243 HydrophobicContact CG1-CG 3.69Å
167	R	90.3	Very high	89.1	Confident	104 Å²	104	59.9 Å²	59.9	39%	0.392	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-56.7	-35.9	-171.6	-60.4	-174.7	-173.9	-137.1	5.4	112.7	P165 L169 G170	P165-R167 VanDerWaalsContact C-N 3.33Å; P165-R167 HydrophobicContact CB-CG 4.33Å; P165-R167 HydrophobicContact CG-CG 4.33Å; P165-R167 PolarHBondContact O-N 3.17Å; P165-R167 VanDerWaalsContact O-N 3.13Å; R167-L169 PolarHBondContact O-N 3.2Å; R167-L169 VanDerWaalsContact O-N 3.08Å; R167-G170 PolarHBondContact O-N 2.98Å
168	L	93.4	Very high	89.5	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.037	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-56.6	-28	179.9	-174.1	62.9	0	0	0	113.9	V166 G170 V176 W226 L243 K246 F247	V166-L168 PolarHBondContact O-N 3.46Å; L168-G170 VanDerWaalsContact C-N 3.29Å; L168-G170 PolarHBondContact O-N 3.46Å; L168-V176 HydrophobicContact CD1-CG1 4.25Å; L168-V176 HydrophobicContact CD1-CG2 3.95Å; L168-W226 HydrophobicContact CD1-CH2 4.32Å; L168-W226 HydrophobicContact CD1-CZ2 3.99Å; L168-W226 HydrophobicContact CD2-CH2 4.19Å; L168-W226 HydrophobicContact CD2-CZ2 3.71Å; L168-W226 HydrophobicContact CG-CZ2 4.48Å; L168-L243 HydrophobicContact CB-CD2 4.3Å; L168-L243 HydrophobicContact CD2-CD2 4.02Å; L168-L243 HydrophobicContact CG-CD2 4.48Å; L168-K246 HydrophobicContact CG-CG 4.39Å; L168-K246 WeakPolarHBondContact O-CE 3.46Å; L168-F247 HydrophobicContact CD2-CD1 4.5Å; L168-F247 HydrophobicContact CD2-CE1 3.66Å; L168-F247 HydrophobicContact CD2-CE2 4.16Å; L168-F247 HydrophobicContact CD2-CZ 3.46Å; L168-F247 VanDerWaalsContact CD2-CZ 3.46Å
169	L	94.9	Very high	89.9	Confident	45 Å²	45	55.1 Å²	55.1	24%	0.236	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-68.8	-27.6	178.3	-68.5	179.1	0	0	0	113	V166 R167 K239 Q242 L243 K246	V166-L169 HydrophobicContact CB-CD1 4.03Å; V166-L169 HydrophobicContact CB-CG 4.3Å; V166-L169 HydrophobicContact CG1-CD1 3.81Å; V166-L169 HydrophobicContact CG1-CG 3.71Å; V166-L169 PolarHBondContact O-N 2.88Å; V166-L169 VanDerWaalsContact O-N 3.15Å; R167-L169 PolarHBondContact O-N 3.2Å; R167-L169 VanDerWaalsContact O-N 3.08Å; L169-K239 HydrophobicContact CD1-CB 4.14Å; L169-K239 HydrophobicContact CD1-CG 4.41Å; L169-Q242 HydrophobicContact CD1-CB 4.12Å; L169-Q242 HydrophobicContact CD2-CB 3.72Å; L169-L243 HydrophobicContact CD2-CD2 3.92Å; L169-L243 HydrophobicContact CD2-CG 4.09Å; L169-L243 HydrophobicContact CG-CD2 4.1Å; L169-L243 HydrophobicContact CG-CG 4.3Å; L169-K246 HydrophobicContact CD2-CB 4.39Å
170	G	93.3	Very high	90.7	Very high	71 Å²	71	51.2 Å²	51.2	73%	0.732	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-20.9	-179.4	0	0	0	0	0	114.4	R167 L168	R167-G170 PolarHBondContact O-N 2.98Å; L168-G170 VanDerWaalsContact C-N 3.29Å; L168-G170 PolarHBondContact O-N 3.46Å
171	I	94.2	Very high	91.4	Very high	12 Å²	12	47 Å²	47	6%	0.062	25%	0.245	C	C	.	.	S	Bend	trans	-83.7	148.7	-176.4	-52	177.2	0	0	0	109.6	V176 K246 E380 V381	I171-V176 HydrophobicContact CB-CG2 4.08Å; I171-V176 HydrophobicContact CG2-CG2 3.6Å; I171-K246 WeakPolarHBondContact O-CE 3.38Å; I171-K246 PolarHBondContact O-NZ 2.66Å; I171-E380 HydrophobicContact CD1-CG 4.01Å; I171-E380 HydrophobicContact CG1-CG 4.19Å; I171-V381 HydrophobicContact CG2-CG2 3.56Å
172	N	95.1	Very high	91.8	Very high	92 Å²	92	52.4 Å²	52.4	49%	0.492	27%	0.27	S	S	.	.			trans	-64.5	140.6	173.7	-171.2	-57.9	0	0	0	111.4	W174 D175 V176	N172-W174 WeakPolarHBondContact OD1-CB 3.29Å; N172-W174 PolarHBondContact OD1-N 3.11Å; N172-D175 HydrophobicContact CB-CB 4.14Å; N172-D175 WeakPolarHBondContact CB-OD2 3.04Å; N172-D175 PolarHBondContact O-N 2.82Å; N172-V176 WeakPolarHBondContact O-CG2 3.49Å; N172-V176 PolarHBondContact O-N 2.9Å
173	T	96.4	Very high	92.5	Very high	15 Å²	15	48.8 Å²	48.8	9%	0.092	24%	0.244	C	C	.	.	H	α-helix	trans	-66.1	-40	-178.9	-51.9	0	0	0	0	112.9	A177 K246 K249 I250	T173-A177 PolarHBondContact O-N 2.8Å; T173-A177 VanDerWaalsContact O-N 3.16Å; T173-K246 VanDerWaalsContact N-NZ 3.16Å; T173-K246 WeakPolarHBondContact OG1-CD 3.46Å; T173-K246 WeakPolarHBondContact OG1-CE 3.39Å; T173-K246 PolarHBondContact OG1-NZ 3.13Å; T173-K249 HydrophobicContact CG2-CB 3.5Å; T173-K249 VanDerWaalsContact CG2-CB 3.5Å; T173-I250 HydrophobicContact CG2-CB 4.4Å; T173-I250 HydrophobicContact CG2-CG1 3.59Å
174	W	94.9	Very high	93.1	Very high	99 Å²	99	38 Å²	38	38%	0.375	20%	0.204	S	C	.	.	H	α-helix	trans	-63	-44.2	177.7	173.4	-93.5	0	0	0	110.9	N172 V176 A177 A178 H253 Q257	N172-W174 WeakPolarHBondContact OD1-CB 3.29Å; N172-W174 PolarHBondContact OD1-N 3.11Å; W174-V176 PolarHBondContact O-N 3.39Å; W174-A177 PolarHBondContact O-N 3.37Å; W174-A177 VanDerWaalsContact O-N 3.16Å; W174-A178 WeakPolarHBondContact O-CB 3.5Å; W174-A178 PolarHBondContact O-N 3.02Å; W174-H253 HydrophobicContact CE3-CB 4.46Å; W174-H253 AromaticContact CE3-CE1 3.96Å; W174-H253 AromaticContact CE3-ND1 3.48Å; W174-H253 AromaticContact CZ3-ND1 3.88Å; W174-Q257 HydrophobicContact CH2-CG 4.05Å; W174-Q257 HydrophobicContact CZ3-CG 4.27Å
175	D	94.3	Very high	93.7	Very high	21 Å²	21	36.1 Å²	36.1	11%	0.112	20%	0.197	C	C	.	.	H	α-helix	trans	-63.6	-40.1	-178.8	-65.3	-31.1	0	0	0	111.8	N172 A178 A179 G375 V376 V381	N172-D175 HydrophobicContact CB-CB 4.14Å; N172-D175 WeakPolarHBondContact CB-OD2 3.04Å; N172-D175 PolarHBondContact O-N 2.82Å; D175-A178 PolarHBondContact O-N 3.32Å; D175-A179 VanDerWaalsContact O-CB 3.29Å; D175-A179 WeakPolarHBondContact O-CB 3.25Å; D175-A179 PolarHBondContact O-N 3.18Å; D175-G375 WeakPolarHBondContact OD1-CA 3.4Å; D175-V376 PolarHBondContact OD1-N 3.48Å; D175-V376 VanDerWaalsContact OD1-N 3.1Å; D175-V381 HydrophobicContact CB-CG1 4.09Å; D175-V381 HydrophobicContact CB-CG2 3.79Å
176	V	96	Very high	94.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.5	-44.4	173.5	178.1	0	0	0	0	111.3	L168 I171 N172 W174 A179 L180 W226 I250 V385	L168-V176 HydrophobicContact CD1-CG1 4.25Å; L168-V176 HydrophobicContact CD1-CG2 3.95Å; I171-V176 HydrophobicContact CB-CG2 4.08Å; I171-V176 HydrophobicContact CG2-CG2 3.6Å; N172-V176 WeakPolarHBondContact O-CG2 3.49Å; N172-V176 PolarHBondContact O-N 2.9Å; W174-V176 PolarHBondContact O-N 3.39Å; V176-A179 PolarHBondContact O-N 3.33Å; V176-L180 HydrophobicContact CG1-CD1 4.18Å; V176-L180 WeakPolarHBondContact O-CB 2.89Å; V176-L180 WeakPolarHBondContact O-CG 3.38Å; V176-L180 PolarHBondContact O-N 3.14Å; V176-W226 HydrophobicContact CG1-CH2 4.25Å; V176-I250 HydrophobicContact CB-CD1 4.26Å; V176-I250 HydrophobicContact CB-CG1 4.46Å; V176-I250 HydrophobicContact CG1-CD1 3.77Å; V176-I250 HydrophobicContact CG1-CG1 4.32Å; V176-I250 HydrophobicContact CG1-CG2 4.39Å; V176-V385 HydrophobicContact CG1-CG2 4.31Å
177	A	96.8	Very high	94.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-41.7	178.3	0	0	0	0	0	112.2	T173 W174 L180 T181 I250 H253 Q257	T173-A177 PolarHBondContact O-N 2.8Å; T173-A177 VanDerWaalsContact O-N 3.16Å; W174-A177 PolarHBondContact O-N 3.37Å; W174-A177 VanDerWaalsContact O-N 3.16Å; A177-L180 PolarHBondContact O-N 2.9Å; A177-T181 WeakPolarHBondContact O-CB 3.36Å; A177-T181 PolarHBondContact O-N 2.97Å; A177-T181 PolarHBondContact O-OG1 3.17Å; A177-I250 HydrophobicContact CB-CG2 4.2Å; A177-H253 HydrophobicContact CB-CB 3.47Å; A177-H253 VanDerWaalsContact CB-CB 3.47Å; A177-Q257 PolarHBondContact O-OE1 3.24Å; A177-Q257 VanDerWaalsContact O-OE1 3.13Å
178	A	94.1	Very high	94.3	Very high	4 Å²	4	28.8 Å²	28.8	3%	0.033	16%	0.164	C	C	.	.	H	α-helix	trans	-63.1	-42.9	176	0	0	0	0	0	111.4	W174 D175 T181 H182 V373	W174-A178 WeakPolarHBondContact O-CB 3.5Å; W174-A178 PolarHBondContact O-N 3.02Å; D175-A178 PolarHBondContact O-N 3.32Å; A178-T181 PolarHBondContact O-N 3.33Å; A178-H182 WeakPolarHBondContact O-CB 3.41Å; A178-H182 PolarHBondContact O-N 3.15Å; A178-V373 HydrophobicContact CB-CG1 4.28Å
179	A	93.9	Very high	94.3	Very high	20 Å²	20	34.2 Å²	34.2	17%	0.165	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-40.6	176.1	0	0	0	0	0	112.6	D175 V176 H182 L183 V381 V385	D175-A179 VanDerWaalsContact O-CB 3.29Å; D175-A179 WeakPolarHBondContact O-CB 3.25Å; D175-A179 PolarHBondContact O-N 3.18Å; V176-A179 PolarHBondContact O-N 3.33Å; A179-H182 PolarHBondContact O-N 3.43Å; A179-L183 WeakPolarHBondContact O-CB 3.32Å; A179-L183 PolarHBondContact O-N 2.88Å; A179-V381 HydrophobicContact CB-CG1 3.63Å; A179-V385 HydrophobicContact CB-CB 4.3Å; A179-V385 HydrophobicContact CB-CG2 3.72Å
180	L	95.9	Very high	94	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.4	-47.9	171.1	-79.7	165.8	0	0	0	111.3	V176 A177 H182 L183 D184 V223 W226 I250 I266 V385	V176-L180 HydrophobicContact CG1-CD1 4.18Å; V176-L180 WeakPolarHBondContact O-CB 2.89Å; V176-L180 WeakPolarHBondContact O-CG 3.38Å; V176-L180 PolarHBondContact O-N 3.14Å; A177-L180 PolarHBondContact O-N 2.9Å; L180-H182 PolarHBondContact O-N 3.02Å; L180-L183 PolarHBondContact O-N 3.5Å; L180-D184 VanDerWaalsContact O-CB 3.31Å; L180-D184 WeakPolarHBondContact O-CB 3.39Å; L180-D184 VanDerWaalsContact O-CG 3.26Å; L180-D184 PolarHBondContact O-N 3.45Å; L180-V223 HydrophobicContact CD2-CG2 3.99Å; L180-W226 HydrophobicContact CD1-CZ3 4.33Å; L180-I250 HydrophobicContact CD1-CG2 3.78Å; L180-I266 HydrophobicContact CD1-CD1 4.34Å; L180-V385 HydrophobicContact CD2-CG1 3.72Å; L180-V385 HydrophobicContact CD2-CG2 4.44Å; L180-V385 HydrophobicContact CG-CG1 4.04Å; L180-V385 HydrophobicContact CG-CG2 4.06Å
181	T	95.8	Very high	93.9	Very high	12 Å²	12	32 Å²	32	7%	0.074	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-41	178.7	-62.4	0	0	0	0	112.5	A177 A178 W185 Q257 N259	A177-T181 WeakPolarHBondContact O-CB 3.36Å; A177-T181 PolarHBondContact O-N 2.97Å; A177-T181 PolarHBondContact O-OG1 3.17Å; A178-T181 PolarHBondContact O-N 3.33Å; T181-W185 WeakPolarHBondContact O-CB 3.34Å; T181-W185 PolarHBondContact O-N 2.98Å; T181-Q257 HydrophobicContact CG2-CB 4.31Å; T181-Q257 PolarHBondContact OG1-OE1 3.45Å; T181-N259 WeakPolarHBondContact CA-ND2 3.42Å; T181-N259 HydrophobicContact CG2-CB 4.04Å; T181-N259 WeakPolarHBondContact OG1-CB 3.48Å; T181-N259 PolarHBondContact OG1-ND2 2.89Å
182	H	92.3	Very high	93.7	Very high	128 Å²	128	36 Å²	36	59%	0.593	18%	0.182	S	C	*	.	H	α-helix	trans	-63.4	-47.7	177.2	-179.7	-85.2	0	0	0	111.6	A178 A179 L180 W185 S186	A178-H182 WeakPolarHBondContact O-CB 3.41Å; A178-H182 PolarHBondContact O-N 3.15Å; A179-H182 PolarHBondContact O-N 3.43Å; L180-H182 PolarHBondContact O-N 3.02Å; H182-W185 PolarHBondContact O-N 3.34Å; H182-S186 PolarHBondContact O-N 3.07Å
183	L	92.4	Very high	93.5	Very high	2 Å²	2	35 Å²	35	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-50.5	178.2	-179.4	59.4	0	0	0	111.6	H85 A179 L180 W185 S186 L187 V385	H85-L183 VanDerWaalsContact CE1-CD1 3.43Å; H85-L183 WeakPolarHBondContact CE1-CD1 3.32Å; A179-L183 WeakPolarHBondContact O-CB 3.32Å; A179-L183 PolarHBondContact O-N 2.88Å; L180-L183 PolarHBondContact O-N 3.5Å; L183-W185 PolarHBondContact O-N 3.5Å; L183-S186 WeakPolarHBondContact O-CB 3.4Å; L183-S186 PolarHBondContact O-N 3.43Å; L183-L187 HydrophobicContact CG-CD1 4.46Å; L183-L187 PolarHBondContact O-N 2.94Å; L183-L187 VanDerWaalsContact O-N 3.07Å; L183-V385 HydrophobicContact CB-CG1 4.45Å; L183-V385 HydrophobicContact CD2-CG1 3.83Å
184	D	95.3	Very high	93.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.2	-35.1	177.8	-73.8	-7.7	0	0	0	111.4	L180 F188 N259 S262 I321	L180-D184 VanDerWaalsContact O-CB 3.31Å; L180-D184 WeakPolarHBondContact O-CB 3.39Å; L180-D184 VanDerWaalsContact O-CG 3.26Å; L180-D184 PolarHBondContact O-N 3.45Å; D184-F188 WeakPolarHBondContact O-CB 3.42Å; D184-F188 PolarHBondContact O-N 3.42Å; D184-N259 PolarHBondContact OD2-ND2 3.48Å; D184-N259 PolarHBondContact OD2-OD1 2.84Å; D184-S262 WeakPolarHBondContact OD2-CB 3.13Å; D184-S262 PolarHBondContact OD2-OG 2.87Å; D184-I321 HydrophobicContact CB-CD1 3.66Å
185	W	94.5	Very high	93	Very high	32 Å²	32	35.7 Å²	35.7	12%	0.121	18%	0.181	C	C	.	.	H	α-helix	trans	-68.6	-42.6	176.6	-174.7	-103	0	0	0	112.3	T181 H182 L183 L187 F188 K189 P319 I321 P369	T181-W185 WeakPolarHBondContact O-CB 3.34Å; T181-W185 PolarHBondContact O-N 2.98Å; H182-W185 PolarHBondContact O-N 3.34Å; L183-W185 PolarHBondContact O-N 3.5Å; W185-L187 VanDerWaalsContact C-N 3.34Å; W185-L187 PolarHBondContact O-N 3.35Å; W185-F188 HydrophobicContact CE3-CD1 4.18Å; W185-F188 HydrophobicContact CZ3-CD1 4.03Å; W185-F188 HydrophobicContact CZ3-CE1 4.33Å; W185-F188 PolarHBondContact O-N 3.01Å; W185-K189 WeakPolarHBondContact O-CB 3.34Å; W185-K189 PolarHBondContact O-N 2.92Å; W185-P319 HydrophobicContact CH2-CB 3.23Å; W185-P319 HydrophobicContact CZ2-CB 3.79Å; W185-P319 HydrophobicContact CZ3-CB 3.77Å; W185-I321 HydrophobicContact CB-CD1 4.06Å; W185-I321 HydrophobicContact CE3-CD1 4.04Å; W185-I321 HydrophobicContact CE3-CG1 3.63Å; W185-I321 HydrophobicContact CZ3-CG1 4.14Å; W185-P369 HydrophobicContact CD2-CG 4.4Å; W185-P369 HydrophobicContact CG-CG 4.42Å; W185-P369 HydrophobicContact CZ2-CG 4.38Å
186	S	91.6	Very high	92.9	Very high	43 Å²	43	34.8 Å²	34.8	30%	0.301	18%	0.176	S	C	.	.	H	α-helix	trans	-55.6	-51.8	174.3	-173.9	0	0	0	0	110.5	E69 H182 L183 K189 S190	E69-S186 PolarHBondContact OE1-OG 3.45Å; E69-S186 PolarHBondContact OE2-OG 3.46Å; H182-S186 PolarHBondContact O-N 3.07Å; L183-S186 WeakPolarHBondContact O-CB 3.4Å; L183-S186 PolarHBondContact O-N 3.43Å; S186-K189 PolarHBondContact O-N 3.12Å; S186-S190 PolarHBondContact O-N 3.12Å; S186-S190 VanDerWaalsContact O-N 3.12Å
187	L	91.5	Very high	92.5	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-50.8	177.6	-70.1	177.2	0	0	0	111.5	E69 H85 L183 W185 K189 S190 I191 V215 L216 R219	E69-L187 HydrophobicContact CB-CD2 4.3Å; H85-L187 WeakPolarHBondContact NE2-CD2 3.31Å; L183-L187 HydrophobicContact CG-CD1 4.46Å; L183-L187 PolarHBondContact O-N 2.94Å; L183-L187 VanDerWaalsContact O-N 3.07Å; W185-L187 VanDerWaalsContact C-N 3.34Å; W185-L187 PolarHBondContact O-N 3.35Å; L187-K189 VanDerWaalsContact C-N 3.31Å; L187-K189 PolarHBondContact O-N 3.34Å; L187-S190 PolarHBondContact O-N 3.49Å; L187-S190 VanDerWaalsContact O-N 3.08Å; L187-S190 PolarHBondContact O-OG 3.26Å; L187-I191 PolarHBondContact O-N 3.3Å; L187-V215 HydrophobicContact CD1-CG1 4.14Å; L187-V215 HydrophobicContact CD2-CB 4.41Å; L187-V215 HydrophobicContact CD2-CG1 3.5Å; L187-V215 VanDerWaalsContact CD2-CG1 3.5Å; L187-V215 HydrophobicContact CG-CG1 4.45Å; L187-L216 HydrophobicContact CB-CB 4.42Å; L187-L216 HydrophobicContact CB-CD1 3.92Å; L187-L216 HydrophobicContact CD1-CD1 4.48Å; L187-R219 HydrophobicContact CD1-CB 4.13Å; L187-R219 HydrophobicContact CD1-CG 4.05Å
188	F	94.8	Very high	92.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.1	-39.2	-179.5	-179.3	-122.6	0	0	0	112.7	D184 W185 S190 I191 L216 I321 P322 M324 I361 C364 Q365	D184-F188 WeakPolarHBondContact O-CB 3.42Å; D184-F188 PolarHBondContact O-N 3.42Å; W185-F188 HydrophobicContact CE3-CD1 4.18Å; W185-F188 HydrophobicContact CZ3-CD1 4.03Å; W185-F188 HydrophobicContact CZ3-CE1 4.33Å; W185-F188 PolarHBondContact O-N 3.01Å; F188-S190 VanDerWaalsContact C-N 3.3Å; F188-S190 PolarHBondContact O-N 3.17Å; F188-I191 HydrophobicContact CD2-CD1 4.13Å; F188-I191 WeakPolarHBondContact O-CB 3.25Å; F188-I191 PolarHBondContact O-N 3.16Å; F188-L216 HydrophobicContact CB-CD2 4.12Å; F188-L216 HydrophobicContact CD2-CD2 3.9Å; F188-L216 HydrophobicContact CG-CD2 4.48Å; F188-I321 HydrophobicContact CB-CG2 4.38Å; F188-I321 HydrophobicContact CD1-CG1 4.41Å; F188-I321 HydrophobicContact CD1-CG2 4.43Å; F188-I321 HydrophobicContact CG-CG2 4.25Å; F188-P322 HydrophobicContact CE2-CG 4.13Å; F188-P322 HydrophobicContact CZ-CG 4.04Å; F188-M324 HydrophobicContact CD2-SD 4.32Å; F188-M324 HydrophobicContact CE2-SD 3.79Å; F188-I361 HydrophobicContact CE2-CG2 3.85Å; F188-I361 HydrophobicContact CZ-CG2 3.91Å; F188-C364 HydrophobicContact CE1-CB 4.11Å; F188-C364 HydrophobicContact CZ-CB 4.1Å; F188-Q365 HydrophobicContact CD1-CG 3.9Å; F188-Q365 HydrophobicContact CE1-CG 3.37Å; F188-Q365 HydrophobicContact CZ-CG 3.82Å; F188-Q365 PolarHBondContact O-NE2 3.4Å
189	K	91.8	Very high	91.7	Very high	120 Å²	120	46.3 Å²	46.3	52%	0.522	23%	0.226	S	C	.	.	H	α-helix	trans	-69.9	-26.3	177.5	-173	-178.4	178	-172	0	112.7	W185 S186 L187 I191	W185-K189 WeakPolarHBondContact O-CB 3.34Å; W185-K189 PolarHBondContact O-N 2.92Å; S186-K189 PolarHBondContact O-N 3.12Å; L187-K189 VanDerWaalsContact C-N 3.31Å; L187-K189 PolarHBondContact O-N 3.34Å; K189-I191 VanDerWaalsContact C-N 3.28Å
190	S	89.9	Confident	91.1	Very high	62 Å²	62	46.1 Å²	46.1	43%	0.434	22%	0.222	S	C	.	.	H	α-helix	trans	-74.6	-18.1	177.7	73.1	0	0	0	0	113.6	S186 L187 F188 H192 A212	S186-S190 PolarHBondContact O-N 3.12Å; S186-S190 VanDerWaalsContact O-N 3.12Å; L187-S190 PolarHBondContact O-N 3.49Å; L187-S190 VanDerWaalsContact O-N 3.08Å; L187-S190 PolarHBondContact O-OG 3.26Å; F188-S190 VanDerWaalsContact C-N 3.3Å; F188-S190 PolarHBondContact O-N 3.17Å; S190-H192 PolarHBondContact O-N 3.23Å; S190-A212 VanDerWaalsContact OG-CB 3.28Å; S190-A212 WeakPolarHBondContact OG-CB 3.41Å
191	I	90.9	Very high	90.3	Very high	9 Å²	9	49.1 Å²	49.1	5%	0.046	24%	0.238	C	C	.	.			trans	-67.6	120.3	179.5	-62.2	171.6	0	0	0	110.4	L187 F188 K189 E195 L196 A212 L213 L216	L187-I191 PolarHBondContact O-N 3.3Å; F188-I191 HydrophobicContact CD2-CD1 4.13Å; F188-I191 WeakPolarHBondContact O-CB 3.25Å; F188-I191 PolarHBondContact O-N 3.16Å; K189-I191 VanDerWaalsContact C-N 3.28Å; I191-E195 HydrophobicContact CG2-CB 4.31Å; I191-L196 HydrophobicContact CG2-CD2 4.24Å; I191-L196 HydrophobicContact CG2-CG 4.37Å; I191-A212 HydrophobicContact CG1-CB 3.94Å; I191-L213 HydrophobicContact CD1-CB 4.42Å; I191-L213 HydrophobicContact CD1-CD1 3.89Å; I191-L213 HydrophobicContact CG1-CB 4.43Å; I191-L213 HydrophobicContact CG2-CB 4.37Å; I191-L216 HydrophobicContact CD1-CB 4.07Å; I191-L216 HydrophobicContact CD1-CD2 3.44Å; I191-L216 VanDerWaalsContact CD1-CD2 3.44Å; I191-L216 HydrophobicContact CD1-CG 4.4Å
192	H	90.2	Very high	89.1	Confident	95 Å²	95	51 Å²	51	44%	0.44	25%	0.252	S	S	.	.			trans	-80	143.4	170	-164.6	-96.9	0	0	0	111.1	S190 Q194 E195	S190-H192 PolarHBondContact O-N 3.23Å; H192-Q194 VanDerWaalsContact CE1-CD 3.42Å; H192-Q194 PolarHBondContact CE1-OE1 2.83Å; H192-Q194 WeakPolarHBondContact ND1-CB 3.29Å; H192-Q194 WeakPolarHBondContact ND1-CG 3.33Å; H192-Q194 PolarHBondContact ND1-N 3.05Å; H192-Q194 PolarHBondContact ND1-OE1 3.15Å; H192-Q194 PolarHBondContact O-N 3.07Å; H192-Q194 VanDerWaalsContact O-N 3.07Å; H192-E195 HydrophobicContact CB-CG 4.06Å; H192-E195 PolarHBondContact N-OE1 3.12Å; H192-E195 VanDerWaalsContact O-CB 3.31Å; H192-E195 WeakPolarHBondContact O-CB 3.45Å; H192-E195 WeakPolarHBondContact O-CG 3.45Å; H192-E195 PolarHBondContact O-N 2.57Å
193	E	90.2	Very high	87.4	Confident	70 Å²	70	55.1 Å²	55.1	33%	0.327	26%	0.262	S	S	.	.	H	α-helix	trans	-53.8	-33.4	179.6	-71.6	176.3	-128	0	0	113	E195 L196 V358 R362	E193-E195 VanDerWaalsContact C-N 3.3Å; E193-E195 PolarHBondContact O-N 3.22Å; E193-L196 WeakPolarHBondContact O-CB 3.44Å; E193-L196 PolarHBondContact O-N 3Å; E193-V358 HydrophobicContact CB-CG1 3.68Å; E193-V358 HydrophobicContact CG-CG1 3.83Å; E193-R362 HydrophobicContact CG-CB 4.48Å; E193-R362 WeakPolarHBondContact OE1-CD 3.38Å; E193-R362 IonicContact OE1-NE 3.94Å; E193-R362 IonicContact OE1-NH1 3.97Å; E193-R362 PolarHBondContact OE1-NH1 2.98Å; E193-R362 IonicContact OE2-NH1 3.74Å
194	Q	89.9	Confident	85.5	Confident	109 Å²	109	58.2 Å²	58.2	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-65.7	-30.2	177.3	-67.4	171.1	-23.1	0	0	112.7	H192 L196 V197 Y198	H192-Q194 VanDerWaalsContact CE1-CD 3.42Å; H192-Q194 PolarHBondContact CE1-OE1 2.83Å; H192-Q194 WeakPolarHBondContact ND1-CB 3.29Å; H192-Q194 WeakPolarHBondContact ND1-CG 3.33Å; H192-Q194 PolarHBondContact ND1-N 3.05Å; H192-Q194 PolarHBondContact ND1-OE1 3.15Å; H192-Q194 PolarHBondContact O-N 3.07Å; H192-Q194 VanDerWaalsContact O-N 3.07Å; Q194-L196 PolarHBondContact O-N 3.18Å; Q194-V197 PolarHBondContact O-N 2.94Å; Q194-V197 VanDerWaalsContact O-N 3.14Å; Q194-Y198 HydrophobicContact CB-CD2 3.99Å; Q194-Y198 HydrophobicContact CB-CE2 3.86Å; Q194-Y198 WeakPolarHBondContact O-CD2 3.45Å; Q194-Y198 PolarHBondContact O-N 3.38Å
195	E	91.1	Very high	83.5	Confident	21 Å²	21	64.3 Å²	64.3	10%	0.098	33%	0.327	C	S	.	.	H	α-helix	trans	-62	-36.5	178.3	-55.6	-170.4	-131.8	0	0	111	I191 H192 E193 V197 Y198 Y199 H209 T210 A211 A212 L213	I191-E195 HydrophobicContact CG2-CB 4.31Å; H192-E195 HydrophobicContact CB-CG 4.06Å; H192-E195 PolarHBondContact N-OE1 3.12Å; H192-E195 VanDerWaalsContact O-CB 3.31Å; H192-E195 WeakPolarHBondContact O-CB 3.45Å; H192-E195 WeakPolarHBondContact O-CG 3.45Å; H192-E195 PolarHBondContact O-N 2.57Å; E193-E195 VanDerWaalsContact C-N 3.3Å; E193-E195 PolarHBondContact O-N 3.22Å; E195-V197 VanDerWaalsContact C-N 3.31Å; E195-V197 PolarHBondContact O-N 2.87Å; E195-Y198 PolarHBondContact O-N 2.96Å; E195-Y199 WeakPolarHBondContact O-CB 3.34Å; E195-Y199 PolarHBondContact O-N 3.24Å; E195-H209 VanDerWaalsContact CG-O 3.29Å; E195-H209 WeakPolarHBondContact CG-O 3.43Å; E195-T210 WeakPolarHBondContact OE2-CA 3.39Å; E195-A211 PolarHBondContact OE2-N 3.07Å; E195-A212 PolarHBondContact OE2-N 2.93Å; E195-L213 HydrophobicContact CB-CB 4.19Å; E195-L213 PolarHBondContact OE2-N 3.36Å
196	L	91.6	Very high	81.5	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-63.1	-40.4	176.9	-56.1	169.3	0	0	0	111.2	I191 E193 Q194 T200 L213 M324 L328 I331 V358 I361	I191-L196 HydrophobicContact CG2-CD2 4.24Å; I191-L196 HydrophobicContact CG2-CG 4.37Å; E193-L196 WeakPolarHBondContact O-CB 3.44Å; E193-L196 PolarHBondContact O-N 3Å; Q194-L196 PolarHBondContact O-N 3.18Å; L196-T200 PolarHBondContact O-N 3.03Å; L196-T200 PolarHBondContact O-OG1 2.86Å; L196-L213 HydrophobicContact CD2-CD1 4.04Å; L196-L213 HydrophobicContact CD2-CD2 4.16Å; L196-M324 HydrophobicContact CD2-CE 3.54Å; L196-L328 HydrophobicContact CD2-CD2 4Å; L196-I331 HydrophobicContact CB-CD1 4.3Å; L196-V358 HydrophobicContact CB-CG2 4.24Å; L196-V358 HydrophobicContact CD1-CG1 4.23Å; L196-V358 HydrophobicContact CD1-CG2 4.26Å; L196-I361 HydrophobicContact CD1-CB 4.13Å; L196-I361 HydrophobicContact CD1-CD1 3.74Å; L196-I361 HydrophobicContact CD1-CG2 3.89Å; L196-I361 HydrophobicContact CD2-CD1 4.2Å
197	V	88.6	Confident	79.9	Confident	54 Å²	54	67.2 Å²	67.2	33%	0.327	37%	0.366	S	S	.	.	H	α-helix	trans	-71.3	-49.2	178.1	179.7	0	0	0	0	109.9	Q194 E195 Y199 T200 L201 I354 V358	Q194-V197 PolarHBondContact O-N 2.94Å; Q194-V197 VanDerWaalsContact O-N 3.14Å; E195-V197 VanDerWaalsContact C-N 3.31Å; E195-V197 PolarHBondContact O-N 2.87Å; V197-Y199 VanDerWaalsContact C-N 3.34Å; V197-Y199 PolarHBondContact O-N 3.39Å; V197-T200 PolarHBondContact O-N 3.46Å; V197-L201 HydrophobicContact CB-CD1 4.34Å; V197-L201 HydrophobicContact CG1-CD1 3.38Å; V197-L201 WeakPolarHBondContact O-CB 3.49Å; V197-L201 WeakPolarHBondContact O-CD1 3.36Å; V197-L201 PolarHBondContact O-N 3.24Å; V197-I354 HydrophobicContact CG2-CG2 4.48Å; V197-V358 HydrophobicContact CG2-CG2 4.07Å
198	Y	88.2	Confident	78.7	Confident	89 Å²	89	69.2 Å²	69.2	35%	0.349	39%	0.387	S	S	.	.	H	α-helix	trans	-60.9	-42.5	178.7	-76.7	-60.5	0	0	0	112.1	Q194 E195 T200 L201 S202 H209	Q194-Y198 HydrophobicContact CB-CD2 3.99Å; Q194-Y198 HydrophobicContact CB-CE2 3.86Å; Q194-Y198 WeakPolarHBondContact O-CD2 3.45Å; Q194-Y198 PolarHBondContact O-N 3.38Å; E195-Y198 PolarHBondContact O-N 2.96Å; Y198-T200 VanDerWaalsContact C-N 3.29Å; Y198-T200 PolarHBondContact O-N 3.3Å; Y198-L201 PolarHBondContact O-N 3.49Å; Y198-S202 WeakPolarHBondContact O-CA 3.29Å; Y198-S202 WeakPolarHBondContact O-CB 3.49Å; Y198-S202 PolarHBondContact O-N 2.74Å; Y198-S202 PolarHBondContact O-OG 3.48Å; Y198-H209 HydrophobicContact CD2-CB 3.92Å; Y198-H209 HydrophobicContact CE2-CB 4.45Å; Y198-H209 HydrophobicContact CG-CB 4.03Å
199	Y	85.3	Confident	77.7	Confident	103 Å²	103	73.9 Å²	73.9	40%	0.404	41%	0.409	S	S	.	.	H	α-helix	trans	-58.2	-40.8	179.7	-177	-90.4	0	0	0	112.7	E195 V197 T210 L213 L217 L328	E195-Y199 WeakPolarHBondContact O-CB 3.34Å; E195-Y199 PolarHBondContact O-N 3.24Å; V197-Y199 VanDerWaalsContact C-N 3.34Å; V197-Y199 PolarHBondContact O-N 3.39Å; Y199-T210 HydrophobicContact CD2-CG2 4.46Å; Y199-L213 HydrophobicContact CD1-CD2 4.31Å; Y199-L213 HydrophobicContact CD2-CD2 3.86Å; Y199-L213 HydrophobicContact CG-CD2 3.64Å; Y199-L217 HydrophobicContact CE1-CD1 4.46Å; Y199-L217 HydrophobicContact CE2-CD1 3.77Å; Y199-L328 HydrophobicContact CD1-CD1 4.07Å; Y199-L328 HydrophobicContact CD1-CD2 4.17Å; Y199-L328 HydrophobicContact CE1-CD1 3.82Å
200	T	80.6	Confident	77.3	Confident	15 Å²	15	69.7 Å²	69.7	9%	0.092	39%	0.393	C	S	.	.	H	α-helix	trans	-82.7	-40.4	-179.8	-57	0	0	0	0	113	L196 V197 Y198 I331 H335	L196-T200 PolarHBondContact O-N 3.03Å; L196-T200 PolarHBondContact O-OG1 2.86Å; V197-T200 PolarHBondContact O-N 3.46Å; Y198-T200 VanDerWaalsContact C-N 3.29Å; Y198-T200 PolarHBondContact O-N 3.3Å; T200-I331 HydrophobicContact CG2-CB 4.41Å; T200-I331 HydrophobicContact CG2-CG2 3.85Å; T200-I331 WeakPolarHBondContact OG1-CG2 3.25Å; T200-H335 HydrophobicContact CG2-CB 3.76Å
201	L	79.6	Confident	77	Confident	64 Å²	64	67.7 Å²	67.7	34%	0.335	38%	0.38	S	S	.	.	H	α-helix	trans	-90	-22.7	-172.7	-75.4	121.3	0	0	0	114	V197 Y198 H335 I354	V197-L201 HydrophobicContact CB-CD1 4.34Å; V197-L201 HydrophobicContact CG1-CD1 3.38Å; V197-L201 WeakPolarHBondContact O-CB 3.49Å; V197-L201 WeakPolarHBondContact O-CD1 3.36Å; V197-L201 PolarHBondContact O-N 3.24Å; Y198-L201 PolarHBondContact O-N 3.49Å; L201-H335 WeakPolarHBondContact CD2-ND1 3.3Å; L201-I354 HydrophobicContact CD1-CD1 4.38Å
202	S	71.3	Confident	76.8	Confident	51 Å²	51	67.9 Å²	67.9	36%	0.357	38%	0.383	S	S	.	.			trans	-108	108	-176.9	-54	0	0	0	0	110.2	Y198 A204	Y198-S202 WeakPolarHBondContact O-CA 3.29Å; Y198-S202 WeakPolarHBondContact O-CB 3.49Å; Y198-S202 PolarHBondContact O-N 2.74Å; Y198-S202 PolarHBondContact O-OG 3.48Å; S202-A204 PolarHBondContact O-N 2.66Å
203	R	55.3	Low	76.8	Confident	214 Å²	214	63.3 Å²	63.3	81%	0.808	36%	0.362	S	S	*	.			trans	-79.7	6	174.1	-68.9	-174	172.9	148.6	-1.4	113.9	P205 E336	R203-P205 WeakPolarHBondContact O-CD 3.19Å; R203-E336 IonicContact NH2-OE1 3.89Å
204	A	54	Low	76.8	Confident	67 Å²	67	62.3 Å²	62.3	55%	0.554	36%	0.363	S	S	*	.			trans	-88	103.7	-179.1	0	0	0	0	0	110.5	S202	S202-A204 PolarHBondContact O-N 2.66Å
205	P	51.7	Low	76.8	Confident	128 Å²	128	57.9 Å²	57.9	83%	0.831	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	145.4	173.2	26.3	-32.7	0	0	0	110.5	R203	R203-P205 WeakPolarHBondContact O-CD 3.19Å
206	G	53.4	Low	76.9	Confident	83 Å²	83	57 Å²	57	86%	0.856	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	2.4	166.6	0	0	0	0	0	117.5	G208	G206-G208 PolarHBondContact O-N 2.84Å; G206-G208 VanDerWaalsContact O-N 3.15Å
207	S	58.2	Low	77	Confident	54 Å²	54	57.8 Å²	57.8	38%	0.378	34%	0.343	S	S	.	.	S	Bend	trans	-72.3	-1.8	177.6	63.6	0	0	0	0	115	H209	S207-H209 VanDerWaalsContact CB-ND1 3.35Å; S207-H209 WeakPolarHBondContact CB-ND1 3.45Å; S207-H209 PolarHBondContact O-N 3.23Å; S207-H209 PolarHBondContact OG-ND1 3.28Å
208	G	66.1	Low	77.2	Confident	44 Å²	44	58.6 Å²	58.6	45%	0.454	34%	0.343	S	S	.	.	S	Bend	trans	69.5	-9.2	-176.2	0	0	0	0	0	114.9	G206 T210 A211	G206-G208 PolarHBondContact O-N 2.84Å; G206-G208 VanDerWaalsContact O-N 3.15Å; G208-T210 PolarHBondContact O-N 3.38Å; G208-T210 VanDerWaalsContact O-N 3.16Å; G208-A211 WeakPolarHBondContact O-CB 3.43Å; G208-A211 PolarHBondContact O-N 3.35Å
209	H	74.2	Confident	77.4	Confident	98 Å²	98	54.3 Å²	54.3	45%	0.454	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-5.2	-175.6	-60.6	143.3	0	0	0	115.4	E195 Y198 S207	E195-H209 VanDerWaalsContact CG-O 3.29Å; E195-H209 WeakPolarHBondContact CG-O 3.43Å; Y198-H209 HydrophobicContact CD2-CB 3.92Å; Y198-H209 HydrophobicContact CE2-CB 4.45Å; Y198-H209 HydrophobicContact CG-CB 4.03Å; S207-H209 VanDerWaalsContact CB-ND1 3.35Å; S207-H209 WeakPolarHBondContact CB-ND1 3.45Å; S207-H209 PolarHBondContact O-N 3.23Å; S207-H209 PolarHBondContact OG-ND1 3.28Å
210	T	82.2	Confident	78	Confident	31 Å²	31	49.6 Å²	49.6	19%	0.19	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	24.1	-178.6	58.8	0	0	0	0	112.2	E195 Y199 G208 S214	E195-T210 WeakPolarHBondContact OE2-CA 3.39Å; Y199-T210 HydrophobicContact CD2-CG2 4.46Å; G208-T210 PolarHBondContact O-N 3.38Å; G208-T210 VanDerWaalsContact O-N 3.16Å; T210-S214 VanDerWaalsContact O-CB 3.29Å; T210-S214 WeakPolarHBondContact O-CB 3.38Å; T210-S214 PolarHBondContact O-N 2.88Å; T210-S214 PolarHBondContact O-OG 3.29Å
211	A	83.7	Confident	78.7	Confident	20 Å²	20	53.1 Å²	53.1	17%	0.165	33%	0.327	C	S	.	.	H	α-helix	trans	-45.7	-64.7	-177	0	0	0	0	0	114.5	E195 G208 S214 V215	E195-A211 PolarHBondContact OE2-N 3.07Å; G208-A211 WeakPolarHBondContact O-CB 3.43Å; G208-A211 PolarHBondContact O-N 3.35Å; A211-S214 PolarHBondContact O-N 2.86Å; A211-V215 WeakPolarHBondContact O-CG2 3.49Å; A211-V215 PolarHBondContact O-N 2.91Å
212	A	87.3	Confident	79.4	Confident	13 Å²	13	50.1 Å²	50.1	11%	0.107	31%	0.311	C	S	.	.	H	α-helix	trans	-70.7	-37.9	-172.6	0	0	0	0	0	110.9	S190 I191 E195 S214 V215 L216	S190-A212 VanDerWaalsContact OG-CB 3.28Å; S190-A212 WeakPolarHBondContact OG-CB 3.41Å; I191-A212 HydrophobicContact CG1-CB 3.94Å; E195-A212 PolarHBondContact OE2-N 2.93Å; A212-S214 VanDerWaalsContact C-N 3.32Å; A212-S214 PolarHBondContact O-N 3.01Å; A212-V215 PolarHBondContact O-N 3.41Å; A212-L216 PolarHBondContact O-N 2.68Å
213	L	90.6	Very high	80.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.8	-44	175.4	-179.6	62.8	0	0	0	111.3	I191 E195 L196 Y199 V215 L216 L217 M324 L328	I191-L213 HydrophobicContact CD1-CB 4.42Å; I191-L213 HydrophobicContact CD1-CD1 3.89Å; I191-L213 HydrophobicContact CG1-CB 4.43Å; I191-L213 HydrophobicContact CG2-CB 4.37Å; E195-L213 HydrophobicContact CB-CB 4.19Å; E195-L213 PolarHBondContact OE2-N 3.36Å; L196-L213 HydrophobicContact CD2-CD1 4.04Å; L196-L213 HydrophobicContact CD2-CD2 4.16Å; Y199-L213 HydrophobicContact CD1-CD2 4.31Å; Y199-L213 HydrophobicContact CD2-CD2 3.86Å; Y199-L213 HydrophobicContact CG-CD2 3.64Å; L213-V215 VanDerWaalsContact C-N 3.32Å; L213-V215 PolarHBondContact O-N 3.35Å; L213-L216 PolarHBondContact O-N 3.4Å; L213-L217 HydrophobicContact CD1-CD1 4.38Å; L213-L217 HydrophobicContact CD1-CG 4.32Å; L213-L217 HydrophobicContact CG-CD1 4.11Å; L213-L217 HydrophobicContact CG-CG 4.45Å; L213-L217 VanDerWaalsContact O-CG 3.32Å; L213-L217 WeakPolarHBondContact O-CG 3.33Å; L213-L217 PolarHBondContact O-N 3.05Å; L213-M324 HydrophobicContact CD1-CE 3.71Å; L213-L328 HydrophobicContact CD1-CD1 4.24Å; L213-L328 HydrophobicContact CD2-CD1 4.4Å; L213-L328 HydrophobicContact CD2-CD2 4.19Å
214	S	89.2	Confident	82.7	Confident	49 Å²	49	39.3 Å²	39.3	34%	0.343	26%	0.264	S	S	.	.	H	α-helix	trans	-63	-40.4	179.6	-56.2	0	0	0	0	111.4	T210 A211 A212 L217 Q218	T210-S214 VanDerWaalsContact O-CB 3.29Å; T210-S214 WeakPolarHBondContact O-CB 3.38Å; T210-S214 PolarHBondContact O-N 2.88Å; T210-S214 PolarHBondContact O-OG 3.29Å; A211-S214 PolarHBondContact O-N 2.86Å; A212-S214 VanDerWaalsContact C-N 3.32Å; A212-S214 PolarHBondContact O-N 3.01Å; S214-L217 PolarHBondContact O-N 3.41Å; S214-Q218 VanDerWaalsContact O-CB 3.32Å; S214-Q218 WeakPolarHBondContact O-CB 3.14Å; S214-Q218 PolarHBondContact O-N 2.75Å
215	V	89.9	Confident	84.8	Confident	16 Å²	16	38 Å²	38	10%	0.097	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-44.8	175.7	174.8	0	0	0	0	111.2	I71 L187 A211 A212 L213 L217 Q218 R219	I71-V215 HydrophobicContact CD1-CG1 3.72Å; I71-V215 HydrophobicContact CG1-CG1 3.96Å; L187-V215 HydrophobicContact CD1-CG1 4.14Å; L187-V215 HydrophobicContact CD2-CB 4.41Å; L187-V215 HydrophobicContact CD2-CG1 3.5Å; L187-V215 VanDerWaalsContact CD2-CG1 3.5Å; L187-V215 HydrophobicContact CG-CG1 4.45Å; A211-V215 WeakPolarHBondContact O-CG2 3.49Å; A211-V215 PolarHBondContact O-N 2.91Å; A212-V215 PolarHBondContact O-N 3.41Å; L213-V215 VanDerWaalsContact C-N 3.32Å; L213-V215 PolarHBondContact O-N 3.35Å; V215-L217 PolarHBondContact O-N 3.23Å; V215-Q218 PolarHBondContact O-N 2.87Å; V215-R219 VanDerWaalsContact O-CB 3.26Å; V215-R219 WeakPolarHBondContact O-CB 3.3Å; V215-R219 PolarHBondContact O-N 3.22Å
216	L	93.3	Very high	87	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-39.9	177.2	-177.2	67.9	0	0	0	112.5	L187 F188 I191 A212 L213 R219 C220 M324	L187-L216 HydrophobicContact CB-CB 4.42Å; L187-L216 HydrophobicContact CB-CD1 3.92Å; L187-L216 HydrophobicContact CD1-CD1 4.48Å; F188-L216 HydrophobicContact CB-CD2 4.12Å; F188-L216 HydrophobicContact CD2-CD2 3.9Å; F188-L216 HydrophobicContact CG-CD2 4.48Å; I191-L216 HydrophobicContact CD1-CB 4.07Å; I191-L216 HydrophobicContact CD1-CD2 3.44Å; I191-L216 VanDerWaalsContact CD1-CD2 3.44Å; I191-L216 HydrophobicContact CD1-CG 4.4Å; A212-L216 PolarHBondContact O-N 2.68Å; L213-L216 PolarHBondContact O-N 3.4Å; L216-R219 WeakPolarHBondContact O-CB 3.26Å; L216-R219 PolarHBondContact O-N 3.27Å; L216-C220 PolarHBondContact O-N 2.9Å; L216-M324 HydrophobicContact CD2-CG 3.73Å
217	L	93.9	Very high	89.2	Confident	20 Å²	20	28.2 Å²	28.2	11%	0.105	17%	0.167	C	C	.	.	H	α-helix	trans	-67.4	-44.2	177	-68.2	175.4	0	0	0	111.7	Y199 L213 S214 V215 R219 C220 N221 M324 P325 L328	Y199-L217 HydrophobicContact CE1-CD1 4.46Å; Y199-L217 HydrophobicContact CE2-CD1 3.77Å; L213-L217 HydrophobicContact CD1-CD1 4.38Å; L213-L217 HydrophobicContact CD1-CG 4.32Å; L213-L217 HydrophobicContact CG-CD1 4.11Å; L213-L217 HydrophobicContact CG-CG 4.45Å; L213-L217 VanDerWaalsContact O-CG 3.32Å; L213-L217 WeakPolarHBondContact O-CG 3.33Å; L213-L217 PolarHBondContact O-N 3.05Å; S214-L217 PolarHBondContact O-N 3.41Å; V215-L217 PolarHBondContact O-N 3.23Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 2.78Å; L217-C220 WeakPolarHBondContact O-CB 3.32Å; L217-C220 PolarHBondContact O-N 3.2Å; L217-N221 PolarHBondContact O-N 3.47Å; L217-M324 HydrophobicContact CD2-CB 4.09Å; L217-P325 HydrophobicContact CD2-CG 4.18Å; L217-L328 HydrophobicContact CD1-CD1 3.68Å; L217-L328 HydrophobicContact CD2-CD1 3.78Å; L217-L328 HydrophobicContact CG-CD1 4.25Å
218	Q	92.8	Very high	91.1	Very high	70 Å²	70	25.7 Å²	25.7	33%	0.327	15%	0.15	S	C	.	.	H	α-helix	trans	-57.1	-46.1	172	178	175.3	-8	0	0	110.1	I71 S214 V215 C220 N221 E222	I71-Q218 HydrophobicContact CD1-CB 4.24Å; I71-Q218 HydrophobicContact CD1-CG 4.02Å; I71-Q218 VanDerWaalsContact CG2-NE2 3.33Å; S214-Q218 VanDerWaalsContact O-CB 3.32Å; S214-Q218 WeakPolarHBondContact O-CB 3.14Å; S214-Q218 PolarHBondContact O-N 2.75Å; V215-Q218 PolarHBondContact O-N 2.87Å; Q218-C220 VanDerWaalsContact C-N 3.32Å; Q218-C220 PolarHBondContact O-N 2.97Å; Q218-N221 WeakPolarHBondContact O-CB 3.25Å; Q218-N221 PolarHBondContact O-N 3.42Å; Q218-E222 HydrophobicContact CG-CG 4.28Å; Q218-E222 PolarHBondContact NE2-OE1 3.13Å; Q218-E222 WeakPolarHBondContact O-CG 3.46Å; Q218-E222 PolarHBondContact O-N 2.9Å
219	R	93.7	Very high	92.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.1	-41.3	179	-176.8	61	-174.3	176.9	3.2	112.9	I71 L187 V215 L216 L217 N221 E222 V223 V385	I71-R219 HydrophobicContact CD1-CB 4.13Å; L187-R219 HydrophobicContact CD1-CB 4.13Å; L187-R219 HydrophobicContact CD1-CG 4.05Å; V215-R219 VanDerWaalsContact O-CB 3.26Å; V215-R219 WeakPolarHBondContact O-CB 3.3Å; V215-R219 PolarHBondContact O-N 3.22Å; L216-R219 WeakPolarHBondContact O-CB 3.26Å; L216-R219 PolarHBondContact O-N 3.27Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 2.78Å; R219-N221 VanDerWaalsContact C-N 3.31Å; R219-N221 PolarHBondContact O-N 3.23Å; R219-E222 IonicContact NH1-OE2 2.75Å; R219-E222 PolarHBondContact O-N 3.11Å; R219-V223 WeakPolarHBondContact O-CG2 3.48Å; R219-V223 PolarHBondContact O-N 3.5Å; R219-V385 PolarHBondContact NH1-O 3.49Å; R219-V385 VanDerWaalsContact NH2-CG1 3.31Å; R219-V385 PolarHBondContact NH2-O 2.68Å
220	C	96.1	Very high	93.6	Very high	4 Å²	4	20.2 Å²	20.2	3%	0.027	11%	0.112	C	C	.	.	H	α-helix	trans	-58.3	-44.7	174.8	-173.8	0	0	0	0	111.5	L216 L217 Q218 Q224 A265	L216-C220 PolarHBondContact O-N 2.9Å; L217-C220 WeakPolarHBondContact O-CB 3.32Å; L217-C220 PolarHBondContact O-N 3.2Å; Q218-C220 VanDerWaalsContact C-N 3.32Å; Q218-C220 PolarHBondContact O-N 2.97Å; C220-Q224 PolarHBondContact O-N 3.3Å; C220-A265 WeakPolarHBondContact O-CB 3.41Å
221	N	95.6	Very high	94.3	Very high	88 Å²	88	18.8 Å²	18.8	47%	0.471	10%	0.103	S	C	.	.	H	α-helix	trans	-65.7	-41.9	176.9	-65.5	-26.2	0	0	0	111.6	L217 Q218 R219 V223 Q224 Q225	L217-N221 PolarHBondContact O-N 3.47Å; Q218-N221 WeakPolarHBondContact O-CB 3.25Å; Q218-N221 PolarHBondContact O-N 3.42Å; R219-N221 VanDerWaalsContact C-N 3.31Å; R219-N221 PolarHBondContact O-N 3.23Å; N221-V223 PolarHBondContact O-N 2.66Å; N221-Q224 WeakPolarHBondContact O-CB 3.48Å; N221-Q224 PolarHBondContact O-N 2.86Å; N221-Q225 WeakPolarHBondContact O-CG 3.31Å; N221-Q225 PolarHBondContact O-N 3.46Å
222	E	96.1	Very high	95	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-63.7	-40.1	178.6	-74	-174.1	155.3	0	0	112.8	I71 S83 Q218 R219 Q224 Q225 W226 L388 I390	I71-E222 WeakPolarHBondContact CG2-OE1 3.27Å; S83-E222 VanDerWaalsContact CB-OE1 3.25Å; S83-E222 WeakPolarHBondContact CB-OE1 3.47Å; S83-E222 PolarHBondContact OG-OE1 2.89Å; S83-E222 PolarHBondContact OG-OE2 3.04Å; Q218-E222 HydrophobicContact CG-CG 4.28Å; Q218-E222 PolarHBondContact NE2-OE1 3.13Å; Q218-E222 WeakPolarHBondContact O-CG 3.46Å; Q218-E222 PolarHBondContact O-N 2.9Å; R219-E222 IonicContact NH1-OE2 2.75Å; R219-E222 PolarHBondContact O-N 3.11Å; E222-Q224 VanDerWaalsContact C-N 3.32Å; E222-Q224 PolarHBondContact O-N 2.96Å; E222-Q225 PolarHBondContact O-N 3.49Å; E222-W226 WeakPolarHBondContact O-CB 3.12Å; E222-W226 PolarHBondContact O-N 3.31Å; E222-L388 HydrophobicContact CB-CD1 4.29Å; E222-I390 HydrophobicContact CB-CD1 3.56Å; E222-I390 HydrophobicContact CG-CD1 3.65Å
223	V	97.9	Very high	95.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.9	-40.4	175.2	171.8	0	0	0	0	110.6	L180 R219 N221 W226 V227 A265 I266 L388	L180-V223 HydrophobicContact CD2-CG2 3.99Å; R219-V223 WeakPolarHBondContact O-CG2 3.48Å; R219-V223 PolarHBondContact O-N 3.5Å; N221-V223 PolarHBondContact O-N 2.66Å; V223-W226 HydrophobicContact CG1-CE3 4.29Å; V223-V227 VanDerWaalsContact O-CG2 3.24Å; V223-V227 WeakPolarHBondContact O-CG2 3.18Å; V223-V227 PolarHBondContact O-N 2.71Å; V223-A265 HydrophobicContact CB-CB 3.93Å; V223-A265 HydrophobicContact CG1-CB 3.73Å; V223-I266 HydrophobicContact CG1-CG1 3.89Å; V223-L388 HydrophobicContact CG2-CD1 4.49Å
224	Q	97.8	Very high	95.6	Very high	38 Å²	38	17.9 Å²	17.9	18%	0.178	9%	0.094	C	C	.	.	H	α-helix	trans	-60.8	-48.6	173.6	-179	-173.7	-18.3	0	0	111.2	C220 N221 E222 V227 M228 A265 M268	C220-Q224 PolarHBondContact O-N 3.3Å; N221-Q224 WeakPolarHBondContact O-CB 3.48Å; N221-Q224 PolarHBondContact O-N 2.86Å; E222-Q224 VanDerWaalsContact C-N 3.32Å; E222-Q224 PolarHBondContact O-N 2.96Å; Q224-V227 PolarHBondContact O-N 3.49Å; Q224-M228 HydrophobicContact CG-CE 4.43Å; Q224-M228 PolarHBondContact O-N 3.21Å; Q224-A265 WeakPolarHBondContact CA-O 3.34Å; Q224-A265 HydrophobicContact CB-CB 4.44Å; Q224-M268 HydrophobicContact CG-CB 4.18Å
225	Q	97.6	Very high	95.9	Very high	39 Å²	39	20.3 Å²	20.3	18%	0.182	10%	0.102	C	C	.	.	H	α-helix	trans	-68.7	-35.5	-179	-65.8	172.7	-21.8	0	0	112.9	Y81 N221 E222 V227 M228 S229 I390	Y81-Q225 PolarHBondContact OH-OE1 3.22Å; N221-Q225 WeakPolarHBondContact O-CG 3.31Å; N221-Q225 PolarHBondContact O-N 3.46Å; E222-Q225 PolarHBondContact O-N 3.49Å; Q225-V227 VanDerWaalsContact C-N 3.34Å; Q225-V227 PolarHBondContact O-N 3.09Å; Q225-M228 HydrophobicContact CB-CE 4.07Å; Q225-M228 HydrophobicContact CG-CE 3.75Å; Q225-M228 PolarHBondContact O-N 2.85Å; Q225-S229 VanDerWaalsContact O-CB 3.3Å; Q225-S229 WeakPolarHBondContact O-CB 3.3Å; Q225-S229 PolarHBondContact O-N 3.19Å; Q225-S229 PolarHBondContact O-OG 3.38Å; Q225-I390 HydrophobicContact CB-CG2 3.52Å; Q225-I390 HydrophobicContact CG-CG2 4.4Å
226	W	97.8	Very high	96.1	Very high	7 Å²	7	22.1 Å²	22.1	3%	0.027	12%	0.115	C	C	.	.	H	α-helix	trans	-59.6	-44.1	173.9	166.3	59.4	0	0	0	111.9	L168 V176 L180 E222 V223 M228 S229 E230 F247 L388 I390	L168-W226 HydrophobicContact CD1-CH2 4.32Å; L168-W226 HydrophobicContact CD1-CZ2 3.99Å; L168-W226 HydrophobicContact CD2-CH2 4.19Å; L168-W226 HydrophobicContact CD2-CZ2 3.71Å; L168-W226 HydrophobicContact CG-CZ2 4.48Å; V176-W226 HydrophobicContact CG1-CH2 4.25Å; L180-W226 HydrophobicContact CD1-CZ3 4.33Å; E222-W226 WeakPolarHBondContact O-CB 3.12Å; E222-W226 PolarHBondContact O-N 3.31Å; V223-W226 HydrophobicContact CG1-CE3 4.29Å; W226-M228 VanDerWaalsContact C-N 3.34Å; W226-M228 PolarHBondContact O-N 2.98Å; W226-S229 PolarHBondContact O-N 3.41Å; W226-E230 HydrophobicContact CG-CG 4.47Å; W226-E230 VanDerWaalsContact NE1-CG 3.29Å; W226-E230 WeakPolarHBondContact O-CB 3.38Å; W226-E230 WeakPolarHBondContact O-CG 3.43Å; W226-E230 PolarHBondContact O-N 2.84Å; W226-F247 HydrophobicContact CD2-CE1 4.36Å; W226-F247 HydrophobicContact CE3-CE1 4.06Å; W226-F247 AromaticContact CH2-CE1 3.62Å; W226-F247 HydrophobicContact CH2-CE1 3.62Å; W226-F247 HydrophobicContact CH2-CZ 4.42Å; W226-F247 AromaticContact CZ2-CE1 3.91Å; W226-F247 HydrophobicContact CZ2-CE1 3.91Å; W226-F247 HydrophobicContact CZ2-CZ 4.27Å; W226-F247 HydrophobicContact CZ3-CD1 4.46Å; W226-F247 AromaticContact CZ3-CE1 3.69Å; W226-F247 HydrophobicContact CZ3-CE1 3.69Å; W226-L388 HydrophobicContact CB-CB 4.31Å; W226-L388 HydrophobicContact CB-CD1 3.93Å; W226-L388 HydrophobicContact CB-CG 4.49Å; W226-L388 HydrophobicContact CD2-CD2 3.91Å; W226-L388 HydrophobicContact CG-CB 4.31Å; W226-L388 HydrophobicContact CG-CD1 4.15Å; W226-L388 HydrophobicContact CG-CD2 3.87Å; W226-L388 HydrophobicContact CG-CG 4.34Å; W226-I390 HydrophobicContact CB-CG1 4.36Å
227	V	98.4	Very high	96.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.9	-46.5	176.5	171.1	0	0	0	0	110.8	V223 Q224 Q225 V231 F247 I266 L270	V223-V227 VanDerWaalsContact O-CG2 3.24Å; V223-V227 WeakPolarHBondContact O-CG2 3.18Å; V223-V227 PolarHBondContact O-N 2.71Å; Q224-V227 PolarHBondContact O-N 3.49Å; Q225-V227 VanDerWaalsContact C-N 3.34Å; Q225-V227 PolarHBondContact O-N 3.09Å; V227-V231 VanDerWaalsContact O-CG2 3.29Å; V227-V231 WeakPolarHBondContact O-CG2 3.4Å; V227-V231 PolarHBondContact O-N 3.39Å; V227-F247 HydrophobicContact CB-CE1 4.37Å; V227-F247 HydrophobicContact CB-CZ 4.44Å; V227-F247 HydrophobicContact CG1-CD1 4.37Å; V227-F247 HydrophobicContact CG1-CD2 4.15Å; V227-F247 HydrophobicContact CG1-CE2 4.38Å; V227-F247 HydrophobicContact CG1-CG 4.15Å; V227-F247 HydrophobicContact CG2-CD1 3.73Å; V227-F247 HydrophobicContact CG2-CE1 3.65Å; V227-F247 HydrophobicContact CG2-CG 4.33Å; V227-F247 HydrophobicContact CG2-CZ 4.19Å; V227-I266 HydrophobicContact CG2-CB 4.25Å; V227-I266 HydrophobicContact CG2-CG1 3.95Å; V227-I266 HydrophobicContact CG2-CG2 4.09Å; V227-L270 HydrophobicContact CG1-CD2 3.75Å; V227-L270 HydrophobicContact CG1-CG 3.87Å
228	M	98	Very high	96.4	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-60.5	-47.8	175.7	-62.4	-173.3	-73.7	0	0	111.3	Q224 Q225 W226 V231 L232 G269 T272 V275 L397	Q224-M228 HydrophobicContact CG-CE 4.43Å; Q224-M228 PolarHBondContact O-N 3.21Å; Q225-M228 HydrophobicContact CB-CE 4.07Å; Q225-M228 HydrophobicContact CG-CE 3.75Å; Q225-M228 PolarHBondContact O-N 2.85Å; W226-M228 VanDerWaalsContact C-N 3.34Å; W226-M228 PolarHBondContact O-N 2.98Å; M228-V231 PolarHBondContact O-N 2.86Å; M228-L232 HydrophobicContact CB-CD1 4.41Å; M228-L232 VanDerWaalsContact O-CB 3.32Å; M228-L232 WeakPolarHBondContact O-CB 3.38Å; M228-L232 WeakPolarHBondContact O-CD1 3.43Å; M228-L232 VanDerWaalsContact O-CG 3.26Å; M228-L232 WeakPolarHBondContact O-CG 3.45Å; M228-L232 PolarHBondContact O-N 3.35Å; M228-G269 WeakPolarHBondContact CG-O 3.4Å; M228-T272 WeakPolarHBondContact SD-CB 3.48Å; M228-T272 HydrophobicContact SD-CG2 3.46Å; M228-T272 WeakPolarHBondContact SD-CG2 3.29Å; M228-T272 PolarHBondContact SD-OG1 3.05Å; M228-T272 VanDerWaalsContact SD-OG1 3.36Å; M228-V275 HydrophobicContact CB-CG2 4.32Å; M228-V275 HydrophobicContact CG-CG2 4.17Å; M228-L397 HydrophobicContact CB-CD2 4.06Å; M228-L397 HydrophobicContact CE-CD1 3.98Å; M228-L397 HydrophobicContact SD-CD1 4.11Å
229	S	97.1	Very high	96.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-50.1	-176.3	-56.1	0	0	0	0	111.4	Q225 W226 V231 L232 M233 H389 I391	Q225-S229 VanDerWaalsContact O-CB 3.3Å; Q225-S229 WeakPolarHBondContact O-CB 3.3Å; Q225-S229 PolarHBondContact O-N 3.19Å; Q225-S229 PolarHBondContact O-OG 3.38Å; W226-S229 PolarHBondContact O-N 3.41Å; S229-V231 VanDerWaalsContact C-N 3.33Å; S229-V231 PolarHBondContact O-N 3.13Å; S229-L232 PolarHBondContact O-N 2.87Å; S229-M233 VanDerWaalsContact O-CB 3.29Å; S229-M233 WeakPolarHBondContact O-CB 3.38Å; S229-M233 WeakPolarHBondContact O-CE 3.34Å; S229-M233 VanDerWaalsContact O-CG 3.25Å; S229-M233 WeakPolarHBondContact O-CG 3.49Å; S229-M233 PolarHBondContact O-N 2.9Å; S229-H389 WeakPolarHBondContact CB-O 3.42Å; S229-I391 PolarHBondContact OG-N 3.48Å
230	E	96.9	Very high	96.9	Very high	27 Å²	27	29.4 Å²	29.4	13%	0.126	15%	0.151	C	C	.	.	H	α-helix	trans	-61.8	-39.2	179.2	-75.7	-70	126.9	0	0	112.4	R164 W226 C234 L243 F247	R164-E230 IonicContact NH2-OE1 2.92Å; W226-E230 HydrophobicContact CG-CG 4.47Å; W226-E230 VanDerWaalsContact NE1-CG 3.29Å; W226-E230 WeakPolarHBondContact O-CB 3.38Å; W226-E230 WeakPolarHBondContact O-CG 3.43Å; W226-E230 PolarHBondContact O-N 2.84Å; E230-C234 WeakPolarHBondContact O-CB 3.04Å; E230-C234 PolarHBondContact O-N 3.33Å; E230-L243 WeakPolarHBondContact O-CD1 3.18Å; E230-F247 HydrophobicContact CB-CE2 3.95Å; E230-F247 HydrophobicContact CB-CZ 3.81Å; E230-F247 HydrophobicContact CG-CZ 4.19Å
231	V	97.8	Very high	97	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.8	-44.5	177.3	172.6	0	0	0	0	111.1	V227 M228 S229 C234 R240 F247 V275 L278	V227-V231 VanDerWaalsContact O-CG2 3.29Å; V227-V231 WeakPolarHBondContact O-CG2 3.4Å; V227-V231 PolarHBondContact O-N 3.39Å; M228-V231 PolarHBondContact O-N 2.86Å; S229-V231 VanDerWaalsContact C-N 3.33Å; S229-V231 PolarHBondContact O-N 3.13Å; V231-C234 PolarHBondContact O-N 3.21Å; V231-R240 HydrophobicContact CG1-CG 3.98Å; V231-R240 VanDerWaalsContact O-CD 3.3Å; V231-R240 WeakPolarHBondContact O-CD 3.47Å; V231-F247 HydrophobicContact CG2-CD2 4.07Å; V231-F247 HydrophobicContact CG2-CE2 3.99Å; V231-V275 HydrophobicContact CG1-CG1 4.12Å; V231-V275 HydrophobicContact CG1-CG2 4.42Å; V231-L278 HydrophobicContact CG1-CD1 3.86Å
232	L	96.9	Very high	97.1	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-81.4	-23.1	-173.1	-67.7	166.8	0	0	0	113.7	M228 S229 C234 A274 V275 L278 L397 L400 L404	M228-L232 HydrophobicContact CB-CD1 4.41Å; M228-L232 VanDerWaalsContact O-CB 3.32Å; M228-L232 WeakPolarHBondContact O-CB 3.38Å; M228-L232 WeakPolarHBondContact O-CD1 3.43Å; M228-L232 VanDerWaalsContact O-CG 3.26Å; M228-L232 WeakPolarHBondContact O-CG 3.45Å; M228-L232 PolarHBondContact O-N 3.35Å; S229-L232 PolarHBondContact O-N 2.87Å; L232-C234 VanDerWaalsContact C-N 3.29Å; L232-A274 HydrophobicContact CD1-CB 3.9Å; L232-V275 HydrophobicContact CD1-CG2 4.43Å; L232-V275 HydrophobicContact CG-CG2 4.49Å; L232-L278 HydrophobicContact CD2-CD1 4.23Å; L232-L397 HydrophobicContact CD1-CB 3.93Å; L232-L397 HydrophobicContact CD1-CD2 3.48Å; L232-L397 VanDerWaalsContact CD1-CD2 3.48Å; L232-L397 HydrophobicContact CD1-CG 4.33Å; L232-L400 HydrophobicContact CB-CB 4.27Å; L232-L404 HydrophobicContact CD2-CD1 4.13Å; L232-L404 WeakPolarHBondContact O-CD1 3.44Å
233	M	95	Very high	97.2	Very high	7 Å²	7	30.2 Å²	30.2	3%	0.034	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.7	169.4	-67.7	-175	-65.2	0	0	112.6	L155 L161 R164 S229 M235 H389 I391	L155-M233 HydrophobicContact CD1-CG 4.5Å; L155-M233 HydrophobicContact CD1-SD 3.92Å; L161-M233 HydrophobicContact CD2-CB 4.07Å; L161-M233 HydrophobicContact CD2-CG 4.08Å; L161-M233 HydrophobicContact CD2-SD 4.37Å; R164-M233 PolarHBondContact NH1-SD 2.87Å; S229-M233 VanDerWaalsContact O-CB 3.29Å; S229-M233 WeakPolarHBondContact O-CB 3.38Å; S229-M233 WeakPolarHBondContact O-CE 3.34Å; S229-M233 VanDerWaalsContact O-CG 3.25Å; S229-M233 WeakPolarHBondContact O-CG 3.49Å; S229-M233 PolarHBondContact O-N 2.9Å; M233-M235 PolarHBondContact O-N 3.12Å; M233-H389 HydrophobicContact CE-CB 4.41Å; M233-I391 HydrophobicContact CG-CD1 3.92Å; M233-I391 HydrophobicContact SD-CD1 4.19Å; M233-I391 HydrophobicContact SD-CG1 4.47Å
234	C	95.9	Very high	97.3	Very high	6 Å²	6	30.2 Å²	30.2	4%	0.041	15%	0.153	C	C	.	.			trans	-86.6	91	-179.2	-176.6	0	0	0	0	112.4	E230 V231 L232 S236 K239 R240 L243	E230-C234 WeakPolarHBondContact O-CB 3.04Å; E230-C234 PolarHBondContact O-N 3.33Å; V231-C234 PolarHBondContact O-N 3.21Å; L232-C234 VanDerWaalsContact C-N 3.29Å; C234-S236 PolarHBondContact O-N 3.32Å; C234-K239 VanDerWaalsContact SG-CB 3.58Å; C234-R240 HydrophobicContact CB-CB 4.26Å; C234-R240 HydrophobicContact CB-CG 4.38Å; C234-R240 PolarHBondContact O-NH1 3.19Å; C234-R240 PolarHBondContact SG-N 3.47Å; C234-R240 VanDerWaalsContact SG-N 3.36Å; C234-L243 HydrophobicContact CB-CD1 3.57Å
235	M	94.6	Very high	97.3	Very high	100 Å²	100	31.4 Å²	31.4	49%	0.493	16%	0.157	S	C	.	.			trans	-62.4	-38.7	-177.3	-58.3	-159.8	80.9	0	0	113.9	L161 S162 M233 L237 R240	L161-M235 HydrophobicContact CB-CG 4.2Å; L161-M235 HydrophobicContact CB-SD 3.91Å; S162-M235 WeakPolarHBondContact CA-SD 3.48Å; S162-M235 PolarHBondContact N-SD 2.87Å; M233-M235 PolarHBondContact O-N 3.12Å; M235-L237 PolarHBondContact O-N 3.38Å; M235-R240 PolarHBondContact O-NH1 3.09Å; M235-R240 VanDerWaalsContact O-NH1 3.09Å
236	S	95.4	Very high	97.3	Very high	54 Å²	54	30.6 Å²	30.6	38%	0.378	15%	0.153	S	C	.	.			trans	-71.5	117.3	-179.9	176.7	0	0	0	0	111.8	C234 N238 K239 R240	C234-S236 PolarHBondContact O-N 3.32Å; S236-N238 VanDerWaalsContact C-N 3.32Å; S236-N238 PolarHBondContact O-N 3.39Å; S236-K239 PolarHBondContact O-N 3.5Å; S236-R240 WeakPolarHBondContact O-CB 3.46Å; S236-R240 PolarHBondContact O-N 2.82Å
237	L	96.8	Very high	97.4	Very high	34 Å²	34	30.2 Å²	30.2	18%	0.178	15%	0.152	C	C	.	.	H	α-helix	trans	-53.3	-45.9	177.6	175.6	60.1	0	0	0	112.5	M235 K239 R240 V241 Q280 T281 K284	M235-L237 PolarHBondContact O-N 3.38Å; L237-K239 PolarHBondContact O-N 3.28Å; L237-R240 PolarHBondContact O-N 3.49Å; L237-V241 HydrophobicContact CD1-CG2 4.23Å; L237-V241 WeakPolarHBondContact O-CG2 3.23Å; L237-V241 PolarHBondContact O-N 2.91Å; L237-Q280 HydrophobicContact CD1-CB 4.49Å; L237-T281 WeakPolarHBondContact CD1-OG1 3.4Å; L237-K284 HydrophobicContact CD2-CD 3.85Å; L237-K284 VanDerWaalsContact CD2-NZ 3.35Å; L237-K284 HydrophobicContact CG-CD 4.22Å
238	N	97.1	Very high	97.4	Very high	108 Å²	108	30.2 Å²	30.2	58%	0.578	15%	0.152	S	C	*	.	H	α-helix	trans	-63.4	-43.1	-179.4	-71.6	-18.1	0	0	0	112.1	S236 R240 Q242	S236-N238 VanDerWaalsContact C-N 3.32Å; S236-N238 PolarHBondContact O-N 3.39Å; N238-R240 VanDerWaalsContact C-N 3.35Å; N238-Q242 WeakPolarHBondContact O-CG 3.45Å; N238-Q242 PolarHBondContact O-N 2.57Å
239	K	97.6	Very high	97.5	Very high	97 Å²	97	34.4 Å²	34.4	42%	0.422	17%	0.17	S	C	.	.	H	α-helix	trans	-67.6	-36.7	175.5	-66.7	-176.5	-179.4	176.5	0	111.2	V166 L169 C234 S236 L237 Q242 L243	V166-K239 HydrophobicContact CG2-CB 4.45Å; V166-K239 HydrophobicContact CG2-CD 4.01Å; L169-K239 HydrophobicContact CD1-CB 4.14Å; L169-K239 HydrophobicContact CD1-CG 4.41Å; C234-K239 VanDerWaalsContact SG-CB 3.58Å; S236-K239 PolarHBondContact O-N 3.5Å; L237-K239 PolarHBondContact O-N 3.28Å; K239-Q242 CarbonylContact O-C 3.28Å; K239-Q242 WeakPolarHBondContact O-CA 3.37Å; K239-Q242 WeakPolarHBondContact O-CB 3.48Å; K239-Q242 PolarHBondContact O-N 3.4Å; K239-Q242 VanDerWaalsContact O-N 3.1Å; K239-L243 PolarHBondContact O-N 3.01Å
240	R	98.1	Very high	97.5	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.015	17%	0.17	C	C	.	.	H	α-helix	trans	-65.2	-41	178.1	-166	169.9	57	-112.7	10.8	112.2	V231 C234 M235 S236 L237 N238 Q242 L243 L244 T281 E405	V231-R240 HydrophobicContact CG1-CG 3.98Å; V231-R240 VanDerWaalsContact O-CD 3.3Å; V231-R240 WeakPolarHBondContact O-CD 3.47Å; C234-R240 HydrophobicContact CB-CB 4.26Å; C234-R240 HydrophobicContact CB-CG 4.38Å; C234-R240 PolarHBondContact O-NH1 3.19Å; C234-R240 PolarHBondContact SG-N 3.47Å; C234-R240 VanDerWaalsContact SG-N 3.36Å; M235-R240 PolarHBondContact O-NH1 3.09Å; M235-R240 VanDerWaalsContact O-NH1 3.09Å; S236-R240 WeakPolarHBondContact O-CB 3.46Å; S236-R240 PolarHBondContact O-N 2.82Å; L237-R240 PolarHBondContact O-N 3.49Å; N238-R240 VanDerWaalsContact C-N 3.35Å; R240-Q242 VanDerWaalsContact C-N 3.3Å; R240-Q242 PolarHBondContact O-N 3.45Å; R240-L243 WeakPolarHBondContact O-CB 3.48Å; R240-L243 PolarHBondContact O-N 2.99Å; R240-L244 PolarHBondContact O-N 3.29Å; R240-T281 HydrophobicContact CB-CG2 4.41Å; R240-T281 HydrophobicContact CG-CG2 3.96Å; R240-T281 PolarHBondContact NE-OG1 2.83Å; R240-T281 PolarHBondContact NH2-OG1 3.14Å; R240-E405 IonicContact CZ-OE1 3.68Å; R240-E405 IonicContact NE-OE1 2.72Å; R240-E405 IonicContact NH2-OE1 3.47Å; R240-E405 PolarHBondContact NH2-OE1 2.9Å
241	V	98.6	Very high	97.6	Very high	14 Å²	14	33.2 Å²	33.2	9%	0.085	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-39.6	170.5	174.2	0	0	0	0	111.2	L237 L244 K245 T281 K284	L237-V241 HydrophobicContact CD1-CG2 4.23Å; L237-V241 WeakPolarHBondContact O-CG2 3.23Å; L237-V241 PolarHBondContact O-N 2.91Å; V241-L244 PolarHBondContact O-N 3.35Å; V241-K245 HydrophobicContact CG1-CD 4.24Å; V241-K245 WeakPolarHBondContact O-CD 3.38Å; V241-K245 VanDerWaalsContact O-CG 3.32Å; V241-K245 WeakPolarHBondContact O-CG 3.39Å; V241-K245 PolarHBondContact O-N 3.28Å; V241-K245 VanDerWaalsContact O-N 3.12Å; V241-T281 HydrophobicContact CG2-CG2 3.97Å; V241-K284 HydrophobicContact CG2-CB 3.81Å
242	Q	98.5	Very high	97.7	Very high	96 Å²	96	34.4 Å²	34.4	45%	0.449	17%	0.174	S	C	.	.	H	α-helix	trans	-65.9	-39.8	175.4	-66.8	176.2	26	0	0	112.2	L169 N238 K239 R240 K245 K246	L169-Q242 HydrophobicContact CD1-CB 4.12Å; L169-Q242 HydrophobicContact CD2-CB 3.72Å; N238-Q242 WeakPolarHBondContact O-CG 3.45Å; N238-Q242 PolarHBondContact O-N 2.57Å; K239-Q242 CarbonylContact O-C 3.28Å; K239-Q242 WeakPolarHBondContact O-CA 3.37Å; K239-Q242 WeakPolarHBondContact O-CB 3.48Å; K239-Q242 PolarHBondContact O-N 3.4Å; K239-Q242 VanDerWaalsContact O-N 3.1Å; R240-Q242 VanDerWaalsContact C-N 3.3Å; R240-Q242 PolarHBondContact O-N 3.45Å; Q242-K245 PolarHBondContact O-N 3.49Å; Q242-K246 WeakPolarHBondContact O-CB 3.2Å; Q242-K246 PolarHBondContact O-N 3.38Å
243	L	98.3	Very high	97.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-43.8	174.4	-82.9	176.2	0	0	0	111.7	V166 L168 L169 E230 C234 K239 R240 K245 K246 F247	V166-L243 HydrophobicContact CG1-CD1 3.63Å; V166-L243 HydrophobicContact CG1-CD2 3.56Å; V166-L243 HydrophobicContact CG1-CG 3.69Å; L168-L243 HydrophobicContact CB-CD2 4.3Å; L168-L243 HydrophobicContact CD2-CD2 4.02Å; L168-L243 HydrophobicContact CG-CD2 4.48Å; L169-L243 HydrophobicContact CD2-CD2 3.92Å; L169-L243 HydrophobicContact CD2-CG 4.09Å; L169-L243 HydrophobicContact CG-CD2 4.1Å; L169-L243 HydrophobicContact CG-CG 4.3Å; E230-L243 WeakPolarHBondContact O-CD1 3.18Å; C234-L243 HydrophobicContact CB-CD1 3.57Å; K239-L243 PolarHBondContact O-N 3.01Å; R240-L243 WeakPolarHBondContact O-CB 3.48Å; R240-L243 PolarHBondContact O-N 2.99Å; L243-K245 PolarHBondContact O-N 3.23Å; L243-K246 CarbonylContact O-C 3.44Å; L243-K246 WeakPolarHBondContact O-CA 3.42Å; L243-K246 WeakPolarHBondContact O-CB 3.12Å; L243-K246 PolarHBondContact O-N 2.77Å; L243-F247 HydrophobicContact CD2-CE2 4.34Å; L243-F247 VanDerWaalsContact O-CD2 3.29Å; L243-F247 WeakPolarHBondContact O-CD2 3.43Å; L243-F247 PolarHBondContact O-N 2.9Å
244	L	98.4	Very high	97.9	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-59.5	-47.3	177.3	-170.7	136.3	0	0	0	111.3	R240 V241 K246 F247 I248 T281 W282 C285	R240-L244 PolarHBondContact O-N 3.29Å; V241-L244 PolarHBondContact O-N 3.35Å; L244-K246 VanDerWaalsContact C-N 3.26Å; L244-K246 PolarHBondContact O-N 2.97Å; L244-F247 PolarHBondContact O-N 3.45Å; L244-I248 HydrophobicContact CD2-CD1 3.59Å; L244-I248 HydrophobicContact CG-CD1 4.29Å; L244-I248 WeakPolarHBondContact O-CD1 3.37Å; L244-I248 VanDerWaalsContact O-CG1 3.25Å; L244-I248 WeakPolarHBondContact O-CG1 2.7Å; L244-I248 PolarHBondContact O-N 3.46Å; L244-I248 VanDerWaalsContact O-N 3.07Å; L244-T281 HydrophobicContact CD1-CG2 4.18Å; L244-W282 HydrophobicContact CD1-CD2 3.7Å; L244-W282 HydrophobicContact CD1-CE3 3.84Å; L244-W282 HydrophobicContact CD1-CG 4.44Å; L244-W282 HydrophobicContact CD1-CH2 3.77Å; L244-W282 HydrophobicContact CD1-CZ2 3.6Å; L244-W282 HydrophobicContact CD1-CZ3 3.88Å; L244-W282 HydrophobicContact CD2-CD2 4.49Å; L244-W282 HydrophobicContact CD2-CE3 3.82Å; L244-W282 HydrophobicContact CD2-CH2 4.19Å; L244-W282 HydrophobicContact CD2-CZ3 3.66Å; L244-W282 HydrophobicContact CG-CE3 4.39Å; L244-W282 HydrophobicContact CG-CH2 4.15Å; L244-W282 HydrophobicContact CG-CZ2 4.45Å; L244-W282 HydrophobicContact CG-CZ3 4.12Å; L244-C285 HydrophobicContact CD2-CB 3.86Å; L244-C285 WeakPolarHBondContact CD2-SG 3.33Å
245	K	98.6	Very high	98	Very high	62 Å²	62	40.2 Å²	40.2	27%	0.27	20%	0.199	S	C	.	.	H	α-helix	trans	-59.7	-37.8	172.1	-66.1	161.9	57.9	-171.4	0	112.2	V241 Q242 L243 K249 P286 F289	V241-K245 HydrophobicContact CG1-CD 4.24Å; V241-K245 WeakPolarHBondContact O-CD 3.38Å; V241-K245 VanDerWaalsContact O-CG 3.32Å; V241-K245 WeakPolarHBondContact O-CG 3.39Å; V241-K245 PolarHBondContact O-N 3.28Å; V241-K245 VanDerWaalsContact O-N 3.12Å; Q242-K245 PolarHBondContact O-N 3.49Å; L243-K245 PolarHBondContact O-N 3.23Å; K245-K249 WeakPolarHBondContact O-CG 3.41Å; K245-K249 PolarHBondContact O-N 3.26Å; K245-K249 VanDerWaalsContact O-N 3.15Å; K245-P286 HydrophobicContact CD-CG 4.39Å; K245-F289 HydrophobicContact CB-CD1 4.31Å; K245-F289 HydrophobicContact CB-CD2 4.4Å; K245-F289 HydrophobicContact CB-CE1 4.41Å; K245-F289 HydrophobicContact CB-CE2 4.49Å; K245-F289 HydrophobicContact CB-CG 4.31Å; K245-F289 HydrophobicContact CB-CZ 4.49Å; K245-F289 HydrophobicContact CD-CD2 4.1Å; K245-F289 HydrophobicContact CD-CE2 4.12Å; K245-F289 HydrophobicContact CG-CB 4.36Å; K245-F289 HydrophobicContact CG-CD1 4.38Å; K245-F289 HydrophobicContact CG-CD2 3.71Å; K245-F289 HydrophobicContact CG-CE2 4.06Å; K245-F289 HydrophobicContact CG-CG 3.89Å
246	K	98.6	Very high	98.1	Very high	22 Å²	22	38.9 Å²	38.9	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-52.9	179.9	-170.4	71.5	174.3	-177.7	0	110.3	L168 L169 I171 T173 Q242 L243 L244 I248 K249 I250	L168-K246 HydrophobicContact CG-CG 4.39Å; L168-K246 WeakPolarHBondContact O-CE 3.46Å; L169-K246 HydrophobicContact CD2-CB 4.39Å; I171-K246 WeakPolarHBondContact O-CE 3.38Å; I171-K246 PolarHBondContact O-NZ 2.66Å; T173-K246 VanDerWaalsContact N-NZ 3.16Å; T173-K246 WeakPolarHBondContact OG1-CD 3.46Å; T173-K246 WeakPolarHBondContact OG1-CE 3.39Å; T173-K246 PolarHBondContact OG1-NZ 3.13Å; Q242-K246 WeakPolarHBondContact O-CB 3.2Å; Q242-K246 PolarHBondContact O-N 3.38Å; L243-K246 CarbonylContact O-C 3.44Å; L243-K246 WeakPolarHBondContact O-CA 3.42Å; L243-K246 WeakPolarHBondContact O-CB 3.12Å; L243-K246 PolarHBondContact O-N 2.77Å; L244-K246 VanDerWaalsContact C-N 3.26Å; L244-K246 PolarHBondContact O-N 2.97Å; K246-I248 PolarHBondContact O-N 3.34Å; K246-K249 PolarHBondContact O-N 3.36Å; K246-I250 HydrophobicContact CG-CD1 4.06Å; K246-I250 WeakPolarHBondContact O-CG1 3.42Å; K246-I250 PolarHBondContact O-N 2.63Å
247	F	98.8	Very high	98.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-41.8	179.4	-75.5	-58.5	0	0	0	113.1	L168 W226 V227 E230 V231 L243 L244 K249 I250 A251 I266 L270	L168-F247 HydrophobicContact CD2-CD1 4.5Å; L168-F247 HydrophobicContact CD2-CE1 3.66Å; L168-F247 HydrophobicContact CD2-CE2 4.16Å; L168-F247 HydrophobicContact CD2-CZ 3.46Å; L168-F247 VanDerWaalsContact CD2-CZ 3.46Å; W226-F247 HydrophobicContact CD2-CE1 4.36Å; W226-F247 HydrophobicContact CE3-CE1 4.06Å; W226-F247 AromaticContact CH2-CE1 3.62Å; W226-F247 HydrophobicContact CH2-CE1 3.62Å; W226-F247 HydrophobicContact CH2-CZ 4.42Å; W226-F247 AromaticContact CZ2-CE1 3.91Å; W226-F247 HydrophobicContact CZ2-CE1 3.91Å; W226-F247 HydrophobicContact CZ2-CZ 4.27Å; W226-F247 HydrophobicContact CZ3-CD1 4.46Å; W226-F247 AromaticContact CZ3-CE1 3.69Å; W226-F247 HydrophobicContact CZ3-CE1 3.69Å; V227-F247 HydrophobicContact CB-CE1 4.37Å; V227-F247 HydrophobicContact CB-CZ 4.44Å; V227-F247 HydrophobicContact CG1-CD1 4.37Å; V227-F247 HydrophobicContact CG1-CD2 4.15Å; V227-F247 HydrophobicContact CG1-CE2 4.38Å; V227-F247 HydrophobicContact CG1-CG 4.15Å; V227-F247 HydrophobicContact CG2-CD1 3.73Å; V227-F247 HydrophobicContact CG2-CE1 3.65Å; V227-F247 HydrophobicContact CG2-CG 4.33Å; V227-F247 HydrophobicContact CG2-CZ 4.19Å; E230-F247 HydrophobicContact CB-CE2 3.95Å; E230-F247 HydrophobicContact CB-CZ 3.81Å; E230-F247 HydrophobicContact CG-CZ 4.19Å; V231-F247 HydrophobicContact CG2-CD2 4.07Å; V231-F247 HydrophobicContact CG2-CE2 3.99Å; L243-F247 HydrophobicContact CD2-CE2 4.34Å; L243-F247 VanDerWaalsContact O-CD2 3.29Å; L243-F247 WeakPolarHBondContact O-CD2 3.43Å; L243-F247 PolarHBondContact O-N 2.9Å; L244-F247 PolarHBondContact O-N 3.45Å; F247-K249 VanDerWaalsContact C-N 3.27Å; F247-K249 PolarHBondContact O-N 3.31Å; F247-I250 HydrophobicContact CD1-CD1 4.12Å; F247-I250 PolarHBondContact O-N 3.08Å; F247-I250 VanDerWaalsContact O-N 3.14Å; F247-A251 PolarHBondContact O-N 3.26Å; F247-I266 HydrophobicContact CB-CG2 3.95Å; F247-I266 HydrophobicContact CD1-CG2 4.34Å; F247-L270 HydrophobicContact CB-CD1 4.07Å; F247-L270 HydrophobicContact CB-CD2 4.24Å; F247-L270 HydrophobicContact CB-CG 4.48Å
248	I	98.9	Very high	98.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.9	-44.2	174.3	-67	164.8	0	0	0	110.7	L244 K246 A252 L270 W282 F289 L292 F293 L296	L244-I248 HydrophobicContact CD2-CD1 3.59Å; L244-I248 HydrophobicContact CG-CD1 4.29Å; L244-I248 WeakPolarHBondContact O-CD1 3.37Å; L244-I248 VanDerWaalsContact O-CG1 3.25Å; L244-I248 WeakPolarHBondContact O-CG1 2.7Å; L244-I248 PolarHBondContact O-N 3.46Å; L244-I248 VanDerWaalsContact O-N 3.07Å; K246-I248 PolarHBondContact O-N 3.34Å; I248-A252 PolarHBondContact O-N 3.49Å; I248-L270 HydrophobicContact CG1-CD1 3.9Å; I248-W282 HydrophobicContact CD1-CZ3 4.49Å; I248-F289 HydrophobicContact CD1-CB 4.25Å; I248-L292 HydrophobicContact CG2-CB 4.17Å; I248-L292 HydrophobicContact CG2-CD2 3.78Å; I248-L292 HydrophobicContact CG2-CG 3.8Å; I248-F293 HydrophobicContact CD1-CB 3.92Å; I248-F293 HydrophobicContact CD1-CD2 4.46Å; I248-F293 HydrophobicContact CD1-CG 4.31Å; I248-F293 HydrophobicContact CG1-CB 4.06Å; I248-F293 HydrophobicContact CG1-CD2 3.85Å; I248-F293 HydrophobicContact CG1-CG 4.19Å; I248-F293 HydrophobicContact CG2-CB 4.24Å; I248-L296 HydrophobicContact CG2-CD1 4.28Å
249	K	98.8	Very high	98.1	Very high	89 Å²	89	35.5 Å²	35.5	39%	0.387	17%	0.174	S	C	.	.	H	α-helix	trans	-68.4	-39.2	176.9	-69.7	177.1	145.9	-162.6	0	112.5	T173 K245 K246 F247 A252 H253 F289	T173-K249 HydrophobicContact CG2-CB 3.5Å; T173-K249 VanDerWaalsContact CG2-CB 3.5Å; K245-K249 WeakPolarHBondContact O-CG 3.41Å; K245-K249 PolarHBondContact O-N 3.26Å; K245-K249 VanDerWaalsContact O-N 3.15Å; K246-K249 PolarHBondContact O-N 3.36Å; F247-K249 VanDerWaalsContact C-N 3.27Å; F247-K249 PolarHBondContact O-N 3.31Å; K249-A252 PolarHBondContact O-N 3.49Å; K249-H253 PolarHBondContact O-CD2 3.27Å; K249-H253 PolarHBondContact O-N 3.38Å; K249-F289 HydrophobicContact CD-CE1 3.91Å; K249-F289 HydrophobicContact CD-CZ 4.5Å; K249-F289 HydrophobicContact CG-CD1 4.36Å; K249-F289 HydrophobicContact CG-CE1 3.75Å
250	I	98.8	Very high	98.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.7	-48.8	175.6	-65.3	165.9	0	0	0	109.3	T173 V176 A177 L180 K246 F247 A252 H253 C254 I266	T173-I250 HydrophobicContact CG2-CB 4.4Å; T173-I250 HydrophobicContact CG2-CG1 3.59Å; V176-I250 HydrophobicContact CB-CD1 4.26Å; V176-I250 HydrophobicContact CB-CG1 4.46Å; V176-I250 HydrophobicContact CG1-CD1 3.77Å; V176-I250 HydrophobicContact CG1-CG1 4.32Å; V176-I250 HydrophobicContact CG1-CG2 4.39Å; A177-I250 HydrophobicContact CB-CG2 4.2Å; L180-I250 HydrophobicContact CD1-CG2 3.78Å; K246-I250 HydrophobicContact CG-CD1 4.06Å; K246-I250 WeakPolarHBondContact O-CG1 3.42Å; K246-I250 PolarHBondContact O-N 2.63Å; F247-I250 HydrophobicContact CD1-CD1 4.12Å; F247-I250 PolarHBondContact O-N 3.08Å; F247-I250 VanDerWaalsContact O-N 3.14Å; I250-A252 VanDerWaalsContact C-N 3.32Å; I250-A252 PolarHBondContact O-N 3.03Å; I250-H253 PolarHBondContact O-N 2.96Å; I250-H253 VanDerWaalsContact O-N 3.09Å; I250-C254 PolarHBondContact O-N 2.98Å; I250-C254 PolarHBondContact O-SG 3.47Å; I250-C254 VanDerWaalsContact O-SG 3.33Å; I250-I266 HydrophobicContact CB-CD1 4.19Å; I250-I266 HydrophobicContact CG2-CD1 3.52Å
251	A	98.8	Very high	98.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-58	-42.6	177.2	0	0	0	0	0	112.5	F247 H253 C254 K255 I266 I267 L296	F247-A251 PolarHBondContact O-N 3.26Å; A251-H253 PolarHBondContact O-N 3.17Å; A251-C254 PolarHBondContact O-N 3.28Å; A251-K255 WeakPolarHBondContact O-CB 3.27Å; A251-K255 PolarHBondContact O-N 3.19Å; A251-I266 HydrophobicContact CB-CB 4.07Å; A251-I266 HydrophobicContact CB-CD1 4.41Å; A251-I266 HydrophobicContact CB-CG2 3.87Å; A251-I267 HydrophobicContact CB-CG1 4.36Å; A251-L296 HydrophobicContact CB-CD1 3.99Å
252	A	98.7	Very high	98.1	Very high	26 Å²	26	30.1 Å²	30.1	22%	0.215	15%	0.15	C	C	.	.	H	α-helix	trans	-61.3	-42.2	174.9	0	0	0	0	0	112.5	I248 K249 I250 K255 A256 L292 L296	I248-A252 PolarHBondContact O-N 3.49Å; K249-A252 PolarHBondContact O-N 3.49Å; I250-A252 VanDerWaalsContact C-N 3.32Å; I250-A252 PolarHBondContact O-N 3.03Å; A252-K255 PolarHBondContact O-N 3.29Å; A252-A256 WeakPolarHBondContact O-CB 3.19Å; A252-A256 PolarHBondContact O-N 3.04Å; A252-L292 HydrophobicContact CB-CD1 4.27Å; A252-L292 HydrophobicContact CB-CD2 4.22Å; A252-L296 HydrophobicContact CB-CD1 4.27Å; A252-L296 HydrophobicContact CB-CD2 4.46Å
253	H	98.3	Very high	98.1	Very high	57 Å²	57	25.6 Å²	25.6	26%	0.264	13%	0.129	S	C	.	.	H	α-helix	trans	-68.2	-42.9	175.8	-73.6	-57.9	0	0	0	112.6	W174 A177 K249 I250 A251 K255 A256 Q257	W174-H253 HydrophobicContact CE3-CB 4.46Å; W174-H253 AromaticContact CE3-CE1 3.96Å; W174-H253 AromaticContact CE3-ND1 3.48Å; W174-H253 AromaticContact CZ3-ND1 3.88Å; A177-H253 HydrophobicContact CB-CB 3.47Å; A177-H253 VanDerWaalsContact CB-CB 3.47Å; K249-H253 PolarHBondContact O-CD2 3.27Å; K249-H253 PolarHBondContact O-N 3.38Å; I250-H253 PolarHBondContact O-N 2.96Å; I250-H253 VanDerWaalsContact O-N 3.09Å; A251-H253 PolarHBondContact O-N 3.17Å; H253-K255 VanDerWaalsContact C-N 3.3Å; H253-K255 PolarHBondContact O-N 2.93Å; H253-A256 WeakPolarHBondContact O-CB 3.21Å; H253-A256 PolarHBondContact O-N 3.28Å; H253-A256 VanDerWaalsContact O-N 3.11Å; H253-Q257 WeakPolarHBondContact O-CB 3.24Å; H253-Q257 WeakPolarHBondContact O-CG 3.35Å; H253-Q257 PolarHBondContact O-N 3.03Å
254	C	98.3	Very high	98.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-56.7	-45.7	174	-66.6	0	0	0	0	110.9	I250 A251 A256 Q257 R258 N259 A263	I250-C254 PolarHBondContact O-N 2.98Å; I250-C254 PolarHBondContact O-SG 3.47Å; I250-C254 VanDerWaalsContact O-SG 3.33Å; A251-C254 PolarHBondContact O-N 3.28Å; C254-A256 PolarHBondContact O-N 3.36Å; C254-Q257 CarbonylContact O-C 3.55Å; C254-Q257 PolarHBondContact O-N 2.81Å; C254-R258 PolarHBondContact O-N 3.03Å; C254-N259 CarbonylContact C-O 3.51Å; C254-N259 HydrophobicContact CB-CB 4.38Å; C254-N259 WeakPolarHBondContact O-CA 3.28Å; C254-N259 PolarHBondContact O-N 2.93Å; C254-A263 HydrophobicContact CB-CB 4.04Å
255	K	97.8	Very high	98.1	Very high	79 Å²	79	25.7 Å²	25.7	34%	0.343	13%	0.129	S	C	.	.	H	α-helix	trans	-61.7	-42.1	174.9	178.2	174.2	173.1	-77.1	0	112.4	A251 A252 H253 Q257 R258 L260 A263 L296 I299	A251-K255 WeakPolarHBondContact O-CB 3.27Å; A251-K255 PolarHBondContact O-N 3.19Å; A252-K255 PolarHBondContact O-N 3.29Å; H253-K255 VanDerWaalsContact C-N 3.3Å; H253-K255 PolarHBondContact O-N 2.93Å; K255-Q257 VanDerWaalsContact C-N 3.29Å; K255-Q257 PolarHBondContact O-N 2.95Å; K255-R258 PolarHBondContact O-N 3.29Å; K255-L260 HydrophobicContact CB-CD2 4.48Å; K255-L260 HydrophobicContact CG-CD2 4.1Å; K255-A263 HydrophobicContact CB-CB 4.18Å; K255-L296 HydrophobicContact CD-CD2 3.8Å; K255-I299 HydrophobicContact CD-CD1 4.41Å
256	A	96.4	Very high	98.2	Very high	72 Å²	72	22.8 Å²	22.8	60%	0.595	12%	0.116	S	C	*	.	H	α-helix	trans	-63.9	-35.5	176.8	0	0	0	0	0	112.3	A252 H253 C254 R258	A252-A256 WeakPolarHBondContact O-CB 3.19Å; A252-A256 PolarHBondContact O-N 3.04Å; H253-A256 WeakPolarHBondContact O-CB 3.21Å; H253-A256 PolarHBondContact O-N 3.28Å; H253-A256 VanDerWaalsContact O-N 3.11Å; C254-A256 PolarHBondContact O-N 3.36Å; A256-R258 PolarHBondContact O-N 2.81Å
257	Q	95.6	Very high	98.2	Very high	32 Å²	32	21.8 Å²	21.8	15%	0.15	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	6.6	173.2	-66.6	172.7	-9.1	0	0	113.1	W174 A177 T181 H253 C254 K255 N259	W174-Q257 HydrophobicContact CH2-CG 4.05Å; W174-Q257 HydrophobicContact CZ3-CG 4.27Å; A177-Q257 PolarHBondContact O-OE1 3.24Å; A177-Q257 VanDerWaalsContact O-OE1 3.13Å; T181-Q257 HydrophobicContact CG2-CB 4.31Å; T181-Q257 PolarHBondContact OG1-OE1 3.45Å; H253-Q257 WeakPolarHBondContact O-CB 3.24Å; H253-Q257 WeakPolarHBondContact O-CG 3.35Å; H253-Q257 PolarHBondContact O-N 3.03Å; C254-Q257 CarbonylContact O-C 3.55Å; C254-Q257 PolarHBondContact O-N 2.81Å; K255-Q257 VanDerWaalsContact C-N 3.29Å; K255-Q257 PolarHBondContact O-N 2.95Å; Q257-N259 PolarHBondContact O-N 3.27Å
258	R	97.1	Very high	98.1	Very high	93 Å²	93	25.1 Å²	25.1	35%	0.351	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	21.7	-178.6	-45.7	175.9	-164	163.7	11.7	113.7	C254 K255 A256 L260 M316 K317 P318 P319 K320 I321	C254-R258 PolarHBondContact O-N 3.03Å; K255-R258 PolarHBondContact O-N 3.29Å; A256-R258 PolarHBondContact O-N 2.81Å; R258-L260 PolarHBondContact O-N 3.31Å; R258-M316 HydrophobicContact CB-SD 4.41Å; R258-K317 WeakPolarHBondContact CD-O 3.41Å; R258-K317 PolarHBondContact NH1-O 3.4Å; R258-P318 PolarHBondContact NH1-O 3.16Å; R258-P318 VanDerWaalsContact NH1-O 3.14Å; R258-P319 WeakPolarHBondContact CD-O 3.43Å; R258-K320 HydrophobicContact CB-CB 3.82Å; R258-I321 PolarHBondContact O-N 3.15Å
259	N	97.8	Very high	98.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-90.1	87	167	-177.7	0.2	0	0	0	109.6	T181 D184 C254 Q257 N261 S262 A263 I321	T181-N259 WeakPolarHBondContact CA-ND2 3.42Å; T181-N259 HydrophobicContact CG2-CB 4.04Å; T181-N259 WeakPolarHBondContact OG1-CB 3.48Å; T181-N259 PolarHBondContact OG1-ND2 2.89Å; D184-N259 PolarHBondContact OD2-ND2 3.48Å; D184-N259 PolarHBondContact OD2-OD1 2.84Å; C254-N259 CarbonylContact C-O 3.51Å; C254-N259 HydrophobicContact CB-CB 4.38Å; C254-N259 WeakPolarHBondContact O-CA 3.28Å; C254-N259 PolarHBondContact O-N 2.93Å; Q257-N259 PolarHBondContact O-N 3.27Å; N259-N261 VanDerWaalsContact C-N 3.32Å; N259-N261 WeakPolarHBondContact OD1-CB 3.45Å; N259-N261 PolarHBondContact OD1-N 3.43Å; N259-S262 WeakPolarHBondContact ND2-CB 3.4Å; N259-S262 PolarHBondContact OD1-N 3.44Å; N259-S262 VanDerWaalsContact OD1-N 3.09Å; N259-A263 WeakPolarHBondContact O-CB 3.47Å; N259-A263 PolarHBondContact O-N 3.28Å; N259-I321 HydrophobicContact CB-CD1 4.2Å
260	L	98.3	Very high	98.1	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-76.6	-21	176.8	-62	-173.8	0	0	0	112.5	K255 R258 F264 I299 Y309 F313 M316 I321	K255-L260 HydrophobicContact CB-CD2 4.48Å; K255-L260 HydrophobicContact CG-CD2 4.1Å; R258-L260 PolarHBondContact O-N 3.31Å; L260-F264 HydrophobicContact CB-CD2 4.43Å; L260-F264 WeakPolarHBondContact O-CB 3.42Å; L260-F264 VanDerWaalsContact O-CD2 3.23Å; L260-F264 WeakPolarHBondContact O-CD2 3.24Å; L260-F264 PolarHBondContact O-N 2.88Å; L260-I299 HydrophobicContact CD1-CD1 4.32Å; L260-I299 HydrophobicContact CD2-CD1 3.94Å; L260-Y309 HydrophobicContact CB-CE2 4.32Å; L260-Y309 HydrophobicContact CD1-CD2 4.09Å; L260-Y309 HydrophobicContact CD1-CE2 3.55Å; L260-F313 HydrophobicContact CD1-CB 4.37Å; L260-F313 HydrophobicContact CD1-CD2 3.79Å; L260-M316 HydrophobicContact CD1-CE 4.06Å; L260-M316 HydrophobicContact CD1-SD 4Å; L260-M316 HydrophobicContact CD2-CE 3.99Å; L260-M316 HydrophobicContact CD2-SD 4.33Å; L260-M316 HydrophobicContact CG-CE 4.4Å; L260-M316 HydrophobicContact CG-SD 4.22Å; L260-I321 WeakPolarHBondContact CB-O 3.29Å; L260-I321 PolarHBondContact N-O 3.01Å
261	N	97.9	Very high	98	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-59.6	177.7	-166.4	65.5	0	0	0	111.5	N259 A263 F264 A265 I321 P322	N259-N261 VanDerWaalsContact C-N 3.32Å; N259-N261 WeakPolarHBondContact OD1-CB 3.45Å; N259-N261 PolarHBondContact OD1-N 3.43Å; N261-A263 PolarHBondContact O-N 3.36Å; N261-F264 PolarHBondContact O-N 3.07Å; N261-A265 PolarHBondContact O-N 2.86Å; N261-I321 HydrophobicContact CB-CG2 3.72Å; N261-P322 WeakPolarHBondContact CB-O 3.31Å
262	S	98.3	Very high	97.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.9	-35.4	176.7	-86.5	0	0	0	0	112.9	D184 N259 F264 A265 I266	D184-S262 WeakPolarHBondContact OD2-CB 3.13Å; D184-S262 PolarHBondContact OD2-OG 2.87Å; N259-S262 WeakPolarHBondContact ND2-CB 3.4Å; N259-S262 PolarHBondContact OD1-N 3.44Å; N259-S262 VanDerWaalsContact OD1-N 3.09Å; S262-F264 PolarHBondContact O-N 3.18Å; S262-A265 PolarHBondContact O-N 3.34Å; S262-I266 VanDerWaalsContact O-CG1 3.27Å; S262-I266 WeakPolarHBondContact O-CG1 3.43Å; S262-I266 PolarHBondContact O-N 3Å
263	A	98.5	Very high	97.9	Very high	1 Å²	1	26 Å²	26	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-60.6	-46.6	177.3	0	0	0	0	0	111.3	C254 K255 N259 N261 I266 I267	C254-A263 HydrophobicContact CB-CB 4.04Å; K255-A263 HydrophobicContact CB-CB 4.18Å; N259-A263 WeakPolarHBondContact O-CB 3.47Å; N259-A263 PolarHBondContact O-N 3.28Å; N261-A263 PolarHBondContact O-N 3.36Å; A263-I266 PolarHBondContact O-N 3.44Å; A263-I267 VanDerWaalsContact O-CD1 3.27Å; A263-I267 WeakPolarHBondContact O-CD1 3.41Å; A263-I267 WeakPolarHBondContact O-CG1 3.47Å; A263-I267 PolarHBondContact O-N 3.45Å; A263-I267 VanDerWaalsContact O-N 3.09Å
264	F	98.4	Very high	97.8	Very high	4 Å²	4	23.3 Å²	23.3	2%	0.018	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-48	174.9	-93.4	-112.2	0	0	0	111.9	L260 N261 S262 I266 I267 M268 I299 T300 Y309 F323	L260-F264 HydrophobicContact CB-CD2 4.43Å; L260-F264 WeakPolarHBondContact O-CB 3.42Å; L260-F264 VanDerWaalsContact O-CD2 3.23Å; L260-F264 WeakPolarHBondContact O-CD2 3.24Å; L260-F264 PolarHBondContact O-N 2.88Å; N261-F264 PolarHBondContact O-N 3.07Å; S262-F264 PolarHBondContact O-N 3.18Å; F264-I266 VanDerWaalsContact C-N 3.27Å; F264-I266 PolarHBondContact O-N 2.95Å; F264-I267 PolarHBondContact O-N 3.21Å; F264-I267 VanDerWaalsContact O-N 3.16Å; F264-M268 WeakPolarHBondContact O-CB 3.41Å; F264-M268 VanDerWaalsContact O-CG 3.29Å; F264-M268 WeakPolarHBondContact O-CG 3.33Å; F264-M268 PolarHBondContact O-N 3.23Å; F264-I299 HydrophobicContact CD2-CG2 4.42Å; F264-I299 HydrophobicContact CE2-CG1 4.33Å; F264-I299 HydrophobicContact CE2-CG2 3.72Å; F264-I299 HydrophobicContact CZ-CG2 4.16Å; F264-I299 VanDerWaalsContact CZ-O 3.26Å; F264-I299 WeakPolarHBondContact CZ-O 3.41Å; F264-T300 HydrophobicContact CD1-CG2 3.86Å; F264-T300 HydrophobicContact CD2-CG2 4.42Å; F264-T300 HydrophobicContact CE1-CG2 3.75Å; F264-T300 HydrophobicContact CE2-CG2 4.33Å; F264-T300 HydrophobicContact CG-CG2 4.22Å; F264-T300 HydrophobicContact CZ-CG2 4Å; F264-Y309 AromaticContact CE2-CD2 3.55Å; F264-Y309 HydrophobicContact CE2-CD2 3.55Å; F264-Y309 AromaticContact CE2-CE2 3.9Å; F264-Y309 HydrophobicContact CE2-CE2 3.9Å; F264-Y309 AromaticContact CZ-CD2 3.45Å; F264-Y309 HydrophobicContact CZ-CD2 3.45Å; F264-Y309 VanDerWaalsContact CZ-CD2 3.45Å; F264-Y309 HydrophobicContact CZ-CE2 4.07Å; F264-Y309 HydrophobicContact CZ-CG 4.16Å; F264-F323 HydrophobicContact CB-CD2 3.49Å; F264-F323 VanDerWaalsContact CB-CD2 3.49Å; F264-F323 HydrophobicContact CB-CE2 3.78Å; F264-F323 HydrophobicContact CB-CG 4.03Å; F264-F323 HydrophobicContact CD1-CB 4.3Å; F264-F323 AromaticContact CD1-CD1 3.63Å; F264-F323 HydrophobicContact CD1-CD1 3.63Å; F264-F323 AromaticContact CD1-CD2 3.91Å; F264-F323 HydrophobicContact CD1-CD2 3.91Å; F264-F323 AromaticContact CD1-CE1 3.84Å; F264-F323 HydrophobicContact CD1-CE1 3.84Å; F264-F323 HydrophobicContact CD1-CE2 4.09Å; F264-F323 AromaticContact CD1-CG 3.68Å; F264-F323 HydrophobicContact CD1-CG 3.68Å; F264-F323 HydrophobicContact CD1-CZ 4.06Å; F264-F323 HydrophobicContact CD2-CB 4.17Å; F264-F323 HydrophobicContact CD2-CG 4.34Å; F264-F323 AromaticContact CE1-CD1 3.84Å; F264-F323 HydrophobicContact CE1-CD1 3.84Å; F264-F323 HydrophobicContact CE1-CE1 4.22Å; F264-F323 HydrophobicContact CE1-CG 4.18Å; F264-F323 HydrophobicContact CE2-CB 4.42Å; F264-F323 HydrophobicContact CG-CB 4.09Å; F264-F323 HydrophobicContact CG-CD1 4.21Å; F264-F323 AromaticContact CG-CD2 3.77Å; F264-F323 HydrophobicContact CG-CD2 3.77Å; F264-F323 HydrophobicContact CG-CE2 4.24Å; F264-F323 AromaticContact CG-CG 3.76Å; F264-F323 HydrophobicContact CG-CG 3.76Å
265	A	98.4	Very high	97.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-55.5	-43.3	-180	0	0	0	0	0	112	C220 V223 Q224 N261 S262 G269	C220-A265 WeakPolarHBondContact O-CB 3.41Å; V223-A265 HydrophobicContact CB-CB 3.93Å; V223-A265 HydrophobicContact CG1-CB 3.73Å; Q224-A265 WeakPolarHBondContact CA-O 3.34Å; Q224-A265 HydrophobicContact CB-CB 4.44Å; N261-A265 PolarHBondContact O-N 2.86Å; S262-A265 PolarHBondContact O-N 3.34Å; A265-G269 PolarHBondContact O-N 3.49Å
266	I	98.8	Very high	97.8	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.9	-44.3	178.1	-63.2	164.4	0	0	0	111.8	L180 V223 V227 F247 I250 A251 S262 A263 F264 M268 G269 L270	L180-I266 HydrophobicContact CD1-CD1 4.34Å; V223-I266 HydrophobicContact CG1-CG1 3.89Å; V227-I266 HydrophobicContact CG2-CB 4.25Å; V227-I266 HydrophobicContact CG2-CG1 3.95Å; V227-I266 HydrophobicContact CG2-CG2 4.09Å; F247-I266 HydrophobicContact CB-CG2 3.95Å; F247-I266 HydrophobicContact CD1-CG2 4.34Å; I250-I266 HydrophobicContact CB-CD1 4.19Å; I250-I266 HydrophobicContact CG2-CD1 3.52Å; A251-I266 HydrophobicContact CB-CB 4.07Å; A251-I266 HydrophobicContact CB-CD1 4.41Å; A251-I266 HydrophobicContact CB-CG2 3.87Å; S262-I266 VanDerWaalsContact O-CG1 3.27Å; S262-I266 WeakPolarHBondContact O-CG1 3.43Å; S262-I266 PolarHBondContact O-N 3Å; A263-I266 PolarHBondContact O-N 3.44Å; F264-I266 VanDerWaalsContact C-N 3.27Å; F264-I266 PolarHBondContact O-N 2.95Å; I266-M268 VanDerWaalsContact C-N 3.35Å; I266-M268 PolarHBondContact O-N 3.27Å; I266-G269 PolarHBondContact O-N 2.89Å; I266-L270 HydrophobicContact CG2-CD1 4.28Å; I266-L270 WeakPolarHBondContact O-CG 3.26Å; I266-L270 PolarHBondContact O-N 3.24Å
267	I	98.6	Very high	97.8	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-61.3	-45.7	178.2	-64.8	159.3	0	0	0	110.3	A251 A263 F264 G269 L270 N271 F293 L296 E297 I299 T300	A251-I267 HydrophobicContact CB-CG1 4.36Å; A263-I267 VanDerWaalsContact O-CD1 3.27Å; A263-I267 WeakPolarHBondContact O-CD1 3.41Å; A263-I267 WeakPolarHBondContact O-CG1 3.47Å; A263-I267 PolarHBondContact O-N 3.45Å; A263-I267 VanDerWaalsContact O-N 3.09Å; F264-I267 PolarHBondContact O-N 3.21Å; F264-I267 VanDerWaalsContact O-N 3.16Å; I267-G269 VanDerWaalsContact C-N 3.32Å; I267-G269 PolarHBondContact O-N 3.31Å; I267-L270 PolarHBondContact O-N 3.36Å; I267-N271 WeakPolarHBondContact O-CB 3.46Å; I267-N271 PolarHBondContact O-N 3.5Å; I267-F293 HydrophobicContact CG1-CE2 4.49Å; I267-F293 HydrophobicContact CG2-CE2 4.18Å; I267-F293 HydrophobicContact CG2-CZ 4.37Å; I267-L296 HydrophobicContact CD1-CB 3.82Å; I267-L296 HydrophobicContact CG1-CB 4.2Å; I267-E297 HydrophobicContact CG2-CG 4.11Å; I267-I299 HydrophobicContact CD1-CG2 4.46Å; I267-T300 HydrophobicContact CB-CG2 4.25Å; I267-T300 HydrophobicContact CD1-CG2 3.94Å; I267-T300 HydrophobicContact CG2-CG2 3.82Å
268	M	98.1	Very high	98	Very high	71 Å²	71	18.7 Å²	18.7	35%	0.35	10%	0.101	S	C	.	.	H	α-helix	trans	-62.3	-37.8	176.9	-70	177.3	63.6	0	0	112.3	Q224 F264 I266 N271 T272 F323	Q224-M268 HydrophobicContact CG-CB 4.18Å; F264-M268 WeakPolarHBondContact O-CB 3.41Å; F264-M268 VanDerWaalsContact O-CG 3.29Å; F264-M268 WeakPolarHBondContact O-CG 3.33Å; F264-M268 PolarHBondContact O-N 3.23Å; I266-M268 VanDerWaalsContact C-N 3.35Å; I266-M268 PolarHBondContact O-N 3.27Å; M268-N271 PolarHBondContact O-N 2.84Å; M268-T272 PolarHBondContact O-N 3.15Å; M268-T272 VanDerWaalsContact O-N 3.11Å; M268-T272 PolarHBondContact O-OG1 3.37Å; M268-F323 HydrophobicContact SD-CE2 4.32Å; M268-F323 HydrophobicContact SD-CZ 4Å
269	G	98.2	Very high	98	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.4	-44.5	176	0	0	0	0	0	111.8	M228 A265 I266 I267 N271 T272	M228-G269 WeakPolarHBondContact CG-O 3.4Å; A265-G269 PolarHBondContact O-N 3.49Å; I266-G269 PolarHBondContact O-N 2.89Å; I267-G269 VanDerWaalsContact C-N 3.32Å; I267-G269 PolarHBondContact O-N 3.31Å; G269-N271 VanDerWaalsContact C-N 3.32Å; G269-N271 PolarHBondContact O-N 2.61Å; G269-T272 PolarHBondContact O-N 3.39Å
270	L	98.6	Very high	97.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-67.8	-30.4	176.2	-67.3	176.1	0	0	0	113.1	V227 F247 I248 I266 I267 V275 W282 F293	V227-L270 HydrophobicContact CG1-CD2 3.75Å; V227-L270 HydrophobicContact CG1-CG 3.87Å; F247-L270 HydrophobicContact CB-CD1 4.07Å; F247-L270 HydrophobicContact CB-CD2 4.24Å; F247-L270 HydrophobicContact CB-CG 4.48Å; I248-L270 HydrophobicContact CG1-CD1 3.9Å; I266-L270 HydrophobicContact CG2-CD1 4.28Å; I266-L270 WeakPolarHBondContact O-CG 3.26Å; I266-L270 PolarHBondContact O-N 3.24Å; I267-L270 PolarHBondContact O-N 3.36Å; L270-V275 HydrophobicContact CD2-CG1 4.3Å; L270-V275 WeakPolarHBondContact O-CG1 3.41Å; L270-W282 HydrophobicContact CB-CH2 4.46Å; L270-F293 HydrophobicContact CB-CE2 3.79Å; L270-F293 HydrophobicContact CB-CZ 3.64Å; L270-F293 HydrophobicContact CD1-CD2 4.04Å; L270-F293 HydrophobicContact CD1-CE2 3.57Å; L270-F293 HydrophobicContact CD1-CZ 4.25Å; L270-F293 HydrophobicContact CG-CE2 4.33Å
271	N	97.8	Very high	97.9	Very high	60 Å²	60	23.7 Å²	23.7	32%	0.321	13%	0.131	S	C	.	.	H	α-helix	trans	-85	-5.1	178.9	-82.5	-12.7	0	0	0	114.8	I267 M268 G269 F293 E297	I267-N271 WeakPolarHBondContact O-CB 3.46Å; I267-N271 PolarHBondContact O-N 3.5Å; M268-N271 PolarHBondContact O-N 2.84Å; G269-N271 VanDerWaalsContact C-N 3.32Å; G269-N271 PolarHBondContact O-N 2.61Å; N271-F293 VanDerWaalsContact OD1-CE1 3.26Å; N271-F293 WeakPolarHBondContact OD1-CE1 3.47Å; N271-F293 WeakPolarHBondContact OD1-CZ 3.21Å; N271-E297 PolarHBondContact ND2-OE1 3.28Å; N271-E297 PolarHBondContact OD1-OE1 2.86Å; N271-E297 VanDerWaalsContact OD1-OE1 3.11Å
272	T	97.2	Very high	98	Very high	26 Å²	26	25.5 Å²	25.5	16%	0.16	14%	0.138	C	C	.	.	S	Bend	trans	-64.7	141.8	177.1	-60.2	0	0	0	0	110.3	M228 M268 G269 A274 V275 S276	M228-T272 WeakPolarHBondContact SD-CB 3.48Å; M228-T272 HydrophobicContact SD-CG2 3.46Å; M228-T272 WeakPolarHBondContact SD-CG2 3.29Å; M228-T272 PolarHBondContact SD-OG1 3.05Å; M228-T272 VanDerWaalsContact SD-OG1 3.36Å; M268-T272 PolarHBondContact O-N 3.15Å; M268-T272 VanDerWaalsContact O-N 3.11Å; M268-T272 PolarHBondContact O-OG1 3.37Å; G269-T272 PolarHBondContact O-N 3.39Å; T272-A274 PolarHBondContact O-N 2.77Å; T272-V275 PolarHBondContact O-N 3.21Å; T272-S276 PolarHBondContact O-N 3.4Å; T272-S276 PolarHBondContact O-OG 3.33Å
273	A	96.9	Very high	97.9	Very high	49 Å²	49	32.2 Å²	32.2	41%	0.405	17%	0.17	S	C	.	.	H	α-helix	trans	-52.4	-32.5	-175.3	0	0	0	0	0	114.5	V275 S276 R277 F398	A273-V275 VanDerWaalsContact C-N 3.33Å; A273-V275 PolarHBondContact O-N 2.99Å; A273-S276 WeakPolarHBondContact CA-OG 3.46Å; A273-R277 WeakPolarHBondContact O-CB 3.46Å; A273-R277 WeakPolarHBondContact O-CG 3.48Å; A273-R277 PolarHBondContact O-N 3.08Å; A273-F398 HydrophobicContact CB-CE1 3.86Å; A273-F398 HydrophobicContact CB-CZ 3.57Å
274	A	97.2	Very high	97.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67.7	-29.7	175.6	0	0	0	0	0	113.2	L232 T272 L397 F398 S401	L232-A274 HydrophobicContact CD1-CB 3.9Å; T272-A274 PolarHBondContact O-N 2.77Å; A274-L397 HydrophobicContact CB-CB 4.25Å; A274-F398 HydrophobicContact CB-CD1 4.32Å; A274-F398 HydrophobicContact CB-CE1 4.47Å; A274-S401 VanDerWaalsContact O-CB 3.24Å; A274-S401 WeakPolarHBondContact O-CB 3.24Å; A274-S401 PolarHBondContact O-OG 2.95Å
275	V	98.3	Very high	97.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-94.3	-42.9	178.9	178.5	0	0	0	0	111.5	M228 V231 L232 L270 T272 A273 R277 L278 W282	M228-V275 HydrophobicContact CB-CG2 4.32Å; M228-V275 HydrophobicContact CG-CG2 4.17Å; V231-V275 HydrophobicContact CG1-CG1 4.12Å; V231-V275 HydrophobicContact CG1-CG2 4.42Å; L232-V275 HydrophobicContact CD1-CG2 4.43Å; L232-V275 HydrophobicContact CG-CG2 4.49Å; L270-V275 HydrophobicContact CD2-CG1 4.3Å; L270-V275 WeakPolarHBondContact O-CG1 3.41Å; T272-V275 PolarHBondContact O-N 3.21Å; A273-V275 VanDerWaalsContact C-N 3.33Å; A273-V275 PolarHBondContact O-N 2.99Å; V275-R277 PolarHBondContact O-N 2.96Å; V275-L278 WeakPolarHBondContact O-CB 3.43Å; V275-L278 WeakPolarHBondContact O-CG 3.23Å; V275-L278 PolarHBondContact O-N 2.95Å; V275-W282 HydrophobicContact CG1-CZ2 4.41Å; V275-W282 PolarHBondContact O-NE1 3.37Å
276	S	97.3	Very high	97.9	Very high	51 Å²	51	40.5 Å²	40.5	36%	0.357	21%	0.211	S	C	.	.	H	α-helix	trans	-66	-25.6	-177.3	60.6	0	0	0	0	113.2	T272 A273 L278	T272-S276 PolarHBondContact O-N 3.4Å; T272-S276 PolarHBondContact O-OG 3.33Å; A273-S276 WeakPolarHBondContact CA-OG 3.46Å; S276-L278 VanDerWaalsContact C-N 3.28Å; S276-L278 PolarHBondContact O-N 2.75Å
277	R	97.4	Very high	97.8	Very high	34 Å²	34	43 Å²	43	13%	0.128	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-10.2	175.5	72.2	173.6	-72.5	-58.1	-8	115.6	A273 V275 N279 S401 E405	A273-R277 WeakPolarHBondContact O-CB 3.46Å; A273-R277 WeakPolarHBondContact O-CG 3.48Å; A273-R277 PolarHBondContact O-N 3.08Å; V275-R277 PolarHBondContact O-N 2.96Å; R277-N279 PolarHBondContact O-N 3.08Å; R277-S401 WeakPolarHBondContact CD-OG 3.41Å; R277-S401 VanDerWaalsContact CG-OG 3.25Å; R277-S401 WeakPolarHBondContact CG-OG 3.32Å; R277-S401 PolarHBondContact NH1-O 3.15Å; R277-S401 PolarHBondContact NH1-OG 3.11Å; R277-E405 PolarHBondContact NH1-O 3.37Å; R277-E405 PolarHBondContact NH2-O 2.93Å
278	L	98.1	Very high	97.8	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.268	C	S	.	.			trans	-75.1	65.9	-176.6	-62.3	176.9	0	0	0	111.1	V231 L232 V275 S276 Q280 T281 W282 S401 L404 E405	V231-L278 HydrophobicContact CG1-CD1 3.86Å; L232-L278 HydrophobicContact CD2-CD1 4.23Å; V275-L278 WeakPolarHBondContact O-CB 3.43Å; V275-L278 WeakPolarHBondContact O-CG 3.23Å; V275-L278 PolarHBondContact O-N 2.95Å; S276-L278 VanDerWaalsContact C-N 3.28Å; S276-L278 PolarHBondContact O-N 2.75Å; L278-Q280 VanDerWaalsContact C-N 3.31Å; L278-Q280 PolarHBondContact O-N 2.89Å; L278-T281 WeakPolarHBondContact O-CB 3.19Å; L278-T281 PolarHBondContact O-N 3.33Å; L278-W282 PolarHBondContact O-N 2.8Å; L278-S401 WeakPolarHBondContact CD2-OG 3.5Å; L278-L404 HydrophobicContact CD2-CB 4.3Å; L278-E405 VanDerWaalsContact CA-OE2 3.23Å; L278-E405 WeakPolarHBondContact CA-OE2 3.49Å; L278-E405 HydrophobicContact CD2-CB 4.07Å; L278-E405 HydrophobicContact CD2-CG 4.01Å
279	N	97.1	Very high	97.8	Very high	103 Å²	103	47.5 Å²	47.5	55%	0.551	25%	0.254	S	S	*	.	H	α-helix	trans	-54.3	-43.3	-172.4	-69.7	-29.1	0	0	0	112.6	R277 T281 W282 E283 E405	R277-N279 PolarHBondContact O-N 3.08Å; N279-T281 VanDerWaalsContact C-N 3.28Å; N279-T281 PolarHBondContact O-N 3.4Å; N279-W282 PolarHBondContact O-N 3.04Å; N279-E283 VanDerWaalsContact O-CB 3.24Å; N279-E283 WeakPolarHBondContact O-CB 3.33Å; N279-E283 WeakPolarHBondContact O-CG 3.41Å; N279-E283 PolarHBondContact O-N 2.91Å; N279-E405 PolarHBondContact N-OE2 3.26Å
280	Q	97.6	Very high	97.8	Very high	96 Å²	96	51 Å²	51	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-65.6	-35.6	-179.4	-54.4	179.9	28.7	0	0	111.4	L237 L278 K284 E405	L237-Q280 HydrophobicContact CD1-CB 4.49Å; L278-Q280 VanDerWaalsContact C-N 3.31Å; L278-Q280 PolarHBondContact O-N 2.89Å; Q280-K284 WeakPolarHBondContact O-CG 3.49Å; Q280-K284 PolarHBondContact O-N 3.25Å; Q280-E405 HydrophobicContact CB-CG 4.47Å; Q280-E405 WeakPolarHBondContact CB-OE2 3.44Å; Q280-E405 HydrophobicContact CG-CG 4.49Å; Q280-E405 PolarHBondContact N-OE2 2.88Å
281	T	98.2	Very high	97.8	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68.1	-49.2	174.8	-57.8	0	0	0	0	111.1	L237 R240 V241 L244 L278 N279 K284 C285 E405	L237-T281 WeakPolarHBondContact CD1-OG1 3.4Å; R240-T281 HydrophobicContact CB-CG2 4.41Å; R240-T281 HydrophobicContact CG-CG2 3.96Å; R240-T281 PolarHBondContact NE-OG1 2.83Å; R240-T281 PolarHBondContact NH2-OG1 3.14Å; V241-T281 HydrophobicContact CG2-CG2 3.97Å; L244-T281 HydrophobicContact CD1-CG2 4.18Å; L278-T281 WeakPolarHBondContact O-CB 3.19Å; L278-T281 PolarHBondContact O-N 3.33Å; N279-T281 VanDerWaalsContact C-N 3.28Å; N279-T281 PolarHBondContact O-N 3.4Å; T281-K284 PolarHBondContact O-N 3.34Å; T281-C285 PolarHBondContact O-N 3.21Å; T281-E405 WeakPolarHBondContact CB-OE1 3.2Å; T281-E405 PolarHBondContact N-OE1 3.16Å; T281-E405 VanDerWaalsContact N-OE1 3.15Å; T281-E405 PolarHBondContact OG1-OE1 2.82Å
282	W	98.2	Very high	97.9	Very high	38 Å²	38	57.1 Å²	57.1	14%	0.144	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-44.2	179.5	-75.3	106.1	0	0	0	111.2	L244 I248 L270 V275 L278 N279 K284 C285 K290 F293	L244-W282 HydrophobicContact CD1-CD2 3.7Å; L244-W282 HydrophobicContact CD1-CE3 3.84Å; L244-W282 HydrophobicContact CD1-CG 4.44Å; L244-W282 HydrophobicContact CD1-CH2 3.77Å; L244-W282 HydrophobicContact CD1-CZ2 3.6Å; L244-W282 HydrophobicContact CD1-CZ3 3.88Å; L244-W282 HydrophobicContact CD2-CD2 4.49Å; L244-W282 HydrophobicContact CD2-CE3 3.82Å; L244-W282 HydrophobicContact CD2-CH2 4.19Å; L244-W282 HydrophobicContact CD2-CZ3 3.66Å; L244-W282 HydrophobicContact CG-CE3 4.39Å; L244-W282 HydrophobicContact CG-CH2 4.15Å; L244-W282 HydrophobicContact CG-CZ2 4.45Å; L244-W282 HydrophobicContact CG-CZ3 4.12Å; I248-W282 HydrophobicContact CD1-CZ3 4.49Å; L270-W282 HydrophobicContact CB-CH2 4.46Å; V275-W282 HydrophobicContact CG1-CZ2 4.41Å; V275-W282 PolarHBondContact O-NE1 3.37Å; L278-W282 PolarHBondContact O-N 2.8Å; N279-W282 PolarHBondContact O-N 3.04Å; W282-K284 VanDerWaalsContact C-N 3.34Å; W282-K284 PolarHBondContact O-N 3.47Å; W282-C285 WeakPolarHBondContact O-CB 3.27Å; W282-C285 PolarHBondContact O-N 3.12Å; W282-K290 WeakPolarHBondContact O-CE 3.43Å; W282-K290 PolarHBondContact O-NZ 3.48Å; W282-F293 AromaticContact CH2-CD1 3.83Å; W282-F293 HydrophobicContact CH2-CD1 3.83Å; W282-F293 AromaticContact CH2-CE1 3.68Å; W282-F293 HydrophobicContact CH2-CE1 3.68Å; W282-F293 HydrophobicContact CH2-CG 4.43Å; W282-F293 HydrophobicContact CH2-CZ 4.17Å; W282-F293 AromaticContact CZ3-CD1 3.94Å; W282-F293 HydrophobicContact CZ3-CD1 3.94Å; W282-F293 HydrophobicContact CZ3-CE1 4.24Å; W282-F293 HydrophobicContact CZ3-CG 4.48Å
283	E	97.4	Very high	97.9	Very high	142 Å²	142	56.3 Å²	56.3	66%	0.664	29%	0.29	S	S	*	.	H	α-helix	trans	-53.9	-48	176.8	-79.2	175.9	179.5	0	0	112.2	N279 C285 K290	N279-E283 VanDerWaalsContact O-CB 3.24Å; N279-E283 WeakPolarHBondContact O-CB 3.33Å; N279-E283 WeakPolarHBondContact O-CG 3.41Å; N279-E283 PolarHBondContact O-N 2.91Å; E283-C285 PolarHBondContact O-N 3.23Å; E283-K290 PolarHBondContact O-NZ 2.85Å; E283-K290 VanDerWaalsContact O-NZ 3.13Å
284	K	98.1	Very high	98	Very high	122 Å²	122	57 Å²	57	53%	0.53	29%	0.292	S	S	.	.	H	α-helix	trans	-72.3	-9.7	177.8	-71	-170.4	-179.3	-175.2	0	114.5	L237 V241 Q280 T281 W282	L237-K284 HydrophobicContact CD2-CD 3.85Å; L237-K284 VanDerWaalsContact CD2-NZ 3.35Å; L237-K284 HydrophobicContact CG-CD 4.22Å; V241-K284 HydrophobicContact CG2-CB 3.81Å; Q280-K284 WeakPolarHBondContact O-CG 3.49Å; Q280-K284 PolarHBondContact O-N 3.25Å; T281-K284 PolarHBondContact O-N 3.34Å; W282-K284 VanDerWaalsContact C-N 3.34Å; W282-K284 PolarHBondContact O-N 3.47Å
285	C	98.1	Very high	98	Very high	3 Å²	3	62 Å²	62	2%	0.02	32%	0.315	C	S	.	.	S	Bend	trans	-69.6	127.5	173.4	-170.8	0	0	0	0	110.5	L244 T281 W282 E283 G287 K290	L244-C285 HydrophobicContact CD2-CB 3.86Å; L244-C285 WeakPolarHBondContact CD2-SG 3.33Å; T281-C285 PolarHBondContact O-N 3.21Å; W282-C285 WeakPolarHBondContact O-CB 3.27Å; W282-C285 PolarHBondContact O-N 3.12Å; E283-C285 PolarHBondContact O-N 3.23Å; C285-G287 PolarHBondContact O-N 3.41Å; C285-K290 HydrophobicContact CB-CG 4.45Å; C285-K290 WeakPolarHBondContact O-CE 3.46Å
286	P	98.1	Very high	98	Very high	53 Å²	53	62.2 Å²	62.2	34%	0.344	32%	0.316	S	S	.	.			trans	-60.1	140.4	-179.2	-22.3	31.5	0	0	0	112.5	K245 K288 F289 K290	K245-P286 HydrophobicContact CD-CG 4.39Å; P286-K288 HydrophobicContact CB-CG 4.47Å; P286-K288 PolarHBondContact O-N 3.32Å; P286-F289 HydrophobicContact CB-CD2 4.04Å; P286-F289 HydrophobicContact CG-CD2 4.11Å; P286-F289 HydrophobicContact CG-CE2 4.47Å; P286-F289 PolarHBondContact O-N 3.1Å; P286-K290 PolarHBondContact O-N 2.97Å
287	G	98.1	Very high	98	Very high	52 Å²	52	62.5 Å²	62.5	54%	0.536	31%	0.312	S	S	.	.	H	α-helix	trans	-53.4	-32.9	-173.9	0	0	0	0	0	115.1	C285 F289 K290 K291	C285-G287 PolarHBondContact O-N 3.41Å; G287-F289 VanDerWaalsContact C-N 3.27Å; G287-F289 PolarHBondContact O-N 2.89Å; G287-K290 PolarHBondContact O-N 3.2Å; G287-K291 PolarHBondContact O-N 3.09Å
288	K	98.3	Very high	98	Very high	153 Å²	153	66.3 Å²	66.3	67%	0.665	33%	0.334	S	S	*	.	H	α-helix	trans	-59.7	-34.7	175.3	70.3	-177.6	-178.6	-176.4	0	113.8	P286 L292	P286-K288 HydrophobicContact CB-CG 4.47Å; P286-K288 PolarHBondContact O-N 3.32Å; K288-L292 WeakPolarHBondContact O-CB 3.34Å; K288-L292 PolarHBondContact O-N 3.02Å; K288-L292 VanDerWaalsContact O-N 3.13Å
289	F	98.5	Very high	97.9	Very high	15 Å²	15	66.8 Å²	66.8	7%	0.066	34%	0.337	C	S	.	.	H	α-helix	trans	-80.7	-35.3	178.4	-68.7	-72.4	0	0	0	111.6	K245 I248 K249 P286 G287 L292 F293	K245-F289 HydrophobicContact CB-CD1 4.31Å; K245-F289 HydrophobicContact CB-CD2 4.4Å; K245-F289 HydrophobicContact CB-CE1 4.41Å; K245-F289 HydrophobicContact CB-CE2 4.49Å; K245-F289 HydrophobicContact CB-CG 4.31Å; K245-F289 HydrophobicContact CB-CZ 4.49Å; K245-F289 HydrophobicContact CD-CD2 4.1Å; K245-F289 HydrophobicContact CD-CE2 4.12Å; K245-F289 HydrophobicContact CG-CB 4.36Å; K245-F289 HydrophobicContact CG-CD1 4.38Å; K245-F289 HydrophobicContact CG-CD2 3.71Å; K245-F289 HydrophobicContact CG-CE2 4.06Å; K245-F289 HydrophobicContact CG-CG 3.89Å; I248-F289 HydrophobicContact CD1-CB 4.25Å; K249-F289 HydrophobicContact CD-CE1 3.91Å; K249-F289 HydrophobicContact CD-CZ 4.5Å; K249-F289 HydrophobicContact CG-CD1 4.36Å; K249-F289 HydrophobicContact CG-CE1 3.75Å; P286-F289 HydrophobicContact CB-CD2 4.04Å; P286-F289 HydrophobicContact CG-CD2 4.11Å; P286-F289 HydrophobicContact CG-CE2 4.47Å; P286-F289 PolarHBondContact O-N 3.1Å; G287-F289 VanDerWaalsContact C-N 3.27Å; G287-F289 PolarHBondContact O-N 2.89Å; F289-L292 PolarHBondContact O-N 3.4Å; F289-F293 WeakPolarHBondContact O-CB 3.16Å; F289-F293 PolarHBondContact O-N 3.41Å
290	K	98.2	Very high	97.8	Very high	73 Å²	73	63.2 Å²	63.2	32%	0.317	32%	0.319	S	S	.	.	H	α-helix	trans	-58.9	-48	170.3	-65.6	-179.8	177.2	169.9	0	111.1	W282 E283 C285 P286 G287 L292 F293 S294	W282-K290 WeakPolarHBondContact O-CE 3.43Å; W282-K290 PolarHBondContact O-NZ 3.48Å; E283-K290 PolarHBondContact O-NZ 2.85Å; E283-K290 VanDerWaalsContact O-NZ 3.13Å; C285-K290 HydrophobicContact CB-CG 4.45Å; C285-K290 WeakPolarHBondContact O-CE 3.46Å; P286-K290 PolarHBondContact O-N 2.97Å; G287-K290 PolarHBondContact O-N 3.2Å; K290-L292 PolarHBondContact O-N 3.15Å; K290-F293 WeakPolarHBondContact O-CB 3.2Å; K290-F293 PolarHBondContact O-N 3.28Å; K290-F293 VanDerWaalsContact O-N 3.15Å; K290-S294 PolarHBondContact O-N 3.48Å; K290-S294 PolarHBondContact O-OG 3.03Å
291	K	98.4	Very high	97.7	Very high	138 Å²	138	61.6 Å²	61.6	60%	0.6	31%	0.313	S	S	*	.	H	α-helix	trans	-58.6	-47.8	176.1	-175.9	178.4	176.5	-178.5	0	111.9	G287 F293 S294 E295	G287-K291 PolarHBondContact O-N 3.09Å; K291-F293 VanDerWaalsContact C-N 3.29Å; K291-F293 PolarHBondContact O-N 2.9Å; K291-S294 PolarHBondContact O-N 2.81Å; K291-E295 WeakPolarHBondContact CE-OE1 3.41Å; K291-E295 WeakPolarHBondContact O-CG 3.33Å; K291-E295 PolarHBondContact O-N 3.32Å
292	L	98.6	Very high	97.6	Very high	50 Å²	50	66 Å²	66	26%	0.262	34%	0.341	S	S	.	.	H	α-helix	trans	-59.5	-40.4	175.9	177.2	59.4	0	0	0	111.8	I248 A252 K288 F289 K290 E295 L296	I248-L292 HydrophobicContact CG2-CB 4.17Å; I248-L292 HydrophobicContact CG2-CD2 3.78Å; I248-L292 HydrophobicContact CG2-CG 3.8Å; A252-L292 HydrophobicContact CB-CD1 4.27Å; A252-L292 HydrophobicContact CB-CD2 4.22Å; K288-L292 WeakPolarHBondContact O-CB 3.34Å; K288-L292 PolarHBondContact O-N 3.02Å; K288-L292 VanDerWaalsContact O-N 3.13Å; F289-L292 PolarHBondContact O-N 3.4Å; K290-L292 PolarHBondContact O-N 3.15Å; L292-E295 PolarHBondContact O-N 3.42Å; L292-L296 HydrophobicContact CG-CD1 4.39Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.45Å; L292-L296 PolarHBondContact O-N 3.2Å
293	F	98.6	Very high	97.5	Very high	9 Å²	9	67.2 Å²	67.2	4%	0.039	36%	0.356	C	S	.	.	H	α-helix	trans	-64.2	-47.3	176.3	-172.5	-116.2	0	0	0	111.5	I248 I267 L270 N271 W282 F289 K290 K291 E295 L296 E297	I248-F293 HydrophobicContact CD1-CB 3.92Å; I248-F293 HydrophobicContact CD1-CD2 4.46Å; I248-F293 HydrophobicContact CD1-CG 4.31Å; I248-F293 HydrophobicContact CG1-CB 4.06Å; I248-F293 HydrophobicContact CG1-CD2 3.85Å; I248-F293 HydrophobicContact CG1-CG 4.19Å; I248-F293 HydrophobicContact CG2-CB 4.24Å; I267-F293 HydrophobicContact CG1-CE2 4.49Å; I267-F293 HydrophobicContact CG2-CE2 4.18Å; I267-F293 HydrophobicContact CG2-CZ 4.37Å; L270-F293 HydrophobicContact CB-CE2 3.79Å; L270-F293 HydrophobicContact CB-CZ 3.64Å; L270-F293 HydrophobicContact CD1-CD2 4.04Å; L270-F293 HydrophobicContact CD1-CE2 3.57Å; L270-F293 HydrophobicContact CD1-CZ 4.25Å; L270-F293 HydrophobicContact CG-CE2 4.33Å; N271-F293 VanDerWaalsContact OD1-CE1 3.26Å; N271-F293 WeakPolarHBondContact OD1-CE1 3.47Å; N271-F293 WeakPolarHBondContact OD1-CZ 3.21Å; W282-F293 AromaticContact CH2-CD1 3.83Å; W282-F293 HydrophobicContact CH2-CD1 3.83Å; W282-F293 AromaticContact CH2-CE1 3.68Å; W282-F293 HydrophobicContact CH2-CE1 3.68Å; W282-F293 HydrophobicContact CH2-CG 4.43Å; W282-F293 HydrophobicContact CH2-CZ 4.17Å; W282-F293 AromaticContact CZ3-CD1 3.94Å; W282-F293 HydrophobicContact CZ3-CD1 3.94Å; W282-F293 HydrophobicContact CZ3-CE1 4.24Å; W282-F293 HydrophobicContact CZ3-CG 4.48Å; F289-F293 WeakPolarHBondContact O-CB 3.16Å; F289-F293 PolarHBondContact O-N 3.41Å; K290-F293 WeakPolarHBondContact O-CB 3.2Å; K290-F293 PolarHBondContact O-N 3.28Å; K290-F293 VanDerWaalsContact O-N 3.15Å; K291-F293 VanDerWaalsContact C-N 3.29Å; K291-F293 PolarHBondContact O-N 2.9Å; F293-E295 VanDerWaalsContact C-N 3.3Å; F293-E295 PolarHBondContact O-N 2.94Å; F293-L296 CarbonylContact O-C 3.49Å; F293-L296 WeakPolarHBondContact O-CA 3.4Å; F293-L296 WeakPolarHBondContact O-CB 3.49Å; F293-L296 PolarHBondContact O-N 3.45Å; F293-E297 HydrophobicContact CD1-CG 4.19Å; F293-E297 VanDerWaalsContact CE1-CD 3.48Å; F293-E297 HydrophobicContact CE1-CG 3.93Å; F293-E297 HydrophobicContact CE2-CG 4.43Å; F293-E297 HydrophobicContact CZ-CG 4.06Å; F293-E297 WeakPolarHBondContact O-CG 3.47Å; F293-E297 PolarHBondContact O-N 3.19Å
294	S	98.2	Very high	97.5	Very high	65 Å²	65	67.2 Å²	67.2	46%	0.455	36%	0.36	S	S	.	.	H	α-helix	trans	-59.6	-38	175.4	-56.9	0	0	0	0	112.9	K290 K291 L296 E297 L298	K290-S294 PolarHBondContact O-N 3.48Å; K290-S294 PolarHBondContact O-OG 3.03Å; K291-S294 PolarHBondContact O-N 2.81Å; S294-L296 VanDerWaalsContact C-N 3.32Å; S294-L296 PolarHBondContact O-N 2.88Å; S294-E297 WeakPolarHBondContact CA-OE2 3.36Å; S294-E297 PolarHBondContact O-N 2.84Å; S294-L298 WeakPolarHBondContact O-CG 3.29Å; S294-L298 PolarHBondContact O-N 3.03Å
295	E	97.8	Very high	97.4	Very high	103 Å²	103	65.4 Å²	65.4	48%	0.481	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-35.8	172.8	-73.5	171.7	-167.8	0	0	112.6	K291 L292 F293	K291-E295 WeakPolarHBondContact CE-OE1 3.41Å; K291-E295 WeakPolarHBondContact O-CG 3.33Å; K291-E295 PolarHBondContact O-N 3.32Å; L292-E295 PolarHBondContact O-N 3.42Å; F293-E295 VanDerWaalsContact C-N 3.3Å; F293-E295 PolarHBondContact O-N 2.94Å
296	L	98.2	Very high	97.4	Very high	6 Å²	6	66.7 Å²	66.7	3%	0.031	36%	0.362	C	S	.	.	H	α-helix	trans	-69.5	-41	173.7	-70.1	169.5	0	0	0	111.2	I248 A251 A252 K255 I267 L292 F293 S294 L298 I299	I248-L296 HydrophobicContact CG2-CD1 4.28Å; A251-L296 HydrophobicContact CB-CD1 3.99Å; A252-L296 HydrophobicContact CB-CD1 4.27Å; A252-L296 HydrophobicContact CB-CD2 4.46Å; K255-L296 HydrophobicContact CD-CD2 3.8Å; I267-L296 HydrophobicContact CD1-CB 3.82Å; I267-L296 HydrophobicContact CG1-CB 4.2Å; L292-L296 HydrophobicContact CG-CD1 4.39Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.45Å; L292-L296 PolarHBondContact O-N 3.2Å; F293-L296 CarbonylContact O-C 3.49Å; F293-L296 WeakPolarHBondContact O-CA 3.4Å; F293-L296 WeakPolarHBondContact O-CB 3.49Å; F293-L296 PolarHBondContact O-N 3.45Å; S294-L296 VanDerWaalsContact C-N 3.32Å; S294-L296 PolarHBondContact O-N 2.88Å; L296-L298 PolarHBondContact O-N 3.39Å; L296-I299 WeakPolarHBondContact O-CG2 3.5Å; L296-I299 PolarHBondContact O-N 2.97Å; L296-I299 VanDerWaalsContact O-N 3.15Å
297	E	97.6	Very high	97.4	Very high	57 Å²	57	69 Å²	69	27%	0.266	37%	0.367	S	S	.	.	H	α-helix	trans	-59.7	-31.4	179.2	-70.7	-179.3	103.9	0	0	113	I267 N271 F293 S294 I299 T300 D301	I267-E297 HydrophobicContact CG2-CG 4.11Å; N271-E297 PolarHBondContact ND2-OE1 3.28Å; N271-E297 PolarHBondContact OD1-OE1 2.86Å; N271-E297 VanDerWaalsContact OD1-OE1 3.11Å; F293-E297 HydrophobicContact CD1-CG 4.19Å; F293-E297 VanDerWaalsContact CE1-CD 3.48Å; F293-E297 HydrophobicContact CE1-CG 3.93Å; F293-E297 HydrophobicContact CE2-CG 4.43Å; F293-E297 HydrophobicContact CZ-CG 4.06Å; F293-E297 WeakPolarHBondContact O-CG 3.47Å; F293-E297 PolarHBondContact O-N 3.19Å; S294-E297 WeakPolarHBondContact CA-OE2 3.36Å; S294-E297 PolarHBondContact O-N 2.84Å; E297-I299 PolarHBondContact O-N 3.39Å; E297-I299 VanDerWaalsContact O-N 3.14Å; E297-T300 WeakPolarHBondContact O-CA 3.43Å; E297-T300 PolarHBondContact O-N 3.09Å; E297-T300 PolarHBondContact O-OG1 3.16Å; E297-D301 PolarHBondContact O-N 3.03Å
298	L	96.6	Very high	97.3	Very high	113 Å²	113	68.3 Å²	68.3	59%	0.592	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-55.3	-32.6	176.6	-67.5	175.7	0	0	0	113.2	S294 L296 T300 A308	S294-L298 WeakPolarHBondContact O-CG 3.29Å; S294-L298 PolarHBondContact O-N 3.03Å; L296-L298 PolarHBondContact O-N 3.39Å; L298-T300 PolarHBondContact O-N 2.93Å; L298-A308 WeakPolarHBondContact O-CB 3.27Å
299	I	95.1	Very high	97.3	Very high	11 Å²	11	61.1 Å²	61.1	6%	0.056	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-73.3	-20.2	178.1	-153.5	173.3	0	0	0	112.1	K255 L260 F264 I267 L296 E297 Y309 A312	K255-I299 HydrophobicContact CD-CD1 4.41Å; L260-I299 HydrophobicContact CD1-CD1 4.32Å; L260-I299 HydrophobicContact CD2-CD1 3.94Å; F264-I299 HydrophobicContact CD2-CG2 4.42Å; F264-I299 HydrophobicContact CE2-CG1 4.33Å; F264-I299 HydrophobicContact CE2-CG2 3.72Å; F264-I299 HydrophobicContact CZ-CG2 4.16Å; F264-I299 VanDerWaalsContact CZ-O 3.26Å; F264-I299 WeakPolarHBondContact CZ-O 3.41Å; I267-I299 HydrophobicContact CD1-CG2 4.46Å; L296-I299 WeakPolarHBondContact O-CG2 3.5Å; L296-I299 PolarHBondContact O-N 2.97Å; L296-I299 VanDerWaalsContact O-N 3.15Å; E297-I299 PolarHBondContact O-N 3.39Å; E297-I299 VanDerWaalsContact O-N 3.14Å; I299-Y309 HydrophobicContact CG1-CD2 4.42Å; I299-Y309 WeakPolarHBondContact O-CB 3.41Å; I299-A312 HydrophobicContact CD1-CB 3.99Å; I299-A312 HydrophobicContact CG1-CB 4.32Å
300	T	95.1	Very high	97.3	Very high	29 Å²	29	63.8 Å²	63.8	18%	0.178	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-92.7	-7.7	-177.9	69.3	0	0	0	0	113.6	F264 I267 E297 L298	F264-T300 HydrophobicContact CD1-CG2 3.86Å; F264-T300 HydrophobicContact CD2-CG2 4.42Å; F264-T300 HydrophobicContact CE1-CG2 3.75Å; F264-T300 HydrophobicContact CE2-CG2 4.33Å; F264-T300 HydrophobicContact CG-CG2 4.22Å; F264-T300 HydrophobicContact CZ-CG2 4Å; I267-T300 HydrophobicContact CB-CG2 4.25Å; I267-T300 HydrophobicContact CD1-CG2 3.94Å; I267-T300 HydrophobicContact CG2-CG2 3.82Å; E297-T300 WeakPolarHBondContact O-CA 3.43Å; E297-T300 PolarHBondContact O-N 3.09Å; E297-T300 PolarHBondContact O-OG1 3.16Å; L298-T300 PolarHBondContact O-N 2.93Å
301	D	95.9	Very high	97.2	Very high	62 Å²	62	64.6 Å²	64.6	33%	0.332	34%	0.339	S	S	.	.			trans	-53.3	121.8	-178.8	-177.3	-1.7	0	0	0	111.4	E297 S303 H306	E297-D301 PolarHBondContact O-N 3.03Å; D301-S303 PolarHBondContact O-N 3.49Å; D301-S303 WeakPolarHBondContact OD1-CB 3.23Å; D301-S303 PolarHBondContact OD1-N 3.46Å; D301-S303 PolarHBondContact OD1-OG 3.33Å; D301-S303 PolarHBondContact OD2-OG 2.95Å; D301-H306 WeakPolarHBondContact O-CA 3.4Å; D301-H306 PolarHBondContact O-ND1 2.92Å
302	P	96.2	Very high	97.1	Very high	91 Å²	91	58.7 Å²	58.7	59%	0.591	32%	0.315	S	S	*	.			trans	-73.9	-12	178.6	31.2	-36.1	0	0	0	114	N305 H306	P302-N305 PolarHBondContact O-N 3.05Å; P302-H306 PolarHBondContact O-N 2.85Å; P302-H306 VanDerWaalsContact O-N 3.14Å
303	S	97.2	Very high	97	Very high	65 Å²	65	57 Å²	57	46%	0.455	31%	0.306	S	S	.	.	H	α-helix	trans	-55.2	142.2	-176.2	-59.6	0	0	0	0	112.8	D301 N305 H306 K307	D301-S303 PolarHBondContact O-N 3.49Å; D301-S303 WeakPolarHBondContact OD1-CB 3.23Å; D301-S303 PolarHBondContact OD1-N 3.46Å; D301-S303 PolarHBondContact OD1-OG 3.33Å; D301-S303 PolarHBondContact OD2-OG 2.95Å; S303-N305 PolarHBondContact O-N 3.42Å; S303-H306 PolarHBondContact O-N 2.95Å; S303-H306 VanDerWaalsContact O-N 3.13Å; S303-K307 PolarHBondContact O-N 3.32Å
304	L	96.5	Very high	96.9	Very high	141 Å²	141	65.3 Å²	65.3	74%	0.738	34%	0.342	S	S	*	.	H	α-helix	trans	51.7	41.8	179.7	-58.1	173.1	0	0	0	112.7	K307	L304-K307 HydrophobicContact CB-CB 3.86Å; L304-K307 HydrophobicContact CB-CD 4.35Å; L304-K307 HydrophobicContact CD1-CD 3.83Å
305	N	96.1	Very high	96.7	Very high	85 Å²	85	70.6 Å²	70.6	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	57	54.3	-175.7	-175	18.9	0	0	0	112.3	P302 S303 K307 R310	P302-N305 PolarHBondContact O-N 3.05Å; S303-N305 PolarHBondContact O-N 3.42Å; N305-K307 VanDerWaalsContact C-N 3.34Å; N305-K307 PolarHBondContact O-N 3.47Å; N305-R310 PolarHBondContact ND2-NH2 3.12Å; N305-R310 WeakPolarHBondContact O-CD 3.22Å; N305-R310 PolarHBondContact O-NE 3.47Å; N305-R310 PolarHBondContact OD1-NH2 3.32Å
306	H	97.8	Very high	96.6	Very high	29 Å²	29	67.2 Å²	67.2	13%	0.134	34%	0.337	C	S	.	.	H	α-helix	trans	55.7	43.8	-179.5	-59.7	-91.3	0	0	0	113.6	D301 P302 S303 A308 Y309 R310 L326	D301-H306 WeakPolarHBondContact O-CA 3.4Å; D301-H306 PolarHBondContact O-ND1 2.92Å; P302-H306 PolarHBondContact O-N 2.85Å; P302-H306 VanDerWaalsContact O-N 3.14Å; S303-H306 PolarHBondContact O-N 2.95Å; S303-H306 VanDerWaalsContact O-N 3.13Å; H306-A308 VanDerWaalsContact C-N 3.31Å; H306-A308 PolarHBondContact O-N 3.36Å; H306-Y309 WeakPolarHBondContact O-CB 3.18Å; H306-Y309 PolarHBondContact O-N 3.16Å; H306-R310 WeakPolarHBondContact O-CG 3.36Å; H306-R310 PolarHBondContact O-N 3.15Å; H306-L326 HydrophobicContact CB-CD2 3.78Å; H306-L326 VanDerWaalsContact CD2-CD1 3.49Å; H306-L326 WeakPolarHBondContact CD2-CD1 3.44Å
307	K	97.9	Very high	96.3	Very high	103 Å²	103	74.5 Å²	74.5	45%	0.448	37%	0.368	S	S	.	.	H	α-helix	trans	-53.9	-45.4	-176.5	178.9	178.4	175.4	-178.9	0	112.6	S303 L304 N305 Y309 R310 E311	S303-K307 PolarHBondContact O-N 3.32Å; L304-K307 HydrophobicContact CB-CB 3.86Å; L304-K307 HydrophobicContact CB-CD 4.35Å; L304-K307 HydrophobicContact CD1-CD 3.83Å; N305-K307 VanDerWaalsContact C-N 3.34Å; N305-K307 PolarHBondContact O-N 3.47Å; K307-Y309 PolarHBondContact O-N 3.42Å; K307-R310 PolarHBondContact O-N 3.43Å; K307-E311 WeakPolarHBondContact CE-OE1 3.47Å; K307-E311 HydrophobicContact CG-CG 4.3Å; K307-E311 IonicContact NZ-OE1 2.75Å; K307-E311 WeakPolarHBondContact O-CG 3.26Å; K307-E311 PolarHBondContact O-N 2.88Å
308	A	97.4	Very high	96.1	Very high	37 Å²	37	72.8 Å²	72.8	31%	0.306	36%	0.362	S	S	.	.	H	α-helix	trans	-59.7	-45.6	-179.7	0	0	0	0	0	112.3	L298 H306 A312	L298-A308 WeakPolarHBondContact O-CB 3.27Å; H306-A308 VanDerWaalsContact C-N 3.31Å; H306-A308 PolarHBondContact O-N 3.36Å; A308-A312 VanDerWaalsContact O-CB 3.32Å; A308-A312 WeakPolarHBondContact O-CB 3.23Å; A308-A312 PolarHBondContact O-N 3.25Å; A308-A312 VanDerWaalsContact O-N 3.08Å
309	Y	98.1	Very high	96	Very high	1 Å²	1	68.7 Å²	68.7	0%	0.004	34%	0.342	C	S	.	.	H	α-helix	trans	-57.8	-53.4	171.8	171.6	-98.4	0	0	0	111.4	L260 F264 I299 H306 K307 E311 A312 F313 F323 L326	L260-Y309 HydrophobicContact CB-CE2 4.32Å; L260-Y309 HydrophobicContact CD1-CD2 4.09Å; L260-Y309 HydrophobicContact CD1-CE2 3.55Å; F264-Y309 AromaticContact CE2-CD2 3.55Å; F264-Y309 HydrophobicContact CE2-CD2 3.55Å; F264-Y309 AromaticContact CE2-CE2 3.9Å; F264-Y309 HydrophobicContact CE2-CE2 3.9Å; F264-Y309 AromaticContact CZ-CD2 3.45Å; F264-Y309 HydrophobicContact CZ-CD2 3.45Å; F264-Y309 VanDerWaalsContact CZ-CD2 3.45Å; F264-Y309 HydrophobicContact CZ-CE2 4.07Å; F264-Y309 HydrophobicContact CZ-CG 4.16Å; I299-Y309 HydrophobicContact CG1-CD2 4.42Å; I299-Y309 WeakPolarHBondContact O-CB 3.41Å; H306-Y309 WeakPolarHBondContact O-CB 3.18Å; H306-Y309 PolarHBondContact O-N 3.16Å; K307-Y309 PolarHBondContact O-N 3.42Å; Y309-E311 VanDerWaalsContact C-N 3.34Å; Y309-E311 PolarHBondContact O-N 3.07Å; Y309-A312 PolarHBondContact O-N 2.97Å; Y309-F313 HydrophobicContact CE1-CB 4.24Å; Y309-F313 HydrophobicContact CE1-CG 4.34Å; Y309-F313 HydrophobicContact CE2-CB 4.49Å; Y309-F313 WeakPolarHBondContact O-CB 3.35Å; Y309-F313 PolarHBondContact O-N 3.36Å; Y309-F323 HydrophobicContact CE2-CB 3.91Å; Y309-F323 PolarHBondContact OH-N 2.79Å; Y309-L326 HydrophobicContact CD1-CD2 3.36Å; Y309-L326 HydrophobicContact CE1-CD2 3.57Å; Y309-L326 HydrophobicContact CE1-CG 4.48Å; Y309-L326 HydrophobicContact CG-CD2 4Å
310	R	97.8	Very high	96	Very high	72 Å²	72	68.9 Å²	68.9	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-42.3	-173	-68.6	-177.2	-171.1	-81.3	1	111.7	N305 H306 K307 K314 D330	N305-R310 PolarHBondContact ND2-NH2 3.12Å; N305-R310 WeakPolarHBondContact O-CD 3.22Å; N305-R310 PolarHBondContact O-NE 3.47Å; N305-R310 PolarHBondContact OD1-NH2 3.32Å; H306-R310 WeakPolarHBondContact O-CG 3.36Å; H306-R310 PolarHBondContact O-N 3.15Å; K307-R310 PolarHBondContact O-N 3.43Å; R310-K314 VanDerWaalsContact O-CB 3.27Å; R310-K314 WeakPolarHBondContact O-CB 3.49Å; R310-K314 PolarHBondContact O-N 2.94Å; R310-D330 IonicContact CZ-OD1 2.66Å; R310-D330 IonicContact CZ-OD2 2.71Å; R310-D330 IonicContact NH1-OD1 3.39Å; R310-D330 IonicContact NH1-OD2 3.96Å; R310-D330 PolarHBondContact NH1-OD2 2.94Å; R310-D330 IonicContact NH2-OD1 3.98Å; R310-D330 PolarHBondContact NH2-OD1 3.34Å; R310-D330 IonicContact NH2-OD2 3.55Å; R310-D330 PolarHBondContact NH2-OD2 3.33Å
311	E	97	Very high	96.2	Very high	90 Å²	90	67.7 Å²	67.7	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-65.4	-46.6	175.9	-72.3	-176.1	177.1	0	0	112.1	K307 Y309 K314 R315	K307-E311 WeakPolarHBondContact CE-OE1 3.47Å; K307-E311 HydrophobicContact CG-CG 4.3Å; K307-E311 IonicContact NZ-OE1 2.75Å; K307-E311 WeakPolarHBondContact O-CG 3.26Å; K307-E311 PolarHBondContact O-N 2.88Å; Y309-E311 VanDerWaalsContact C-N 3.34Å; Y309-E311 PolarHBondContact O-N 3.07Å; E311-K314 PolarHBondContact O-N 3.03Å; E311-R315 WeakPolarHBondContact O-CG 3.29Å; E311-R315 PolarHBondContact O-N 3.11Å
312	A	96.3	Very high	96.2	Very high	13 Å²	13	64.7 Å²	64.7	11%	0.107	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-46.5	177.1	0	0	0	0	0	111.3	I299 A308 Y309 K314 R315 M316	I299-A312 HydrophobicContact CD1-CB 3.99Å; I299-A312 HydrophobicContact CG1-CB 4.32Å; A308-A312 VanDerWaalsContact O-CB 3.32Å; A308-A312 WeakPolarHBondContact O-CB 3.23Å; A308-A312 PolarHBondContact O-N 3.25Å; A308-A312 VanDerWaalsContact O-N 3.08Å; Y309-A312 PolarHBondContact O-N 2.97Å; A312-K314 PolarHBondContact O-N 3.4Å; A312-R315 PolarHBondContact O-N 2.88Å; A312-M316 HydrophobicContact CB-CE 4.24Å; A312-M316 WeakPolarHBondContact O-CG 3.4Å; A312-M316 PolarHBondContact O-N 3.05Å
313	F	96.6	Very high	96.3	Very high	15 Å²	15	61.4 Å²	61.4	7%	0.066	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-39	-179.7	-176.3	-110.4	0	0	0	112.4	L260 Y309 R315 M316 K320 P322 M360 C364	L260-F313 HydrophobicContact CD1-CB 4.37Å; L260-F313 HydrophobicContact CD1-CD2 3.79Å; Y309-F313 HydrophobicContact CE1-CB 4.24Å; Y309-F313 HydrophobicContact CE1-CG 4.34Å; Y309-F313 HydrophobicContact CE2-CB 4.49Å; Y309-F313 WeakPolarHBondContact O-CB 3.35Å; Y309-F313 PolarHBondContact O-N 3.36Å; F313-R315 VanDerWaalsContact C-N 3.33Å; F313-R315 PolarHBondContact O-N 3.22Å; F313-M316 PolarHBondContact O-N 3.36Å; F313-K320 HydrophobicContact CD2-CD 4.06Å; F313-K320 HydrophobicContact CE2-CD 3.63Å; F313-K320 HydrophobicContact CE2-CG 3.96Å; F313-K320 HydrophobicContact CZ-CD 4.14Å; F313-K320 HydrophobicContact CZ-CG 4.46Å; F313-K320 PolarHBondContact O-NZ 2.66Å; F313-P322 HydrophobicContact CE2-CB 3.71Å; F313-P322 HydrophobicContact CZ-CB 3.64Å; F313-P322 HydrophobicContact CZ-CG 4.45Å; F313-M360 HydrophobicContact CE1-SD 3.78Å; F313-M360 HydrophobicContact CZ-SD 4.38Å; F313-C364 WeakPolarHBondContact CZ-SG 3.08Å
314	K	95.5	Very high	96.2	Very high	183 Å²	183	58.3 Å²	58.3	80%	0.796	27%	0.274	S	S	*	.	H	α-helix	trans	-63.2	-37.2	174.8	-175.2	177.6	179.6	179.5	0	112.3	R310 E311 A312 M316	R310-K314 VanDerWaalsContact O-CB 3.27Å; R310-K314 WeakPolarHBondContact O-CB 3.49Å; R310-K314 PolarHBondContact O-N 2.94Å; E311-K314 PolarHBondContact O-N 3.03Å; A312-K314 PolarHBondContact O-N 3.4Å; K314-M316 VanDerWaalsContact C-N 3.34Å
315	R	95	Very high	96.2	Very high	176 Å²	176	53.7 Å²	53.7	66%	0.664	25%	0.252	S	S	*	.	H	α-helix	trans	-72.6	-24.7	177.5	-68.7	-173.7	-57.7	-102.9	2	113.4	E311 A312 F313 K317	E311-R315 WeakPolarHBondContact O-CG 3.29Å; E311-R315 PolarHBondContact O-N 3.11Å; A312-R315 PolarHBondContact O-N 2.88Å; F313-R315 VanDerWaalsContact C-N 3.33Å; F313-R315 PolarHBondContact O-N 3.22Å; R315-K317 PolarHBondContact O-N 2.89Å
316	M	94.7	Very high	96.2	Very high	33 Å²	33	49.9 Å²	49.9	16%	0.163	23%	0.232	C	C	.	.	S	Bend	trans	-71.9	127	178.2	-68.7	178.3	-157.3	0	0	110.9	R258 L260 A312 F313 K314 K320	R258-M316 HydrophobicContact CB-SD 4.41Å; L260-M316 HydrophobicContact CD1-CE 4.06Å; L260-M316 HydrophobicContact CD1-SD 4Å; L260-M316 HydrophobicContact CD2-CE 3.99Å; L260-M316 HydrophobicContact CD2-SD 4.33Å; L260-M316 HydrophobicContact CG-CE 4.4Å; L260-M316 HydrophobicContact CG-SD 4.22Å; A312-M316 HydrophobicContact CB-CE 4.24Å; A312-M316 WeakPolarHBondContact O-CG 3.4Å; A312-M316 PolarHBondContact O-N 3.05Å; F313-M316 PolarHBondContact O-N 3.36Å; K314-M316 VanDerWaalsContact C-N 3.34Å; M316-K320 HydrophobicContact CB-CD 3.81Å; M316-K320 WeakPolarHBondContact O-CD 3.42Å; M316-K320 PolarHBondContact O-NZ 2.99Å
317	K	92.9	Very high	96.1	Very high	159 Å²	159	48.7 Å²	48.7	69%	0.691	23%	0.226	S	C	*	.	P	Polyproline II helix	trans	-75.7	147.1	170.7	-64.2	-174.4	179	-176.7	0	110.3	R258 R315	R258-K317 WeakPolarHBondContact CD-O 3.41Å; R258-K317 PolarHBondContact NH1-O 3.4Å; R315-K317 PolarHBondContact O-N 2.89Å
318	P	93.3	Very high	95.9	Very high	20 Å²	20	44 Å²	44	13%	0.13	21%	0.207	C	C	.	.	S	Bend	trans	-55.8	158.6	162.9	-22.1	34.1	0	0	0	111.9	R258 H363 S366	R258-P318 PolarHBondContact NH1-O 3.16Å; R258-P318 VanDerWaalsContact NH1-O 3.14Å; P318-H363 WeakPolarHBondContact CB-O 3.44Å; P318-H363 WeakPolarHBondContact CG-NE2 3.37Å; P318-H363 WeakPolarHBondContact CG-O 3.45Å; P318-S366 WeakPolarHBondContact CB-O 3.27Å
319	P	94.1	Very high	95.8	Very high	27 Å²	27	47.9 Å²	47.9	18%	0.175	22%	0.216	C	C	.	.	S	Bend	cis	-69.1	143.5	-10.2	25.4	-28.7	0	0	0	111.5	W185 R258 P369	W185-P319 HydrophobicContact CH2-CB 3.23Å; W185-P319 HydrophobicContact CZ2-CB 3.79Å; W185-P319 HydrophobicContact CZ3-CB 3.77Å; R258-P319 WeakPolarHBondContact CD-O 3.43Å; P319-P369 HydrophobicContact CG-CB 4.03Å
320	K	95.8	Very high	95.6	Very high	16 Å²	16	49.1 Å²	49.1	7%	0.07	22%	0.223	C	C	.	.			trans	-153.5	147	178.6	62.5	-172.9	179.2	-175.2	0	111.3	R258 F313 M316 C364	R258-K320 HydrophobicContact CB-CB 3.82Å; F313-K320 HydrophobicContact CD2-CD 4.06Å; F313-K320 HydrophobicContact CE2-CD 3.63Å; F313-K320 HydrophobicContact CE2-CG 3.96Å; F313-K320 HydrophobicContact CZ-CD 4.14Å; F313-K320 HydrophobicContact CZ-CG 4.46Å; F313-K320 PolarHBondContact O-NZ 2.66Å; M316-K320 HydrophobicContact CB-CD 3.81Å; M316-K320 WeakPolarHBondContact O-CD 3.42Å; M316-K320 PolarHBondContact O-NZ 2.99Å; K320-C364 VanDerWaalsContact CE-SG 3.58Å; K320-C364 HydrophobicContact CG-CB 3.94Å; K320-C364 PolarHBondContact N-O 3.33Å; K320-C364 VanDerWaalsContact N-O 3.1Å; K320-C364 WeakPolarHBondContact O-CB 3.44Å
321	I	97.5	Very high	95.5	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.015	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-104.7	112.4	176.6	-49	177.9	0	0	0	108	D184 W185 F188 R258 N259 L260 N261	D184-I321 HydrophobicContact CB-CD1 3.66Å; W185-I321 HydrophobicContact CB-CD1 4.06Å; W185-I321 HydrophobicContact CE3-CD1 4.04Å; W185-I321 HydrophobicContact CE3-CG1 3.63Å; W185-I321 HydrophobicContact CZ3-CG1 4.14Å; F188-I321 HydrophobicContact CB-CG2 4.38Å; F188-I321 HydrophobicContact CD1-CG1 4.41Å; F188-I321 HydrophobicContact CD1-CG2 4.43Å; F188-I321 HydrophobicContact CG-CG2 4.25Å; R258-I321 PolarHBondContact O-N 3.15Å; N259-I321 HydrophobicContact CB-CD1 4.2Å; L260-I321 WeakPolarHBondContact CB-O 3.29Å; L260-I321 PolarHBondContact N-O 3.01Å; N261-I321 HydrophobicContact CB-CG2 3.72Å
322	P	97.6	Very high	95.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.203	C	C	.	.			trans	-69.5	161.5	176.8	28.5	-33.7	0	0	0	112	F188 N261 F313 M324 L327	F188-P322 HydrophobicContact CE2-CG 4.13Å; F188-P322 HydrophobicContact CZ-CG 4.04Å; N261-P322 WeakPolarHBondContact CB-O 3.31Å; F313-P322 HydrophobicContact CE2-CB 3.71Å; F313-P322 HydrophobicContact CZ-CB 3.64Å; F313-P322 HydrophobicContact CZ-CG 4.45Å; P322-M324 HydrophobicContact CG-CG 4.37Å; P322-M324 HydrophobicContact CG-SD 3.64Å; P322-M324 PolarHBondContact O-N 3.48Å; P322-L327 HydrophobicContact CB-CD1 3.38Å; P322-L327 HydrophobicContact CB-CG 4.1Å; P322-L327 HydrophobicContact CG-CD1 3.64Å
323	F	97.6	Very high	95.3	Very high	21 Å²	21	50.3 Å²	50.3	9%	0.092	23%	0.23	C	C	.	.			trans	-72.6	94.5	161	-179.2	-122.7	0	0	0	108.9	F264 M268 Y309 P325 L326	F264-F323 HydrophobicContact CB-CD2 3.49Å; F264-F323 VanDerWaalsContact CB-CD2 3.49Å; F264-F323 HydrophobicContact CB-CE2 3.78Å; F264-F323 HydrophobicContact CB-CG 4.03Å; F264-F323 HydrophobicContact CD1-CB 4.3Å; F264-F323 AromaticContact CD1-CD1 3.63Å; F264-F323 HydrophobicContact CD1-CD1 3.63Å; F264-F323 AromaticContact CD1-CD2 3.91Å; F264-F323 HydrophobicContact CD1-CD2 3.91Å; F264-F323 AromaticContact CD1-CE1 3.84Å; F264-F323 HydrophobicContact CD1-CE1 3.84Å; F264-F323 HydrophobicContact CD1-CE2 4.09Å; F264-F323 AromaticContact CD1-CG 3.68Å; F264-F323 HydrophobicContact CD1-CG 3.68Å; F264-F323 HydrophobicContact CD1-CZ 4.06Å; F264-F323 HydrophobicContact CD2-CB 4.17Å; F264-F323 HydrophobicContact CD2-CG 4.34Å; F264-F323 AromaticContact CE1-CD1 3.84Å; F264-F323 HydrophobicContact CE1-CD1 3.84Å; F264-F323 HydrophobicContact CE1-CE1 4.22Å; F264-F323 HydrophobicContact CE1-CG 4.18Å; F264-F323 HydrophobicContact CE2-CB 4.42Å; F264-F323 HydrophobicContact CG-CB 4.09Å; F264-F323 HydrophobicContact CG-CD1 4.21Å; F264-F323 AromaticContact CG-CD2 3.77Å; F264-F323 HydrophobicContact CG-CD2 3.77Å; F264-F323 HydrophobicContact CG-CE2 4.24Å; F264-F323 AromaticContact CG-CG 3.76Å; F264-F323 HydrophobicContact CG-CG 3.76Å; M268-F323 HydrophobicContact SD-CE2 4.32Å; M268-F323 HydrophobicContact SD-CZ 4Å; Y309-F323 HydrophobicContact CE2-CB 3.91Å; Y309-F323 PolarHBondContact OH-N 2.79Å; F323-P325 VanDerWaalsContact C-CD 3.47Å; F323-P325 HydrophobicContact CD2-CG 4.24Å; F323-P325 HydrophobicContact CE1-CB 3.97Å; F323-P325 HydrophobicContact CE1-CG 4.32Å; F323-P325 HydrophobicContact CE2-CB 4.22Å; F323-P325 HydrophobicContact CE2-CG 3.67Å; F323-P325 HydrophobicContact CZ-CB 3.75Å; F323-P325 HydrophobicContact CZ-CG 3.71Å; F323-L326 HydrophobicContact CD1-CB 3.61Å; F323-L326 HydrophobicContact CE1-CB 4.11Å; F323-L326 PolarHBondContact O-N 3.24Å
324	M	96	Very high	95.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57	-40.2	-171.9	-75.9	-60.2	-65.2	0	0	114.7	F188 L196 L213 L216 L217 P322 L326 L327 L328 I361	F188-M324 HydrophobicContact CD2-SD 4.32Å; F188-M324 HydrophobicContact CE2-SD 3.79Å; L196-M324 HydrophobicContact CD2-CE 3.54Å; L213-M324 HydrophobicContact CD1-CE 3.71Å; L216-M324 HydrophobicContact CD2-CG 3.73Å; L217-M324 HydrophobicContact CD2-CB 4.09Å; P322-M324 HydrophobicContact CG-CG 4.37Å; P322-M324 HydrophobicContact CG-SD 3.64Å; P322-M324 PolarHBondContact O-N 3.48Å; M324-L326 VanDerWaalsContact C-N 3.25Å; M324-L326 PolarHBondContact O-N 3.49Å; M324-L327 PolarHBondContact O-N 3.2Å; M324-L327 VanDerWaalsContact O-N 3.08Å; M324-L328 HydrophobicContact CE-CD2 4.44Å; M324-L328 HydrophobicContact CE-CG 4.45Å; M324-L328 WeakPolarHBondContact O-CG 3.42Å; M324-L328 PolarHBondContact O-N 3.29Å; M324-I361 HydrophobicContact CE-CD1 4.44Å
325	P	95.1	Very high	95.2	Very high	45 Å²	45	43.7 Å²	43.7	29%	0.292	20%	0.203	S	C	.	.	H	α-helix	trans	-55.1	-38.2	178.2	-28.8	36.5	0	0	0	113.9	L217 F323 K329	L217-P325 HydrophobicContact CD2-CG 4.18Å; F323-P325 VanDerWaalsContact C-CD 3.47Å; F323-P325 HydrophobicContact CD2-CG 4.24Å; F323-P325 HydrophobicContact CE1-CB 3.97Å; F323-P325 HydrophobicContact CE1-CG 4.32Å; F323-P325 HydrophobicContact CE2-CB 4.22Å; F323-P325 HydrophobicContact CE2-CG 3.67Å; F323-P325 HydrophobicContact CZ-CB 3.75Å; F323-P325 HydrophobicContact CZ-CG 3.71Å; P325-K329 WeakPolarHBondContact O-CB 3.18Å; P325-K329 PolarHBondContact O-N 3.02Å
326	L	95.9	Very high	95.2	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-70.5	-39.2	177.6	178.1	58.7	0	0	0	112.1	H306 Y309 F323 M324 K329 D330	H306-L326 HydrophobicContact CB-CD2 3.78Å; H306-L326 VanDerWaalsContact CD2-CD1 3.49Å; H306-L326 WeakPolarHBondContact CD2-CD1 3.44Å; Y309-L326 HydrophobicContact CD1-CD2 3.36Å; Y309-L326 HydrophobicContact CE1-CD2 3.57Å; Y309-L326 HydrophobicContact CE1-CG 4.48Å; Y309-L326 HydrophobicContact CG-CD2 4Å; F323-L326 HydrophobicContact CD1-CB 3.61Å; F323-L326 HydrophobicContact CE1-CB 4.11Å; F323-L326 PolarHBondContact O-N 3.24Å; M324-L326 VanDerWaalsContact C-N 3.25Å; M324-L326 PolarHBondContact O-N 3.49Å; L326-K329 HydrophobicContact CD1-CD 4.43Å; L326-K329 WeakPolarHBondContact O-CB 3.32Å; L326-K329 PolarHBondContact O-N 3.21Å; L326-D330 PolarHBondContact O-N 3.06Å; L326-D330 VanDerWaalsContact O-N 3.14Å
327	L	95.5	Very high	95.2	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-69.3	-37.6	177.5	-59.5	-166.5	0	0	0	112	P322 M324 K329 D330 I331 M360 I361	P322-L327 HydrophobicContact CB-CD1 3.38Å; P322-L327 HydrophobicContact CB-CG 4.1Å; P322-L327 HydrophobicContact CG-CD1 3.64Å; M324-L327 PolarHBondContact O-N 3.2Å; M324-L327 VanDerWaalsContact O-N 3.08Å; L327-K329 VanDerWaalsContact C-N 3.33Å; L327-D330 WeakPolarHBondContact O-CB 3.4Å; L327-D330 PolarHBondContact O-N 3.34Å; L327-I331 PolarHBondContact O-N 3.16Å; L327-M360 HydrophobicContact CD1-CE 3.92Å; L327-M360 HydrophobicContact CD1-SD 4.07Å; L327-M360 HydrophobicContact CD2-CE 3.96Å; L327-M360 HydrophobicContact CG-CE 4.47Å; L327-I361 HydrophobicContact CB-CD1 4.17Å; L327-I361 HydrophobicContact CD1-CD1 4.13Å; L327-I361 HydrophobicContact CD1-CG1 3.58Å
328	L	94.9	Very high	95.4	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-37.3	173.7	-66.2	175.5	0	0	0	111.5	L196 Y199 L213 L217 M324 D330 I331 T332	L196-L328 HydrophobicContact CD2-CD2 4Å; Y199-L328 HydrophobicContact CD1-CD1 4.07Å; Y199-L328 HydrophobicContact CD1-CD2 4.17Å; Y199-L328 HydrophobicContact CE1-CD1 3.82Å; L213-L328 HydrophobicContact CD1-CD1 4.24Å; L213-L328 HydrophobicContact CD2-CD1 4.4Å; L213-L328 HydrophobicContact CD2-CD2 4.19Å; L217-L328 HydrophobicContact CD1-CD1 3.68Å; L217-L328 HydrophobicContact CD2-CD1 3.78Å; L217-L328 HydrophobicContact CG-CD1 4.25Å; M324-L328 HydrophobicContact CE-CD2 4.44Å; M324-L328 HydrophobicContact CE-CG 4.45Å; M324-L328 WeakPolarHBondContact O-CG 3.42Å; M324-L328 PolarHBondContact O-N 3.29Å; L328-D330 VanDerWaalsContact C-N 3.26Å; L328-D330 PolarHBondContact O-N 3.24Å; L328-I331 HydrophobicContact CD2-CD1 4.41Å; L328-I331 PolarHBondContact O-N 3.36Å; L328-T332 PolarHBondContact O-N 3.06Å; L328-T332 PolarHBondContact O-OG1 2.74Å; L328-T332 VanDerWaalsContact O-OG1 3.09Å
329	K	94.4	Very high	95.4	Very high	117 Å²	117	43.7 Å²	43.7	51%	0.509	23%	0.225	S	C	.	.	H	α-helix	trans	-57.4	-39.9	172	-178.6	-174.8	175	-175.9	0	111.6	P325 L326 L327 T332 F333	P325-K329 WeakPolarHBondContact O-CB 3.18Å; P325-K329 PolarHBondContact O-N 3.02Å; L326-K329 HydrophobicContact CD1-CD 4.43Å; L326-K329 WeakPolarHBondContact O-CB 3.32Å; L326-K329 PolarHBondContact O-N 3.21Å; L327-K329 VanDerWaalsContact C-N 3.33Å; K329-T332 PolarHBondContact O-N 2.89Å; K329-F333 WeakPolarHBondContact O-CB 3.49Å; K329-F333 PolarHBondContact O-N 2.77Å
330	D	95.1	Very high	95.4	Very high	28 Å²	28	44.5 Å²	44.5	15%	0.15	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-45.7	176	-66.5	-22.3	0	0	0	111.3	R310 L326 L327 L328 T332 F333 I334	R310-D330 IonicContact CZ-OD1 2.66Å; R310-D330 IonicContact CZ-OD2 2.71Å; R310-D330 IonicContact NH1-OD1 3.39Å; R310-D330 IonicContact NH1-OD2 3.96Å; R310-D330 PolarHBondContact NH1-OD2 2.94Å; R310-D330 IonicContact NH2-OD1 3.98Å; R310-D330 PolarHBondContact NH2-OD1 3.34Å; R310-D330 IonicContact NH2-OD2 3.55Å; R310-D330 PolarHBondContact NH2-OD2 3.33Å; L326-D330 PolarHBondContact O-N 3.06Å; L326-D330 VanDerWaalsContact O-N 3.14Å; L327-D330 WeakPolarHBondContact O-CB 3.4Å; L327-D330 PolarHBondContact O-N 3.34Å; L328-D330 VanDerWaalsContact C-N 3.26Å; L328-D330 PolarHBondContact O-N 3.24Å; D330-T332 PolarHBondContact O-N 3.24Å; D330-F333 PolarHBondContact O-N 3.03Å; D330-I334 WeakPolarHBondContact O-CD1 3.49Å; D330-I334 VanDerWaalsContact O-CG1 3.28Å; D330-I334 WeakPolarHBondContact O-CG1 3.19Å; D330-I334 PolarHBondContact O-N 3.23Å
331	I	95.2	Very high	95.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-43.5	176.9	-53.9	176.8	0	0	0	110.6	L196 T200 L327 L328 F333 I334 H335 I354 T357 V358 I361	L196-I331 HydrophobicContact CB-CD1 4.3Å; T200-I331 HydrophobicContact CG2-CB 4.41Å; T200-I331 HydrophobicContact CG2-CG2 3.85Å; T200-I331 WeakPolarHBondContact OG1-CG2 3.25Å; L327-I331 PolarHBondContact O-N 3.16Å; L328-I331 HydrophobicContact CD2-CD1 4.41Å; L328-I331 PolarHBondContact O-N 3.36Å; I331-F333 PolarHBondContact O-N 3.15Å; I331-I334 PolarHBondContact O-N 3.24Å; I331-H335 WeakPolarHBondContact O-CB 3.36Å; I331-H335 PolarHBondContact O-N 3.31Å; I331-I354 HydrophobicContact CG2-CG1 4.31Å; I331-I354 HydrophobicContact CG2-CG2 4.07Å; I331-T357 HydrophobicContact CD1-CG2 4.03Å; I331-T357 HydrophobicContact CG1-CG2 3.54Å; I331-V358 HydrophobicContact CD1-CG2 4.44Å; I331-I361 HydrophobicContact CD1-CD1 4.42Å
332	T	94.1	Very high	95.3	Very high	43 Å²	43	53.8 Å²	53.8	26%	0.264	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-44.8	176.7	-60.2	0	0	0	0	111.5	L328 K329 D330 I334 H335 E336	L328-T332 PolarHBondContact O-N 3.06Å; L328-T332 PolarHBondContact O-OG1 2.74Å; L328-T332 VanDerWaalsContact O-OG1 3.09Å; K329-T332 PolarHBondContact O-N 2.89Å; D330-T332 PolarHBondContact O-N 3.24Å; T332-I334 PolarHBondContact O-N 3.3Å; T332-H335 WeakPolarHBondContact O-CB 3.29Å; T332-H335 PolarHBondContact O-N 3.22Å; T332-H335 VanDerWaalsContact O-N 3.1Å; T332-E336 HydrophobicContact CG2-CG 4.24Å; T332-E336 WeakPolarHBondContact O-CG 3.35Å; T332-E336 PolarHBondContact O-N 3.15Å
333	F	95.4	Very high	95.1	Very high	156 Å²	156	61.2 Å²	61.2	68%	0.684	31%	0.311	S	S	*	.	H	α-helix	trans	-63.5	-40.7	178.7	-168.7	-97.3	0	0	0	112.1	K329 D330 I331 H335 G337	K329-F333 WeakPolarHBondContact O-CB 3.49Å; K329-F333 PolarHBondContact O-N 2.77Å; D330-F333 PolarHBondContact O-N 3.03Å; I331-F333 PolarHBondContact O-N 3.15Å; F333-H335 VanDerWaalsContact C-N 3.32Å; F333-G337 WeakPolarHBondContact O-CA 3.39Å; F333-G337 PolarHBondContact O-N 3.14Å
334	I	95.8	Very high	94.9	Very high	18 Å²	18	67.7 Å²	67.7	9%	0.092	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-43.2	172.5	-65.2	161.5	0	0	0	110.4	D330 I331 T332 N338 K350 M353 I354	D330-I334 WeakPolarHBondContact O-CD1 3.49Å; D330-I334 VanDerWaalsContact O-CG1 3.28Å; D330-I334 WeakPolarHBondContact O-CG1 3.19Å; D330-I334 PolarHBondContact O-N 3.23Å; I331-I334 PolarHBondContact O-N 3.24Å; T332-I334 PolarHBondContact O-N 3.3Å; I334-N338 WeakPolarHBondContact O-CB 3.41Å; I334-N338 PolarHBondContact O-N 3.14Å; I334-N338 PolarHBondContact O-ND2 3.3Å; I334-K350 HydrophobicContact CG2-CG 4.46Å; I334-M353 HydrophobicContact CD1-CB 4.09Å; I334-M353 HydrophobicContact CG1-CB 4.42Å; I334-M353 HydrophobicContact CG1-CE 4.13Å; I334-M353 HydrophobicContact CG2-CB 3.68Å; I334-M353 HydrophobicContact CG2-CE 4.43Å; I334-M353 HydrophobicContact CG2-SD 4.23Å; I334-I354 HydrophobicContact CB-CG1 4.36Å; I334-I354 HydrophobicContact CG2-CD1 4.41Å; I334-I354 HydrophobicContact CG2-CG1 3.7Å
335	H	94.2	Very high	94.9	Very high	41 Å²	41	73.7 Å²	73.7	19%	0.19	38%	0.378	C	S	.	.	H	α-helix	trans	-64.1	-44.7	-178.5	178.6	72.8	0	0	0	112.7	T200 L201 I331 T332 F333 N338 K350	T200-H335 HydrophobicContact CG2-CB 3.76Å; L201-H335 WeakPolarHBondContact CD2-ND1 3.3Å; I331-H335 WeakPolarHBondContact O-CB 3.36Å; I331-H335 PolarHBondContact O-N 3.31Å; T332-H335 WeakPolarHBondContact O-CB 3.29Å; T332-H335 PolarHBondContact O-N 3.22Å; T332-H335 VanDerWaalsContact O-N 3.1Å; F333-H335 VanDerWaalsContact C-N 3.32Å; H335-N338 VanDerWaalsContact O-O 3.14Å; H335-K350 PolarHBondContact ND1-NZ 2.82Å; H335-K350 WeakPolarHBondContact O-CE 2.87Å; H335-K350 PolarHBondContact O-NZ 3.3Å
336	E	93.6	Very high	95	Very high	126 Å²	126	74.7 Å²	74.7	59%	0.589	38%	0.383	S	S	*	.	H	α-helix	trans	-80	-33.9	-177.5	-66.8	-177.1	160.8	0	0	112.5	R203 T332	R203-E336 IonicContact NH2-OE1 3.89Å; T332-E336 HydrophobicContact CG2-CG 4.24Å; T332-E336 WeakPolarHBondContact O-CG 3.35Å; T332-E336 PolarHBondContact O-N 3.15Å
337	G	95.5	Very high	95.1	Very high	56 Å²	56	75.3 Å²	75.3	58%	0.577	39%	0.386	S	S	*	.	H	α-helix	trans	-77.3	-15.8	-179.5	0	0	0	0	0	114.9	F333	F333-G337 WeakPolarHBondContact O-CA 3.39Å; F333-G337 PolarHBondContact O-N 3.14Å
338	N	95.9	Very high	95.1	Very high	53 Å²	53	81.4 Å²	81.4	28%	0.283	41%	0.413	S	S	.	.	S	Bend	trans	-126.7	131.4	-175.6	-60.3	-82.3	0	0	0	111.4	I334 H335 K350	I334-N338 WeakPolarHBondContact O-CB 3.41Å; I334-N338 PolarHBondContact O-N 3.14Å; I334-N338 PolarHBondContact O-ND2 3.3Å; H335-N338 VanDerWaalsContact O-O 3.14Å; N338-K350 HydrophobicContact CB-CB 4.05Å; N338-K350 HydrophobicContact CB-CD 3.94Å; N338-K350 HydrophobicContact CB-CG 3.93Å; N338-K350 WeakPolarHBondContact O-CD 3.44Å; N338-K350 VanDerWaalsContact O-CE 3.28Å; N338-K350 WeakPolarHBondContact O-CE 3.5Å; N338-K350 PolarHBondContact O-NZ 2.95Å
339	K	94.8	Very high	95.2	Very high	153 Å²	153	87.9 Å²	87.9	67%	0.665	44%	0.443	S	S	*	.			trans	-66.8	138.4	174.1	-66.6	-176.8	-179.6	178.2	0	110.6	F341 N347	K339-F341 VanDerWaalsContact C-N 3.31Å; K339-N347 VanDerWaalsContact O-CB 3.26Å; K339-N347 WeakPolarHBondContact O-CB 3.45Å; K339-N347 PolarHBondContact O-ND2 3.03Å
340	T	94.5	Very high	95.3	Very high	45 Å²	45	82.5 Å²	82.5	28%	0.276	42%	0.42	S	S	.	.	S	Bend	trans	-71.8	-29.8	174.9	-53.1	0	0	0	0	111.7	N347 K350	T340-N347 WeakPolarHBondContact O-CB 3.21Å; T340-N347 PolarHBondContact O-N 3.04Å; T340-K350 PolarHBondContact OG1-NZ 3.26Å
341	F	96.3	Very high	95.3	Very high	121 Å²	121	84.5 Å²	84.5	53%	0.531	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.7	179.3	-60.8	-87	0	0	0	111.1	K339 L345 V346	K339-F341 VanDerWaalsContact C-N 3.31Å; F341-L345 CarbonylContact C-O 3.59Å; F341-L345 WeakPolarHBondContact CA-O 3.4Å; F341-V346 HydrophobicContact CD1-CG2 4.21Å; F341-V346 HydrophobicContact CE1-CG2 3.75Å
342	H	94.3	Very high	95.4	Very high	93 Å²	93	89.3 Å²	89.3	43%	0.431	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.5	167.8	-67.2	108.1	0	0	0	107.4	N344 L345 N347	H342-N344 PolarHBondContact O-N 3.39Å; H342-N344 VanDerWaalsContact O-N 3.16Å; H342-L345 PolarHBondContact N-O 3.17Å; H342-L345 WeakPolarHBondContact O-CA 3.46Å; H342-L345 WeakPolarHBondContact O-CB 3.46Å; H342-L345 PolarHBondContact O-N 3.43Å; H342-N347 PolarHBondContact CE1-ND2 2.72Å; H342-N347 VanDerWaalsContact CE1-ND2 3.29Å
343	D	93.1	Very high	95.5	Very high	156 Å²	156	90.8 Å²	90.8	83%	0.834	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	44.5	-179.6	-53.9	-33.7	0	0	0	113.4	L345	D343-L345 PolarHBondContact O-N 2.93Å; D343-L345 VanDerWaalsContact O-N 3.16Å
344	N	93.8	Very high	95.5	Very high	157 Å²	157	83.7 Å²	83.7	84%	0.84	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	6.6	-175.5	-54.8	-41.7	0	0	0	115.8	H342	H342-N344 PolarHBondContact O-N 3.39Å; H342-N344 VanDerWaalsContact O-N 3.16Å
345	L	96.5	Very high	95.5	Very high	126 Å²	126	84.2 Å²	84.2	66%	0.66	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	144.2	171.6	-58.3	176.8	0	0	0	110.9	F341 H342 D343 N347	F341-L345 CarbonylContact C-O 3.59Å; F341-L345 WeakPolarHBondContact CA-O 3.4Å; H342-L345 PolarHBondContact N-O 3.17Å; H342-L345 WeakPolarHBondContact O-CA 3.46Å; H342-L345 WeakPolarHBondContact O-CB 3.46Å; H342-L345 PolarHBondContact O-N 3.43Å; D343-L345 PolarHBondContact O-N 2.93Å; D343-L345 VanDerWaalsContact O-N 3.16Å; L345-N347 PolarHBondContact O-N 3.37Å
346	V	97.1	Very high	95.6	Very high	66 Å²	66	86.5 Å²	86.5	40%	0.4	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	129.4	177.8	177.7	0	0	0	0	110.1	F341 F348 L351	F341-V346 HydrophobicContact CD1-CG2 4.21Å; F341-V346 HydrophobicContact CE1-CG2 3.75Å; V346-F348 HydrophobicContact CB-CD2 4.27Å; V346-F348 HydrophobicContact CB-CE2 4.02Å; V346-F348 HydrophobicContact CG1-CD2 4.17Å; V346-F348 HydrophobicContact CG1-CE2 4.07Å; V346-F348 WeakPolarHBondContact O-CD2 3.18Å; V346-F348 PolarHBondContact O-N 2.86Å; V346-F348 VanDerWaalsContact O-N 3.11Å; V346-L351 HydrophobicContact CG1-CD1 3.69Å
347	N	96.7	Very high	95.7	Very high	17 Å²	17	81.3 Å²	81.3	9%	0.091	42%	0.424	C	S	.	.			trans	-77.4	92.3	173.1	-178.3	0.9	0	0	0	111	K339 T340 H342 L345 E349 K350 L351	K339-N347 VanDerWaalsContact O-CB 3.26Å; K339-N347 WeakPolarHBondContact O-CB 3.45Å; K339-N347 PolarHBondContact O-ND2 3.03Å; T340-N347 WeakPolarHBondContact O-CB 3.21Å; T340-N347 PolarHBondContact O-N 3.04Å; H342-N347 PolarHBondContact CE1-ND2 2.72Å; H342-N347 VanDerWaalsContact CE1-ND2 3.29Å; L345-N347 PolarHBondContact O-N 3.37Å; N347-E349 VanDerWaalsContact C-N 3.31Å; N347-E349 PolarHBondContact O-N 3.11Å; N347-E349 WeakPolarHBondContact OD1-CB 3.32Å; N347-E349 PolarHBondContact OD1-N 3.38Å; N347-E349 VanDerWaalsContact OD1-N 3.15Å; N347-K350 HydrophobicContact CB-CB 4.24Å; N347-K350 WeakPolarHBondContact ND2-CB 3.49Å; N347-K350 PolarHBondContact O-N 3.08Å; N347-K350 PolarHBondContact OD1-N 2.93Å; N347-L351 PolarHBondContact O-N 3.43Å
348	F	96.9	Very high	95.7	Very high	131 Å²	131	79 Å²	79	58%	0.575	40%	0.398	S	S	*	.	H	α-helix	trans	-67.4	-27.4	178.1	-84.5	-91	0	0	0	113.8	V346 K350 L351 H352	V346-F348 HydrophobicContact CB-CD2 4.27Å; V346-F348 HydrophobicContact CB-CE2 4.02Å; V346-F348 HydrophobicContact CG1-CD2 4.17Å; V346-F348 HydrophobicContact CG1-CE2 4.07Å; V346-F348 WeakPolarHBondContact O-CD2 3.18Å; V346-F348 PolarHBondContact O-N 2.86Å; V346-F348 VanDerWaalsContact O-N 3.11Å; F348-K350 PolarHBondContact O-N 3.25Å; F348-L351 HydrophobicContact CD1-CD1 4.3Å; F348-L351 HydrophobicContact CE1-CD1 4.46Å; F348-L351 PolarHBondContact O-N 2.81Å; F348-L351 VanDerWaalsContact O-N 3.15Å; F348-H352 PolarHBondContact O-CD2 3.02Å; F348-H352 PolarHBondContact O-N 3.21Å
349	E	97.1	Very high	95.6	Very high	142 Å²	142	81.6 Å²	81.6	66%	0.664	40%	0.404	S	S	*	.	H	α-helix	trans	-61.5	-46.2	176.6	-174.3	176.7	-168.6	0	0	110.7	N347 L351 H352 M353	N347-E349 VanDerWaalsContact C-N 3.31Å; N347-E349 PolarHBondContact O-N 3.11Å; N347-E349 WeakPolarHBondContact OD1-CB 3.32Å; N347-E349 PolarHBondContact OD1-N 3.38Å; N347-E349 VanDerWaalsContact OD1-N 3.15Å; E349-L351 VanDerWaalsContact C-N 3.3Å; E349-L351 PolarHBondContact O-N 2.87Å; E349-H352 WeakPolarHBondContact O-CB 3.45Å; E349-H352 PolarHBondContact O-N 3.25Å; E349-M353 WeakPolarHBondContact O-CG 3.19Å; E349-M353 PolarHBondContact O-N 3.32Å
350	K	95.8	Very high	95.7	Very high	5 Å²	5	77.2 Å²	77.2	2%	0.022	39%	0.387	C	S	.	.	H	α-helix	trans	-55.5	-45.6	171.9	176.8	-176.9	-174.1	169	0	111.9	I334 H335 N338 T340 N347 F348 H352 M353 I354	I334-K350 HydrophobicContact CG2-CG 4.46Å; H335-K350 PolarHBondContact ND1-NZ 2.82Å; H335-K350 WeakPolarHBondContact O-CE 2.87Å; H335-K350 PolarHBondContact O-NZ 3.3Å; N338-K350 HydrophobicContact CB-CB 4.05Å; N338-K350 HydrophobicContact CB-CD 3.94Å; N338-K350 HydrophobicContact CB-CG 3.93Å; N338-K350 WeakPolarHBondContact O-CD 3.44Å; N338-K350 VanDerWaalsContact O-CE 3.28Å; N338-K350 WeakPolarHBondContact O-CE 3.5Å; N338-K350 PolarHBondContact O-NZ 2.95Å; T340-K350 PolarHBondContact OG1-NZ 3.26Å; N347-K350 HydrophobicContact CB-CB 4.24Å; N347-K350 WeakPolarHBondContact ND2-CB 3.49Å; N347-K350 PolarHBondContact O-N 3.08Å; N347-K350 PolarHBondContact OD1-N 2.93Å; F348-K350 PolarHBondContact O-N 3.25Å; K350-H352 VanDerWaalsContact C-N 3.32Å; K350-H352 PolarHBondContact O-N 3.08Å; K350-M353 PolarHBondContact O-N 3.08Å; K350-I354 HydrophobicContact CG-CD1 4.29Å; K350-I354 WeakPolarHBondContact O-CG1 3.45Å; K350-I354 PolarHBondContact O-N 2.82Å; K350-I354 VanDerWaalsContact O-N 3.14Å
351	L	94.8	Very high	95.7	Very high	69 Å²	69	75.2 Å²	75.2	36%	0.361	37%	0.374	S	S	.	.	H	α-helix	trans	-64.6	-38	-179.6	-61.5	-177.1	0	0	0	111.7	V346 N347 F348 E349 I354 A355	V346-L351 HydrophobicContact CG1-CD1 3.69Å; N347-L351 PolarHBondContact O-N 3.43Å; F348-L351 HydrophobicContact CD1-CD1 4.3Å; F348-L351 HydrophobicContact CE1-CD1 4.46Å; F348-L351 PolarHBondContact O-N 2.81Å; F348-L351 VanDerWaalsContact O-N 3.15Å; E349-L351 VanDerWaalsContact C-N 3.3Å; E349-L351 PolarHBondContact O-N 2.87Å; L351-I354 PolarHBondContact O-N 3.34Å; L351-A355 VanDerWaalsContact O-CB 3.26Å; L351-A355 WeakPolarHBondContact O-CB 3.26Å; L351-A355 PolarHBondContact O-N 3.14Å
352	H	96.8	Very high	95.6	Very high	101 Å²	101	74.9 Å²	74.9	47%	0.468	37%	0.37	S	S	.	.	H	α-helix	trans	-62.8	-46.3	174.7	-85.3	-72.8	0	0	0	112.1	F348 E349 K350 I354 A355 D356	F348-H352 PolarHBondContact O-CD2 3.02Å; F348-H352 PolarHBondContact O-N 3.21Å; E349-H352 WeakPolarHBondContact O-CB 3.45Å; E349-H352 PolarHBondContact O-N 3.25Å; K350-H352 VanDerWaalsContact C-N 3.32Å; K350-H352 PolarHBondContact O-N 3.08Å; H352-I354 VanDerWaalsContact C-N 3.34Å; H352-I354 PolarHBondContact O-N 2.91Å; H352-A355 PolarHBondContact O-N 3.35Å; H352-A355 VanDerWaalsContact O-N 3.15Å; H352-D356 VanDerWaalsContact O-CG 3.32Å; H352-D356 PolarHBondContact O-N 2.83Å
353	M	97	Very high	95.6	Very high	74 Å²	74	75.4 Å²	75.4	37%	0.365	37%	0.372	S	S	.	.	H	α-helix	trans	-58.9	-43.1	177.5	-65.1	176.4	79.6	0	0	112.5	I334 E349 K350 T357	I334-M353 HydrophobicContact CD1-CB 4.09Å; I334-M353 HydrophobicContact CG1-CB 4.42Å; I334-M353 HydrophobicContact CG1-CE 4.13Å; I334-M353 HydrophobicContact CG2-CB 3.68Å; I334-M353 HydrophobicContact CG2-CE 4.43Å; I334-M353 HydrophobicContact CG2-SD 4.23Å; E349-M353 WeakPolarHBondContact O-CG 3.19Å; E349-M353 PolarHBondContact O-N 3.32Å; K350-M353 PolarHBondContact O-N 3.08Å; M353-T357 PolarHBondContact O-N 3.42Å; M353-T357 PolarHBondContact O-OG1 3.45Å
354	I	95.4	Very high	95.7	Very high	8 Å²	8	68 Å²	68	4%	0.041	33%	0.332	C	S	.	.	H	α-helix	trans	-64	-47.7	175	-68.1	174.9	0	0	0	110.1	V197 L201 I331 I334 K350 L351 H352 D356 T357 V358	V197-I354 HydrophobicContact CG2-CG2 4.48Å; L201-I354 HydrophobicContact CD1-CD1 4.38Å; I331-I354 HydrophobicContact CG2-CG1 4.31Å; I331-I354 HydrophobicContact CG2-CG2 4.07Å; I334-I354 HydrophobicContact CB-CG1 4.36Å; I334-I354 HydrophobicContact CG2-CD1 4.41Å; I334-I354 HydrophobicContact CG2-CG1 3.7Å; K350-I354 HydrophobicContact CG-CD1 4.29Å; K350-I354 WeakPolarHBondContact O-CG1 3.45Å; K350-I354 PolarHBondContact O-N 2.82Å; K350-I354 VanDerWaalsContact O-N 3.14Å; L351-I354 PolarHBondContact O-N 3.34Å; H352-I354 VanDerWaalsContact C-N 3.34Å; H352-I354 PolarHBondContact O-N 2.91Å; I354-D356 VanDerWaalsContact C-N 3.29Å; I354-D356 PolarHBondContact O-N 3.46Å; I354-T357 PolarHBondContact O-N 2.79Å; I354-V358 HydrophobicContact CG2-CG2 4.46Å; I354-V358 WeakPolarHBondContact O-CG2 3.47Å; I354-V358 PolarHBondContact O-N 3.32Å
355	A	95.4	Very high	95.6	Very high	28 Å²	28	63 Å²	63	23%	0.231	30%	0.304	C	S	.	.	H	α-helix	trans	-61.3	-35.8	-178.9	0	0	0	0	0	112.5	L351 H352 V358 R359	L351-A355 VanDerWaalsContact O-CB 3.26Å; L351-A355 WeakPolarHBondContact O-CB 3.26Å; L351-A355 PolarHBondContact O-N 3.14Å; H352-A355 PolarHBondContact O-N 3.35Å; H352-A355 VanDerWaalsContact O-N 3.15Å; A355-V358 PolarHBondContact O-N 3.46Å; A355-R359 WeakPolarHBondContact O-CB 3.39Å; A355-R359 VanDerWaalsContact O-CG 3.23Å; A355-R359 WeakPolarHBondContact O-CG 3.46Å; A355-R359 PolarHBondContact O-N 3.34Å
356	D	96.6	Very high	95.1	Very high	89 Å²	89	59.1 Å²	59.1	48%	0.476	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-39.3	176.8	-71.5	-20.2	0	0	0	112.2	H352 I354 R359 M360	H352-D356 VanDerWaalsContact O-CG 3.32Å; H352-D356 PolarHBondContact O-N 2.83Å; I354-D356 VanDerWaalsContact C-N 3.29Å; I354-D356 PolarHBondContact O-N 3.46Å; D356-R359 PolarHBondContact O-N 3.19Å; D356-R359 IonicContact OD1-CZ 3.05Å; D356-R359 IonicContact OD1-NH1 3.85Å; D356-R359 PolarHBondContact OD1-NH1 3.47Å; D356-M360 WeakPolarHBondContact O-CB 3.31Å; D356-M360 PolarHBondContact O-N 3.45Å
357	T	95.4	Very high	93.9	Very high	18 Å²	18	61.8 Å²	61.8	11%	0.11	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-43.9	174	-52.4	0	0	0	0	111	I331 M353 I354 M360 I361	I331-T357 HydrophobicContact CD1-CG2 4.03Å; I331-T357 HydrophobicContact CG1-CG2 3.54Å; M353-T357 PolarHBondContact O-N 3.42Å; M353-T357 PolarHBondContact O-OG1 3.45Å; I354-T357 PolarHBondContact O-N 2.79Å; T357-M360 HydrophobicContact CG2-CE 3.89Å; T357-M360 PolarHBondContact O-N 3.22Å; T357-I361 HydrophobicContact CG2-CD1 4.43Å; T357-I361 WeakPolarHBondContact O-CG1 3.43Å; T357-I361 PolarHBondContact O-N 2.92Å
358	V	95	Very high	92.2	Very high	7 Å²	7	68.1 Å²	68.1	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-45.4	176.4	172	0	0	0	0	111.7	E193 L196 V197 I331 I354 A355 M360 I361 R362	E193-V358 HydrophobicContact CB-CG1 3.68Å; E193-V358 HydrophobicContact CG-CG1 3.83Å; L196-V358 HydrophobicContact CB-CG2 4.24Å; L196-V358 HydrophobicContact CD1-CG1 4.23Å; L196-V358 HydrophobicContact CD1-CG2 4.26Å; V197-V358 HydrophobicContact CG2-CG2 4.07Å; I331-V358 HydrophobicContact CD1-CG2 4.44Å; I354-V358 HydrophobicContact CG2-CG2 4.46Å; I354-V358 WeakPolarHBondContact O-CG2 3.47Å; I354-V358 PolarHBondContact O-N 3.32Å; A355-V358 PolarHBondContact O-N 3.46Å; V358-M360 VanDerWaalsContact C-N 3.29Å; V358-M360 PolarHBondContact O-N 3.45Å; V358-I361 PolarHBondContact O-N 3.37Å; V358-R362 PolarHBondContact O-N 2.93Å
359	R	95.4	Very high	90.5	Very high	108 Å²	108	63.9 Å²	63.9	41%	0.408	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-37.6	176.4	-74.3	174.8	-165.5	121.5	3.5	112.1	A355 D356 R362 H363	A355-R359 WeakPolarHBondContact O-CB 3.39Å; A355-R359 VanDerWaalsContact O-CG 3.23Å; A355-R359 WeakPolarHBondContact O-CG 3.46Å; A355-R359 PolarHBondContact O-N 3.34Å; D356-R359 PolarHBondContact O-N 3.19Å; D356-R359 IonicContact OD1-CZ 3.05Å; D356-R359 IonicContact OD1-NH1 3.85Å; D356-R359 PolarHBondContact OD1-NH1 3.47Å; R359-R362 WeakPolarHBondContact O-CB 3.4Å; R359-R362 PolarHBondContact O-N 3.2Å; R359-H363 WeakPolarHBondContact O-CB 3.08Å; R359-H363 PolarHBondContact O-N 3.45Å
360	M	95.6	Very high	88.5	Confident	61 Å²	61	59.3 Å²	59.3	30%	0.3	31%	0.305	S	S	.	.	H	α-helix	trans	-65.8	-41.5	175.4	173.1	-84.8	-57.4	0	0	111.6	F313 L327 D356 T357 V358 H363 C364	F313-M360 HydrophobicContact CE1-SD 3.78Å; F313-M360 HydrophobicContact CZ-SD 4.38Å; L327-M360 HydrophobicContact CD1-CE 3.92Å; L327-M360 HydrophobicContact CD1-SD 4.07Å; L327-M360 HydrophobicContact CD2-CE 3.96Å; L327-M360 HydrophobicContact CG-CE 4.47Å; D356-M360 WeakPolarHBondContact O-CB 3.31Å; D356-M360 PolarHBondContact O-N 3.45Å; T357-M360 HydrophobicContact CG2-CE 3.89Å; T357-M360 PolarHBondContact O-N 3.22Å; V358-M360 VanDerWaalsContact C-N 3.29Å; V358-M360 PolarHBondContact O-N 3.45Å; M360-H363 WeakPolarHBondContact O-CB 3.13Å; M360-H363 PolarHBondContact O-N 3.19Å; M360-C364 PolarHBondContact O-N 3.42Å; M360-C364 PolarHBondContact O-SG 3.08Å
361	I	95.4	Very high	86.2	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-61.9	-45.6	173.5	-68	164.2	0	0	0	110.6	F188 L196 M324 L327 I331 T357 V358 H363 C364	F188-I361 HydrophobicContact CE2-CG2 3.85Å; F188-I361 HydrophobicContact CZ-CG2 3.91Å; L196-I361 HydrophobicContact CD1-CB 4.13Å; L196-I361 HydrophobicContact CD1-CD1 3.74Å; L196-I361 HydrophobicContact CD1-CG2 3.89Å; L196-I361 HydrophobicContact CD2-CD1 4.2Å; M324-I361 HydrophobicContact CE-CD1 4.44Å; L327-I361 HydrophobicContact CB-CD1 4.17Å; L327-I361 HydrophobicContact CD1-CD1 4.13Å; L327-I361 HydrophobicContact CD1-CG1 3.58Å; I331-I361 HydrophobicContact CD1-CD1 4.42Å; T357-I361 HydrophobicContact CG2-CD1 4.43Å; T357-I361 WeakPolarHBondContact O-CG1 3.43Å; T357-I361 PolarHBondContact O-N 2.92Å; V358-I361 PolarHBondContact O-N 3.37Å; I361-H363 VanDerWaalsContact C-N 3.29Å; I361-H363 PolarHBondContact O-N 3.28Å; I361-C364 WeakPolarHBondContact O-CB 3.14Å; I361-C364 PolarHBondContact O-N 2.82Å
362	R	93.6	Very high	84.1	Confident	115 Å²	115	71.1 Å²	71.1	43%	0.434	36%	0.363	S	S	.	.	H	α-helix	trans	-58.4	-40.8	174.1	-178.9	-178.7	82.3	-171.9	0.3	112.7	E193 V358 R359 C364 Q365	E193-R362 HydrophobicContact CG-CB 4.48Å; E193-R362 WeakPolarHBondContact OE1-CD 3.38Å; E193-R362 IonicContact OE1-NE 3.94Å; E193-R362 IonicContact OE1-NH1 3.97Å; E193-R362 PolarHBondContact OE1-NH1 2.98Å; E193-R362 IonicContact OE2-NH1 3.74Å; V358-R362 PolarHBondContact O-N 2.93Å; R359-R362 WeakPolarHBondContact O-CB 3.4Å; R359-R362 PolarHBondContact O-N 3.2Å; R362-C364 PolarHBondContact O-N 3.46Å; R362-Q365 WeakPolarHBondContact O-CB 3.31Å; R362-Q365 PolarHBondContact O-N 3.31Å
363	H	94	Very high	81.9	Confident	103 Å²	103	68.7 Å²	68.7	48%	0.477	36%	0.355	S	S	.	.	H	α-helix	trans	-61.9	-27.7	177.3	-177.5	56.2	0	0	0	112.3	P318 R359 M360 I361 Q365 S366	P318-H363 WeakPolarHBondContact CB-O 3.44Å; P318-H363 WeakPolarHBondContact CG-NE2 3.37Å; P318-H363 WeakPolarHBondContact CG-O 3.45Å; R359-H363 WeakPolarHBondContact O-CB 3.08Å; R359-H363 PolarHBondContact O-N 3.45Å; M360-H363 WeakPolarHBondContact O-CB 3.13Å; M360-H363 PolarHBondContact O-N 3.19Å; I361-H363 VanDerWaalsContact C-N 3.29Å; I361-H363 PolarHBondContact O-N 3.28Å; H363-Q365 PolarHBondContact O-N 2.96Å; H363-S366 WeakPolarHBondContact CA-OG 3.49Å; H363-S366 WeakPolarHBondContact O-CB 3.41Å; H363-S366 PolarHBondContact O-N 3.38Å; H363-S366 VanDerWaalsContact O-N 3.09Å; H363-S366 PolarHBondContact O-OG 3.05Å
364	C	95.3	Very high	79.8	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.007	37%	0.37	C	S	.	.	H	α-helix	trans	-66.7	-24.4	175.2	-57.9	0	0	0	0	113.2	F188 F313 K320 M360 I361 R362 S366	F188-C364 HydrophobicContact CE1-CB 4.11Å; F188-C364 HydrophobicContact CZ-CB 4.1Å; F313-C364 WeakPolarHBondContact CZ-SG 3.08Å; K320-C364 VanDerWaalsContact CE-SG 3.58Å; K320-C364 HydrophobicContact CG-CB 3.94Å; K320-C364 PolarHBondContact N-O 3.33Å; K320-C364 VanDerWaalsContact N-O 3.1Å; K320-C364 WeakPolarHBondContact O-CB 3.44Å; M360-C364 PolarHBondContact O-N 3.42Å; M360-C364 PolarHBondContact O-SG 3.08Å; I361-C364 WeakPolarHBondContact O-CB 3.14Å; I361-C364 PolarHBondContact O-N 2.82Å; R362-C364 PolarHBondContact O-N 3.46Å; C364-S366 VanDerWaalsContact C-N 3.35Å
365	Q	91.1	Very high	77.9	Confident	52 Å²	52	71.8 Å²	71.8	24%	0.243	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-4.3	174.6	-59.3	174.4	-12.5	0	0	113.2	F188 R362 H363	F188-Q365 HydrophobicContact CD1-CG 3.9Å; F188-Q365 HydrophobicContact CE1-CG 3.37Å; F188-Q365 HydrophobicContact CZ-CG 3.82Å; F188-Q365 PolarHBondContact O-NE2 3.4Å; R362-Q365 WeakPolarHBondContact O-CB 3.31Å; R362-Q365 PolarHBondContact O-N 3.31Å; H363-Q365 PolarHBondContact O-N 2.96Å
366	S	86.8	Confident	76.1	Confident	44 Å²	44	75.1 Å²	75.1	31%	0.308	39%	0.393	S	S	.	.			trans	-69.3	143	177.5	-57.9	0	0	0	0	110.4	P318 H363 C364	P318-S366 WeakPolarHBondContact CB-O 3.27Å; H363-S366 WeakPolarHBondContact CA-OG 3.49Å; H363-S366 WeakPolarHBondContact O-CB 3.41Å; H363-S366 PolarHBondContact O-N 3.38Å; H363-S366 VanDerWaalsContact O-N 3.09Å; H363-S366 PolarHBondContact O-OG 3.05Å; C364-S366 VanDerWaalsContact C-N 3.35Å
367	D	72.3	Confident	74.6	Confident	123 Å²	123	76 Å²	76	66%	0.658	40%	0.397	S	S	*	.	S	Bend	trans	66.2	136.9	-169.6	-56	-32.9	0	0	0	113.9
368	Q	61.5	Low	73.9	Confident	150 Å²	150	76.9 Å²	76.9	70%	0.701	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-70	140.7	171.6	-66.8	-163	17.2	0	0	108.6	G370	Q368-G370 PolarHBondContact O-N 3.23Å
369	P	60.8	Low	73.2	Confident	42 Å²	42	79.9 Å²	79.9	27%	0.273	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-54.5	118.6	163.7	23.3	-29.8	0	0	0	105.6	W185 P319 V373	W185-P369 HydrophobicContact CD2-CG 4.4Å; W185-P369 HydrophobicContact CG-CG 4.42Å; W185-P369 HydrophobicContact CZ2-CG 4.38Å; P319-P369 HydrophobicContact CG-CB 4.03Å; P369-V373 HydrophobicContact CB-CG2 4.37Å
370	G	54.8	Low	72.6	Confident	46 Å²	46	79.9 Å²	79.9	47%	0.474	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-50.3	150.1	175.9	0	0	0	0	0	108.5	Q368 E372 V373	Q368-G370 PolarHBondContact O-N 3.23Å; G370-E372 PolarHBondContact O-N 3.14Å; G370-V373 PolarHBondContact O-N 3.37Å
371	N	48.3	Very low	72.1	Confident	141 Å²	141	77.4 Å²	77.4	75%	0.754	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-56.2	10.8	175.4	-76.6	-11.1	0	0	0	114.2	V373 I374	N371-V373 VanDerWaalsContact C-N 3.27Å; N371-V373 PolarHBondContact O-N 3.23Å; N371-I374 HydrophobicContact CB-CD1 4.37Å; N371-I374 WeakPolarHBondContact O-CD1 3.23Å; N371-I374 VanDerWaalsContact O-CG1 3.31Å; N371-I374 WeakPolarHBondContact O-CG1 3.21Å
372	E	48.8	Very low	71.4	Confident	181 Å²	181	82.9 Å²	82.9	85%	0.846	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-74.1	-10.8	174.5	-59.5	-175	169.3	0	0	113.3	G370 I374	G370-E372 PolarHBondContact O-N 3.14Å; E372-I374 VanDerWaalsContact C-N 3.26Å; E372-I374 PolarHBondContact O-N 3.34Å
373	V	52.5	Low	71	Confident	50 Å²	50	78.4 Å²	78.4	30%	0.303	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-91.1	30.4	176	-158.6	0	0	0	0	112.1	A178 P369 G370 N371 G375	A178-V373 HydrophobicContact CB-CG1 4.28Å; P369-V373 HydrophobicContact CB-CG2 4.37Å; G370-V373 PolarHBondContact O-N 3.37Å; N371-V373 VanDerWaalsContact C-N 3.27Å; N371-V373 PolarHBondContact O-N 3.23Å; V373-G375 PolarHBondContact O-N 3.4Å
374	I	51.2	Low	70.5	Confident	133 Å²	133	74 Å²	74	68%	0.682	41%	0.412	S	S	*	.			trans	-87.5	86.3	172.4	-57.2	169.5	0	0	0	107.6	N371 E372	N371-I374 HydrophobicContact CB-CD1 4.37Å; N371-I374 WeakPolarHBondContact O-CD1 3.23Å; N371-I374 VanDerWaalsContact O-CG1 3.31Å; N371-I374 WeakPolarHBondContact O-CG1 3.21Å; E372-I374 VanDerWaalsContact C-N 3.26Å; E372-I374 PolarHBondContact O-N 3.34Å
375	G	55.5	Low	70.2	Confident	14 Å²	14	74 Å²	74	14%	0.144	41%	0.411	C	S	.	.			trans	-65.3	165.9	156	0	0	0	0	0	109.9	D175 V373 D377	D175-G375 WeakPolarHBondContact OD1-CA 3.4Å; V373-G375 PolarHBondContact O-N 3.4Å; G375-D377 PolarHBondContact O-N 3.09Å
376	V	58.1	Low	70	Confident	98 Å²	98	73.5 Å²	73.5	59%	0.594	41%	0.409	S	S	*	.			trans	-62.8	111.4	174.6	179.2	0	0	0	0	108.4	D175 S378	D175-V376 PolarHBondContact OD1-N 3.48Å; D175-V376 VanDerWaalsContact OD1-N 3.1Å; V376-S378 PolarHBondContact O-N 2.88Å
377	D	65.9	Low	70.3	Confident	106 Å²	106	74.2 Å²	74.2	57%	0.567	41%	0.405	S	S	*	.			trans	-76	67.9	176.1	-174.1	19.6	0	0	0	110.3	G375 R382	G375-D377 PolarHBondContact O-N 3.09Å; D377-R382 WeakPolarHBondContact OD1-CD 3.49Å; D377-R382 WeakPolarHBondContact OD1-CG 3.35Å; D377-R382 IonicContact OD1-CZ 3.38Å; D377-R382 IonicContact OD1-NE 2.74Å; D377-R382 PolarHBondContact OD1-NE 3.21Å; D377-R382 IonicContact OD1-NH1 3.5Å; D377-R382 PolarHBondContact OD1-NH1 3.14Å; D377-R382 IonicContact OD2-CZ 3.84Å; D377-R382 IonicContact OD2-NH1 3.14Å; D377-R382 PolarHBondContact OD2-NH1 3.13Å
378	S	80	Confident	71.3	Confident	38 Å²	38	68.4 Å²	68.4	27%	0.266	37%	0.374	S	S	.	.			trans	-84	145.8	171.6	85.7	0	0	0	0	110	V376 E380 V381 R382	V376-S378 PolarHBondContact O-N 2.88Å; S378-E380 PolarHBondContact O-N 2.72Å; S378-E380 VanDerWaalsContact O-N 3.14Å; S378-V381 PolarHBondContact O-N 2.99Å; S378-V381 VanDerWaalsContact O-N 3.11Å; S378-V381 VanDerWaalsContact OG-CG2 3.25Å; S378-V381 WeakPolarHBondContact OG-CG2 3.45Å; S378-V381 PolarHBondContact OG-N 2.94Å; S378-V381 VanDerWaalsContact OG-N 3.07Å; S378-R382 PolarHBondContact O-N 3.25Å
379	A	80.3	Confident	72.9	Confident	70 Å²	70	61.8 Å²	61.8	58%	0.579	34%	0.343	S	S	*	.	H	α-helix	trans	-56.1	-31.4	174.5	0	0	0	0	0	112	A383	A379-A383 WeakPolarHBondContact O-CB 3.41Å; A379-A383 PolarHBondContact O-N 3.32Å
380	E	81.8	Confident	74.5	Confident	108 Å²	108	59.8 Å²	59.8	51%	0.505	33%	0.33	S	S	.	.	H	α-helix	trans	-69.6	-43	177.3	-172.1	175.4	-162.3	0	0	112.5	I171 S378 A383 S384	I171-E380 HydrophobicContact CD1-CG 4.01Å; I171-E380 HydrophobicContact CG1-CG 4.19Å; S378-E380 PolarHBondContact O-N 2.72Å; S378-E380 VanDerWaalsContact O-N 3.14Å; E380-A383 PolarHBondContact O-N 2.87Å; E380-S384 WeakPolarHBondContact O-CB 3.39Å; E380-S384 PolarHBondContact O-N 3.34Å
381	V	85.3	Confident	76.5	Confident	8 Å²	8	57.6 Å²	57.6	5%	0.048	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-49.2	175.3	170.2	0	0	0	0	109.9	I171 D175 A179 S378 A383 S384 V385	I171-V381 HydrophobicContact CG2-CG2 3.56Å; D175-V381 HydrophobicContact CB-CG1 4.09Å; D175-V381 HydrophobicContact CB-CG2 3.79Å; A179-V381 HydrophobicContact CB-CG1 3.63Å; S378-V381 PolarHBondContact O-N 2.99Å; S378-V381 VanDerWaalsContact O-N 3.11Å; S378-V381 VanDerWaalsContact OG-CG2 3.25Å; S378-V381 WeakPolarHBondContact OG-CG2 3.45Å; S378-V381 PolarHBondContact OG-N 2.94Å; S378-V381 VanDerWaalsContact OG-N 3.07Å; V381-A383 PolarHBondContact O-N 3.37Å; V381-S384 WeakPolarHBondContact O-CB 3.48Å; V381-S384 PolarHBondContact O-N 3.17Å; V381-S384 VanDerWaalsContact O-N 3.11Å; V381-S384 PolarHBondContact O-OG 2.75Å; V381-V385 PolarHBondContact O-N 3.26Å
382	R	82.5	Confident	78.4	Confident	117 Å²	117	53.3 Å²	53.3	44%	0.442	29%	0.285	S	S	.	.	H	α-helix	trans	-57.7	-48.6	175.9	-71.2	-165.4	-64.5	-131.4	4.6	111.5	D377 S378 S384 V385 H386	D377-R382 WeakPolarHBondContact OD1-CD 3.49Å; D377-R382 WeakPolarHBondContact OD1-CG 3.35Å; D377-R382 IonicContact OD1-CZ 3.38Å; D377-R382 IonicContact OD1-NE 2.74Å; D377-R382 PolarHBondContact OD1-NE 3.21Å; D377-R382 IonicContact OD1-NH1 3.5Å; D377-R382 PolarHBondContact OD1-NH1 3.14Å; D377-R382 IonicContact OD2-CZ 3.84Å; D377-R382 IonicContact OD2-NH1 3.14Å; D377-R382 PolarHBondContact OD2-NH1 3.13Å; S378-R382 PolarHBondContact O-N 3.25Å; R382-S384 PolarHBondContact O-N 2.97Å; R382-V385 PolarHBondContact O-N 2.75Å; R382-V385 VanDerWaalsContact O-N 3.12Å; R382-H386 WeakPolarHBondContact O-CB 3.42Å; R382-H386 PolarHBondContact O-CD2 3.39Å; R382-H386 VanDerWaalsContact O-CD2 3.29Å; R382-H386 PolarHBondContact O-N 2.8Å
383	A	84	Confident	80.4	Confident	21 Å²	21	48 Å²	48	17%	0.174	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-31.3	178.7	0	0	0	0	0	112.5	K102 A379 E380 V381 V385 Y387	K102-A383 WeakPolarHBondContact CE-O 3.41Å; K102-A383 VanDerWaalsContact NZ-C 3.27Å; K102-A383 PolarHBondContact NZ-O 3.38Å; A379-A383 WeakPolarHBondContact O-CB 3.41Å; A379-A383 PolarHBondContact O-N 3.32Å; E380-A383 PolarHBondContact O-N 2.87Å; V381-A383 PolarHBondContact O-N 3.37Å; A383-V385 VanDerWaalsContact C-N 3.25Å; A383-V385 PolarHBondContact O-N 3.23Å; A383-Y387 HydrophobicContact CB-CD2 3.8Å; A383-Y387 HydrophobicContact CB-CE2 4.04Å; A383-Y387 WeakPolarHBondContact O-CB 3.45Å; A383-Y387 PolarHBondContact O-N 2.85Å
384	S	83.7	Confident	82.3	Confident	11 Å²	11	49.8 Å²	49.8	8%	0.077	27%	0.267	C	S	.	.	H	α-helix	trans	-68.8	-23.3	178.7	76.9	0	0	0	0	113.9	E380 V381 R382 L388	E380-S384 WeakPolarHBondContact O-CB 3.39Å; E380-S384 PolarHBondContact O-N 3.34Å; V381-S384 WeakPolarHBondContact O-CB 3.48Å; V381-S384 PolarHBondContact O-N 3.17Å; V381-S384 VanDerWaalsContact O-N 3.11Å; V381-S384 PolarHBondContact O-OG 2.75Å; R382-S384 PolarHBondContact O-N 2.97Å; S384-L388 WeakPolarHBondContact O-CD2 3.42Å
385	V	88.4	Confident	84.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-105.2	-41.7	-178.5	177.5	0	0	0	0	111.2	V176 A179 L180 L183 R219 V381 R382 A383 Y387 L388	V176-V385 HydrophobicContact CG1-CG2 4.31Å; A179-V385 HydrophobicContact CB-CB 4.3Å; A179-V385 HydrophobicContact CB-CG2 3.72Å; L180-V385 HydrophobicContact CD2-CG1 3.72Å; L180-V385 HydrophobicContact CD2-CG2 4.44Å; L180-V385 HydrophobicContact CG-CG1 4.04Å; L180-V385 HydrophobicContact CG-CG2 4.06Å; L183-V385 HydrophobicContact CB-CG1 4.45Å; L183-V385 HydrophobicContact CD2-CG1 3.83Å; R219-V385 PolarHBondContact NH1-O 3.49Å; R219-V385 VanDerWaalsContact NH2-CG1 3.31Å; R219-V385 PolarHBondContact NH2-O 2.68Å; V381-V385 PolarHBondContact O-N 3.26Å; R382-V385 PolarHBondContact O-N 2.75Å; R382-V385 VanDerWaalsContact O-N 3.12Å; A383-V385 VanDerWaalsContact C-N 3.25Å; A383-V385 PolarHBondContact O-N 3.23Å; V385-Y387 VanDerWaalsContact C-N 3.35Å; V385-Y387 PolarHBondContact O-N 3.15Å; V385-L388 WeakPolarHBondContact O-CD2 3.22Å
386	H	88.3	Confident	86.2	Confident	43 Å²	43	48.5 Å²	48.5	20%	0.199	26%	0.255	C	S	.	.	H	α-helix	trans	-73.4	-25.1	-178.3	-79.4	-100	0	0	0	113.8	H85 R382	H85-H386 PolarHBondContact N-O 2.91Å; H85-H386 AromaticContact ND1-CE1 3.87Å; H85-H386 AromaticContact ND1-ND1 3.7Å; H85-H386 PolarHBondContact O-ND1 3.39Å; R382-H386 WeakPolarHBondContact O-CB 3.42Å; R382-H386 PolarHBondContact O-CD2 3.39Å; R382-H386 VanDerWaalsContact O-CD2 3.29Å; R382-H386 PolarHBondContact O-N 2.8Å
387	Y	92.1	Very high	88	Confident	59 Å²	59	43.9 Å²	43.9	23%	0.231	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	90.8	-173.4	-46.2	-40.6	0	0	0	110	S83 V84 I98 K102 A383 V385	S83-Y387 CarbonylContact O-C 3.59Å; S83-Y387 VanDerWaalsContact O-CA 3.23Å; S83-Y387 WeakPolarHBondContact O-CA 3.39Å; V84-Y387 HydrophobicContact CB-CD1 4.2Å; V84-Y387 HydrophobicContact CG1-CD1 3.76Å; V84-Y387 HydrophobicContact CG1-CE1 3.73Å; V84-Y387 HydrophobicContact CG2-CD1 4.11Å; I98-Y387 HydrophobicContact CD1-CE1 3.96Å; I98-Y387 HydrophobicContact CG1-CE1 4.39Å; I98-Y387 HydrophobicContact CG1-CE2 4.33Å; I98-Y387 HydrophobicContact CG2-CD1 3.69Å; I98-Y387 HydrophobicContact CG2-CD2 3.73Å; I98-Y387 HydrophobicContact CG2-CE1 3.76Å; I98-Y387 HydrophobicContact CG2-CE2 3.78Å; I98-Y387 HydrophobicContact CG2-CG 3.7Å; K102-Y387 VanDerWaalsContact CE-CB 3.43Å; K102-Y387 HydrophobicContact CG-CD2 4.32Å; A383-Y387 HydrophobicContact CB-CD2 3.8Å; A383-Y387 HydrophobicContact CB-CE2 4.04Å; A383-Y387 WeakPolarHBondContact O-CB 3.45Å; A383-Y387 PolarHBondContact O-N 2.85Å; V385-Y387 VanDerWaalsContact C-N 3.35Å; V385-Y387 PolarHBondContact O-N 3.15Å
388	L	94.1	Very high	89.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128	-175.4	-55.1	-175.4	0	0	0	110.6	L82 S83 E222 V223 W226 S384 V385 I390	L82-L388 CarbonylContact C-O 3.59Å; L82-L388 WeakPolarHBondContact CA-O 2.84Å; S83-L388 PolarHBondContact N-O 3.25Å; S83-L388 PolarHBondContact O-N 3.48Å; E222-L388 HydrophobicContact CB-CD1 4.29Å; V223-L388 HydrophobicContact CG2-CD1 4.49Å; W226-L388 HydrophobicContact CB-CB 4.31Å; W226-L388 HydrophobicContact CB-CD1 3.93Å; W226-L388 HydrophobicContact CB-CG 4.49Å; W226-L388 HydrophobicContact CD2-CD2 3.91Å; W226-L388 HydrophobicContact CG-CB 4.31Å; W226-L388 HydrophobicContact CG-CD1 4.15Å; W226-L388 HydrophobicContact CG-CD2 3.87Å; W226-L388 HydrophobicContact CG-CG 4.34Å; S384-L388 WeakPolarHBondContact O-CD2 3.42Å; V385-L388 WeakPolarHBondContact O-CD2 3.22Å; L388-I390 HydrophobicContact CB-CD1 3.98Å; L388-I390 HydrophobicContact CB-CG1 4Å; L388-I390 HydrophobicContact CD1-CD1 4.46Å
389	H	93.8	Very high	90.2	Very high	11 Å²	11	43.8 Å²	43.8	5%	0.051	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	117.9	170.3	-169.3	139.1	0	0	0	108.5	S80 L82 R164 S229 M233	S80-H389 PolarHBondContact OG-NE2 3.01Å; L82-H389 HydrophobicContact CD1-CB 4.2Å; R164-H389 PolarHBondContact NH1-CE1 3.19Å; R164-H389 PolarHBondContact NH1-ND1 3.14Å; R164-H389 PolarHBondContact NH2-ND1 3.3Å; S229-H389 WeakPolarHBondContact CB-O 3.42Å; M233-H389 HydrophobicContact CE-CB 4.41Å
390	I	95.8	Very high	90.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.7	-169.6	-64.5	173	0	0	0	110.9	S80 Y81 E222 Q225 W226 L388	S80-I390 CarbonylContact C-O 3.57Å; S80-I390 WeakPolarHBondContact CA-O 3.42Å; S80-I390 VanDerWaalsContact CB-O 3.3Å; S80-I390 WeakPolarHBondContact CB-O 3.13Å; Y81-I390 HydrophobicContact CD1-CB 4.25Å; Y81-I390 HydrophobicContact CD1-CG2 4.33Å; Y81-I390 HydrophobicContact CE1-CB 3.72Å; Y81-I390 HydrophobicContact CE1-CG2 3.46Å; Y81-I390 VanDerWaalsContact CE1-CG2 3.46Å; Y81-I390 HydrophobicContact CE2-CB 4.2Å; Y81-I390 HydrophobicContact CE2-CD1 4.1Å; Y81-I390 PolarHBondContact N-O 3.32Å; Y81-I390 PolarHBondContact O-N 3.13Å; E222-I390 HydrophobicContact CB-CD1 3.56Å; E222-I390 HydrophobicContact CG-CD1 3.65Å; Q225-I390 HydrophobicContact CB-CG2 3.52Å; Q225-I390 HydrophobicContact CG-CG2 4.4Å; W226-I390 HydrophobicContact CB-CG1 4.36Å; L388-I390 HydrophobicContact CB-CD1 3.98Å; L388-I390 HydrophobicContact CB-CG1 4Å; L388-I390 HydrophobicContact CD1-CD1 4.46Å
391	I	95.6	Very high	91.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.169	C	C	.	.			trans	-98.6	110.5	165.7	-51.1	-179.7	0	0	0	106.9	D79 L155 S229 M233 T396 L397 L400	D79-I391 WeakPolarHBondContact O-CA 3.26Å; D79-I391 WeakPolarHBondContact O-CG2 3.18Å; L155-I391 HydrophobicContact CD1-CD1 3.51Å; L155-I391 HydrophobicContact CD1-CG1 3.55Å; S229-I391 PolarHBondContact OG-N 3.48Å; M233-I391 HydrophobicContact CG-CD1 3.92Å; M233-I391 HydrophobicContact SD-CD1 4.19Å; M233-I391 HydrophobicContact SD-CG1 4.47Å; I391-T396 HydrophobicContact CG2-CG2 3.69Å; I391-L397 HydrophobicContact CB-CD2 3.8Å; I391-L397 HydrophobicContact CB-CG 4.25Å; I391-L397 HydrophobicContact CD1-CD2 4.18Å; I391-L397 HydrophobicContact CG1-CD2 4.49Å; I391-L397 HydrophobicContact CG2-CD2 3.9Å; I391-L397 HydrophobicContact CG2-CG 3.87Å; I391-L400 HydrophobicContact CD1-CD1 3.51Å
392	D	88.3	Confident	92.1	Very high	52 Å²	52	38.4 Å²	38.4	28%	0.278	18%	0.181	S	C	.	.			trans	-86.3	-19.8	175.9	49.7	0.6	0	0	0	113	Y75 Y81 Q394	Y75-D392 WeakPolarHBondContact CE1-OD2 3.48Å; Y75-D392 PolarHBondContact OH-OD2 2.88Å; Y81-D392 HydrophobicContact CD1-CB 4.38Å; Y81-D392 HydrophobicContact CE1-CB 3.82Å; D392-Q394 PolarHBondContact O-N 3.1Å
393	N	92.3	Very high	92.7	Very high	69 Å²	69	38.3 Å²	38.3	37%	0.369	18%	0.183	S	C	.	.			trans	-79.2	111.2	-179.9	-170.4	-28.8	0	0	0	111.8	D79 Q395 T396 L397	D79-N393 HydrophobicContact CB-CB 4.26Å; N393-Q395 VanDerWaalsContact C-N 3.3Å; N393-Q395 PolarHBondContact O-N 2.87Å; N393-Q395 WeakPolarHBondContact OD1-CA 3.48Å; N393-Q395 VanDerWaalsContact OD1-CB 3.27Å; N393-Q395 WeakPolarHBondContact OD1-CB 3.28Å; N393-Q395 PolarHBondContact OD1-N 2.87Å; N393-T396 WeakPolarHBondContact O-CB 3.42Å; N393-T396 PolarHBondContact O-N 3.44Å; N393-T396 PolarHBondContact OD1-N 3.39Å; N393-L397 WeakPolarHBondContact O-CG 3.38Å; N393-L397 PolarHBondContact O-N 3.34Å; N393-L397 VanDerWaalsContact O-N 3.08Å
394	Q	91.9	Very high	93.2	Very high	87 Å²	87	38.7 Å²	38.7	41%	0.407	18%	0.183	S	C	.	.	H	α-helix	trans	-61	-36.6	178.2	-66.8	-61.4	-40.4	0	0	113.2	D392 L397 F398	D392-Q394 PolarHBondContact O-N 3.1Å; Q394-L397 WeakPolarHBondContact O-CB 3.5Å; Q394-L397 PolarHBondContact O-N 3.5Å; Q394-F398 WeakPolarHBondContact O-CD2 3.43Å; Q394-F398 PolarHBondContact O-N 3.03Å; Q394-F398 VanDerWaalsContact O-N 3.08Å
395	Q	94.1	Very high	93.8	Very high	113 Å²	113	38.5 Å²	38.5	53%	0.528	18%	0.18	S	C	.	.	H	α-helix	trans	-63.9	-46.1	177.7	-178.1	62.2	23.9	0	0	110.4	N393 L397 F398 E399	N393-Q395 VanDerWaalsContact C-N 3.3Å; N393-Q395 PolarHBondContact O-N 2.87Å; N393-Q395 WeakPolarHBondContact OD1-CA 3.48Å; N393-Q395 VanDerWaalsContact OD1-CB 3.27Å; N393-Q395 WeakPolarHBondContact OD1-CB 3.28Å; N393-Q395 PolarHBondContact OD1-N 2.87Å; Q395-L397 VanDerWaalsContact C-N 3.34Å; Q395-L397 PolarHBondContact O-N 3.37Å; Q395-F398 PolarHBondContact O-N 3.48Å; Q395-F398 VanDerWaalsContact O-N 3.15Å; Q395-E399 WeakPolarHBondContact CG-OE1 3.48Å; Q395-E399 PolarHBondContact NE2-OE1 3.49Å; Q395-E399 WeakPolarHBondContact O-CG 3.49Å; Q395-E399 PolarHBondContact O-N 2.87Å
396	T	94.5	Very high	94	Very high	8 Å²	8	42.9 Å²	42.9	5%	0.049	21%	0.209	C	C	.	.	H	α-helix	trans	-56.7	-45.7	174.1	-60.3	0	0	0	0	111.8	D79 T156 I391 N393 F398 E399 L400	D79-T396 HydrophobicContact CB-CG2 3.99Å; D79-T396 WeakPolarHBondContact CB-OG1 3.46Å; D79-T396 WeakPolarHBondContact OD2-CG2 3.38Å; D79-T396 PolarHBondContact OD2-OG1 3.18Å; T156-T396 HydrophobicContact CG2-CG2 4.07Å; I391-T396 HydrophobicContact CG2-CG2 3.69Å; N393-T396 WeakPolarHBondContact O-CB 3.42Å; N393-T396 PolarHBondContact O-N 3.44Å; N393-T396 PolarHBondContact OD1-N 3.39Å; T396-F398 VanDerWaalsContact C-N 3.3Å; T396-F398 PolarHBondContact O-N 3.17Å; T396-E399 PolarHBondContact O-N 3.32Å; T396-L400 HydrophobicContact CG2-CD1 4.04Å; T396-L400 HydrophobicContact CG2-CG 4.39Å; T396-L400 WeakPolarHBondContact O-CB 3.28Å; T396-L400 WeakPolarHBondContact O-CG 3.46Å; T396-L400 PolarHBondContact O-N 3.23Å
397	L	95.8	Very high	93.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.4	-43.5	177.1	-69.8	170.1	0	0	0	111.6	M228 L232 A274 I391 N393 Q394 Q395 S401	M228-L397 HydrophobicContact CB-CD2 4.06Å; M228-L397 HydrophobicContact CE-CD1 3.98Å; M228-L397 HydrophobicContact SD-CD1 4.11Å; L232-L397 HydrophobicContact CD1-CB 3.93Å; L232-L397 HydrophobicContact CD1-CD2 3.48Å; L232-L397 VanDerWaalsContact CD1-CD2 3.48Å; L232-L397 HydrophobicContact CD1-CG 4.33Å; A274-L397 HydrophobicContact CB-CB 4.25Å; I391-L397 HydrophobicContact CB-CD2 3.8Å; I391-L397 HydrophobicContact CB-CG 4.25Å; I391-L397 HydrophobicContact CD1-CD2 4.18Å; I391-L397 HydrophobicContact CG1-CD2 4.49Å; I391-L397 HydrophobicContact CG2-CD2 3.9Å; I391-L397 HydrophobicContact CG2-CG 3.87Å; N393-L397 WeakPolarHBondContact O-CG 3.38Å; N393-L397 PolarHBondContact O-N 3.34Å; N393-L397 VanDerWaalsContact O-N 3.08Å; Q394-L397 WeakPolarHBondContact O-CB 3.5Å; Q394-L397 PolarHBondContact O-N 3.5Å; Q395-L397 VanDerWaalsContact C-N 3.34Å; Q395-L397 PolarHBondContact O-N 3.37Å; L397-S401 WeakPolarHBondContact O-CB 3.49Å; L397-S401 PolarHBondContact O-N 3.35Å
398	F	95.5	Very high	92.2	Very high	69 Å²	69	55.4 Å²	55.4	30%	0.303	29%	0.291	S	S	.	.	H	α-helix	trans	-68.7	-42.6	177.1	-88.7	-71.8	0	0	0	112.9	A273 A274 Q394 Q395 T396 S401 H402	A273-F398 HydrophobicContact CB-CE1 3.86Å; A273-F398 HydrophobicContact CB-CZ 3.57Å; A274-F398 HydrophobicContact CB-CD1 4.32Å; A274-F398 HydrophobicContact CB-CE1 4.47Å; Q394-F398 WeakPolarHBondContact O-CD2 3.43Å; Q394-F398 PolarHBondContact O-N 3.03Å; Q394-F398 VanDerWaalsContact O-N 3.08Å; Q395-F398 PolarHBondContact O-N 3.48Å; Q395-F398 VanDerWaalsContact O-N 3.15Å; T396-F398 VanDerWaalsContact C-N 3.3Å; T396-F398 PolarHBondContact O-N 3.17Å; F398-S401 WeakPolarHBondContact O-CB 3.36Å; F398-S401 PolarHBondContact O-N 3.15Å; F398-H402 PolarHBondContact O-N 3.41Å; F398-H402 PolarHBondContact O-ND1 3.28Å
399	E	95.5	Very high	92.1	Very high	73 Å²	73	58.2 Å²	58.2	34%	0.341	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-46.2	178	-74.2	175.5	-168.2	0	0	111.2	T156 Q395 T396 S401 H402 K403	T156-E399 HydrophobicContact CG2-CB 3.78Å; T156-E399 WeakPolarHBondContact CG2-OE2 3.07Å; Q395-E399 WeakPolarHBondContact CG-OE1 3.48Å; Q395-E399 PolarHBondContact NE2-OE1 3.49Å; Q395-E399 WeakPolarHBondContact O-CG 3.49Å; Q395-E399 PolarHBondContact O-N 2.87Å; T396-E399 PolarHBondContact O-N 3.32Å; E399-S401 VanDerWaalsContact C-N 3.3Å; E399-S401 PolarHBondContact O-N 3.43Å; E399-H402 PolarHBondContact O-N 2.89Å; E399-K403 WeakPolarHBondContact O-CG 3.41Å; E399-K403 PolarHBondContact O-N 2.87Å
400	L	95.8	Very high	92	Very high	9 Å²	9	60.6 Å²	60.6	5%	0.047	32%	0.319	C	S	.	.	H	α-helix	trans	-58	-43.9	173.2	-72.9	174	0	0	0	111.4	L155 T156 L161 L232 I391 T396 H402 K403 L404	L155-L400 HydrophobicContact CB-CD1 4.42Å; T156-L400 HydrophobicContact CG2-CD2 4.36Å; T156-L400 HydrophobicContact CG2-CG 4.25Å; L161-L400 HydrophobicContact CD1-CD2 4.2Å; L232-L400 HydrophobicContact CB-CB 4.27Å; I391-L400 HydrophobicContact CD1-CD1 3.51Å; T396-L400 HydrophobicContact CG2-CD1 4.04Å; T396-L400 HydrophobicContact CG2-CG 4.39Å; T396-L400 WeakPolarHBondContact O-CB 3.28Å; T396-L400 WeakPolarHBondContact O-CG 3.46Å; T396-L400 PolarHBondContact O-N 3.23Å; L400-H402 VanDerWaalsContact C-N 3.35Å; L400-H402 PolarHBondContact O-N 3.45Å; L400-K403 PolarHBondContact O-N 2.9Å; L400-L404 VanDerWaalsContact O-CG 3.31Å; L400-L404 WeakPolarHBondContact O-CG 3.26Å; L400-L404 PolarHBondContact O-N 3.48Å
401	S	97.3	Very high	91.8	Very high	0 Å²	0	64 Å²	64	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.2	-43.9	176.7	-174.6	0	0	0	0	112.7	A274 R277 L278 L397 F398 E399 L404 E405	A274-S401 VanDerWaalsContact O-CB 3.24Å; A274-S401 WeakPolarHBondContact O-CB 3.24Å; A274-S401 PolarHBondContact O-OG 2.95Å; R277-S401 WeakPolarHBondContact CD-OG 3.41Å; R277-S401 VanDerWaalsContact CG-OG 3.25Å; R277-S401 WeakPolarHBondContact CG-OG 3.32Å; R277-S401 PolarHBondContact NH1-O 3.15Å; R277-S401 PolarHBondContact NH1-OG 3.11Å; L278-S401 WeakPolarHBondContact CD2-OG 3.5Å; L397-S401 WeakPolarHBondContact O-CB 3.49Å; L397-S401 PolarHBondContact O-N 3.35Å; F398-S401 WeakPolarHBondContact O-CB 3.36Å; F398-S401 PolarHBondContact O-N 3.15Å; E399-S401 VanDerWaalsContact C-N 3.3Å; E399-S401 PolarHBondContact O-N 3.43Å; S401-L404 PolarHBondContact O-N 2.88Å; S401-E405 PolarHBondContact O-N 3.29Å
402	H	95.9	Very high	91.5	Very high	65 Å²	65	67.8 Å²	67.8	30%	0.301	36%	0.357	S	S	.	.	H	α-helix	trans	-69.3	-35.4	177.1	-72.2	88.4	0	0	0	112.5	F398 E399 L400 L404 E405 P406	F398-H402 PolarHBondContact O-N 3.41Å; F398-H402 PolarHBondContact O-ND1 3.28Å; E399-H402 PolarHBondContact O-N 2.89Å; L400-H402 VanDerWaalsContact C-N 3.35Å; L400-H402 PolarHBondContact O-N 3.45Å; H402-L404 VanDerWaalsContact C-N 3.33Å; H402-E405 CarbonylContact O-C 3.55Å; H402-E405 VanDerWaalsContact O-C 3.3Å; H402-P406 VanDerWaalsContact O-CA 3.29Å; H402-P406 WeakPolarHBondContact O-CA 3.49Å; H402-P406 WeakPolarHBondContact O-CD 3.44Å; H402-P406 WeakPolarHBondContact O-CG 3.34Å
403	K	94.2	Very high	91.8	Very high	114 Å²	114	68.8 Å²	68.8	50%	0.496	36%	0.362	S	S	.	.	H	α-helix	trans	-64.4	-37.6	172.8	-71.7	-174.4	-173.7	-164.6	0	111.6	T156 D157 E399 L400	T156-K403 VanDerWaalsContact C-NZ 3.34Å; T156-K403 PolarHBondContact O-NZ 2.73Å; D157-K403 IonicContact OD1-NZ 3.4Å; D157-K403 PolarHBondContact OD1-NZ 2.82Å; E399-K403 WeakPolarHBondContact O-CG 3.41Å; E399-K403 PolarHBondContact O-N 2.87Å; L400-K403 PolarHBondContact O-N 2.9Å
404	L	95.4	Very high	91.7	Very high	30 Å²	30	68.7 Å²	68.7	16%	0.157	36%	0.361	C	S	.	.	H	α-helix	trans	-70.2	-44.5	177.4	-71	178.7	0	0	0	112.8	L232 L278 L400 S401 H402	L232-L404 HydrophobicContact CD2-CD1 4.13Å; L232-L404 WeakPolarHBondContact O-CD1 3.44Å; L278-L404 HydrophobicContact CD2-CB 4.3Å; L400-L404 VanDerWaalsContact O-CG 3.31Å; L400-L404 WeakPolarHBondContact O-CG 3.26Å; L400-L404 PolarHBondContact O-N 3.48Å; S401-L404 PolarHBondContact O-N 2.88Å; H402-L404 VanDerWaalsContact C-N 3.33Å
405	E	96.3	Very high	91.7	Very high	6 Å²	6	67.4 Å²	67.4	3%	0.028	36%	0.358	C	S	.	.	S	Bend	trans	-141	90.4	-178.4	-64.8	-175.4	-154.8	0	0	109.2	R240 R277 L278 N279 Q280 T281 S401 H402	R240-E405 IonicContact CZ-OE1 3.68Å; R240-E405 IonicContact NE-OE1 2.72Å; R240-E405 IonicContact NH2-OE1 3.47Å; R240-E405 PolarHBondContact NH2-OE1 2.9Å; R277-E405 PolarHBondContact NH1-O 3.37Å; R277-E405 PolarHBondContact NH2-O 2.93Å; L278-E405 VanDerWaalsContact CA-OE2 3.23Å; L278-E405 WeakPolarHBondContact CA-OE2 3.49Å; L278-E405 HydrophobicContact CD2-CB 4.07Å; L278-E405 HydrophobicContact CD2-CG 4.01Å; N279-E405 PolarHBondContact N-OE2 3.26Å; Q280-E405 HydrophobicContact CB-CG 4.47Å; Q280-E405 WeakPolarHBondContact CB-OE2 3.44Å; Q280-E405 HydrophobicContact CG-CG 4.49Å; Q280-E405 PolarHBondContact N-OE2 2.88Å; T281-E405 WeakPolarHBondContact CB-OE1 3.2Å; T281-E405 PolarHBondContact N-OE1 3.16Å; T281-E405 VanDerWaalsContact N-OE1 3.15Å; T281-E405 PolarHBondContact OG1-OE1 2.82Å; S401-E405 PolarHBondContact O-N 3.29Å; H402-E405 CarbonylContact O-C 3.55Å; H402-E405 VanDerWaalsContact O-C 3.3Å
406	P	92.6	Very high	91.5	Very high	93 Å²	93	63.9 Å²	63.9	60%	0.604	35%	0.345	S	S	*	.			trans	-58	146.6	177.6	-25.1	34.5	0	0	0	111.5	H402 A408	H402-P406 VanDerWaalsContact O-CA 3.29Å; H402-P406 WeakPolarHBondContact O-CA 3.49Å; H402-P406 WeakPolarHBondContact O-CD 3.44Å; H402-P406 WeakPolarHBondContact O-CG 3.34Å; P406-A408 PolarHBondContact O-N 3.16Å
407	R	81.8	Confident	91.3	Very high	189 Å²	189	68.6 Å²	68.6	71%	0.713	37%	0.37	S	S	*	.			trans	-68	128.5	169.2	-71.4	-172.9	173.3	170.4	1.5	107.6
408	A	59.2	Low	90.9	Very high	175 Å²	175	74.8 Å²	74.8	100%	1.446	40%	0.403	S	S	*	.			trans	-66.3	0	172.4	0	0	0	0	0	111.1	P406	P406-A408 PolarHBondContact O-N 3.16Å

Retrieved 408 of 408 residues in 198 ms (Link to these results)

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