A0A096LPP2_POEFO Loading...

Glycerol-3-phosphate dehydrogenase [NAD(+)]

Has glycerol-3-phosphate dehydrogenase activity.

AlphaFold DB , UniProt , Accession A0A096LPP2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 351 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	59.3	Low	92	Very high	246 Å²	246	60.5 Å²	60.5	100%	1.212	35%	0.353	S	S	*	.				0	142.4	0	-71.4	-178.4	-119	0	0	107.7
2	A	78.4	Confident	92.4	Very high	96 Å²	96	56.4 Å²	56.4	79%	0.793	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-62.9	149.4	173.8	0	0	0	0	0	109.7
3	A	90.6	Very high	92.4	Very high	80 Å²	80	54.3 Å²	54.3	66%	0.661	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-60.1	143.6	176.6	0	0	0	0	0	110.7
4	P	96.3	Very high	92.3	Very high	63 Å²	63	53.7 Å²	53.7	41%	0.409	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-57.9	141.3	176.5	-21.4	31.6	0	0	0	111.6	K32 D34	P4-K32 CarbonylContact C-O 3.52Å; P4-K32 WeakPolarHBondContact CA-O 3.44Å; P4-D34 HydrophobicContact CB-CB 4.4Å
5	K	97.8	Very high	92.4	Very high	75 Å²	75	53.1 Å²	53.1	33%	0.326	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	124.1	-178.4	-64.3	-58.7	-168.7	173	0	110.8	K32 F33 D34 D88 I89	K5-K32 PolarHBondContact N-O 2.67Å; K5-F33 HydrophobicContact CB-CD1 4.16Å; K5-F33 WeakPolarHBondContact O-CA 3.43Å; K5-D34 PolarHBondContact O-N 3.13Å; K5-D88 WeakPolarHBondContact CA-OD2 3.41Å; K5-D88 HydrophobicContact CB-CB 4.11Å; K5-D88 HydrophobicContact CD-CB 3.76Å; K5-D88 HydrophobicContact CG-CB 4.5Å; K5-D88 IonicContact NZ-OD1 3.83Å; K5-I89 HydrophobicContact CB-CD1 4.31Å
6	K	98.3	Very high	92.7	Very high	99 Å²	99	49.9 Å²	49.9	43%	0.43	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	131	176.3	-72.3	-175.3	172.5	-170.3	0	111	D34 D88 I89	K6-D34 HydrophobicContact CB-CB 4.48Å; K6-D34 VanDerWaalsContact CE-OD2 3.22Å; K6-D34 WeakPolarHBondContact CE-OD2 3.42Å; K6-D34 HydrophobicContact CG-CB 3.75Å; K6-D88 PolarHBondContact N-OD2 2.7Å; K6-D88 PolarHBondContact O-N 2.72Å; K6-I89 PolarHBondContact O-N 2.68Å
7	V	98.6	Very high	93	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.024	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	135	-178.3	-172.1	0	0	0	0	110	I23 F33 N38 I89 I91 L181	V7-I23 HydrophobicContact CB-CG2 4.36Å; V7-I23 HydrophobicContact CG1-CG2 3.71Å; V7-F33 HydrophobicContact CG2-CD1 4.18Å; V7-N38 PolarHBondContact O-N 3.26Å; V7-I89 HydrophobicContact CG1-CB 4.42Å; V7-I89 HydrophobicContact CG2-CB 4.3Å; V7-I89 HydrophobicContact CG2-CD1 4.29Å; V7-I91 HydrophobicContact CG1-CG1 4.13Å; V7-L181 HydrophobicContact CG1-CD2 4.08Å; V7-L181 HydrophobicContact CG2-CD1 4.04Å; V7-L181 HydrophobicContact CG2-CD2 4.15Å
8	C	98.2	Very high	93.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131	175.5	171.6	0	0	0	0	110.2	N38 T83 A87 I89 I91	C8-N38 CarbonylContact C-O 3.57Å; C8-N38 WeakPolarHBondContact CA-O 3.2Å; C8-T83 WeakPolarHBondContact SG-CG2 3.43Å; C8-T83 PolarHBondContact SG-O 3.43Å; C8-A87 HydrophobicContact CB-CB 3.65Å; C8-I89 PolarHBondContact N-O 3.3Å; C8-I91 PolarHBondContact O-N 2.98Å
9	V	98.8	Very high	93.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	108.9	174.1	-175.2	0	0	0	0	109.2	G11 I23 V37 N38 M39 W40 I91 V93	V9-G11 WeakPolarHBondContact CG1-O 3.38Å; V9-G11 PolarHBondContact O-N 2.94Å; V9-I23 HydrophobicContact CG2-CD1 3.94Å; V9-V37 HydrophobicContact CG2-CG1 4.03Å; V9-N38 PolarHBondContact N-O 3.15Å; V9-M39 HydrophobicContact CB-CB 4.25Å; V9-M39 HydrophobicContact CB-CG 4.11Å; V9-M39 HydrophobicContact CG1-CG 4.24Å; V9-M39 CarbonylContact O-C 3.5Å; V9-M39 VanDerWaalsContact O-CA 3.31Å; V9-M39 WeakPolarHBondContact O-CA 3.32Å; V9-W40 PolarHBondContact O-N 3.05Å; V9-I91 HydrophobicContact CG2-CB 4.45Å; V9-V93 HydrophobicContact CG1-CG1 3.62Å
10	I	98.6	Very high	93.8	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	92.6	177.2	-55.7	164.8	0	0	0	107.9	W40 L80 V84 L90 I91 F92 V93 V94 V102 I106	I10-W40 HydrophobicContact CG2-CE3 3.74Å; I10-W40 HydrophobicContact CG2-CZ3 4.34Å; I10-L80 HydrophobicContact CG2-CD1 3.94Å; I10-V84 HydrophobicContact CD1-CG1 3.95Å; I10-V84 HydrophobicContact CG1-CG1 4.1Å; I10-L90 HydrophobicContact CD1-CB 4.06Å; I10-L90 HydrophobicContact CD1-CD2 3.94Å; I10-I91 WeakPolarHBondContact CA-O 3.4Å; I10-I91 PolarHBondContact N-O 3.23Å; I10-F92 HydrophobicContact CB-CD1 4.46Å; I10-F92 HydrophobicContact CD1-CD1 3.72Å; I10-F92 HydrophobicContact CD1-CE1 3.4Å; I10-F92 VanDerWaalsContact CD1-CE1 3.4Å; I10-F92 HydrophobicContact CD1-CE2 4.38Å; I10-F92 HydrophobicContact CD1-CG 4.34Å; I10-F92 HydrophobicContact CD1-CZ 3.77Å; I10-V93 CarbonylContact O-C 3.55Å; I10-V93 PolarHBondContact O-N 2.65Å; I10-V94 HydrophobicContact CG2-CG1 4.35Å; I10-V94 WeakPolarHBondContact O-CG1 3.46Å; I10-V102 HydrophobicContact CG2-CG1 3.65Å; I10-I106 HydrophobicContact CD1-CD1 3.98Å
11	G	96.9	Very high	94	Very high	3 Å²	3	39.7 Å²	39.7	3%	0.031	23%	0.231	C	C	.	.			trans	128.1	137.1	178.2	0	0	0	0	0	112.6	V9	V9-G11 WeakPolarHBondContact CG1-O 3.38Å; V9-G11 PolarHBondContact O-N 2.94Å
12	S	96.6	Very high	95.9	Very high	11 Å²	11	28.6 Å²	28.6	8%	0.077	18%	0.176	C	C	.	.			trans	-132.8	24.5	-171.3	46	0	0	0	0	112.6	S17 W40 V41 N61	S12-S17 PolarHBondContact O-OG 3.09Å; S12-W40 WeakPolarHBondContact CB-O 3.47Å; S12-W40 PolarHBondContact OG-O 3Å; S12-V41 WeakPolarHBondContact OG-CA 3.4Å; S12-N61 PolarHBondContact O-ND2 3.22Å
13	G	93	Very high	96.8	Very high	29 Å²	29	24 Å²	24	30%	0.299	14%	0.139	S	C	.	.	S	Bend	trans	-67.2	-168.4	169.2	0	0	0	0	0	112.2	W15 G16 S17	G13-W15 PolarHBondContact O-N 3.28Å; G13-G16 PolarHBondContact O-N 3.25Å; G13-S17 WeakPolarHBondContact O-CB 3.25Å; G13-S17 PolarHBondContact O-N 3.21Å; G13-S17 PolarHBondContact O-OG 3.21Å
14	N	90.5	Very high	97.2	Very high	46 Å²	46	20.2 Å²	20.2	25%	0.246	11%	0.107	C	C	.	.	H	α-helix	trans	-56.8	-47.9	-178.9	177.7	-112.4	0	0	0	112	A18 Y64 A154 N155	N14-A18 PolarHBondContact O-N 3.45Å; N14-Y64 VanDerWaalsContact CA-O 3.3Å; N14-Y64 WeakPolarHBondContact CA-O 3.19Å; N14-Y64 VanDerWaalsContact CB-O 3.26Å; N14-Y64 WeakPolarHBondContact CB-O 3.32Å; N14-Y64 PolarHBondContact ND2-O 2.93Å; N14-A154 WeakPolarHBondContact OD1-CB 3.2Å; N14-N155 PolarHBondContact ND2-OD1 2.93Å
15	W	93.6	Very high	97.3	Very high	45 Å²	45	19.7 Å²	19.7	17%	0.17	11%	0.108	C	C	.	.	H	α-helix	trans	-71.6	-39	175.6	-171.8	-133.1	0	0	0	113.5	G13 S17 A18 I19 V93 L148 N152 A154 V157 F187	G13-W15 PolarHBondContact O-N 3.28Å; W15-S17 VanDerWaalsContact C-N 3.31Å; W15-S17 PolarHBondContact O-N 3.01Å; W15-A18 HydrophobicContact CE3-CB 4.01Å; W15-A18 HydrophobicContact CZ3-CB 4.25Å; W15-A18 PolarHBondContact O-N 2.88Å; W15-I19 HydrophobicContact CD2-CG1 3.92Å; W15-I19 HydrophobicContact CE3-CG1 4.21Å; W15-I19 HydrophobicContact CH2-CD1 3.55Å; W15-I19 HydrophobicContact CH2-CG1 3.98Å; W15-I19 HydrophobicContact CZ2-CD1 3.49Å; W15-I19 VanDerWaalsContact CZ2-CD1 3.49Å; W15-I19 HydrophobicContact CZ2-CG1 3.68Å; W15-I19 HydrophobicContact CZ3-CD1 4.15Å; W15-I19 HydrophobicContact CZ3-CG1 4.25Å; W15-I19 WeakPolarHBondContact O-CB 3.4Å; W15-I19 WeakPolarHBondContact O-CG1 3.47Å; W15-I19 PolarHBondContact O-N 3.01Å; W15-V93 HydrophobicContact CB-CG2 4.23Å; W15-V93 VanDerWaalsContact CD1-CG2 3.47Å; W15-V93 HydrophobicContact CG-CG2 4.08Å; W15-L148 HydrophobicContact CZ2-CD2 4.44Å; W15-N152 HydrophobicContact CH2-CB 3.42Å; W15-N152 VanDerWaalsContact CH2-CB 3.42Å; W15-N152 HydrophobicContact CZ2-CB 3.83Å; W15-N152 HydrophobicContact CZ3-CB 4.07Å; W15-A154 HydrophobicContact CB-CB 4.38Å; W15-A154 HydrophobicContact CE3-CB 3.59Å; W15-A154 HydrophobicContact CZ3-CB 4.33Å; W15-V157 HydrophobicContact CH2-CB 4.39Å; W15-V157 HydrophobicContact CH2-CG1 4.23Å; W15-V157 HydrophobicContact CH2-CG2 3.94Å; W15-V157 HydrophobicContact CZ3-CB 3.84Å; W15-V157 HydrophobicContact CZ3-CG1 3.96Å; W15-V157 HydrophobicContact CZ3-CG2 3.7Å; W15-F187 HydrophobicContact CH2-CE2 4.07Å; W15-F187 HydrophobicContact CH2-CZ 4.3Å
16	G	96.9	Very high	97.4	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-60.9	-40.2	177.5	0	0	0	0	0	112.5	G13 A20	G13-G16 PolarHBondContact O-N 3.25Å; G16-A20 WeakPolarHBondContact O-CB 3.48Å; G16-A20 PolarHBondContact O-N 3.31Å
17	S	98.1	Very high	97.4	Very high	0 Å²	0	12 Å²	12	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-69.9	-41.6	176.7	-59.5	0	0	0	0	112.1	S12 G13 W15 I19 A20 K21 N61 L70	S12-S17 PolarHBondContact O-OG 3.09Å; G13-S17 WeakPolarHBondContact O-CB 3.25Å; G13-S17 PolarHBondContact O-N 3.21Å; G13-S17 PolarHBondContact O-OG 3.21Å; W15-S17 VanDerWaalsContact C-N 3.31Å; W15-S17 PolarHBondContact O-N 3.01Å; S17-I19 VanDerWaalsContact C-N 3.31Å; S17-I19 PolarHBondContact O-N 3.24Å; S17-A20 PolarHBondContact O-N 3.45Å; S17-K21 PolarHBondContact O-N 3.14Å; S17-K21 VanDerWaalsContact O-N 3.13Å; S17-N61 PolarHBondContact OG-ND2 3.08Å; S17-L70 WeakPolarHBondContact O-CD2 3.45Å
18	A	98	Very high	97.4	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-62	-41.1	176.3	0	0	0	0	0	111.5	N14 W15 K21 L65 A154 A158	N14-A18 PolarHBondContact O-N 3.45Å; W15-A18 HydrophobicContact CE3-CB 4.01Å; W15-A18 HydrophobicContact CZ3-CB 4.25Å; W15-A18 PolarHBondContact O-N 2.88Å; A18-K21 WeakPolarHBondContact O-CB 3.3Å; A18-K21 PolarHBondContact O-N 3.03Å; A18-L65 HydrophobicContact CB-CD2 4.33Å; A18-A154 HydrophobicContact CB-CB 4.23Å; A18-A158 HydrophobicContact CB-CB 4.27Å
19	I	98.1	Very high	97.3	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-71.1	-36.8	175.8	-72	-57.4	0	0	0	112.2	W15 S17 K21 I22 I23 I91 L119 M182	W15-I19 HydrophobicContact CD2-CG1 3.92Å; W15-I19 HydrophobicContact CE3-CG1 4.21Å; W15-I19 HydrophobicContact CH2-CD1 3.55Å; W15-I19 HydrophobicContact CH2-CG1 3.98Å; W15-I19 HydrophobicContact CZ2-CD1 3.49Å; W15-I19 VanDerWaalsContact CZ2-CD1 3.49Å; W15-I19 HydrophobicContact CZ2-CG1 3.68Å; W15-I19 HydrophobicContact CZ3-CD1 4.15Å; W15-I19 HydrophobicContact CZ3-CG1 4.25Å; W15-I19 WeakPolarHBondContact O-CB 3.4Å; W15-I19 WeakPolarHBondContact O-CG1 3.47Å; W15-I19 PolarHBondContact O-N 3.01Å; S17-I19 VanDerWaalsContact C-N 3.31Å; S17-I19 PolarHBondContact O-N 3.24Å; I19-K21 PolarHBondContact O-N 3.47Å; I19-I22 HydrophobicContact CD1-CD1 4.28Å; I19-I22 PolarHBondContact O-N 3.38Å; I19-I22 VanDerWaalsContact O-N 3.1Å; I19-I23 HydrophobicContact CG2-CD1 3.43Å; I19-I23 VanDerWaalsContact CG2-CD1 3.43Å; I19-I23 HydrophobicContact CG2-CG1 3.95Å; I19-I23 WeakPolarHBondContact O-CB 3.36Å; I19-I23 WeakPolarHBondContact O-CG1 3.5Å; I19-I23 PolarHBondContact O-N 3.48Å; I19-I91 HydrophobicContact CG2-CG2 4.39Å; I19-L119 HydrophobicContact CB-CD2 4.38Å; I19-L119 HydrophobicContact CD1-CD2 4.23Å; I19-L119 HydrophobicContact CG1-CD2 3.71Å; I19-L119 HydrophobicContact CG2-CD2 4.07Å; I19-M182 HydrophobicContact CD1-CE 3.84Å; I19-M182 HydrophobicContact CG2-CE 3.83Å
20	A	98.6	Very high	97.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.1	-32.3	173.3	0	0	0	0	0	112.1	G16 S17 G24 M39 V74	G16-A20 WeakPolarHBondContact O-CB 3.48Å; G16-A20 PolarHBondContact O-N 3.31Å; S17-A20 PolarHBondContact O-N 3.45Å; A20-G24 WeakPolarHBondContact O-CA 3.39Å; A20-G24 PolarHBondContact O-N 3.17Å; A20-M39 HydrophobicContact CB-SD 3.66Å; A20-V74 HydrophobicContact CB-CG1 4.11Å; A20-V74 HydrophobicContact CB-CG2 4.5Å; A20-V74 WeakPolarHBondContact O-CG2 3.36Å
21	K	98.6	Very high	97.1	Very high	34 Å²	34	31.6 Å²	31.6	15%	0.148	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-50.4	171.2	-65.3	-178.1	63.5	177.6	0	112.4	S17 A18 I19 A25 L65 H68 K69 L70 P71 A158	S17-K21 PolarHBondContact O-N 3.14Å; S17-K21 VanDerWaalsContact O-N 3.13Å; A18-K21 WeakPolarHBondContact O-CB 3.3Å; A18-K21 PolarHBondContact O-N 3.03Å; I19-K21 PolarHBondContact O-N 3.47Å; K21-A25 WeakPolarHBondContact O-CB 3.4Å; K21-A25 PolarHBondContact O-N 3.46Å; K21-A25 VanDerWaalsContact O-N 3.07Å; K21-L65 HydrophobicContact CD-CD2 4.12Å; K21-H68 HydrophobicContact CD-CB 4.18Å; K21-K69 VanDerWaalsContact CE-O 3.25Å; K21-K69 WeakPolarHBondContact CE-O 3.38Å; K21-L70 HydrophobicContact CD-CD2 4.39Å; K21-L70 HydrophobicContact CG-CD2 3.53Å; K21-P71 WeakPolarHBondContact O-CG 3.22Å; K21-A158 HydrophobicContact CD-CB 4.37Å; K21-A158 PolarHBondContact NZ-O 2.86Å
22	I	98.7	Very high	97.1	Very high	14 Å²	14	35.6 Å²	35.6	7%	0.072	19%	0.194	C	C	.	.	H	α-helix	trans	-62.9	-51.6	180	-70.3	179.2	0	0	0	110.6	I19 A25 N26 V157 M182 T184 F187	I19-I22 HydrophobicContact CD1-CD1 4.28Å; I19-I22 PolarHBondContact O-N 3.38Å; I19-I22 VanDerWaalsContact O-N 3.1Å; I22-A25 PolarHBondContact O-N 3Å; I22-N26 WeakPolarHBondContact O-CB 3.23Å; I22-N26 PolarHBondContact O-N 3.27Å; I22-V157 HydrophobicContact CD1-CG1 3.62Å; I22-M182 WeakPolarHBondContact CG2-O 3.43Å; I22-T184 HydrophobicContact CB-CG2 4.44Å; I22-T184 HydrophobicContact CD1-CG2 4.42Å; I22-T184 HydrophobicContact CG1-CG2 4.07Å; I22-T184 HydrophobicContact CG2-CG2 3.86Å; I22-F187 HydrophobicContact CD1-CB 3.96Å; I22-F187 HydrophobicContact CD1-CD1 3.92Å; I22-F187 HydrophobicContact CD1-CD2 4.13Å; I22-F187 HydrophobicContact CD1-CE1 4.4Å; I22-F187 HydrophobicContact CD1-CG 3.74Å
23	I	98.8	Very high	97.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-46.2	-177.1	-68.9	-179.6	0	0	0	110.4	V7 V9 I19 A25 N26 A27 V37 I91 L181 M182	V7-I23 HydrophobicContact CB-CG2 4.36Å; V7-I23 HydrophobicContact CG1-CG2 3.71Å; V9-I23 HydrophobicContact CG2-CD1 3.94Å; I19-I23 HydrophobicContact CG2-CD1 3.43Å; I19-I23 VanDerWaalsContact CG2-CD1 3.43Å; I19-I23 HydrophobicContact CG2-CG1 3.95Å; I19-I23 WeakPolarHBondContact O-CB 3.36Å; I19-I23 WeakPolarHBondContact O-CG1 3.5Å; I19-I23 PolarHBondContact O-N 3.48Å; I23-A25 PolarHBondContact O-N 3.25Å; I23-N26 PolarHBondContact O-N 2.88Å; I23-A27 WeakPolarHBondContact O-CB 3.12Å; I23-A27 PolarHBondContact O-N 3.35Å; I23-V37 HydrophobicContact CG2-CG1 3.74Å; I23-V37 HydrophobicContact CG2-CG2 4.03Å; I23-I91 HydrophobicContact CD1-CB 4.46Å; I23-I91 HydrophobicContact CD1-CD1 4.35Å; I23-I91 HydrophobicContact CD1-CG1 3.74Å; I23-I91 HydrophobicContact CD1-CG2 4.32Å; I23-L181 HydrophobicContact CG1-CG 4.42Å; I23-L181 HydrophobicContact CG2-CD1 4.09Å; I23-M182 HydrophobicContact CD1-CE 4.43Å; I23-M182 HydrophobicContact CD1-SD 3.83Å; I23-M182 HydrophobicContact CG1-SD 3.65Å
24	G	98.7	Very high	97.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.2	-45.7	177.6	0	0	0	0	0	112	A20 A27 A28 N73	A20-G24 WeakPolarHBondContact O-CA 3.39Å; A20-G24 PolarHBondContact O-N 3.17Å; G24-A27 PolarHBondContact O-N 3.12Å; G24-A28 WeakPolarHBondContact O-CB 3.39Å; G24-A28 PolarHBondContact O-N 3.35Å; G24-N73 PolarHBondContact O-ND2 3.45Å
25	A	98.5	Very high	97.8	Very high	51 Å²	51	37.3 Å²	37.3	42%	0.421	20%	0.201	S	C	.	.	H	α-helix	trans	-63.5	-44.3	178.1	0	0	0	0	0	112.4	K21 I22 I23 K29	K21-A25 WeakPolarHBondContact O-CB 3.4Å; K21-A25 PolarHBondContact O-N 3.46Å; K21-A25 VanDerWaalsContact O-N 3.07Å; I22-A25 PolarHBondContact O-N 3Å; I23-A25 PolarHBondContact O-N 3.25Å; A25-K29 WeakPolarHBondContact O-CB 3.35Å; A25-K29 PolarHBondContact O-N 3.37Å; A25-K29 VanDerWaalsContact O-N 3.16Å
26	N	98.6	Very high	98	Very high	10 Å²	10	37.4 Å²	37.4	5%	0.053	21%	0.209	C	C	.	.	H	α-helix	trans	-71.8	-36.7	179.6	-79	-23.2	0	0	0	112.7	I22 I23 A28 K29 Y30 E180 L181 Q183	I22-N26 WeakPolarHBondContact O-CB 3.23Å; I22-N26 PolarHBondContact O-N 3.27Å; I23-N26 PolarHBondContact O-N 2.88Å; N26-A28 VanDerWaalsContact C-N 3.33Å; N26-A28 PolarHBondContact O-N 2.9Å; N26-K29 PolarHBondContact O-N 3.09Å; N26-K29 VanDerWaalsContact O-N 3.13Å; N26-Y30 HydrophobicContact CB-CD2 4.19Å; N26-Y30 HydrophobicContact CB-CE2 4.2Å; N26-Y30 VanDerWaalsContact O-CD2 3.27Å; N26-Y30 WeakPolarHBondContact O-CD2 3.01Å; N26-Y30 PolarHBondContact O-N 3.28Å; N26-E180 PolarHBondContact ND2-O 3.28Å; N26-L181 WeakPolarHBondContact CB-O 3.28Å; N26-L181 PolarHBondContact ND2-O 3.38Å; N26-Q183 PolarHBondContact ND2-O 3.48Å
27	A	98.5	Very high	98.1	Very high	3 Å²	3	37.4 Å²	37.4	3%	0.025	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-34.8	176.3	0	0	0	0	0	112.4	I23 G24 K29 F33 V37	I23-A27 WeakPolarHBondContact O-CB 3.12Å; I23-A27 PolarHBondContact O-N 3.35Å; G24-A27 PolarHBondContact O-N 3.12Å; A27-K29 VanDerWaalsContact C-N 3.31Å; A27-F33 HydrophobicContact CB-CB 4.05Å; A27-V37 HydrophobicContact CB-CG2 3.57Å
28	A	98.1	Very high	98.1	Very high	62 Å²	62	39.3 Å²	39.3	51%	0.512	22%	0.219	S	C	.	.	H	α-helix	trans	-72.4	-24.7	172	0	0	0	0	0	113.2	G24 N26	G24-A28 WeakPolarHBondContact O-CB 3.39Å; G24-A28 PolarHBondContact O-N 3.35Å; N26-A28 VanDerWaalsContact C-N 3.33Å; N26-A28 PolarHBondContact O-N 2.9Å
29	K	97.7	Very high	98.1	Very high	130 Å²	130	39.3 Å²	39.3	57%	0.565	22%	0.218	S	C	*	.	H	α-helix	trans	-87.1	-37.7	-175.7	179.5	-176.2	175.4	-167.1	0	113.6	A25 N26 A27	A25-K29 WeakPolarHBondContact O-CB 3.35Å; A25-K29 PolarHBondContact O-N 3.37Å; A25-K29 VanDerWaalsContact O-N 3.16Å; N26-K29 PolarHBondContact O-N 3.09Å; N26-K29 VanDerWaalsContact O-N 3.13Å; A27-K29 VanDerWaalsContact C-N 3.31Å
30	Y	97.1	Very high	98.2	Very high	71 Å²	71	41 Å²	41	28%	0.278	23%	0.225	S	C	.	.			trans	-111.4	120.3	-172.8	-57.5	-67.5	0	0	0	111.7	N26 K32 F33	N26-Y30 HydrophobicContact CB-CD2 4.19Å; N26-Y30 HydrophobicContact CB-CE2 4.2Å; N26-Y30 VanDerWaalsContact O-CD2 3.27Å; N26-Y30 WeakPolarHBondContact O-CD2 3.01Å; N26-Y30 PolarHBondContact O-N 3.28Å; Y30-K32 PolarHBondContact O-N 2.76Å; Y30-F33 HydrophobicContact CD2-CD2 4.47Å; Y30-F33 HydrophobicContact CD2-CE2 4.32Å; Y30-F33 PolarHBondContact O-N 2.74Å
31	D	96.2	Very high	98.1	Very high	152 Å²	152	41 Å²	41	81%	0.813	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-14.1	-177.4	-58.3	-27.7	0	0	0	115.2	F33	D31-F33 VanDerWaalsContact C-N 3.26Å; D31-F33 PolarHBondContact O-N 3.08Å
32	K	96.4	Very high	97.9	Very high	88 Å²	88	45.5 Å²	45.5	38%	0.383	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-12.2	176.9	69.6	179.5	64.9	-179.7	0	113.4	P4 K5 Y30 L177 E180	P4-K32 CarbonylContact C-O 3.52Å; P4-K32 WeakPolarHBondContact CA-O 3.44Å; K5-K32 PolarHBondContact N-O 2.67Å; Y30-K32 PolarHBondContact O-N 2.76Å; K32-L177 HydrophobicContact CD-CD1 3.93Å; K32-E180 VanDerWaalsContact CD-OE2 3.25Å; K32-E180 WeakPolarHBondContact CD-OE2 3.37Å; K32-E180 WeakPolarHBondContact CE-OE2 3.48Å; K32-E180 IonicContact NZ-OE1 3.52Å; K32-E180 PolarHBondContact NZ-OE1 2.95Å; K32-E180 IonicContact NZ-OE2 2.85Å; K32-E180 PolarHBondContact NZ-OE2 3.21Å
33	F	98.1	Very high	97.9	Very high	5 Å²	5	47.7 Å²	47.7	2%	0.022	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	142.6	174.6	-57.4	-64.6	0	0	0	109.5	K5 V7 A27 Y30 D31 S35 I89 L177 E180 L181	K5-F33 HydrophobicContact CB-CD1 4.16Å; K5-F33 WeakPolarHBondContact O-CA 3.43Å; V7-F33 HydrophobicContact CG2-CD1 4.18Å; A27-F33 HydrophobicContact CB-CB 4.05Å; Y30-F33 HydrophobicContact CD2-CD2 4.47Å; Y30-F33 HydrophobicContact CD2-CE2 4.32Å; Y30-F33 PolarHBondContact O-N 2.74Å; D31-F33 VanDerWaalsContact C-N 3.26Å; D31-F33 PolarHBondContact O-N 3.08Å; F33-S35 PolarHBondContact O-N 3.18Å; F33-I89 HydrophobicContact CD1-CD1 4.39Å; F33-I89 HydrophobicContact CE1-CD1 3.98Å; F33-L177 HydrophobicContact CE1-CD1 3.67Å; F33-L177 HydrophobicContact CE1-CG 4.12Å; F33-L177 HydrophobicContact CZ-CD1 3.75Å; F33-L177 HydrophobicContact CZ-CG 4.31Å; F33-E180 HydrophobicContact CE2-CB 4.43Å; F33-L181 HydrophobicContact CD1-CD1 4.02Å; F33-L181 HydrophobicContact CD2-CD1 4.13Å; F33-L181 HydrophobicContact CE1-CB 4.11Å; F33-L181 HydrophobicContact CE1-CD1 4Å; F33-L181 HydrophobicContact CE1-CG 4.45Å; F33-L181 HydrophobicContact CE2-CB 4.2Å; F33-L181 HydrophobicContact CE2-CD1 4.12Å; F33-L181 HydrophobicContact CG-CD1 4.1Å; F33-L181 HydrophobicContact CZ-CB 3.71Å; F33-L181 HydrophobicContact CZ-CD1 4.07Å; F33-L181 HydrophobicContact CZ-CG 4.43Å
34	D	98.2	Very high	97.7	Very high	44 Å²	44	50 Å²	50	24%	0.235	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	131.2	169.1	-167.7	-50.3	0	0	0	108	P4 K5 K6 S36	P4-D34 HydrophobicContact CB-CB 4.4Å; K5-D34 PolarHBondContact O-N 3.13Å; K6-D34 HydrophobicContact CB-CB 4.48Å; K6-D34 VanDerWaalsContact CE-OD2 3.22Å; K6-D34 WeakPolarHBondContact CE-OD2 3.42Å; K6-D34 HydrophobicContact CG-CB 3.75Å; D34-S36 PolarHBondContact O-N 3.44Å; D34-S36 PolarHBondContact OD1-N 3.35Å
35	S	97.5	Very high	97.6	Very high	72 Å²	72	55.4 Å²	55.4	50%	0.503	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	-32.4	180	62.6	0	0	0	0	112.1	F33 N73	F33-S35 PolarHBondContact O-N 3.18Å; S35-N73 VanDerWaalsContact O-CB 3.25Å; S35-N73 WeakPolarHBondContact O-CB 3.32Å; S35-N73 PolarHBondContact O-ND2 3.18Å
36	S	98.1	Very high	97.3	Very high	48 Å²	48	54.1 Å²	54.1	34%	0.336	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.6	179.8	-171.3	0	0	0	0	110.9	D34	D34-S36 PolarHBondContact O-N 3.44Å; D34-S36 PolarHBondContact OD1-N 3.35Å
37	V	98.8	Very high	97	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	110.5	178	-179.6	0	0	0	0	109	V9 I23 A27 N73 V74 V75	V9-V37 HydrophobicContact CG2-CG1 4.03Å; I23-V37 HydrophobicContact CG2-CG1 3.74Å; I23-V37 HydrophobicContact CG2-CG2 4.03Å; A27-V37 HydrophobicContact CB-CG2 3.57Å; V37-N73 PolarHBondContact N-O 3.16Å; V37-V74 HydrophobicContact CB-CG2 4.49Å; V37-V74 CarbonylContact O-C 3.54Å; V37-V74 WeakPolarHBondContact O-CA 3.33Å; V37-V75 PolarHBondContact O-N 3.11Å
38	N	98.7	Very high	96.8	Very high	41 Å²	41	64 Å²	64	22%	0.219	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	137.7	174.9	-69.6	-8.3	0	0	0	109.9	V7 C8 V9 V75 V77 T83	V7-N38 PolarHBondContact O-N 3.26Å; C8-N38 CarbonylContact C-O 3.57Å; C8-N38 WeakPolarHBondContact CA-O 3.2Å; V9-N38 PolarHBondContact N-O 3.15Å; N38-V75 CarbonylContact C-O 3.48Å; N38-V75 WeakPolarHBondContact CA-O 3.38Å; N38-V77 HydrophobicContact CB-CG2 4.31Å; N38-T83 HydrophobicContact CB-CG2 3.8Å; N38-T83 PolarHBondContact ND2-O 3.19Å
39	M	98.8	Very high	96.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	120.2	173.7	-179	177.3	64.8	0	0	109.5	V9 A20 V41 I55 L70 V74 V75 A76 V77	V9-M39 HydrophobicContact CB-CB 4.25Å; V9-M39 HydrophobicContact CB-CG 4.11Å; V9-M39 HydrophobicContact CG1-CG 4.24Å; V9-M39 CarbonylContact O-C 3.5Å; V9-M39 VanDerWaalsContact O-CA 3.31Å; V9-M39 WeakPolarHBondContact O-CA 3.32Å; A20-M39 HydrophobicContact CB-SD 3.66Å; M39-V41 HydrophobicContact CE-CG2 4.11Å; M39-V41 PolarHBondContact O-N 2.91Å; M39-I55 HydrophobicContact CE-CD1 4.26Å; M39-I55 HydrophobicContact CE-CG2 4.08Å; M39-L70 HydrophobicContact CE-CD1 3.76Å; M39-V74 HydrophobicContact CB-CG1 3.98Å; M39-V74 HydrophobicContact CE-CG1 4.24Å; M39-V74 HydrophobicContact SD-CG1 4.45Å; M39-V75 PolarHBondContact N-O 3.41Å; M39-A76 WeakPolarHBondContact O-CA 3.48Å; M39-V77 PolarHBondContact O-N 3.25Å
40	W	98.7	Very high	96.8	Very high	36 Å²	36	64 Å²	64	14%	0.136	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	123.8	176.6	176.5	52.2	0	0	0	110.7	V9 I10 S12 F42 V77 P78 L80 T83 V94 V102	V9-W40 PolarHBondContact O-N 3.05Å; I10-W40 HydrophobicContact CG2-CE3 3.74Å; I10-W40 HydrophobicContact CG2-CZ3 4.34Å; S12-W40 WeakPolarHBondContact CB-O 3.47Å; S12-W40 PolarHBondContact OG-O 3Å; W40-F42 HydrophobicContact CZ2-CB 4.36Å; W40-F42 HydrophobicContact CZ2-CD2 4.3Å; W40-V77 WeakPolarHBondContact CA-O 3.34Å; W40-P78 PolarHBondContact NE1-O 3.36Å; W40-L80 HydrophobicContact CB-CD1 4.18Å; W40-L80 HydrophobicContact CD2-CB 4.4Å; W40-L80 HydrophobicContact CD2-CD1 3.71Å; W40-L80 HydrophobicContact CD2-CG 4.44Å; W40-L80 HydrophobicContact CE3-CD1 4.09Å; W40-L80 HydrophobicContact CG-CB 4.36Å; W40-L80 HydrophobicContact CG-CD1 3.72Å; W40-L80 HydrophobicContact CZ2-CB 4.49Å; W40-L80 HydrophobicContact CZ2-CD2 4.3Å; W40-T83 HydrophobicContact CB-CG2 3.79Å; W40-V94 HydrophobicContact CE3-CG1 4.16Å; W40-V94 HydrophobicContact CZ3-CG1 3.71Å; W40-V102 HydrophobicContact CH2-CG2 3.96Å; W40-V102 HydrophobicContact CZ3-CG2 3.76Å
41	V	97.9	Very high	96.8	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.327	C	S	.	.			trans	-114.3	115.1	176.1	-177.2	0	0	0	0	109.8	S12 M39 E43 L51 I55 A76 V77 P78	S12-V41 WeakPolarHBondContact OG-CA 3.4Å; M39-V41 HydrophobicContact CE-CG2 4.11Å; M39-V41 PolarHBondContact O-N 2.91Å; V41-E43 PolarHBondContact O-N 2.91Å; V41-E43 VanDerWaalsContact O-N 3.14Å; V41-L51 HydrophobicContact CG1-CB 4.33Å; V41-L51 HydrophobicContact CG1-CD2 3.99Å; V41-L51 HydrophobicContact CG1-CG 4.03Å; V41-I55 HydrophobicContact CG1-CD1 4.24Å; V41-I55 HydrophobicContact CG2-CD1 3.86Å; V41-A76 HydrophobicContact CG2-CB 3.6Å; V41-V77 PolarHBondContact N-O 3.23Å; V41-P78 WeakPolarHBondContact O-CA 3.34Å
42	F	95	Very high	96.9	Very high	128 Å²	128	53.7 Å²	53.7	56%	0.561	29%	0.29	S	S	*	.			trans	-63.3	118.9	167.1	-177.5	-95.1	0	0	0	107.8	W40 E44	W40-F42 HydrophobicContact CZ2-CB 4.36Å; W40-F42 HydrophobicContact CZ2-CD2 4.3Å; F42-E44 HydrophobicContact CD1-CG 4.07Å; F42-E44 PolarHBondContact O-N 3.18Å
43	E	96.9	Very high	97	Very high	61 Å²	61	53.7 Å²	53.7	29%	0.285	29%	0.292	S	S	.	.			trans	-68.8	129.3	-167.4	-166	68.5	-88	0	0	111.3	V41 K50 L51 S52 P78	V41-E43 PolarHBondContact O-N 2.91Å; V41-E43 VanDerWaalsContact O-N 3.14Å; E43-K50 HydrophobicContact CG-CD 4.35Å; E43-K50 HydrophobicContact CG-CG 4.41Å; E43-K50 WeakPolarHBondContact OE1-CB 3.45Å; E43-L51 PolarHBondContact OE1-N 3.4Å; E43-S52 VanDerWaalsContact CD-OG 3.29Å; E43-S52 PolarHBondContact OE1-N 2.8Å; E43-S52 VanDerWaalsContact OE1-N 3.11Å; E43-S52 PolarHBondContact OE1-OG 3.08Å; E43-S52 PolarHBondContact OE2-OG 2.99Å; E43-P78 HydrophobicContact CB-CB 4.29Å; E43-P78 WeakPolarHBondContact OE2-CB 3.43Å
44	E	95.2	Very high	97	Very high	47 Å²	47	53.7 Å²	53.7	22%	0.22	29%	0.292	C	S	.	.			trans	-137.5	153.3	178.6	-62.1	-166.8	-94.2	0	0	109.7	F42 K50 L51 K63 Y64	F42-E44 HydrophobicContact CD1-CG 4.07Å; F42-E44 PolarHBondContact O-N 3.18Å; E44-K50 CarbonylContact O-C 3.51Å; E44-L51 HydrophobicContact CB-CB 4.33Å; E44-L51 HydrophobicContact CB-CD2 4.44Å; E44-L51 WeakPolarHBondContact O-CB 2.88Å; E44-L51 PolarHBondContact O-N 2.73Å; E44-K63 IonicContact OE1-NZ 2.78Å; E44-K63 PolarHBondContact OE1-NZ 3.39Å; E44-K63 IonicContact OE2-NZ 2.79Å; E44-K63 PolarHBondContact OE2-NZ 3.43Å; E44-Y64 VanDerWaalsContact OE1-CE2 3.31Å; E44-Y64 WeakPolarHBondContact OE1-CE2 3.47Å; E44-Y64 VanDerWaalsContact OE1-CZ 3.31Å; E44-Y64 PolarHBondContact OE1-OH 3.03Å
45	V	96.3	Very high	97	Very high	115 Å²	115	51.6 Å²	51.6	70%	0.697	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.6	172.8	-178	0	0	0	0	108.6	R49	V45-R49 WeakPolarHBondContact CA-O 3.31Å
46	V	93.2	Very high	97.1	Very high	24 Å²	24	51 Å²	51	15%	0.145	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.1	177.6	-177.4	0	0	0	0	108	G48 R49 L51 I54 V62 K63	V46-G48 PolarHBondContact O-N 3.21Å; V46-R49 PolarHBondContact N-O 3.11Å; V46-R49 PolarHBondContact O-N 3.18Å; V46-R49 VanDerWaalsContact O-O 3.12Å; V46-L51 HydrophobicContact CG2-CB 4.44Å; V46-L51 HydrophobicContact CG2-CD1 4.25Å; V46-I54 HydrophobicContact CB-CD1 3.94Å; V46-I54 HydrophobicContact CG1-CD1 4.43Å; V46-I54 WeakPolarHBondContact O-CD1 3.44Å; V46-V62 HydrophobicContact CG1-CG2 3.96Å; V46-K63 HydrophobicContact CG2-CB 4.39Å; V46-K63 HydrophobicContact CG2-CD 4.15Å
47	N	91.6	Very high	97.1	Very high	150 Å²	150	52.5 Å²	52.5	80%	0.802	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	35.2	-177.9	-57.2	-24.8	0	0	0	113.7	R49	N47-R49 VanDerWaalsContact C-N 3.31Å; N47-R49 PolarHBondContact O-N 2.61Å
48	G	95.1	Very high	97	Very high	70 Å²	70	55.6 Å²	55.6	72%	0.722	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	4.4	179.3	0	0	0	0	0	116	V46	V46-G48 PolarHBondContact O-N 3.21Å
49	R	97	Very high	97	Very high	91 Å²	91	55.2 Å²	55.2	34%	0.343	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	156.5	178	-64.3	166.6	64.5	-157.7	-0.2	110.4	V45 V46 N47 I54 T57 D58	V45-R49 WeakPolarHBondContact CA-O 3.31Å; V46-R49 PolarHBondContact N-O 3.11Å; V46-R49 PolarHBondContact O-N 3.18Å; V46-R49 VanDerWaalsContact O-O 3.12Å; N47-R49 VanDerWaalsContact C-N 3.31Å; N47-R49 PolarHBondContact O-N 2.61Å; R49-I54 HydrophobicContact CB-CD1 3.95Å; R49-I54 HydrophobicContact CB-CG1 3.75Å; R49-T57 PolarHBondContact NH2-OG1 2.68Å; R49-D58 IonicContact CZ-OD2 2.63Å; R49-D58 IonicContact NH1-OD1 2.61Å; R49-D58 IonicContact NH1-OD2 3.05Å; R49-D58 PolarHBondContact NH1-OD2 3.47Å; R49-D58 IonicContact NH2-OD2 3.82Å
50	K	98.1	Very high	97	Very high	101 Å²	101	56.8 Å²	56.8	44%	0.439	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	136.1	170.6	-69.3	-174.1	-168.4	164.5	0	109.7	E43 E44 S52 E53 I54	E43-K50 HydrophobicContact CG-CD 4.35Å; E43-K50 HydrophobicContact CG-CG 4.41Å; E43-K50 WeakPolarHBondContact OE1-CB 3.45Å; E44-K50 CarbonylContact O-C 3.51Å; K50-S52 PolarHBondContact O-N 3.45Å; K50-E53 HydrophobicContact CB-CB 4.14Å; K50-E53 HydrophobicContact CB-CG 3.88Å; K50-E53 HydrophobicContact CD-CG 4.47Å; K50-E53 WeakPolarHBondContact CD-OE1 3.37Å; K50-E53 IonicContact NZ-OE1 3.95Å; K50-E53 WeakPolarHBondContact O-CB 3.47Å; K50-E53 PolarHBondContact O-N 3.19Å; K50-E53 VanDerWaalsContact O-N 3.1Å; K50-I54 WeakPolarHBondContact O-CG1 3.5Å; K50-I54 PolarHBondContact O-N 3.18Å
51	L	97.9	Very high	96.9	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-37.5	-179.4	-179.3	59.3	0	0	0	111.2	V41 E43 E44 V46 E53 I54 I55 V62 Y64	V41-L51 HydrophobicContact CG1-CB 4.33Å; V41-L51 HydrophobicContact CG1-CD2 3.99Å; V41-L51 HydrophobicContact CG1-CG 4.03Å; E43-L51 PolarHBondContact OE1-N 3.4Å; E44-L51 HydrophobicContact CB-CB 4.33Å; E44-L51 HydrophobicContact CB-CD2 4.44Å; E44-L51 WeakPolarHBondContact O-CB 2.88Å; E44-L51 PolarHBondContact O-N 2.73Å; V46-L51 HydrophobicContact CG2-CB 4.44Å; V46-L51 HydrophobicContact CG2-CD1 4.25Å; L51-E53 VanDerWaalsContact C-N 3.34Å; L51-E53 PolarHBondContact O-N 2.92Å; L51-I54 PolarHBondContact O-N 2.85Å; L51-I55 HydrophobicContact CD1-CD1 4.11Å; L51-I55 HydrophobicContact CD1-CG1 4.27Å; L51-I55 HydrophobicContact CG-CD1 3.9Å; L51-I55 WeakPolarHBondContact O-CG1 3.43Å; L51-I55 PolarHBondContact O-N 3.45Å; L51-V62 HydrophobicContact CD1-CG2 4.48Å; L51-Y64 HydrophobicContact CD2-CD2 4.25Å; L51-Y64 HydrophobicContact CD2-CE2 3.99Å
52	S	98.1	Very high	96.8	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-60.3	-41.9	174.4	64.8	0	0	0	0	112.4	E43 K50 I55 N56	E43-S52 VanDerWaalsContact CD-OG 3.29Å; E43-S52 PolarHBondContact OE1-N 2.8Å; E43-S52 VanDerWaalsContact OE1-N 3.11Å; E43-S52 PolarHBondContact OE1-OG 3.08Å; E43-S52 PolarHBondContact OE2-OG 2.99Å; K50-S52 PolarHBondContact O-N 3.45Å; S52-I55 PolarHBondContact O-N 3.3Å; S52-N56 WeakPolarHBondContact O-CB 3.39Å; S52-N56 PolarHBondContact O-N 3.45Å; S52-N56 PolarHBondContact O-ND2 3.03Å; S52-N56 VanDerWaalsContact O-ND2 3.16Å
53	E	97.9	Very high	96.8	Very high	89 Å²	89	55.4 Å²	55.4	42%	0.416	30%	0.298	S	S	.	.	H	α-helix	trans	-66.1	-42.6	176.2	-68.4	170.5	-172.9	0	0	111.9	K50 L51 N56 T57	K50-E53 HydrophobicContact CB-CB 4.14Å; K50-E53 HydrophobicContact CB-CG 3.88Å; K50-E53 HydrophobicContact CD-CG 4.47Å; K50-E53 WeakPolarHBondContact CD-OE1 3.37Å; K50-E53 IonicContact NZ-OE1 3.95Å; K50-E53 WeakPolarHBondContact O-CB 3.47Å; K50-E53 PolarHBondContact O-N 3.19Å; K50-E53 VanDerWaalsContact O-N 3.1Å; L51-E53 VanDerWaalsContact C-N 3.34Å; L51-E53 PolarHBondContact O-N 2.92Å; E53-N56 PolarHBondContact O-N 3.11Å; E53-T57 WeakPolarHBondContact O-CB 3.24Å; E53-T57 WeakPolarHBondContact O-CG2 3.43Å; E53-T57 PolarHBondContact O-N 3.28Å; E53-T57 VanDerWaalsContact O-N 3.07Å; E53-T57 PolarHBondContact O-OG1 3.28Å
54	I	98.2	Very high	96.5	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-58.7	-49.7	174.5	-65.3	169.3	0	0	0	109.9	V46 R49 K50 L51 N56 T57 D58 V62	V46-I54 HydrophobicContact CB-CD1 3.94Å; V46-I54 HydrophobicContact CG1-CD1 4.43Å; V46-I54 WeakPolarHBondContact O-CD1 3.44Å; R49-I54 HydrophobicContact CB-CD1 3.95Å; R49-I54 HydrophobicContact CB-CG1 3.75Å; K50-I54 WeakPolarHBondContact O-CG1 3.5Å; K50-I54 PolarHBondContact O-N 3.18Å; L51-I54 PolarHBondContact O-N 2.85Å; I54-N56 VanDerWaalsContact C-N 3.33Å; I54-N56 PolarHBondContact O-N 3.37Å; I54-T57 PolarHBondContact O-N 3.45Å; I54-T57 PolarHBondContact O-OG1 3.4Å; I54-D58 HydrophobicContact CG2-CB 4.36Å; I54-D58 WeakPolarHBondContact O-CA 3.19Å; I54-D58 WeakPolarHBondContact O-CB 3.12Å; I54-D58 PolarHBondContact O-N 3.22Å; I54-V62 HydrophobicContact CD1-CG2 4.36Å; I54-V62 HydrophobicContact CG2-CG1 4Å; I54-V62 HydrophobicContact CG2-CG2 3.92Å
55	I	98.5	Very high	96.6	Very high	1 Å²	1	54 Å²	54	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-42.1	-179.3	-68.6	164.5	0	0	0	111	M39 V41 L51 S52 T57 H59 E60 N61 L70 A76	M39-I55 HydrophobicContact CE-CD1 4.26Å; M39-I55 HydrophobicContact CE-CG2 4.08Å; V41-I55 HydrophobicContact CG1-CD1 4.24Å; V41-I55 HydrophobicContact CG2-CD1 3.86Å; L51-I55 HydrophobicContact CD1-CD1 4.11Å; L51-I55 HydrophobicContact CD1-CG1 4.27Å; L51-I55 HydrophobicContact CG-CD1 3.9Å; L51-I55 WeakPolarHBondContact O-CG1 3.43Å; L51-I55 PolarHBondContact O-N 3.45Å; S52-I55 PolarHBondContact O-N 3.3Å; I55-T57 VanDerWaalsContact C-N 3.3Å; I55-T57 PolarHBondContact O-N 3.36Å; I55-H59 WeakPolarHBondContact O-CA 3.22Å; I55-H59 PolarHBondContact O-N 2.97Å; I55-E60 WeakPolarHBondContact CG1-O 3.46Å; I55-N61 HydrophobicContact CD1-CB 4.11Å; I55-N61 HydrophobicContact CG1-CB 4.17Å; I55-L70 HydrophobicContact CG2-CD1 3.84Å; I55-A76 HydrophobicContact CB-CB 3.8Å; I55-A76 HydrophobicContact CD1-CB 4.43Å; I55-A76 HydrophobicContact CG2-CB 3.65Å
56	N	98.6	Very high	96.5	Very high	58 Å²	58	52.4 Å²	52.4	31%	0.31	28%	0.281	S	S	.	.	H	α-helix	trans	-72.1	-20.1	-179.2	-75	-33	0	0	0	114.5	S52 E53 I54 H59 A76	S52-N56 WeakPolarHBondContact O-CB 3.39Å; S52-N56 PolarHBondContact O-N 3.45Å; S52-N56 PolarHBondContact O-ND2 3.03Å; S52-N56 VanDerWaalsContact O-ND2 3.16Å; E53-N56 PolarHBondContact O-N 3.11Å; I54-N56 VanDerWaalsContact C-N 3.33Å; I54-N56 PolarHBondContact O-N 3.37Å; N56-H59 PolarHBondContact O-CE1 3.29Å; N56-A76 PolarHBondContact ND2-O 3.24Å; N56-A76 PolarHBondContact OD1-N 3.03Å
57	T	98	Very high	96.7	Very high	80 Å²	80	54.5 Å²	54.5	49%	0.491	31%	0.307	S	S	.	.	H	α-helix	trans	-103.6	-47.1	-177.2	49	0	0	0	0	112.2	R49 E53 I54 I55	R49-T57 PolarHBondContact NH2-OG1 2.68Å; E53-T57 WeakPolarHBondContact O-CB 3.24Å; E53-T57 WeakPolarHBondContact O-CG2 3.43Å; E53-T57 PolarHBondContact O-N 3.28Å; E53-T57 VanDerWaalsContact O-N 3.07Å; E53-T57 PolarHBondContact O-OG1 3.28Å; I54-T57 PolarHBondContact O-N 3.45Å; I54-T57 PolarHBondContact O-OG1 3.4Å; I55-T57 VanDerWaalsContact C-N 3.3Å; I55-T57 PolarHBondContact O-N 3.36Å
58	D	98	Very high	97	Very high	65 Å²	65	48.8 Å²	48.8	35%	0.348	28%	0.275	S	S	.	.	H	α-helix	trans	-92.7	-7.8	-175.5	-55.3	-27.9	0	0	0	111.3	R49 I54 E60 K69	R49-D58 IonicContact CZ-OD2 2.63Å; R49-D58 IonicContact NH1-OD1 2.61Å; R49-D58 IonicContact NH1-OD2 3.05Å; R49-D58 PolarHBondContact NH1-OD2 3.47Å; R49-D58 IonicContact NH2-OD2 3.82Å; I54-D58 HydrophobicContact CG2-CB 4.36Å; I54-D58 WeakPolarHBondContact O-CA 3.19Å; I54-D58 WeakPolarHBondContact O-CB 3.12Å; I54-D58 PolarHBondContact O-N 3.22Å; D58-E60 PolarHBondContact O-N 3.4Å; D58-K69 PolarHBondContact O-NZ 3.44Å
59	H	98.4	Very high	97.2	Very high	34 Å²	34	51.1 Å²	51.1	16%	0.157	27%	0.266	C	S	.	.	S	Bend	trans	51	43	-178.1	-64.8	-73	0	0	0	112	I55 N56 K69 L70 H72	I55-H59 WeakPolarHBondContact O-CA 3.22Å; I55-H59 PolarHBondContact O-N 2.97Å; N56-H59 PolarHBondContact O-CE1 3.29Å; H59-K69 CarbonylContact O-C 3.45Å; H59-K69 VanDerWaalsContact O-CA 3.27Å; H59-K69 WeakPolarHBondContact O-CA 3.27Å; H59-K69 WeakPolarHBondContact O-CD 3.48Å; H59-L70 PolarHBondContact O-N 3.32Å; H59-H72 AromaticContact CD2-CE1 3.28Å; H59-H72 PolarHBondContact CD2-CE1 3.23Å; H59-H72 AromaticContact CD2-ND1 3.04Å; H59-H72 PolarHBondContact CD2-ND1 3.01Å; H59-H72 AromaticContact CE1-ND1 3.4Å; H59-H72 PolarHBondContact CE1-ND1 3.41Å; H59-H72 AromaticContact CG-CE1 3.92Å; H59-H72 AromaticContact CG-ND1 3.57Å; H59-H72 AromaticContact ND1-ND1 3.78Å; H59-H72 AromaticContact NE2-CE1 3.57Å; H59-H72 AromaticContact NE2-CG 3.92Å; H59-H72 AromaticContact NE2-ND1 2.87Å; H59-H72 PolarHBondContact NE2-ND1 2.85Å
60	E	98.1	Very high	97.2	Very high	32 Å²	32	47 Å²	47	15%	0.15	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-151.6	133.3	-175.7	-177.3	173	166.6	0	0	110.4	I55 D58 V62 G67 K69	I55-E60 WeakPolarHBondContact CG1-O 3.46Å; D58-E60 PolarHBondContact O-N 3.4Å; E60-V62 VanDerWaalsContact C-N 3.34Å; E60-V62 HydrophobicContact CB-CG1 4.29Å; E60-V62 HydrophobicContact CG-CG1 3.93Å; E60-V62 PolarHBondContact O-N 3.11Å; E60-G67 PolarHBondContact OE1-N 3.14Å; E60-K69 HydrophobicContact CB-CD 4.14Å; E60-K69 IonicContact OE2-NZ 3.07Å; E60-K69 PolarHBondContact OE2-NZ 3.25Å
61	N	97.4	Very high	97.3	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	24%	0.238	C	C	.	.			trans	-87.9	80.5	168.9	-168.2	-26.8	0	0	0	109.5	S12 S17 I55 K63 Y64 L65	S12-N61 PolarHBondContact O-ND2 3.22Å; S17-N61 PolarHBondContact OG-ND2 3.08Å; I55-N61 HydrophobicContact CD1-CB 4.11Å; I55-N61 HydrophobicContact CG1-CB 4.17Å; N61-K63 PolarHBondContact O-N 3.39Å; N61-Y64 PolarHBondContact O-N 2.92Å; N61-Y64 WeakPolarHBondContact OD1-CD2 3.36Å; N61-Y64 PolarHBondContact OD1-N 2.95Å; N61-Y64 VanDerWaalsContact OD1-N 3.12Å; N61-L65 CarbonylContact O-C 3.55Å; N61-L65 VanDerWaalsContact O-C 3.27Å; N61-L65 PolarHBondContact O-N 3.09Å
62	V	96	Very high	97.3	Very high	45 Å²	45	50.6 Å²	50.6	27%	0.273	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-21.2	-173.5	-62.2	0	0	0	0	114.1	V46 L51 I54 E60	V46-V62 HydrophobicContact CG1-CG2 3.96Å; L51-V62 HydrophobicContact CD1-CG2 4.48Å; I54-V62 HydrophobicContact CD1-CG2 4.36Å; I54-V62 HydrophobicContact CG2-CG1 4Å; I54-V62 HydrophobicContact CG2-CG2 3.92Å; E60-V62 VanDerWaalsContact C-N 3.34Å; E60-V62 HydrophobicContact CB-CG1 4.29Å; E60-V62 HydrophobicContact CG-CG1 3.93Å; E60-V62 PolarHBondContact O-N 3.11Å
63	K	93.6	Very high	97.3	Very high	90 Å²	90	52 Å²	52	39%	0.391	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-46.7	178.8	-179.1	173.2	176.4	-179.7	0	112.3	E44 V46 N61	E44-K63 IonicContact OE1-NZ 2.78Å; E44-K63 PolarHBondContact OE1-NZ 3.39Å; E44-K63 IonicContact OE2-NZ 2.79Å; E44-K63 PolarHBondContact OE2-NZ 3.43Å; V46-K63 HydrophobicContact CG2-CB 4.39Å; V46-K63 HydrophobicContact CG2-CD 4.15Å; N61-K63 PolarHBondContact O-N 3.39Å
64	Y	92.4	Very high	97.3	Very high	77 Å²	77	47.8 Å²	47.8	30%	0.302	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-20.1	-168	-65.3	-69	0	0	0	114.5	N14 E44 L51 N61	N14-Y64 VanDerWaalsContact CA-O 3.3Å; N14-Y64 WeakPolarHBondContact CA-O 3.19Å; N14-Y64 VanDerWaalsContact CB-O 3.26Å; N14-Y64 WeakPolarHBondContact CB-O 3.32Å; N14-Y64 PolarHBondContact ND2-O 2.93Å; E44-Y64 VanDerWaalsContact OE1-CE2 3.31Å; E44-Y64 WeakPolarHBondContact OE1-CE2 3.47Å; E44-Y64 VanDerWaalsContact OE1-CZ 3.31Å; E44-Y64 PolarHBondContact OE1-OH 3.03Å; L51-Y64 HydrophobicContact CD2-CD2 4.25Å; L51-Y64 HydrophobicContact CD2-CE2 3.99Å; N61-Y64 PolarHBondContact O-N 2.92Å; N61-Y64 WeakPolarHBondContact OD1-CD2 3.36Å; N61-Y64 PolarHBondContact OD1-N 2.95Å; N61-Y64 VanDerWaalsContact OD1-N 3.12Å
65	L	95.5	Very high	97.4	Very high	1 Å²	1	50 Å²	50	1%	0.005	27%	0.272	C	S	.	.	S	Bend	trans	-145.3	62	176.1	-166.7	70.2	0	0	0	110.3	A18 K21 N61 H68 A158	A18-L65 HydrophobicContact CB-CD2 4.33Å; K21-L65 HydrophobicContact CD-CD2 4.12Å; N61-L65 CarbonylContact O-C 3.55Å; N61-L65 VanDerWaalsContact O-C 3.27Å; N61-L65 PolarHBondContact O-N 3.09Å; L65-H68 HydrophobicContact CD2-CB 3.9Å; L65-H68 HydrophobicContact CG-CB 3.91Å; L65-H68 PolarHBondContact O-N 2.94Å; L65-A158 HydrophobicContact CD1-CB 3.84Å; L65-A158 HydrophobicContact CD2-CB 3.93Å; L65-A158 HydrophobicContact CG-CB 4.32Å
66	P	95.5	Very high	97.4	Very high	82 Å²	82	50.1 Å²	50.1	53%	0.532	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	143.1	-176.8	27.7	-35.4	0	0	0	111.6	H68	P66-H68 VanDerWaalsContact C-N 3.31Å; P66-H68 PolarHBondContact O-CD2 2.78Å
67	G	96.9	Very high	97.4	Very high	67 Å²	67	48.5 Å²	48.5	69%	0.691	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	-1	178.2	0	0	0	0	0	114.8	E60	E60-G67 PolarHBondContact OE1-N 3.14Å
68	H	98.1	Very high	97.4	Very high	30 Å²	30	47.7 Å²	47.7	14%	0.139	26%	0.261	C	S	.	.			trans	-118.7	122.9	179.7	-60.1	-82.8	0	0	0	112	K21 L65 P66 A158 D159	K21-H68 HydrophobicContact CD-CB 4.18Å; L65-H68 HydrophobicContact CD2-CB 3.9Å; L65-H68 HydrophobicContact CG-CB 3.91Å; L65-H68 PolarHBondContact O-N 2.94Å; P66-H68 VanDerWaalsContact C-N 3.31Å; P66-H68 PolarHBondContact O-CD2 2.78Å; H68-A158 PolarHBondContact ND1-O 2.83Å; H68-D159 IonicContact CE1-OD1 2.73Å; H68-D159 PolarHBondContact CE1-OD1 3.42Å; H68-D159 IonicContact NE2-OD1 3.08Å
69	K	98.2	Very high	97.4	Very high	119 Å²	119	48.5 Å²	48.5	52%	0.517	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-74.8	134.5	173.1	-62.6	-54.2	-172.5	-171.3	0	111.9	K21 D58 H59 E60	K21-K69 VanDerWaalsContact CE-O 3.25Å; K21-K69 WeakPolarHBondContact CE-O 3.38Å; D58-K69 PolarHBondContact O-NZ 3.44Å; H59-K69 CarbonylContact O-C 3.45Å; H59-K69 VanDerWaalsContact O-CA 3.27Å; H59-K69 WeakPolarHBondContact O-CA 3.27Å; H59-K69 WeakPolarHBondContact O-CD 3.48Å; E60-K69 HydrophobicContact CB-CD 4.14Å; E60-K69 IonicContact OE2-NZ 3.07Å; E60-K69 PolarHBondContact OE2-NZ 3.25Å
70	L	98.6	Very high	97.4	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.031	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-82.7	146.7	164.8	-57.5	-174.6	0	0	0	109	S17 K21 M39 I55 H59 V74	S17-L70 WeakPolarHBondContact O-CD2 3.45Å; K21-L70 HydrophobicContact CD-CD2 4.39Å; K21-L70 HydrophobicContact CG-CD2 3.53Å; M39-L70 HydrophobicContact CE-CD1 3.76Å; I55-L70 HydrophobicContact CG2-CD1 3.84Å; H59-L70 PolarHBondContact O-N 3.32Å; L70-V74 HydrophobicContact CD1-CG1 4.47Å
71	P	98.6	Very high	97.3	Very high	28 Å²	28	46.6 Å²	46.6	18%	0.182	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-56.1	143.5	171.7	-26.8	35.7	0	0	0	112.2	K21 N73 V74	K21-P71 WeakPolarHBondContact O-CG 3.22Å; P71-N73 WeakPolarHBondContact CB-OD1 3.26Å; P71-N73 PolarHBondContact O-N 3.04Å; P71-N73 VanDerWaalsContact O-N 3.09Å; P71-V74 HydrophobicContact CB-CG2 4.19Å; P71-V74 HydrophobicContact CG-CG2 4.38Å; P71-V74 WeakPolarHBondContact O-CB 3.15Å; P71-V74 PolarHBondContact O-N 3.1Å
72	H	98.2	Very high	97.3	Very high	148 Å²	148	51.2 Å²	51.2	69%	0.685	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.2	-177.6	-74.1	-81.2	0	0	0	114.1	H59 V74	H59-H72 AromaticContact CD2-CE1 3.28Å; H59-H72 PolarHBondContact CD2-CE1 3.23Å; H59-H72 AromaticContact CD2-ND1 3.04Å; H59-H72 PolarHBondContact CD2-ND1 3.01Å; H59-H72 AromaticContact CE1-ND1 3.4Å; H59-H72 PolarHBondContact CE1-ND1 3.41Å; H59-H72 AromaticContact CG-CE1 3.92Å; H59-H72 AromaticContact CG-ND1 3.57Å; H59-H72 AromaticContact ND1-ND1 3.78Å; H59-H72 AromaticContact NE2-CE1 3.57Å; H59-H72 AromaticContact NE2-CG 3.92Å; H59-H72 AromaticContact NE2-ND1 2.87Å; H59-H72 PolarHBondContact NE2-ND1 2.85Å; H72-V74 VanDerWaalsContact C-N 3.3Å
73	N	98.6	Very high	97.4	Very high	34 Å²	34	49.1 Å²	49.1	18%	0.182	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-0.6	178.3	65.6	-54.2	0	0	0	113.7	G24 S35 V37 P71	G24-N73 PolarHBondContact O-ND2 3.45Å; S35-N73 VanDerWaalsContact O-CB 3.25Å; S35-N73 WeakPolarHBondContact O-CB 3.32Å; S35-N73 PolarHBondContact O-ND2 3.18Å; V37-N73 PolarHBondContact N-O 3.16Å; P71-N73 WeakPolarHBondContact CB-OD1 3.26Å; P71-N73 PolarHBondContact O-N 3.04Å; P71-N73 VanDerWaalsContact O-N 3.09Å
74	V	98.8	Very high	97.6	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.012	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	118	168.3	179.7	0	0	0	0	108.9	A20 V37 M39 L70 P71 H72	A20-V74 HydrophobicContact CB-CG1 4.11Å; A20-V74 HydrophobicContact CB-CG2 4.5Å; A20-V74 WeakPolarHBondContact O-CG2 3.36Å; V37-V74 HydrophobicContact CB-CG2 4.49Å; V37-V74 CarbonylContact O-C 3.54Å; V37-V74 WeakPolarHBondContact O-CA 3.33Å; M39-V74 HydrophobicContact CB-CG1 3.98Å; M39-V74 HydrophobicContact CE-CG1 4.24Å; M39-V74 HydrophobicContact SD-CG1 4.45Å; L70-V74 HydrophobicContact CD1-CG1 4.47Å; P71-V74 HydrophobicContact CB-CG2 4.19Å; P71-V74 HydrophobicContact CG-CG2 4.38Å; P71-V74 WeakPolarHBondContact O-CB 3.15Å; P71-V74 PolarHBondContact O-N 3.1Å; H72-V74 VanDerWaalsContact C-N 3.3Å
75	V	98.8	Very high	97.8	Very high	51 Å²	51	47 Å²	47	31%	0.309	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.8	-176.2	-175.4	0	0	0	0	109.6	V37 N38 M39 V77	V37-V75 PolarHBondContact O-N 3.11Å; N38-V75 CarbonylContact C-O 3.48Å; N38-V75 WeakPolarHBondContact CA-O 3.38Å; M39-V75 PolarHBondContact N-O 3.41Å; V75-V77 HydrophobicContact CG1-CG2 4.14Å; V75-V77 PolarHBondContact O-N 3.3Å
76	A	98.8	Very high	97.8	Very high	3 Å²	3	48.5 Å²	48.5	3%	0.025	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	121.4	172.9	0	0	0	0	0	110.7	M39 V41 I55 N56	M39-A76 WeakPolarHBondContact O-CA 3.48Å; V41-A76 HydrophobicContact CG2-CB 3.6Å; I55-A76 HydrophobicContact CB-CB 3.8Å; I55-A76 HydrophobicContact CD1-CB 4.43Å; I55-A76 HydrophobicContact CG2-CB 3.65Å; N56-A76 PolarHBondContact ND2-O 3.24Å; N56-A76 PolarHBondContact OD1-N 3.03Å
77	V	98.6	Very high	98	Very high	24 Å²	24	44.8 Å²	44.8	15%	0.145	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.2	179.9	-176.9	0	0	0	0	108.6	N38 M39 W40 V41 V75 D79 E82 T83	N38-V77 HydrophobicContact CB-CG2 4.31Å; M39-V77 PolarHBondContact O-N 3.25Å; W40-V77 WeakPolarHBondContact CA-O 3.34Å; V41-V77 PolarHBondContact N-O 3.23Å; V75-V77 HydrophobicContact CG1-CG2 4.14Å; V75-V77 PolarHBondContact O-N 3.3Å; V77-D79 WeakPolarHBondContact CG1-O 3.4Å; V77-E82 HydrophobicContact CG1-CB 4.42Å; V77-T83 HydrophobicContact CB-CG2 4.29Å; V77-T83 WeakPolarHBondContact CB-OG1 3.47Å; V77-T83 WeakPolarHBondContact CG1-OG1 3.3Å; V77-T83 PolarHBondContact O-OG1 3.37Å
78	P	97.9	Very high	98	Very high	62 Å²	62	42.4 Å²	42.4	40%	0.403	22%	0.224	S	C	.	.	S	Bend	trans	-79	-29.5	-177.4	29.3	-33.5	0	0	0	113.3	W40 V41 E43	W40-P78 PolarHBondContact NE1-O 3.36Å; V41-P78 WeakPolarHBondContact O-CA 3.34Å; E43-P78 HydrophobicContact CB-CB 4.29Å; E43-P78 WeakPolarHBondContact OE2-CB 3.43Å
79	D	98.3	Very high	98	Very high	83 Å²	83	41 Å²	41	44%	0.444	22%	0.217	S	C	.	.			trans	-83.1	117.8	177.7	-175.8	-89.4	0	0	0	111.1	V77 A81 E82 T83	V77-D79 WeakPolarHBondContact CG1-O 3.4Å; D79-A81 PolarHBondContact O-N 2.95Å; D79-A81 WeakPolarHBondContact OD1-CB 3.23Å; D79-A81 PolarHBondContact OD1-N 2.91Å; D79-E82 HydrophobicContact CB-CB 4.22Å; D79-E82 HydrophobicContact CB-CG 4.43Å; D79-E82 WeakPolarHBondContact OD1-CB 3.25Å; D79-E82 WeakPolarHBondContact OD1-CG 3.3Å; D79-E82 PolarHBondContact OD1-N 3.23Å; D79-T83 PolarHBondContact O-N 3.44Å; D79-T83 PolarHBondContact O-OG1 3.4Å
80	L	97.8	Very high	98.1	Very high	13 Å²	13	35.4 Å²	35.4	7%	0.068	19%	0.193	C	C	.	.	H	α-helix	trans	-65.9	-37.8	-175.3	177.8	55.9	0	0	0	112.5	I10 W40 T83 V84 V102 T105 I106	I10-L80 HydrophobicContact CG2-CD1 3.94Å; W40-L80 HydrophobicContact CB-CD1 4.18Å; W40-L80 HydrophobicContact CD2-CB 4.4Å; W40-L80 HydrophobicContact CD2-CD1 3.71Å; W40-L80 HydrophobicContact CD2-CG 4.44Å; W40-L80 HydrophobicContact CE3-CD1 4.09Å; W40-L80 HydrophobicContact CG-CB 4.36Å; W40-L80 HydrophobicContact CG-CD1 3.72Å; W40-L80 HydrophobicContact CZ2-CB 4.49Å; W40-L80 HydrophobicContact CZ2-CD2 4.3Å; L80-T83 PolarHBondContact O-N 3.14Å; L80-V84 HydrophobicContact CD1-CG1 4.4Å; L80-V84 PolarHBondContact O-N 3.5Å; L80-V102 HydrophobicContact CD2-CB 4.32Å; L80-V102 HydrophobicContact CD2-CG1 4.18Å; L80-V102 HydrophobicContact CD2-CG2 4.21Å; L80-T105 HydrophobicContact CB-CG2 4.3Å; L80-T105 HydrophobicContact CD2-CG2 3.95Å; L80-T105 HydrophobicContact CG-CG2 4.28Å; L80-I106 HydrophobicContact CD1-CG2 3.8Å; L80-I106 HydrophobicContact CD2-CG2 3.86Å; L80-I106 HydrophobicContact CG-CG2 3.45Å; L80-I106 VanDerWaalsContact CG-CG2 3.45Å
81	A	97.5	Very high	98.1	Very high	13 Å²	13	35.1 Å²	35.1	11%	0.107	19%	0.191	C	C	.	.	H	α-helix	trans	-68.8	-41.8	-178.8	0	0	0	0	0	111.7	D79 T83 V84 K85 H109	D79-A81 PolarHBondContact O-N 2.95Å; D79-A81 WeakPolarHBondContact OD1-CB 3.23Å; D79-A81 PolarHBondContact OD1-N 2.91Å; A81-T83 VanDerWaalsContact C-N 3.33Å; A81-V84 VanDerWaalsContact O-CG2 3.27Å; A81-V84 WeakPolarHBondContact O-CG2 3.3Å; A81-K85 PolarHBondContact O-N 2.87Å; A81-H109 HydrophobicContact CB-CB 4.32Å
82	E	97.5	Very high	98.1	Very high	98 Å²	98	33.8 Å²	33.8	46%	0.458	18%	0.183	S	C	.	.	H	α-helix	trans	-69.1	-32.3	174.1	-70	-61.6	123.7	0	0	111.8	V77 D79 V84 K85	V77-E82 HydrophobicContact CG1-CB 4.42Å; D79-E82 HydrophobicContact CB-CB 4.22Å; D79-E82 HydrophobicContact CB-CG 4.43Å; D79-E82 WeakPolarHBondContact OD1-CB 3.25Å; D79-E82 WeakPolarHBondContact OD1-CG 3.3Å; D79-E82 PolarHBondContact OD1-N 3.23Å; E82-V84 VanDerWaalsContact C-N 3.34Å; E82-V84 PolarHBondContact O-N 3.33Å; E82-K85 WeakPolarHBondContact O-CB 3.32Å; E82-K85 PolarHBondContact O-N 3.5Å; E82-K85 IonicContact OE1-NZ 2.55Å; E82-K85 PolarHBondContact OE1-NZ 2.81Å; E82-K85 IonicContact OE2-NZ 2.92Å; E82-K85 PolarHBondContact OE2-NZ 3.37Å
83	T	97.9	Very high	98	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-61.2	-42	178.4	-51.7	0	0	0	0	111.6	C8 N38 W40 V77 D79 L80 A81	C8-T83 WeakPolarHBondContact SG-CG2 3.43Å; C8-T83 PolarHBondContact SG-O 3.43Å; N38-T83 HydrophobicContact CB-CG2 3.8Å; N38-T83 PolarHBondContact ND2-O 3.19Å; W40-T83 HydrophobicContact CB-CG2 3.79Å; V77-T83 HydrophobicContact CB-CG2 4.29Å; V77-T83 WeakPolarHBondContact CB-OG1 3.47Å; V77-T83 WeakPolarHBondContact CG1-OG1 3.3Å; V77-T83 PolarHBondContact O-OG1 3.37Å; D79-T83 PolarHBondContact O-N 3.44Å; D79-T83 PolarHBondContact O-OG1 3.4Å; L80-T83 PolarHBondContact O-N 3.14Å; A81-T83 VanDerWaalsContact C-N 3.33Å
84	V	98	Very high	97.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-84.7	-9.6	-175.7	-60.4	0	0	0	0	114.1	I10 L80 A81 E82 G86 A87 L90 I106 H109 I110	I10-V84 HydrophobicContact CD1-CG1 3.95Å; I10-V84 HydrophobicContact CG1-CG1 4.1Å; L80-V84 HydrophobicContact CD1-CG1 4.4Å; L80-V84 PolarHBondContact O-N 3.5Å; A81-V84 VanDerWaalsContact O-CG2 3.27Å; A81-V84 WeakPolarHBondContact O-CG2 3.3Å; E82-V84 VanDerWaalsContact C-N 3.34Å; E82-V84 PolarHBondContact O-N 3.33Å; V84-G86 PolarHBondContact O-N 2.8Å; V84-A87 VanDerWaalsContact O-CB 3.32Å; V84-A87 WeakPolarHBondContact O-CB 3.17Å; V84-A87 PolarHBondContact O-N 2.79Å; V84-L90 HydrophobicContact CB-CD2 4.07Å; V84-L90 HydrophobicContact CG1-CD2 3.93Å; V84-I106 HydrophobicContact CG1-CB 4.38Å; V84-I106 HydrophobicContact CG1-CD1 4.31Å; V84-I106 HydrophobicContact CG1-CG2 3.88Å; V84-I106 HydrophobicContact CG2-CB 4.03Å; V84-I106 HydrophobicContact CG2-CG2 3.94Å; V84-H109 HydrophobicContact CG2-CB 3.95Å; V84-I110 HydrophobicContact CB-CG2 4.14Å; V84-I110 HydrophobicContact CG2-CG2 4.02Å
85	K	96.1	Very high	97.1	Very high	123 Å²	123	29.8 Å²	29.8	54%	0.535	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	118.3	-170	-169.9	175	-173.7	170.7	0	111.8	A81 E82 A87	A81-K85 PolarHBondContact O-N 2.87Å; E82-K85 WeakPolarHBondContact O-CB 3.32Å; E82-K85 PolarHBondContact O-N 3.5Å; E82-K85 IonicContact OE1-NZ 2.55Å; E82-K85 PolarHBondContact OE1-NZ 2.81Å; E82-K85 IonicContact OE2-NZ 2.92Å; E82-K85 PolarHBondContact OE2-NZ 3.37Å; K85-A87 PolarHBondContact O-N 3.39Å
86	G	96	Very high	96.4	Very high	31 Å²	31	29.7 Å²	29.7	32%	0.32	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	7	179.8	0	0	0	0	0	114.9	V84 K111	V84-G86 PolarHBondContact O-N 2.8Å; G86-K111 WeakPolarHBondContact O-CD 3.22Å
87	A	98.1	Very high	95.5	Very high	4 Å²	4	34.7 Å²	34.7	3%	0.033	19%	0.19	C	C	.	.			trans	-67.4	134	175.2	0	0	0	0	0	111.2	C8 V84 K85 L90 K111	C8-A87 HydrophobicContact CB-CB 3.65Å; V84-A87 VanDerWaalsContact O-CB 3.32Å; V84-A87 WeakPolarHBondContact O-CB 3.17Å; V84-A87 PolarHBondContact O-N 2.79Å; K85-A87 PolarHBondContact O-N 3.39Å; A87-L90 HydrophobicContact CB-CG 4.43Å; A87-K111 WeakPolarHBondContact O-CD 3.48Å
88	D	98.3	Very high	95.1	Very high	18 Å²	18	38.3 Å²	38.3	10%	0.096	20%	0.204	C	C	.	.	S	Bend	trans	-86.6	-31.1	171.3	-65	-82.1	0	0	0	111.7	K5 K6 K111 S114 I115	K5-D88 WeakPolarHBondContact CA-OD2 3.41Å; K5-D88 HydrophobicContact CB-CB 4.11Å; K5-D88 HydrophobicContact CD-CB 3.76Å; K5-D88 HydrophobicContact CG-CB 4.5Å; K5-D88 IonicContact NZ-OD1 3.83Å; K6-D88 PolarHBondContact N-OD2 2.7Å; K6-D88 PolarHBondContact O-N 2.72Å; D88-K111 IonicContact OD1-NZ 3.84Å; D88-K111 PolarHBondContact OD1-NZ 2.94Å; D88-S114 CarbonylContact O-C 3.59Å; D88-S114 VanDerWaalsContact O-CA 3.31Å; D88-S114 WeakPolarHBondContact O-CA 3.22Å; D88-S114 WeakPolarHBondContact O-CB 3.07Å; D88-I115 PolarHBondContact O-N 2.97Å
89	I	98.6	Very high	94.9	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	121.2	-177	-51.6	-178.6	0	0	0	108.7	K5 K6 V7 C8 F33 I91 I115 L177 L178 L181	K5-I89 HydrophobicContact CB-CD1 4.31Å; K6-I89 PolarHBondContact O-N 2.68Å; V7-I89 HydrophobicContact CG1-CB 4.42Å; V7-I89 HydrophobicContact CG2-CB 4.3Å; V7-I89 HydrophobicContact CG2-CD1 4.29Å; C8-I89 PolarHBondContact N-O 3.3Å; F33-I89 HydrophobicContact CD1-CD1 4.39Å; F33-I89 HydrophobicContact CE1-CD1 3.98Å; I89-I91 HydrophobicContact CG2-CD1 3.73Å; I89-I115 CarbonylContact C-O 3.59Å; I89-I115 WeakPolarHBondContact CA-O 3.48Å; I89-I115 HydrophobicContact CB-CG1 4.28Å; I89-I115 HydrophobicContact CD1-CD1 4.38Å; I89-I115 HydrophobicContact CG1-CD1 4.03Å; I89-I115 HydrophobicContact CG1-CG1 3.89Å; I89-I115 HydrophobicContact CG2-CD1 4.48Å; I89-I115 HydrophobicContact CG2-CG1 4.21Å; I89-L177 HydrophobicContact CD1-CD2 4.13Å; I89-L177 HydrophobicContact CD1-CG 4.5Å; I89-L178 HydrophobicContact CG2-CD2 3.99Å; I89-L181 HydrophobicContact CD1-CD2 4.08Å; I89-L181 HydrophobicContact CG2-CD2 4.09Å
90	L	98.8	Very high	94.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.4	178.4	-58.4	95.2	0	0	0	110.2	I10 V84 A87 F92 I106 I110 S114 I115 G116 M117 I143	I10-L90 HydrophobicContact CD1-CB 4.06Å; I10-L90 HydrophobicContact CD1-CD2 3.94Å; V84-L90 HydrophobicContact CB-CD2 4.07Å; V84-L90 HydrophobicContact CG1-CD2 3.93Å; A87-L90 HydrophobicContact CB-CG 4.43Å; L90-F92 HydrophobicContact CB-CD2 4.44Å; L90-F92 HydrophobicContact CB-CE2 3.71Å; L90-F92 HydrophobicContact CB-CZ 4.04Å; L90-F92 HydrophobicContact CD2-CZ 4.44Å; L90-I106 HydrophobicContact CD2-CD1 4.44Å; L90-I110 HydrophobicContact CD2-CG2 3.65Å; L90-S114 WeakPolarHBondContact CD1-OG 3.44Å; L90-I115 PolarHBondContact N-O 2.95Å; L90-G116 CarbonylContact O-C 3.58Å; L90-G116 VanDerWaalsContact O-CA 3.29Å; L90-G116 WeakPolarHBondContact O-CA 3.46Å; L90-M117 PolarHBondContact O-N 2.74Å; L90-I143 HydrophobicContact CD1-CD1 4.37Å
91	I	98.8	Very high	94.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	108.6	-179.8	-48.4	-59.9	0	0	0	108.7	V7 C8 V9 I10 I19 I23 I89 M117 L119 L181	V7-I91 HydrophobicContact CG1-CG1 4.13Å; C8-I91 PolarHBondContact O-N 2.98Å; V9-I91 HydrophobicContact CG2-CB 4.45Å; I10-I91 WeakPolarHBondContact CA-O 3.4Å; I10-I91 PolarHBondContact N-O 3.23Å; I19-I91 HydrophobicContact CG2-CG2 4.39Å; I23-I91 HydrophobicContact CD1-CB 4.46Å; I23-I91 HydrophobicContact CD1-CD1 4.35Å; I23-I91 HydrophobicContact CD1-CG1 3.74Å; I23-I91 HydrophobicContact CD1-CG2 4.32Å; I89-I91 HydrophobicContact CG2-CD1 3.73Å; I91-M117 WeakPolarHBondContact CA-O 3.36Å; I91-M117 HydrophobicContact CD1-CB 3.98Å; I91-M117 HydrophobicContact CD1-CE 3.42Å; I91-M117 VanDerWaalsContact CD1-CE 3.42Å; I91-L119 HydrophobicContact CG2-CD1 3.92Å; I91-L119 HydrophobicContact CG2-CD2 4.18Å; I91-L181 HydrophobicContact CD1-CD2 4.47Å
92	F	98.6	Very high	94.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	111.4	-179.4	-62.7	-93.3	0	0	0	109.9	I10 L90 I99 V102 I106 M117 L119 I120 I137 L141 I143 M145	I10-F92 HydrophobicContact CB-CD1 4.46Å; I10-F92 HydrophobicContact CD1-CD1 3.72Å; I10-F92 HydrophobicContact CD1-CE1 3.4Å; I10-F92 VanDerWaalsContact CD1-CE1 3.4Å; I10-F92 HydrophobicContact CD1-CE2 4.38Å; I10-F92 HydrophobicContact CD1-CG 4.34Å; I10-F92 HydrophobicContact CD1-CZ 3.77Å; L90-F92 HydrophobicContact CB-CD2 4.44Å; L90-F92 HydrophobicContact CB-CE2 3.71Å; L90-F92 HydrophobicContact CB-CZ 4.04Å; L90-F92 HydrophobicContact CD2-CZ 4.44Å; F92-I99 HydrophobicContact CB-CD1 4.5Å; F92-I99 HydrophobicContact CD1-CD1 3.77Å; F92-I99 HydrophobicContact CE1-CD1 4.48Å; F92-I99 HydrophobicContact CG-CD1 4.48Å; F92-V102 HydrophobicContact CE1-CG1 4.49Å; F92-I106 HydrophobicContact CE1-CD1 3.89Å; F92-I106 HydrophobicContact CZ-CD1 4.18Å; F92-M117 PolarHBondContact N-O 3.3Å; F92-L119 PolarHBondContact O-N 3.23Å; F92-I120 HydrophobicContact CB-CD1 4.16Å; F92-I137 HydrophobicContact CB-CD1 4.12Å; F92-I137 HydrophobicContact CD1-CD1 4.16Å; F92-I137 HydrophobicContact CD2-CD1 4.23Å; F92-I137 HydrophobicContact CD2-CG2 4.42Å; F92-I137 HydrophobicContact CE1-CG2 4.11Å; F92-I137 HydrophobicContact CE2-CG2 3.92Å; F92-I137 HydrophobicContact CG-CD1 3.92Å; F92-I137 HydrophobicContact CZ-CG2 3.75Å; F92-L141 HydrophobicContact CE1-CD1 4.06Å; F92-L141 HydrophobicContact CZ-CD1 3.62Å; F92-I143 HydrophobicContact CE2-CD1 4.36Å; F92-I143 HydrophobicContact CZ-CD1 4.46Å; F92-M145 HydrophobicContact CD2-CE 4.03Å; F92-M145 HydrophobicContact CE2-CE 4.22Å; F92-M145 HydrophobicContact CE2-SD 4.26Å
93	V	96.6	Very high	94.4	Very high	13 Å²	13	36.2 Å²	36.2	8%	0.079	18%	0.182	C	C	.	.			trans	-141.8	52.9	-175.1	62	0	0	0	0	111.3	V9 I10 W15 L119	V9-V93 HydrophobicContact CG1-CG1 3.62Å; I10-V93 CarbonylContact O-C 3.55Å; I10-V93 PolarHBondContact O-N 2.65Å; W15-V93 HydrophobicContact CB-CG2 4.23Å; W15-V93 VanDerWaalsContact CD1-CG2 3.47Å; W15-V93 HydrophobicContact CG-CG2 4.08Å; V93-L119 HydrophobicContact CB-CB 4.24Å; V93-L119 HydrophobicContact CG2-CB 4.18Å; V93-L119 HydrophobicContact CG2-CD2 4.47Å
94	V	92.4	Very high	94.4	Very high	13 Å²	13	40.7 Å²	40.7	8%	0.079	21%	0.206	C	C	.	.	S	Bend	trans	-110.5	158.2	176.4	-64.7	0	0	0	0	110.6	I10 W40 H96 I99 I120	I10-V94 HydrophobicContact CG2-CG1 4.35Å; I10-V94 WeakPolarHBondContact O-CG1 3.46Å; W40-V94 HydrophobicContact CE3-CG1 4.16Å; W40-V94 HydrophobicContact CZ3-CG1 3.71Å; V94-H96 PolarHBondContact O-N 3.21Å; V94-I99 HydrophobicContact CG2-CD1 4.04Å; V94-I120 HydrophobicContact CG2-CD1 3.73Å; V94-I120 WeakPolarHBondContact O-CG1 3.36Å
95	P	85.4	Confident	94.3	Very high	74 Å²	74	43.6 Å²	43.6	48%	0.481	22%	0.223	S	C	.	.			trans	-53.6	135.4	164.8	-23.4	32.5	0	0	0	110.9	Q97 F98	P95-Q97 HydrophobicContact CB-CG 4.33Å; P95-Q97 PolarHBondContact O-N 3.28Å; P95-F98 HydrophobicContact CB-CD2 3.73Å; P95-F98 HydrophobicContact CB-CE2 3.96Å; P95-F98 HydrophobicContact CG-CD2 3.87Å; P95-F98 HydrophobicContact CG-CE2 3.93Å; P95-F98 PolarHBondContact O-N 3.18Å
96	H	83.7	Confident	94.4	Very high	49 Å²	49	37.7 Å²	37.7	23%	0.227	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-52.7	-35.3	-171.1	69.5	-127.1	0	0	0	112.7	V94 F98 I99 I120 I133	V94-H96 PolarHBondContact O-N 3.21Å; H96-F98 PolarHBondContact O-N 3.22Å; H96-I99 WeakPolarHBondContact O-CB 3.43Å; H96-I99 WeakPolarHBondContact O-CG2 3.47Å; H96-I99 PolarHBondContact O-N 2.89Å; H96-I120 HydrophobicContact CB-CG2 3.69Å; H96-I133 HydrophobicContact CB-CD1 4.21Å
97	Q	81.4	Confident	94.4	Very high	109 Å²	109	41.8 Å²	41.8	51%	0.509	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-62.7	-18.2	-175.6	67	-168.8	29.5	0	0	113.4	P95	P95-Q97 HydrophobicContact CB-CG 4.33Å; P95-Q97 PolarHBondContact O-N 3.28Å
98	F	89.1	Confident	94.3	Very high	99 Å²	99	48.4 Å²	48.4	43%	0.434	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-97.1	-9.1	179.3	-58.1	-57.9	0	0	0	113.5	P95 H96 G100 R101 V102	P95-F98 HydrophobicContact CB-CD2 3.73Å; P95-F98 HydrophobicContact CB-CE2 3.96Å; P95-F98 HydrophobicContact CG-CD2 3.87Å; P95-F98 HydrophobicContact CG-CE2 3.93Å; P95-F98 PolarHBondContact O-N 3.18Å; H96-F98 PolarHBondContact O-N 3.22Å; F98-G100 VanDerWaalsContact C-N 3.33Å; F98-G100 PolarHBondContact O-N 2.9Å; F98-R101 PolarHBondContact O-N 2.81Å; F98-V102 WeakPolarHBondContact O-CG2 3.39Å; F98-V102 PolarHBondContact O-N 3.31Å
99	I	93.2	Very high	94.2	Very high	8 Å²	8	52 Å²	52	4%	0.041	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-38.3	-170.3	-164.1	54.4	0	0	0	112.7	F92 V94 H96 R101 V102 C103 I120 I133 I137	F92-I99 HydrophobicContact CB-CD1 4.5Å; F92-I99 HydrophobicContact CD1-CD1 3.77Å; F92-I99 HydrophobicContact CE1-CD1 4.48Å; F92-I99 HydrophobicContact CG-CD1 4.48Å; V94-I99 HydrophobicContact CG2-CD1 4.04Å; H96-I99 WeakPolarHBondContact O-CB 3.43Å; H96-I99 WeakPolarHBondContact O-CG2 3.47Å; H96-I99 PolarHBondContact O-N 2.89Å; I99-R101 PolarHBondContact O-N 3.24Å; I99-V102 HydrophobicContact CD1-CB 4.5Å; I99-V102 HydrophobicContact CD1-CG1 4.4Å; I99-V102 PolarHBondContact O-N 3.07Å; I99-C103 PolarHBondContact O-N 2.99Å; I99-C103 PolarHBondContact O-SG 3.26Å; I99-C103 VanDerWaalsContact O-SG 3.37Å; I99-I120 HydrophobicContact CB-CD1 4.39Å; I99-I120 HydrophobicContact CD1-CD1 3.76Å; I99-I120 HydrophobicContact CG1-CD1 4.09Å; I99-I133 HydrophobicContact CG1-CG2 4.13Å; I99-I133 HydrophobicContact CG2-CG2 4.36Å; I99-I137 HydrophobicContact CD1-CD1 3.83Å; I99-I137 HydrophobicContact CD1-CG1 3.88Å; I99-I137 HydrophobicContact CG1-CD1 3.92Å; I99-I137 HydrophobicContact CG1-CG1 3.68Å
100	G	92.9	Very high	94.1	Very high	22 Å²	22	53.1 Å²	53.1	23%	0.227	26%	0.263	C	S	.	.	H	α-helix	trans	-57.4	-52.1	178.6	0	0	0	0	0	111.9	F98 V102 C103 D104	F98-G100 VanDerWaalsContact C-N 3.33Å; F98-G100 PolarHBondContact O-N 2.9Å; G100-V102 PolarHBondContact O-N 3.35Å; G100-C103 PolarHBondContact O-N 2.99Å; G100-D104 PolarHBondContact O-N 3.1Å
101	R	94.8	Very high	93.9	Very high	192 Å²	192	56 Å²	56	73%	0.725	28%	0.276	S	S	*	.	H	α-helix	trans	-63.8	-39	178	-177.9	178.5	176.6	-179.5	-0.3	112.4	F98 I99 D104 T105	F98-R101 PolarHBondContact O-N 2.81Å; I99-R101 PolarHBondContact O-N 3.24Å; R101-D104 PolarHBondContact O-N 3.28Å; R101-T105 PolarHBondContact O-N 3.44Å; R101-T105 PolarHBondContact O-OG1 3.07Å
102	V	96.9	Very high	93.5	Very high	3 Å²	3	65.7 Å²	65.7	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-59	-51.7	176.1	164.3	0	0	0	0	109.9	I10 W40 L80 F92 F98 I99 G100 D104 T105 I106	I10-V102 HydrophobicContact CG2-CG1 3.65Å; W40-V102 HydrophobicContact CH2-CG2 3.96Å; W40-V102 HydrophobicContact CZ3-CG2 3.76Å; L80-V102 HydrophobicContact CD2-CB 4.32Å; L80-V102 HydrophobicContact CD2-CG1 4.18Å; L80-V102 HydrophobicContact CD2-CG2 4.21Å; F92-V102 HydrophobicContact CE1-CG1 4.49Å; F98-V102 WeakPolarHBondContact O-CG2 3.39Å; F98-V102 PolarHBondContact O-N 3.31Å; I99-V102 HydrophobicContact CD1-CB 4.5Å; I99-V102 HydrophobicContact CD1-CG1 4.4Å; I99-V102 PolarHBondContact O-N 3.07Å; G100-V102 PolarHBondContact O-N 3.35Å; V102-D104 VanDerWaalsContact C-N 3.35Å; V102-D104 PolarHBondContact O-N 2.83Å; V102-T105 PolarHBondContact O-N 2.94Å; V102-I106 HydrophobicContact CG1-CD1 4.42Å; V102-I106 WeakPolarHBondContact O-CG1 3.37Å; V102-I106 PolarHBondContact O-N 3.26Å
103	C	97.3	Very high	93.2	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59.8	-43.7	178.2	-70.9	0	0	0	0	112.2	I99 G100 T105 I106 K107 K140 L141	I99-C103 PolarHBondContact O-N 2.99Å; I99-C103 PolarHBondContact O-SG 3.26Å; I99-C103 VanDerWaalsContact O-SG 3.37Å; G100-C103 PolarHBondContact O-N 2.99Å; C103-T105 PolarHBondContact O-N 2.65Å; C103-I106 PolarHBondContact O-N 3.27Å; C103-K107 PolarHBondContact O-N 3.49Å; C103-K140 HydrophobicContact CB-CB 3.88Å; C103-K140 HydrophobicContact CB-CD 3.51Å; C103-K140 HydrophobicContact CB-CG 4.35Å; C103-L141 HydrophobicContact CB-CD2 4.06Å; C103-L141 HydrophobicContact CB-CG 4.32Å; C103-L141 WeakPolarHBondContact O-CD2 3.2Å
104	D	96.8	Very high	93.2	Very high	95 Å²	95	69.9 Å²	69.9	51%	0.508	34%	0.34	S	S	.	.	H	α-helix	trans	-62.9	-33	179.6	-64.9	-24.2	0	0	0	112.2	G100 R101 V102 K140	G100-D104 PolarHBondContact O-N 3.1Å; R101-D104 PolarHBondContact O-N 3.28Å; V102-D104 VanDerWaalsContact C-N 3.35Å; V102-D104 PolarHBondContact O-N 2.83Å; D104-K140 IonicContact OD1-NZ 2.82Å; D104-K140 PolarHBondContact OD1-NZ 3.07Å; D104-K140 IonicContact OD2-NZ 3.76Å; D104-K140 PolarHBondContact OD2-NZ 2.82Å
105	T	97.3	Very high	93.4	Very high	61 Å²	61	69.4 Å²	69.4	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-73.8	-38.3	179.2	-53.2	0	0	0	0	112.2	L80 R101 V102 C103 H109	L80-T105 HydrophobicContact CB-CG2 4.3Å; L80-T105 HydrophobicContact CD2-CG2 3.95Å; L80-T105 HydrophobicContact CG-CG2 4.28Å; R101-T105 PolarHBondContact O-N 3.44Å; R101-T105 PolarHBondContact O-OG1 3.07Å; V102-T105 PolarHBondContact O-N 2.94Å; C103-T105 PolarHBondContact O-N 2.65Å; T105-H109 PolarHBondContact O-ND1 2.79Å
106	I	97.4	Very high	94	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-95.3	-10.8	-171.7	68.8	179.5	0	0	0	114.5	I10 L80 V84 L90 F92 V102 C103 D108 H109 I110 L141	I10-I106 HydrophobicContact CD1-CD1 3.98Å; L80-I106 HydrophobicContact CD1-CG2 3.8Å; L80-I106 HydrophobicContact CD2-CG2 3.86Å; L80-I106 HydrophobicContact CG-CG2 3.45Å; L80-I106 VanDerWaalsContact CG-CG2 3.45Å; V84-I106 HydrophobicContact CG1-CB 4.38Å; V84-I106 HydrophobicContact CG1-CD1 4.31Å; V84-I106 HydrophobicContact CG1-CG2 3.88Å; V84-I106 HydrophobicContact CG2-CB 4.03Å; V84-I106 HydrophobicContact CG2-CG2 3.94Å; L90-I106 HydrophobicContact CD2-CD1 4.44Å; F92-I106 HydrophobicContact CE1-CD1 3.89Å; F92-I106 HydrophobicContact CZ-CD1 4.18Å; V102-I106 HydrophobicContact CG1-CD1 4.42Å; V102-I106 WeakPolarHBondContact O-CG1 3.37Å; V102-I106 PolarHBondContact O-N 3.26Å; C103-I106 PolarHBondContact O-N 3.27Å; I106-D108 PolarHBondContact O-N 3.41Å; I106-H109 PolarHBondContact O-N 3Å; I106-I110 HydrophobicContact CB-CG2 4.07Å; I106-I110 HydrophobicContact CD1-CG2 4.14Å; I106-I110 HydrophobicContact CG1-CG2 4.14Å; I106-I110 WeakPolarHBondContact O-CG2 3.49Å; I106-I110 PolarHBondContact O-N 3.29Å; I106-L141 HydrophobicContact CD1-CD1 3.81Å; I106-L141 HydrophobicContact CD1-CD2 4.41Å; I106-L141 HydrophobicContact CG1-CD1 4.17Å; I106-L141 HydrophobicContact CG1-CD2 3.84Å
107	K	96.1	Very high	94.7	Very high	117 Å²	117	63.6 Å²	63.6	51%	0.509	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-40.1	-171.6	-173.5	178.9	179.4	-176.4	0	114.2	C103 K140 L141	C103-K107 PolarHBondContact O-N 3.49Å; K107-K140 WeakPolarHBondContact CD-O 3.44Å; K107-K140 WeakPolarHBondContact CE-O 3.27Å; K107-L141 HydrophobicContact CB-CD2 4.14Å; K107-L141 HydrophobicContact CG-CD2 4.49Å
108	D	95.4	Very high	95.5	Very high	143 Å²	143	58.4 Å²	58.4	77%	0.765	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	2.5	-177.6	-58.2	-43.7	0	0	0	113.9	I106	I106-D108 PolarHBondContact O-N 3.41Å
109	H	96.3	Very high	95.9	Very high	93 Å²	93	54 Å²	54	43%	0.431	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-8.8	-173.2	-59.9	99.8	0	0	0	113.8	A81 V84 T105 I106	A81-H109 HydrophobicContact CB-CB 4.32Å; V84-H109 HydrophobicContact CG2-CB 3.95Å; T105-H109 PolarHBondContact O-ND1 2.79Å; I106-H109 PolarHBondContact O-N 3Å
110	I	96.5	Very high	95.8	Very high	24 Å²	24	53.8 Å²	53.8	12%	0.123	26%	0.259	C	S	.	.	S	Bend	trans	-89.5	156.1	-179.5	63.2	173.8	0	0	0	112.6	V84 L90 I106 L141 I143	V84-I110 HydrophobicContact CB-CG2 4.14Å; V84-I110 HydrophobicContact CG2-CG2 4.02Å; L90-I110 HydrophobicContact CD2-CG2 3.65Å; I106-I110 HydrophobicContact CB-CG2 4.07Å; I106-I110 HydrophobicContact CD1-CG2 4.14Å; I106-I110 HydrophobicContact CG1-CG2 4.14Å; I106-I110 WeakPolarHBondContact O-CG2 3.49Å; I106-I110 PolarHBondContact O-N 3.29Å; I110-L141 HydrophobicContact CD1-CB 3.79Å; I110-L141 HydrophobicContact CD1-CD1 4.24Å; I110-L141 HydrophobicContact CD1-CD2 4.22Å; I110-L141 HydrophobicContact CD1-CG 4.31Å; I110-I143 HydrophobicContact CD1-CG2 3.71Å
111	K	95.1	Very high	95.5	Very high	61 Å²	61	54.4 Å²	54.4	27%	0.265	26%	0.256	S	S	.	.			trans	-70.3	135.7	167.4	-66.2	-179.4	56.5	-177.1	0	110.1	G86 A87 D88 D113 S114	G86-K111 WeakPolarHBondContact O-CD 3.22Å; A87-K111 WeakPolarHBondContact O-CD 3.48Å; D88-K111 IonicContact OD1-NZ 3.84Å; D88-K111 PolarHBondContact OD1-NZ 2.94Å; K111-D113 VanDerWaalsContact C-N 3.25Å; K111-D113 WeakPolarHBondContact CB-OD1 3.25Å; K111-D113 WeakPolarHBondContact CE-OD1 3.22Å; K111-D113 IonicContact NZ-OD1 2.71Å; K111-D113 IonicContact NZ-OD2 3.28Å; K111-D113 PolarHBondContact O-N 3.39Å; K111-S114 VanDerWaalsContact O-CB 3.29Å; K111-S114 WeakPolarHBondContact O-CB 3.47Å; K111-S114 PolarHBondContact O-N 3.48Å; K111-S114 VanDerWaalsContact O-N 3.13Å; K111-S114 PolarHBondContact O-OG 3.34Å
112	K	89.8	Confident	95	Very high	203 Å²	203	45.2 Å²	45.2	88%	0.883	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.3	179.3	-68.9	-174.8	177.1	-178.7	0	113.7
113	D	92.4	Very high	94.4	Very high	99 Å²	99	45.1 Å²	45.1	53%	0.529	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	10.4	178.6	66.3	-38.5	0	0	0	113	K111	K111-D113 VanDerWaalsContact C-N 3.25Å; K111-D113 WeakPolarHBondContact CB-OD1 3.25Å; K111-D113 WeakPolarHBondContact CE-OD1 3.22Å; K111-D113 IonicContact NZ-OD1 2.71Å; K111-D113 IonicContact NZ-OD2 3.28Å; K111-D113 PolarHBondContact O-N 3.39Å
114	S	96.2	Very high	93.6	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.014	24%	0.238	C	C	.	.			trans	-70.8	156	176.4	63.2	0	0	0	0	112.2	D88 L90 K111	D88-S114 CarbonylContact O-C 3.59Å; D88-S114 VanDerWaalsContact O-CA 3.31Å; D88-S114 WeakPolarHBondContact O-CA 3.22Å; D88-S114 WeakPolarHBondContact O-CB 3.07Å; L90-S114 WeakPolarHBondContact CD1-OG 3.44Å; K111-S114 VanDerWaalsContact O-CB 3.29Å; K111-S114 WeakPolarHBondContact O-CB 3.47Å; K111-S114 PolarHBondContact O-N 3.48Å; K111-S114 VanDerWaalsContact O-N 3.13Å; K111-S114 PolarHBondContact O-OG 3.34Å
115	I	97.4	Very high	92.6	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	140.6	173.6	64.3	172.7	0	0	0	110.2	D88 I89 L90 Y174 L177 L178	D88-I115 PolarHBondContact O-N 2.97Å; I89-I115 CarbonylContact C-O 3.59Å; I89-I115 WeakPolarHBondContact CA-O 3.48Å; I89-I115 HydrophobicContact CB-CG1 4.28Å; I89-I115 HydrophobicContact CD1-CD1 4.38Å; I89-I115 HydrophobicContact CG1-CD1 4.03Å; I89-I115 HydrophobicContact CG1-CG1 3.89Å; I89-I115 HydrophobicContact CG2-CD1 4.48Å; I89-I115 HydrophobicContact CG2-CG1 4.21Å; L90-I115 PolarHBondContact N-O 2.95Å; I115-Y174 HydrophobicContact CD1-CD1 3.72Å; I115-Y174 HydrophobicContact CD1-CE1 4.25Å; I115-Y174 HydrophobicContact CD1-CG 4.03Å; I115-Y174 HydrophobicContact CG2-CD1 3.97Å; I115-Y174 HydrophobicContact CG2-CD2 3.9Å; I115-Y174 HydrophobicContact CG2-CE1 3.63Å; I115-Y174 HydrophobicContact CG2-CE2 3.56Å; I115-Y174 HydrophobicContact CG2-CG 4.11Å; I115-Y174 VanDerWaalsContact CG2-CZ 3.42Å; I115-L177 HydrophobicContact CD1-CD2 4.46Å; I115-L178 HydrophobicContact CD1-CD1 4.45Å; I115-L178 HydrophobicContact CD1-CD2 3.98Å; I115-L178 HydrophobicContact CD1-CG 4.28Å
116	G	98.1	Very high	91.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	146.9	174.3	0	0	0	0	0	112.4	L90 T144 M145 T146	L90-G116 CarbonylContact O-C 3.58Å; L90-G116 VanDerWaalsContact O-CA 3.29Å; L90-G116 WeakPolarHBondContact O-CA 3.46Å; G116-T144 PolarHBondContact N-O 3.47Å; G116-M145 CarbonylContact O-C 3.5Å; G116-T146 PolarHBondContact O-N 3.05Å; G116-T146 PolarHBondContact O-OG1 3.12Å
117	M	98.6	Very high	89.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	116.6	167.9	-172.6	168.8	48.3	0	0	109.7	L90 I91 F92 L119 T146 L148 I167 L178 M182	L90-M117 PolarHBondContact O-N 2.74Å; I91-M117 WeakPolarHBondContact CA-O 3.36Å; I91-M117 HydrophobicContact CD1-CB 3.98Å; I91-M117 HydrophobicContact CD1-CE 3.42Å; I91-M117 VanDerWaalsContact CD1-CE 3.42Å; F92-M117 PolarHBondContact N-O 3.3Å; M117-L119 HydrophobicContact CB-CD1 4.46Å; M117-L119 HydrophobicContact CE-CD1 4.25Å; M117-L119 HydrophobicContact CG-CD1 3.76Å; M117-L119 HydrophobicContact SD-CD1 4.35Å; M117-T146 CarbonylContact C-O 3.57Å; M117-T146 VanDerWaalsContact CA-O 3.3Å; M117-T146 WeakPolarHBondContact CA-O 3.47Å; M117-T146 WeakPolarHBondContact CA-OG1 3.45Å; M117-T146 VanDerWaalsContact CB-OG1 3.28Å; M117-T146 WeakPolarHBondContact CB-OG1 3.43Å; M117-T146 WeakPolarHBondContact CG-OG1 3.48Å; M117-L148 HydrophobicContact CG-CB 4.31Å; M117-L148 HydrophobicContact SD-CB 3.94Å; M117-L148 HydrophobicContact SD-CD1 4.3Å; M117-I167 HydrophobicContact SD-CD1 4.15Å; M117-I167 HydrophobicContact SD-CG1 4.4Å; M117-L178 HydrophobicContact CE-CD2 4.19Å; M117-L178 HydrophobicContact SD-CD1 4.39Å; M117-L178 HydrophobicContact SD-CD2 4.38Å; M117-M182 HydrophobicContact CE-CE 3.94Å; M117-M182 HydrophobicContact CE-CG 3.72Å; M117-M182 HydrophobicContact CE-SD 3.75Å
118	S	98.1	Very high	88.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	127.5	176.2	-178.4	0	0	0	0	111.1	I120 T146 V147 L148	S118-I120 PolarHBondContact OG-N 2.85Å; S118-T146 PolarHBondContact N-O 3Å; S118-V147 CarbonylContact O-C 3.58Å; S118-V147 VanDerWaalsContact O-CA 3.29Å; S118-V147 WeakPolarHBondContact O-CA 3.26Å; S118-L148 PolarHBondContact O-N 2.86Å
119	L	96.8	Very high	87.5	Confident	6 Å²	6	47 Å²	47	3%	0.031	25%	0.247	C	C	.	.			trans	-107.5	11.5	170.9	-79.9	62.2	0	0	0	110.7	I19 I91 F92 V93 M117 K121 L148 M182	I19-L119 HydrophobicContact CB-CD2 4.38Å; I19-L119 HydrophobicContact CD1-CD2 4.23Å; I19-L119 HydrophobicContact CG1-CD2 3.71Å; I19-L119 HydrophobicContact CG2-CD2 4.07Å; I91-L119 HydrophobicContact CG2-CD1 3.92Å; I91-L119 HydrophobicContact CG2-CD2 4.18Å; F92-L119 PolarHBondContact O-N 3.23Å; V93-L119 HydrophobicContact CB-CB 4.24Å; V93-L119 HydrophobicContact CG2-CB 4.18Å; V93-L119 HydrophobicContact CG2-CD2 4.47Å; M117-L119 HydrophobicContact CB-CD1 4.46Å; M117-L119 HydrophobicContact CE-CD1 4.25Å; M117-L119 HydrophobicContact CG-CD1 3.76Å; M117-L119 HydrophobicContact SD-CD1 4.35Å; L119-K121 PolarHBondContact O-N 3.39Å; L119-L148 HydrophobicContact CD1-CB 3.8Å; L119-L148 HydrophobicContact CD2-CD2 4.49Å; L119-L148 HydrophobicContact CG-CB 3.98Å; L119-L148 HydrophobicContact CG-CD2 4.19Å; L119-M182 HydrophobicContact CD2-CE 4.24Å
120	I	92.4	Very high	86.9	Confident	4 Å²	4	44 Å²	44	2%	0.021	23%	0.234	C	C	.	.			trans	-83.9	115.9	-174	-54.1	179.2	0	0	0	108.6	F92 V94 H96 I99 S118 I133 M149	F92-I120 HydrophobicContact CB-CD1 4.16Å; V94-I120 HydrophobicContact CG2-CD1 3.73Å; V94-I120 WeakPolarHBondContact O-CG1 3.36Å; H96-I120 HydrophobicContact CB-CG2 3.69Å; I99-I120 HydrophobicContact CB-CD1 4.39Å; I99-I120 HydrophobicContact CD1-CD1 3.76Å; I99-I120 HydrophobicContact CG1-CD1 4.09Å; S118-I120 PolarHBondContact OG-N 2.85Å; I120-I133 HydrophobicContact CB-CG2 4.12Å; I120-I133 HydrophobicContact CD1-CG2 4.01Å; I120-I133 HydrophobicContact CG2-CG1 4.4Å; I120-I133 HydrophobicContact CG2-CG2 4.2Å; I120-M149 WeakPolarHBondContact O-CE 3.46Å
121	K	87.1	Confident	86.6	Confident	35 Å²	35	45.3 Å²	45.3	15%	0.152	24%	0.238	C	C	.	.			trans	-86	122.5	173.7	-61.7	-175.5	-178	-167.8	0	109.5	L119 M149 G150 D262 Q300	L119-K121 PolarHBondContact O-N 3.39Å; K121-M149 HydrophobicContact CG-SD 3.73Å; K121-G150 PolarHBondContact NZ-O 2.99Å; K121-D262 VanDerWaalsContact NZ-CG 3.33Å; K121-D262 IonicContact NZ-OD1 3.21Å; K121-D262 PolarHBondContact NZ-OD1 2.89Å; K121-D262 IonicContact NZ-OD2 3.86Å; K121-D262 PolarHBondContact NZ-OD2 3.25Å; K121-Q300 PolarHBondContact O-NE2 2.89Å; K121-Q300 PolarHBondContact O-OE1 2.84Å
122	G	82.8	Confident	86.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.			trans	150.5	169.3	-179.1	0	0	0	0	0	111
123	V	84.7	Confident	86.6	Confident	1 Å²	1	33 Å²	33	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	169.2	169.8	-62.7	0	0	0	0	108.8	L130 L132 I200 A203 T304 E307	V123-L130 HydrophobicContact CB-CD1 3.69Å; V123-L130 HydrophobicContact CG1-CD1 3.85Å; V123-L130 HydrophobicContact CG2-CD1 3.78Å; V123-L132 HydrophobicContact CG1-CD2 4.12Å; V123-I200 HydrophobicContact CG1-CD1 3.39Å; V123-A203 HydrophobicContact CG1-CB 3.58Å; V123-T304 HydrophobicContact CG2-CG2 4.25Å; V123-E307 HydrophobicContact CG2-CB 4.15Å; V123-E307 VanDerWaalsContact CG2-OE2 3.29Å; V123-E307 WeakPolarHBondContact CG2-OE2 3.46Å
124	D	81.7	Confident	86.7	Confident	70 Å²	70	28.6 Å²	28.6	37%	0.374	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	150.6	170.8	-164.9	5.2	0	0	0	108.6	K131 I133 V136	D124-K131 HydrophobicContact CB-CB 4.35Å; D124-K131 PolarHBondContact N-O 2.96Å; D124-K131 PolarHBondContact O-N 2.95Å; D124-I133 HydrophobicContact CB-CD1 4.28Å; D124-V136 HydrophobicContact CB-CG2 4.45Å
125	A	73.8	Confident	86.6	Confident	37 Å²	37	29.6 Å²	29.6	31%	0.306	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	104.9	178.9	0	0	0	0	0	109	E307	A125-E307 HydrophobicContact CB-CB 4.11Å; A125-E307 HydrophobicContact CB-CG 4.14Å
126	G	67.3	Low	86.4	Confident	23 Å²	23	30 Å²	30	24%	0.237	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	173.9	177.4	0	0	0	0	0	113.2	E128 G129	G126-E128 PolarHBondContact O-N 3.05Å; G126-E128 VanDerWaalsContact O-N 3.13Å; G126-G129 PolarHBondContact N-O 2.72Å; G126-G129 PolarHBondContact O-N 3.38Å
127	P	64.8	Low	86.3	Confident	136 Å²	136	30 Å²	30	88%	0.883	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.9	171.3	-22.6	32.8	0	0	0	113.4
128	E	69.3	Low	86.1	Confident	185 Å²	185	34.2 Å²	34.2	86%	0.864	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.8	-179.9	-60	-175.9	173.5	0	0	113.3	G126	G126-E128 PolarHBondContact O-N 3.05Å; G126-E128 VanDerWaalsContact O-N 3.13Å
129	G	78.1	Confident	85.9	Confident	4 Å²	4	39.7 Å²	39.7	4%	0.041	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	110.7	-143.8	179.1	0	0	0	0	0	113.6	G126 K131	G126-G129 PolarHBondContact N-O 2.72Å; G126-G129 PolarHBondContact O-N 3.38Å; G129-K131 PolarHBondContact O-N 3.23Å
130	L	83.9	Confident	85.8	Confident	31 Å²	31	42.7 Å²	42.7	16%	0.162	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	130.8	178.2	-174.8	74.9	0	0	0	110.4	V123 I200 F239 F243 I311	V123-L130 HydrophobicContact CB-CD1 3.69Å; V123-L130 HydrophobicContact CG1-CD1 3.85Å; V123-L130 HydrophobicContact CG2-CD1 3.78Å; L130-I200 HydrophobicContact CD1-CD1 4.17Å; L130-I200 HydrophobicContact CD2-CD1 3.89Å; L130-F239 HydrophobicContact CD1-CE1 4.11Å; L130-F239 HydrophobicContact CD1-CZ 4.25Å; L130-F239 HydrophobicContact CD2-CE1 3.77Å; L130-F239 HydrophobicContact CD2-CZ 4.43Å; L130-F243 HydrophobicContact CB-CB 4.49Å; L130-F243 HydrophobicContact CB-CD1 4.43Å; L130-F243 HydrophobicContact CD2-CB 3.57Å; L130-F243 HydrophobicContact CD2-CG 4.33Å; L130-I311 HydrophobicContact CB-CD1 3.72Å; L130-I311 HydrophobicContact CB-CG1 4.47Å; L130-I311 HydrophobicContact CB-CG2 4.42Å; L130-I311 HydrophobicContact CD1-CD1 3.5Å; L130-I311 HydrophobicContact CG-CD1 4.24Å
131	K	89.4	Confident	86	Confident	50 Å²	50	43.3 Å²	43.3	22%	0.217	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126.9	169.6	-163.3	167.7	-172.5	156.1	0	110.3	D124 G129 E135 V136 E139	D124-K131 HydrophobicContact CB-CB 4.35Å; D124-K131 PolarHBondContact N-O 2.96Å; D124-K131 PolarHBondContact O-N 2.95Å; G129-K131 PolarHBondContact O-N 3.23Å; K131-E135 HydrophobicContact CG-CB 4.37Å; K131-V136 HydrophobicContact CD-CG2 3.74Å; K131-V136 HydrophobicContact CG-CG2 3.8Å; K131-E139 WeakPolarHBondContact CE-OE1 3.21Å; K131-E139 WeakPolarHBondContact CE-OE2 3.41Å; K131-E139 IonicContact NZ-OE1 2.87Å; K131-E139 PolarHBondContact NZ-OE1 3.04Å; K131-E139 IonicContact NZ-OE2 3.91Å; K131-E139 PolarHBondContact NZ-OE2 3.02Å
132	L	92.6	Very high	86.4	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	150.4	176.7	-60.8	174.1	0	0	0	110.2	V123 S134 E135 V136 D196 E199 I200	V123-L132 HydrophobicContact CG1-CD2 4.12Å; L132-S134 VanDerWaalsContact C-N 3.29Å; L132-S134 PolarHBondContact O-N 3.39Å; L132-E135 HydrophobicContact CB-CB 4.48Å; L132-E135 HydrophobicContact CB-CG 3.96Å; L132-E135 PolarHBondContact N-OE2 3.29Å; L132-E135 WeakPolarHBondContact O-CB 3.47Å; L132-E135 PolarHBondContact O-N 2.93Å; L132-V136 PolarHBondContact O-N 3.49Å; L132-D196 HydrophobicContact CD1-CB 3.63Å; L132-E199 WeakPolarHBondContact CB-OE2 3.41Å; L132-E199 HydrophobicContact CD1-CB 4.49Å; L132-E199 HydrophobicContact CD2-CB 4.47Å; L132-E199 HydrophobicContact CD2-CG 4.26Å; L132-I200 HydrophobicContact CD2-CB 4.19Å; L132-I200 HydrophobicContact CD2-CD1 3.96Å
133	I	93.3	Very high	87	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-64.7	-37.9	-178.2	-59.7	-60.7	0	0	0	110.5	H96 I99 I120 D124 E135 V136 I137 E199	H96-I133 HydrophobicContact CB-CD1 4.21Å; I99-I133 HydrophobicContact CG1-CG2 4.13Å; I99-I133 HydrophobicContact CG2-CG2 4.36Å; I120-I133 HydrophobicContact CB-CG2 4.12Å; I120-I133 HydrophobicContact CD1-CG2 4.01Å; I120-I133 HydrophobicContact CG2-CG1 4.4Å; I120-I133 HydrophobicContact CG2-CG2 4.2Å; D124-I133 HydrophobicContact CB-CD1 4.28Å; I133-E135 PolarHBondContact O-N 2.92Å; I133-V136 PolarHBondContact O-N 2.83Å; I133-I137 HydrophobicContact CG2-CD1 3.99Å; I133-I137 HydrophobicContact CG2-CG1 4.47Å; I133-I137 VanDerWaalsContact O-CG1 3.28Å; I133-I137 WeakPolarHBondContact O-CG1 3.49Å; I133-I137 PolarHBondContact O-N 2.93Å; I133-E199 PolarHBondContact N-OE1 2.75Å; I133-E199 VanDerWaalsContact N-OE1 3.1Å
134	S	95.2	Very high	87.5	Confident	5 Å²	5	48.3 Å²	48.3	4%	0.035	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-33.1	173.5	74.5	0	0	0	0	112.3	L132 R138 M145 E199	L132-S134 VanDerWaalsContact C-N 3.29Å; L132-S134 PolarHBondContact O-N 3.39Å; S134-R138 WeakPolarHBondContact O-CB 3.44Å; S134-R138 PolarHBondContact O-N 3.29Å; S134-M145 WeakPolarHBondContact O-CG 3.47Å; S134-E199 WeakPolarHBondContact CB-OE2 3.39Å; S134-E199 PolarHBondContact N-OE1 3.13Å; S134-E199 PolarHBondContact OG-OE2 3.19Å
135	E	93.3	Very high	88.2	Confident	24 Å²	24	46.1 Å²	46.1	11%	0.112	26%	0.26	C	S	.	.	H	α-helix	trans	-73.5	-41.6	176.5	-60	-171.1	120.4	0	0	112	K131 L132 I133 I137 R138 E139 N246	K131-E135 HydrophobicContact CG-CB 4.37Å; L132-E135 HydrophobicContact CB-CB 4.48Å; L132-E135 HydrophobicContact CB-CG 3.96Å; L132-E135 PolarHBondContact N-OE2 3.29Å; L132-E135 WeakPolarHBondContact O-CB 3.47Å; L132-E135 PolarHBondContact O-N 2.93Å; I133-E135 PolarHBondContact O-N 2.92Å; E135-I137 VanDerWaalsContact C-N 3.26Å; E135-I137 PolarHBondContact O-N 3.08Å; E135-R138 VanDerWaalsContact CG-NH2 3.28Å; E135-R138 PolarHBondContact O-N 3.06Å; E135-R138 IonicContact OE1-CZ 3.87Å; E135-R138 IonicContact OE1-NH1 3.85Å; E135-R138 IonicContact OE1-NH2 3.06Å; E135-R138 PolarHBondContact OE1-NH2 3.27Å; E135-E139 WeakPolarHBondContact O-CB 3.43Å; E135-E139 WeakPolarHBondContact O-CG 3.45Å; E135-E139 PolarHBondContact O-N 2.94Å; E135-N246 PolarHBondContact OE1-ND2 3.39Å
136	V	93.1	Very high	89.4	Confident	13 Å²	13	44.4 Å²	44.4	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-55.5	-45.9	172.1	177.2	0	0	0	0	110.4	D124 K131 L132 I133 K140	D124-V136 HydrophobicContact CB-CG2 4.45Å; K131-V136 HydrophobicContact CD-CG2 3.74Å; K131-V136 HydrophobicContact CG-CG2 3.8Å; L132-V136 PolarHBondContact O-N 3.49Å; I133-V136 PolarHBondContact O-N 2.83Å; V136-K140 HydrophobicContact CG1-CD 4.24Å; V136-K140 WeakPolarHBondContact O-CB 3.42Å; V136-K140 WeakPolarHBondContact O-CG 3.35Å; V136-K140 PolarHBondContact O-N 3Å; V136-K140 VanDerWaalsContact O-N 3.12Å
137	I	95.8	Very high	90.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66	-46.9	178.4	-61.5	163.8	0	0	0	110.3	F92 I99 I133 E135 E139 K140 L141 M145	F92-I137 HydrophobicContact CB-CD1 4.12Å; F92-I137 HydrophobicContact CD1-CD1 4.16Å; F92-I137 HydrophobicContact CD2-CD1 4.23Å; F92-I137 HydrophobicContact CD2-CG2 4.42Å; F92-I137 HydrophobicContact CE1-CG2 4.11Å; F92-I137 HydrophobicContact CE2-CG2 3.92Å; F92-I137 HydrophobicContact CG-CD1 3.92Å; F92-I137 HydrophobicContact CZ-CG2 3.75Å; I99-I137 HydrophobicContact CD1-CD1 3.83Å; I99-I137 HydrophobicContact CD1-CG1 3.88Å; I99-I137 HydrophobicContact CG1-CD1 3.92Å; I99-I137 HydrophobicContact CG1-CG1 3.68Å; I133-I137 HydrophobicContact CG2-CD1 3.99Å; I133-I137 HydrophobicContact CG2-CG1 4.47Å; I133-I137 VanDerWaalsContact O-CG1 3.28Å; I133-I137 WeakPolarHBondContact O-CG1 3.49Å; I133-I137 PolarHBondContact O-N 2.93Å; E135-I137 VanDerWaalsContact C-N 3.26Å; E135-I137 PolarHBondContact O-N 3.08Å; I137-E139 VanDerWaalsContact C-N 3.35Å; I137-E139 PolarHBondContact O-N 3.12Å; I137-K140 PolarHBondContact O-N 2.91Å; I137-L141 HydrophobicContact CG2-CD1 3.65Å; I137-L141 HydrophobicContact CG2-CG 4.23Å; I137-L141 WeakPolarHBondContact O-CB 3.45Å; I137-L141 PolarHBondContact O-N 3.06Å; I137-M145 HydrophobicContact CB-CE 3.98Å; I137-M145 HydrophobicContact CB-CG 4.43Å; I137-M145 HydrophobicContact CB-SD 4.09Å; I137-M145 HydrophobicContact CD1-CE 3.8Å; I137-M145 HydrophobicContact CG2-CE 3.76Å; I137-M145 HydrophobicContact CG2-CG 4.3Å; I137-M145 HydrophobicContact CG2-SD 3.46Å; I137-M145 WeakPolarHBondContact CG2-SD 3.34Å
138	R	94.9	Very high	92.4	Very high	87 Å²	87	36.9 Å²	36.9	33%	0.328	19%	0.193	S	C	.	.	H	α-helix	trans	-56.3	-46.5	179.2	-179.3	178	68.2	-148.2	3.7	111.8	S134 E135 G142 M145	S134-R138 WeakPolarHBondContact O-CB 3.44Å; S134-R138 PolarHBondContact O-N 3.29Å; E135-R138 VanDerWaalsContact CG-NH2 3.28Å; E135-R138 PolarHBondContact O-N 3.06Å; E135-R138 IonicContact OE1-CZ 3.87Å; E135-R138 IonicContact OE1-NH1 3.85Å; E135-R138 IonicContact OE1-NH2 3.06Å; E135-R138 PolarHBondContact OE1-NH2 3.27Å; R138-G142 VanDerWaalsContact O-CA 3.25Å; R138-G142 WeakPolarHBondContact O-CA 3.31Å; R138-G142 PolarHBondContact O-N 2.54Å; R138-M145 HydrophobicContact CB-CB 4.49Å; R138-M145 HydrophobicContact CB-CG 3.84Å
139	E	93.8	Very high	93.7	Very high	116 Å²	116	28.1 Å²	28.1	54%	0.542	15%	0.152	S	C	.	.	H	α-helix	trans	-69.6	-40.4	-179.7	-72.9	176.1	-154.9	0	0	113	K131 E135 I137	K131-E139 WeakPolarHBondContact CE-OE1 3.21Å; K131-E139 WeakPolarHBondContact CE-OE2 3.41Å; K131-E139 IonicContact NZ-OE1 2.87Å; K131-E139 PolarHBondContact NZ-OE1 3.04Å; K131-E139 IonicContact NZ-OE2 3.91Å; K131-E139 PolarHBondContact NZ-OE2 3.02Å; E135-E139 WeakPolarHBondContact O-CB 3.43Å; E135-E139 WeakPolarHBondContact O-CG 3.45Å; E135-E139 PolarHBondContact O-N 2.94Å; I137-E139 VanDerWaalsContact C-N 3.35Å; I137-E139 PolarHBondContact O-N 3.12Å
140	K	95.3	Very high	94.5	Very high	68 Å²	68	28 Å²	28	30%	0.296	15%	0.15	S	C	.	.	H	α-helix	trans	-71.4	-39.4	-179.3	-77.8	-177.7	169.6	-85.7	0	112.5	C103 D104 K107 V136 I137	C103-K140 HydrophobicContact CB-CB 3.88Å; C103-K140 HydrophobicContact CB-CD 3.51Å; C103-K140 HydrophobicContact CB-CG 4.35Å; D104-K140 IonicContact OD1-NZ 2.82Å; D104-K140 PolarHBondContact OD1-NZ 3.07Å; D104-K140 IonicContact OD2-NZ 3.76Å; D104-K140 PolarHBondContact OD2-NZ 2.82Å; K107-K140 WeakPolarHBondContact CD-O 3.44Å; K107-K140 WeakPolarHBondContact CE-O 3.27Å; V136-K140 HydrophobicContact CG1-CD 4.24Å; V136-K140 WeakPolarHBondContact O-CB 3.42Å; V136-K140 WeakPolarHBondContact O-CG 3.35Å; V136-K140 PolarHBondContact O-N 3Å; V136-K140 VanDerWaalsContact O-N 3.12Å; I137-K140 PolarHBondContact O-N 2.91Å
141	L	96.5	Very high	94.9	Very high	18 Å²	18	27.4 Å²	27.4	9%	0.094	15%	0.15	C	C	.	.	H	α-helix	trans	-102.6	-20	-171.2	-59.3	-172.8	0	0	0	114.1	F92 C103 I106 K107 I110 I137 I143	F92-L141 HydrophobicContact CE1-CD1 4.06Å; F92-L141 HydrophobicContact CZ-CD1 3.62Å; C103-L141 HydrophobicContact CB-CD2 4.06Å; C103-L141 HydrophobicContact CB-CG 4.32Å; C103-L141 WeakPolarHBondContact O-CD2 3.2Å; I106-L141 HydrophobicContact CD1-CD1 3.81Å; I106-L141 HydrophobicContact CD1-CD2 4.41Å; I106-L141 HydrophobicContact CG1-CD1 4.17Å; I106-L141 HydrophobicContact CG1-CD2 3.84Å; K107-L141 HydrophobicContact CB-CD2 4.14Å; K107-L141 HydrophobicContact CG-CD2 4.49Å; I110-L141 HydrophobicContact CD1-CB 3.79Å; I110-L141 HydrophobicContact CD1-CD1 4.24Å; I110-L141 HydrophobicContact CD1-CD2 4.22Å; I110-L141 HydrophobicContact CD1-CG 4.31Å; I137-L141 HydrophobicContact CG2-CD1 3.65Å; I137-L141 HydrophobicContact CG2-CG 4.23Å; I137-L141 WeakPolarHBondContact O-CB 3.45Å; I137-L141 PolarHBondContact O-N 3.06Å; L141-I143 VanDerWaalsContact C-N 3.3Å; L141-I143 HydrophobicContact CB-CD1 4.3Å; L141-I143 HydrophobicContact CB-CG1 4.01Å; L141-I143 HydrophobicContact CB-CG2 4.49Å; L141-I143 HydrophobicContact CD1-CD1 4.11Å; L141-I143 PolarHBondContact O-N 2.55Å
142	G	95.6	Very high	94.7	Very high	64 Å²	64	25.8 Å²	25.8	66%	0.66	14%	0.144	S	C	*	.			trans	69.3	24.2	-179.7	0	0	0	0	0	114.5	R138	R138-G142 VanDerWaalsContact O-CA 3.25Å; R138-G142 WeakPolarHBondContact O-CA 3.31Å; R138-G142 PolarHBondContact O-N 2.54Å
143	I	95.5	Very high	94.3	Very high	8 Å²	8	29 Å²	29	4%	0.041	16%	0.161	C	C	.	.			trans	-107.9	159	-177.8	63.7	175.8	0	0	0	112.4	L90 F92 I110 L141 M145	L90-I143 HydrophobicContact CD1-CD1 4.37Å; F92-I143 HydrophobicContact CE2-CD1 4.36Å; F92-I143 HydrophobicContact CZ-CD1 4.46Å; I110-I143 HydrophobicContact CD1-CG2 3.71Å; L141-I143 VanDerWaalsContact C-N 3.3Å; L141-I143 HydrophobicContact CB-CD1 4.3Å; L141-I143 HydrophobicContact CB-CG1 4.01Å; L141-I143 HydrophobicContact CB-CG2 4.49Å; L141-I143 HydrophobicContact CD1-CD1 4.11Å; L141-I143 PolarHBondContact O-N 2.55Å; I143-M145 HydrophobicContact CD1-SD 4.02Å; I143-M145 HydrophobicContact CG1-SD 3.97Å; I143-M145 PolarHBondContact O-N 3.18Å
144	T	95.1	Very high	94.1	Very high	68 Å²	68	29.3 Å²	29.3	42%	0.417	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	129	171.2	-57.9	0	0	0	0	109.8	G116 Y174	G116-T144 PolarHBondContact N-O 3.47Å; T144-Y174 HydrophobicContact CG2-CD2 4.3Å; T144-Y174 HydrophobicContact CG2-CE2 4.31Å
145	M	96.6	Very high	93.8	Very high	24 Å²	24	33.1 Å²	33.1	12%	0.118	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	140.6	179.5	-70.1	-59.5	-58.8	0	0	111.8	F92 G116 S134 I137 R138 I143	F92-M145 HydrophobicContact CD2-CE 4.03Å; F92-M145 HydrophobicContact CE2-CE 4.22Å; F92-M145 HydrophobicContact CE2-SD 4.26Å; G116-M145 CarbonylContact O-C 3.5Å; S134-M145 WeakPolarHBondContact O-CG 3.47Å; I137-M145 HydrophobicContact CB-CE 3.98Å; I137-M145 HydrophobicContact CB-CG 4.43Å; I137-M145 HydrophobicContact CB-SD 4.09Å; I137-M145 HydrophobicContact CD1-CE 3.8Å; I137-M145 HydrophobicContact CG2-CE 3.76Å; I137-M145 HydrophobicContact CG2-CG 4.3Å; I137-M145 HydrophobicContact CG2-SD 3.46Å; I137-M145 WeakPolarHBondContact CG2-SD 3.34Å; R138-M145 HydrophobicContact CB-CB 4.49Å; R138-M145 HydrophobicContact CB-CG 3.84Å; I143-M145 HydrophobicContact CD1-SD 4.02Å; I143-M145 HydrophobicContact CG1-SD 3.97Å; I143-M145 PolarHBondContact O-N 3.18Å
146	T	97.8	Very high	93.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	170	170.6	62.3	0	0	0	0	108.7	G116 M117 S118 G168 C169 L178	G116-T146 PolarHBondContact O-N 3.05Å; G116-T146 PolarHBondContact O-OG1 3.12Å; M117-T146 CarbonylContact C-O 3.57Å; M117-T146 VanDerWaalsContact CA-O 3.3Å; M117-T146 WeakPolarHBondContact CA-O 3.47Å; M117-T146 WeakPolarHBondContact CA-OG1 3.45Å; M117-T146 VanDerWaalsContact CB-OG1 3.28Å; M117-T146 WeakPolarHBondContact CB-OG1 3.43Å; M117-T146 WeakPolarHBondContact CG-OG1 3.48Å; S118-T146 PolarHBondContact N-O 3Å; T146-G168 WeakPolarHBondContact CA-O 3.49Å; T146-G168 WeakPolarHBondContact CB-O 3.48Å; T146-C169 HydrophobicContact CG2-CB 3.81Å; T146-C169 VanDerWaalsContact CG2-SG 3.54Å; T146-L178 HydrophobicContact CG2-CD1 3.7Å; T146-L178 WeakPolarHBondContact OG1-CD1 3.27Å
147	V	97.9	Very high	93.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	153.2	179.9	-61.7	0	0	0	0	111.4	S118 M149 I167 G168 A195 V198 E199	S118-V147 CarbonylContact O-C 3.58Å; S118-V147 VanDerWaalsContact O-CA 3.29Å; S118-V147 WeakPolarHBondContact O-CA 3.26Å; V147-M149 HydrophobicContact CB-CE 4.43Å; V147-I167 CarbonylContact O-C 3.59Å; V147-I167 VanDerWaalsContact O-CA 3.25Å; V147-I167 WeakPolarHBondContact O-CA 3.13Å; V147-G168 PolarHBondContact N-O 3.28Å; V147-G168 PolarHBondContact O-N 2.71Å; V147-A195 HydrophobicContact CG2-CB 4.26Å; V147-A195 WeakPolarHBondContact CG2-O 3.3Å; V147-V198 HydrophobicContact CG2-CB 3.88Å; V147-V198 HydrophobicContact CG2-CG1 3.71Å; V147-E199 HydrophobicContact CB-CB 4.47Å; V147-E199 HydrophobicContact CG1-CB 4.08Å; V147-E199 HydrophobicContact CG1-CG 4.17Å; V147-E199 HydrophobicContact CG2-CB 4.29Å
148	L	98.2	Very high	93.9	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	115.8	169.7	-178.1	161.5	0	0	0	109.5	W15 M117 S118 L119 T165 T166 I167 M182 F187	W15-L148 HydrophobicContact CZ2-CD2 4.44Å; M117-L148 HydrophobicContact CG-CB 4.31Å; M117-L148 HydrophobicContact SD-CB 3.94Å; M117-L148 HydrophobicContact SD-CD1 4.3Å; S118-L148 PolarHBondContact O-N 2.86Å; L119-L148 HydrophobicContact CD1-CB 3.8Å; L119-L148 HydrophobicContact CD2-CD2 4.49Å; L119-L148 HydrophobicContact CG-CB 3.98Å; L119-L148 HydrophobicContact CG-CD2 4.19Å; L148-T165 HydrophobicContact CD1-CG2 4.05Å; L148-T165 HydrophobicContact CD2-CG2 4.14Å; L148-T165 WeakPolarHBondContact CD2-OG1 3.49Å; L148-T165 HydrophobicContact CG-CG2 4Å; L148-T166 WeakPolarHBondContact CA-O 3.39Å; L148-I167 HydrophobicContact CB-CG1 4.2Å; L148-I167 HydrophobicContact CD1-CD1 4.27Å; L148-I167 HydrophobicContact CD1-CG1 3.99Å; L148-I167 HydrophobicContact CG-CG1 4.1Å; L148-M182 HydrophobicContact CD1-CB 4.33Å; L148-M182 HydrophobicContact CD1-CE 3.44Å; L148-M182 VanDerWaalsContact CD1-CE 3.44Å; L148-M182 HydrophobicContact CD1-CG 4.05Å; L148-F187 HydrophobicContact CD1-CE1 4.36Å; L148-F187 HydrophobicContact CD2-CZ 4.33Å
149	M	96.9	Very high	94	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	148.1	178.3	-56.3	-57.8	174.3	0	0	110.1	I120 K121 V147 T165 T166 V198 E199 C258	I120-M149 WeakPolarHBondContact O-CE 3.46Å; K121-M149 HydrophobicContact CG-SD 3.73Å; V147-M149 HydrophobicContact CB-CE 4.43Å; M149-T165 PolarHBondContact O-OG1 2.87Å; M149-T166 PolarHBondContact N-O 3.2Å; M149-T166 WeakPolarHBondContact O-CA 3.38Å; M149-T166 PolarHBondContact O-N 2.83Å; M149-T166 VanDerWaalsContact O-O 3.05Å; M149-V198 HydrophobicContact CB-CG1 3.78Å; M149-V198 HydrophobicContact CG-CG1 3.91Å; M149-V198 VanDerWaalsContact CG-O 3.28Å; M149-V198 WeakPolarHBondContact CG-O 3.25Å; M149-E199 HydrophobicContact CE-CB 4.44Å; M149-E199 HydrophobicContact CE-CG 3.89Å; M149-C258 HydrophobicContact CB-CB 3.69Å
150	G	94.6	Very high	94.2	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.5	171.9	-176.4	0	0	0	0	0	113.5	K121 N152 S257 D262	K121-G150 PolarHBondContact NZ-O 2.99Å; G150-N152 VanDerWaalsContact C-OD1 3.32Å; G150-N152 PolarHBondContact O-N 2.74Å; G150-S257 WeakPolarHBondContact CA-OG 3.31Å; G150-D262 VanDerWaalsContact O-CG 3.32Å
151	A	91.5	Very high	94.3	Very high	19 Å²	19	37.7 Å²	37.7	16%	0.157	21%	0.211	C	C	.	.	S	Bend	trans	-72.1	64.8	177.7	0	0	0	0	0	112.2	S257 A261 D262 T265	A151-S257 PolarHBondContact N-OG 3.27Å; A151-S257 VanDerWaalsContact N-OG 3.15Å; A151-A261 HydrophobicContact CB-CB 3.93Å; A151-D262 HydrophobicContact CB-CB 4.46Å; A151-T265 HydrophobicContact CB-CG2 3.78Å
152	N	84.4	Confident	94.3	Very high	16 Å²	16	43.6 Å²	43.6	9%	0.086	24%	0.236	C	C	.	.			trans	-121.4	83	-162.6	-47.5	-22.4	0	0	0	111.2	W15 G150 A154 V157 E164 T165 F187	W15-N152 HydrophobicContact CH2-CB 3.42Å; W15-N152 VanDerWaalsContact CH2-CB 3.42Å; W15-N152 HydrophobicContact CZ2-CB 3.83Å; W15-N152 HydrophobicContact CZ3-CB 4.07Å; G150-N152 VanDerWaalsContact C-OD1 3.32Å; G150-N152 PolarHBondContact O-N 2.74Å; N152-A154 PolarHBondContact O-N 3.18Å; N152-V157 HydrophobicContact CB-CG2 4.18Å; N152-E164 PolarHBondContact OD1-O 3.45Å; N152-T165 WeakPolarHBondContact ND2-CB 3.36Å; N152-T165 PolarHBondContact ND2-OG1 3.42Å; N152-F187 HydrophobicContact CB-CE2 4.27Å
153	L	86.1	Confident	94.4	Very high	71 Å²	71	41.3 Å²	41.3	37%	0.372	21%	0.21	S	C	.	.			trans	-70.6	120.1	171.9	-67.6	178.6	0	0	0	109.3	N155 E156 V157	L153-N155 VanDerWaalsContact C-N 3.31Å; L153-N155 PolarHBondContact O-N 3.12Å; L153-E156 HydrophobicContact CB-CB 4.31Å; L153-E156 HydrophobicContact CB-CG 4.11Å; L153-E156 PolarHBondContact O-N 2.8Å; L153-V157 WeakPolarHBondContact O-CG2 3.02Å; L153-V157 PolarHBondContact O-N 3.37Å
154	A	87.8	Confident	94.5	Very high	10 Å²	10	45.1 Å²	45.1	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-54.1	-41.9	-170.7	0	0	0	0	0	114.5	N14 W15 A18 N152 V157 A158	N14-A154 WeakPolarHBondContact OD1-CB 3.2Å; W15-A154 HydrophobicContact CB-CB 4.38Å; W15-A154 HydrophobicContact CE3-CB 3.59Å; W15-A154 HydrophobicContact CZ3-CB 4.33Å; A18-A154 HydrophobicContact CB-CB 4.23Å; N152-A154 PolarHBondContact O-N 3.18Å; A154-V157 PolarHBondContact O-N 3.31Å; A154-A158 VanDerWaalsContact O-CB 3.31Å; A154-A158 WeakPolarHBondContact O-CB 3.31Å; A154-A158 PolarHBondContact O-N 3.05Å
155	N	89.2	Confident	94.6	Very high	85 Å²	85	41.9 Å²	41.9	46%	0.455	21%	0.208	S	C	.	.	H	α-helix	trans	-66.9	-38.7	178.5	-64.8	-15.3	0	0	0	111.6	N14 L153 A158 D159	N14-N155 PolarHBondContact ND2-OD1 2.93Å; L153-N155 VanDerWaalsContact C-N 3.31Å; L153-N155 PolarHBondContact O-N 3.12Å; N155-A158 PolarHBondContact O-N 3.34Å; N155-D159 WeakPolarHBondContact O-CB 3.37Å; N155-D159 PolarHBondContact O-N 3.33Å
156	E	92.9	Very high	94.7	Very high	81 Å²	81	40.8 Å²	40.8	38%	0.379	20%	0.202	S	C	.	.	H	α-helix	trans	-68.7	-37.8	177.3	-62.9	-171	159	0	0	111.9	L153 A158 D159 E160 K161	L153-E156 HydrophobicContact CB-CB 4.31Å; L153-E156 HydrophobicContact CB-CG 4.11Å; L153-E156 PolarHBondContact O-N 2.8Å; E156-A158 VanDerWaalsContact C-N 3.34Å; E156-D159 WeakPolarHBondContact O-CB 3.15Å; E156-D159 PolarHBondContact O-N 2.97Å; E156-E160 PolarHBondContact O-N 3.49Å; E156-K161 HydrophobicContact CB-CB 4.28Å; E156-K161 HydrophobicContact CB-CD 3.99Å; E156-K161 HydrophobicContact CG-CD 4.04Å; E156-K161 WeakPolarHBondContact O-CB 3.4Å; E156-K161 PolarHBondContact O-N 3.18Å
157	V	95.6	Very high	94.8	Very high	10 Å²	10	40.7 Å²	40.7	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-41	172.6	176.4	0	0	0	0	110.7	W15 I22 N152 L153 A154 D159 E160 F187	W15-V157 HydrophobicContact CH2-CB 4.39Å; W15-V157 HydrophobicContact CH2-CG1 4.23Å; W15-V157 HydrophobicContact CH2-CG2 3.94Å; W15-V157 HydrophobicContact CZ3-CB 3.84Å; W15-V157 HydrophobicContact CZ3-CG1 3.96Å; W15-V157 HydrophobicContact CZ3-CG2 3.7Å; I22-V157 HydrophobicContact CD1-CG1 3.62Å; N152-V157 HydrophobicContact CB-CG2 4.18Å; L153-V157 WeakPolarHBondContact O-CG2 3.02Å; L153-V157 PolarHBondContact O-N 3.37Å; A154-V157 PolarHBondContact O-N 3.31Å; V157-D159 VanDerWaalsContact C-N 3.33Å; V157-E160 PolarHBondContact O-N 2.94Å; V157-F187 HydrophobicContact CG1-CD2 4.06Å; V157-F187 HydrophobicContact CG1-CE2 4.36Å; V157-F187 HydrophobicContact CG2-CD2 4.16Å; V157-F187 HydrophobicContact CG2-CE2 4.16Å
158	A	95.6	Very high	94.7	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.017	20%	0.202	C	C	.	.	H	α-helix	trans	-69.7	-28.4	176.8	0	0	0	0	0	113.5	A18 K21 L65 H68 A154 N155 E156 E160	A18-A158 HydrophobicContact CB-CB 4.27Å; K21-A158 HydrophobicContact CD-CB 4.37Å; K21-A158 PolarHBondContact NZ-O 2.86Å; L65-A158 HydrophobicContact CD1-CB 3.84Å; L65-A158 HydrophobicContact CD2-CB 3.93Å; L65-A158 HydrophobicContact CG-CB 4.32Å; H68-A158 PolarHBondContact ND1-O 2.83Å; A154-A158 VanDerWaalsContact O-CB 3.31Å; A154-A158 WeakPolarHBondContact O-CB 3.31Å; A154-A158 PolarHBondContact O-N 3.05Å; N155-A158 PolarHBondContact O-N 3.34Å; E156-A158 VanDerWaalsContact C-N 3.34Å; A158-E160 PolarHBondContact O-N 3.5Å
159	D	97.1	Very high	94.6	Very high	79 Å²	79	40.9 Å²	40.9	42%	0.422	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-2.8	168.9	-73.8	-25.8	0	0	0	112.9	H68 N155 E156 V157 K161	H68-D159 IonicContact CE1-OD1 2.73Å; H68-D159 PolarHBondContact CE1-OD1 3.42Å; H68-D159 IonicContact NE2-OD1 3.08Å; N155-D159 WeakPolarHBondContact O-CB 3.37Å; N155-D159 PolarHBondContact O-N 3.33Å; E156-D159 WeakPolarHBondContact O-CB 3.15Å; E156-D159 PolarHBondContact O-N 2.97Å; V157-D159 VanDerWaalsContact C-N 3.33Å; D159-K161 HydrophobicContact CB-CD 4.15Å; D159-K161 HydrophobicContact CB-CG 3.98Å; D159-K161 PolarHBondContact O-N 2.93Å; D159-K161 WeakPolarHBondContact OD2-CE 3.42Å; D159-K161 IonicContact OD2-NZ 3.96Å; D159-K161 PolarHBondContact OD2-NZ 2.94Å
160	E	97.2	Very high	94.3	Very high	130 Å²	130	48.4 Å²	48.4	61%	0.607	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	29.7	-174.1	-56	177.5	-158.5	0	0	113.1	E156 V157 A158 N186	E156-E160 PolarHBondContact O-N 3.49Å; V157-E160 PolarHBondContact O-N 2.94Å; A158-E160 PolarHBondContact O-N 3.5Å; E160-N186 VanDerWaalsContact O-CB 3.25Å; E160-N186 WeakPolarHBondContact O-CB 3.36Å; E160-N186 VanDerWaalsContact O-CG 3.27Å; E160-N186 PolarHBondContact O-ND2 3.15Å
161	K	97.5	Very high	94	Very high	102 Å²	102	51.4 Å²	51.4	44%	0.443	25%	0.252	S	S	.	.			trans	-70.4	146	171.7	-68.7	170.7	179.9	147.7	0	110	E156 D159 C163	E156-K161 HydrophobicContact CB-CB 4.28Å; E156-K161 HydrophobicContact CB-CD 3.99Å; E156-K161 HydrophobicContact CG-CD 4.04Å; E156-K161 WeakPolarHBondContact O-CB 3.4Å; E156-K161 PolarHBondContact O-N 3.18Å; D159-K161 HydrophobicContact CB-CD 4.15Å; D159-K161 HydrophobicContact CB-CG 3.98Å; D159-K161 PolarHBondContact O-N 2.93Å; D159-K161 WeakPolarHBondContact OD2-CE 3.42Å; D159-K161 IonicContact OD2-NZ 3.96Å; D159-K161 PolarHBondContact OD2-NZ 2.94Å; K161-C163 PolarHBondContact O-N 3.16Å
162	F	97.6	Very high	93.8	Very high	142 Å²	142	58.3 Å²	58.3	62%	0.623	28%	0.279	S	S	*	.			trans	-62	127.5	179.3	178.6	-92.4	0	0	0	111.2	N186 R188	F162-N186 CarbonylContact C-O 3.51Å; F162-N186 WeakPolarHBondContact CA-O 3.31Å; F162-R188 HydrophobicContact CE2-CG 3.65Å; F162-R188 HydrophobicContact CZ-CG 4.17Å
163	C	96.9	Very high	94	Very high	17 Å²	17	62.8 Å²	62.8	12%	0.115	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	175.6	172.6	59.2	0	0	0	0	110.3	K161 N186 F187 R188	K161-C163 PolarHBondContact O-N 3.16Å; C163-N186 PolarHBondContact N-O 3.28Å; C163-N186 VanDerWaalsContact O-O 3.06Å; C163-F187 VanDerWaalsContact SG-CD2 3.57Å; C163-R188 PolarHBondContact O-N 3.39Å
164	E	97.6	Very high	94.4	Very high	87 Å²	87	62.4 Å²	62.4	41%	0.407	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	152.8	-176.1	53	177	-121.5	0	0	111.3	N152 R188 S257	N152-E164 PolarHBondContact OD1-O 3.45Å; E164-R188 CarbonylContact C-O 3.27Å; E164-R188 WeakPolarHBondContact CA-O 3.04Å; E164-R188 HydrophobicContact CB-CB 4.23Å; E164-S257 WeakPolarHBondContact O-CB 3.45Å; E164-S257 PolarHBondContact O-OG 2.96Å
165	T	98.3	Very high	94.8	Very high	1 Å²	1	62 Å²	62	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	162.8	179.9	-161.9	0	0	0	0	111.4	L148 M149 N152 F187 R188 V189 T190	L148-T165 HydrophobicContact CD1-CG2 4.05Å; L148-T165 HydrophobicContact CD2-CG2 4.14Å; L148-T165 WeakPolarHBondContact CD2-OG1 3.49Å; L148-T165 HydrophobicContact CG-CG2 4Å; M149-T165 PolarHBondContact O-OG1 2.87Å; N152-T165 WeakPolarHBondContact ND2-CB 3.36Å; N152-T165 PolarHBondContact ND2-OG1 3.42Å; T165-F187 HydrophobicContact CG2-CD1 4.23Å; T165-F187 HydrophobicContact CG2-CE1 3.38Å; T165-F187 HydrophobicContact CG2-CE2 4.27Å; T165-F187 HydrophobicContact CG2-CZ 3.4Å; T165-R188 PolarHBondContact N-O 3.24Å; T165-V189 HydrophobicContact CG2-CB 4.4Å; T165-V189 HydrophobicContact CG2-CG1 4.46Å; T165-V189 HydrophobicContact CG2-CG2 3.79Å; T165-V189 WeakPolarHBondContact O-CA 3.35Å; T165-T190 PolarHBondContact O-N 2.79Å
166	T	98.6	Very high	95.2	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.4	176	-47.7	0	0	0	0	110.3	L148 M149 T190 V192 V198 E256 S257 C258	L148-T166 WeakPolarHBondContact CA-O 3.39Å; M149-T166 PolarHBondContact N-O 3.2Å; M149-T166 WeakPolarHBondContact O-CA 3.38Å; M149-T166 PolarHBondContact O-N 2.83Å; M149-T166 VanDerWaalsContact O-O 3.05Å; T166-T190 CarbonylContact C-O 3.57Å; T166-T190 WeakPolarHBondContact CA-O 3.44Å; T166-V192 HydrophobicContact CG2-CB 4.48Å; T166-V192 HydrophobicContact CG2-CG1 4.04Å; T166-V192 HydrophobicContact CG2-CG2 3.64Å; T166-V198 HydrophobicContact CG2-CG1 4.28Å; T166-V198 HydrophobicContact CG2-CG2 3.85Å; T166-E256 HydrophobicContact CG2-CB 4.14Å; T166-E256 HydrophobicContact CG2-CG 4.48Å; T166-E256 WeakPolarHBondContact OG1-CB 3.47Å; T166-S257 PolarHBondContact OG1-N 3.02Å; T166-C258 PolarHBondContact OG1-N 3.09Å
167	I	98.5	Very high	95.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124	167.4	-69	-179.8	0	0	0	108.6	M117 V147 L148 C169 L178 M182 V189 T190 V191 V192	M117-I167 HydrophobicContact SD-CD1 4.15Å; M117-I167 HydrophobicContact SD-CG1 4.4Å; V147-I167 CarbonylContact O-C 3.59Å; V147-I167 VanDerWaalsContact O-CA 3.25Å; V147-I167 WeakPolarHBondContact O-CA 3.13Å; L148-I167 HydrophobicContact CB-CG1 4.2Å; L148-I167 HydrophobicContact CD1-CD1 4.27Å; L148-I167 HydrophobicContact CD1-CG1 3.99Å; L148-I167 HydrophobicContact CG-CG1 4.1Å; I167-C169 HydrophobicContact CG2-CB 4.04Å; I167-L178 HydrophobicContact CD1-CB 4.08Å; I167-M182 HydrophobicContact CD1-CB 4.43Å; I167-M182 HydrophobicContact CD1-CG 4.27Å; I167-V189 HydrophobicContact CB-CG1 4.32Å; I167-V189 HydrophobicContact CD1-CG1 3.54Å; I167-V189 HydrophobicContact CG1-CG1 3.73Å; I167-T190 PolarHBondContact N-O 3.16Å; I167-V191 HydrophobicContact CB-CG2 4.29Å; I167-V191 HydrophobicContact CG2-CG1 4.48Å; I167-V191 CarbonylContact O-C 3.48Å; I167-V191 WeakPolarHBondContact O-CA 3.44Å; I167-V192 PolarHBondContact O-N 3.32Å
168	G	97.4	Very high	95.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.7	169.5	0	0	0	0	0	110.3	T146 V147 V192	T146-G168 WeakPolarHBondContact CA-O 3.49Å; T146-G168 WeakPolarHBondContact CB-O 3.48Å; V147-G168 PolarHBondContact N-O 3.28Å; V147-G168 PolarHBondContact O-N 2.71Å; G168-V192 WeakPolarHBondContact CA-O 3.49Å
169	C	96.2	Very high	95.6	Very high	5 Å²	5	62 Å²	62	3%	0.034	30%	0.299	C	S	.	.			trans	-148.6	112.9	-178.8	-178.6	0	0	0	0	110.9	T146 I167 D171 G175 V191 V192	T146-C169 HydrophobicContact CG2-CB 3.81Å; T146-C169 VanDerWaalsContact CG2-SG 3.54Å; I167-C169 HydrophobicContact CG2-CB 4.04Å; C169-D171 VanDerWaalsContact C-N 3.31Å; C169-D171 PolarHBondContact O-N 3.05Å; C169-D171 PolarHBondContact SG-O 2.83Å; C169-G175 PolarHBondContact SG-N 2.98Å; C169-V191 HydrophobicContact CB-CG1 4.24Å; C169-V192 PolarHBondContact N-O 2.64Å
170	K	89.3	Confident	95.6	Very high	159 Å²	159	61.3 Å²	61.3	69%	0.691	29%	0.294	S	S	*	.	S	Bend	trans	-69.7	-28.6	176.5	-172.9	175.8	-178	175.7	0	113
171	D	88.9	Confident	95.7	Very high	63 Å²	63	55.1 Å²	55.1	34%	0.337	27%	0.265	S	S	.	.			trans	-81.1	121.9	-177.5	-166	-53.4	0	0	0	111.2	C169 V173 Y174 G175	C169-D171 VanDerWaalsContact C-N 3.31Å; C169-D171 PolarHBondContact O-N 3.05Å; C169-D171 PolarHBondContact SG-O 2.83Å; D171-V173 PolarHBondContact O-N 3.16Å; D171-V173 WeakPolarHBondContact OD1-CA 3.4Å; D171-V173 VanDerWaalsContact OD1-CB 3.23Å; D171-V173 WeakPolarHBondContact OD1-CB 3.2Å; D171-V173 PolarHBondContact OD1-N 3.28Å; D171-Y174 HydrophobicContact CB-CD2 3.58Å; D171-Y174 HydrophobicContact CB-CE2 4.37Å; D171-Y174 HydrophobicContact CB-CG 4.27Å; D171-Y174 VanDerWaalsContact CG-CD2 3.47Å; D171-Y174 PolarHBondContact O-N 2.83Å; D171-Y174 PolarHBondContact OD1-N 3.35Å; D171-G175 PolarHBondContact O-N 2.97Å; D171-G175 VanDerWaalsContact O-N 3.1Å
172	K	87.4	Confident	95.7	Very high	164 Å²	164	50.2 Å²	50.2	71%	0.713	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-16	-178.3	-65.2	-171.1	175.4	-176	0	113.7	P176 E193	K172-P176 WeakPolarHBondContact O-CD 3.2Å; K172-P176 WeakPolarHBondContact O-CG 3.37Å; K172-E193 VanDerWaalsContact CE-OE1 3.25Å; K172-E193 WeakPolarHBondContact CE-OE1 3.32Å; K172-E193 IonicContact NZ-OE1 2.65Å
173	V	89.3	Confident	95.8	Very high	110 Å²	110	45.5 Å²	45.5	67%	0.667	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-45.3	175.1	-176.9	0	0	0	0	110.2	D171	D171-V173 PolarHBondContact O-N 3.16Å; D171-V173 WeakPolarHBondContact OD1-CA 3.4Å; D171-V173 VanDerWaalsContact OD1-CB 3.23Å; D171-V173 WeakPolarHBondContact OD1-CB 3.2Å; D171-V173 PolarHBondContact OD1-N 3.28Å
174	Y	94.6	Very high	95.8	Very high	64 Å²	64	46.7 Å²	46.7	25%	0.251	23%	0.23	S	C	.	.	H	α-helix	trans	-76	-31.6	-176.9	-61.2	-46.1	0	0	0	113.6	I115 T144 D171 L177 L178	I115-Y174 HydrophobicContact CD1-CD1 3.72Å; I115-Y174 HydrophobicContact CD1-CE1 4.25Å; I115-Y174 HydrophobicContact CD1-CG 4.03Å; I115-Y174 HydrophobicContact CG2-CD1 3.97Å; I115-Y174 HydrophobicContact CG2-CD2 3.9Å; I115-Y174 HydrophobicContact CG2-CE1 3.63Å; I115-Y174 HydrophobicContact CG2-CE2 3.56Å; I115-Y174 HydrophobicContact CG2-CG 4.11Å; I115-Y174 VanDerWaalsContact CG2-CZ 3.42Å; T144-Y174 HydrophobicContact CG2-CD2 4.3Å; T144-Y174 HydrophobicContact CG2-CE2 4.31Å; D171-Y174 HydrophobicContact CB-CD2 3.58Å; D171-Y174 HydrophobicContact CB-CE2 4.37Å; D171-Y174 HydrophobicContact CB-CG 4.27Å; D171-Y174 VanDerWaalsContact CG-CD2 3.47Å; D171-Y174 PolarHBondContact O-N 2.83Å; D171-Y174 PolarHBondContact OD1-N 3.35Å; Y174-L177 HydrophobicContact CD1-CD2 4.45Å; Y174-L177 PolarHBondContact O-N 3.32Å; Y174-L178 WeakPolarHBondContact O-CB 3.42Å; Y174-L178 WeakPolarHBondContact O-CG 3.33Å; Y174-L178 PolarHBondContact O-N 3.15Å
175	G	96.1	Very high	95.8	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-53.6	-56.1	178.8	0	0	0	0	0	113.7	C169 D171 L177 L178 K179	C169-G175 PolarHBondContact SG-N 2.98Å; D171-G175 PolarHBondContact O-N 2.97Å; D171-G175 VanDerWaalsContact O-N 3.1Å; G175-L177 VanDerWaalsContact C-N 3.35Å; G175-L177 PolarHBondContact O-N 2.88Å; G175-L178 PolarHBondContact O-N 3Å; G175-K179 WeakPolarHBondContact O-CB 3.35Å; G175-K179 PolarHBondContact O-N 3.4Å
176	P	96.3	Very high	95.8	Very high	73 Å²	73	51.7 Å²	51.7	47%	0.474	26%	0.259	S	S	.	.	H	α-helix	trans	-60.4	-39.3	175.8	-26	35.6	0	0	0	113.7	K172 K179 E180	K172-P176 WeakPolarHBondContact O-CD 3.2Å; K172-P176 WeakPolarHBondContact O-CG 3.37Å; P176-K179 PolarHBondContact O-N 3.19Å; P176-E180 PolarHBondContact O-N 3.15Å
177	L	96.9	Very high	95.8	Very high	33 Å²	33	51.8 Å²	51.8	17%	0.173	26%	0.26	C	S	.	.	H	α-helix	trans	-61.8	-49.7	177.9	-178.7	70.3	0	0	0	111.4	K32 F33 I89 I115 Y174 G175 K179 E180 L181	K32-L177 HydrophobicContact CD-CD1 3.93Å; F33-L177 HydrophobicContact CE1-CD1 3.67Å; F33-L177 HydrophobicContact CE1-CG 4.12Å; F33-L177 HydrophobicContact CZ-CD1 3.75Å; F33-L177 HydrophobicContact CZ-CG 4.31Å; I89-L177 HydrophobicContact CD1-CD2 4.13Å; I89-L177 HydrophobicContact CD1-CG 4.5Å; I115-L177 HydrophobicContact CD1-CD2 4.46Å; Y174-L177 HydrophobicContact CD1-CD2 4.45Å; Y174-L177 PolarHBondContact O-N 3.32Å; G175-L177 VanDerWaalsContact C-N 3.35Å; G175-L177 PolarHBondContact O-N 2.88Å; L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 3.09Å; L177-E180 PolarHBondContact O-N 2.98Å; L177-L181 PolarHBondContact O-N 2.79Å
178	L	98.1	Very high	95.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.8	-34.8	179.1	-66.9	171.3	0	0	0	111.6	I89 I115 M117 T146 I167 Y174 G175 L181 M182	I89-L178 HydrophobicContact CG2-CD2 3.99Å; I115-L178 HydrophobicContact CD1-CD1 4.45Å; I115-L178 HydrophobicContact CD1-CD2 3.98Å; I115-L178 HydrophobicContact CD1-CG 4.28Å; M117-L178 HydrophobicContact CE-CD2 4.19Å; M117-L178 HydrophobicContact SD-CD1 4.39Å; M117-L178 HydrophobicContact SD-CD2 4.38Å; T146-L178 HydrophobicContact CG2-CD1 3.7Å; T146-L178 WeakPolarHBondContact OG1-CD1 3.27Å; I167-L178 HydrophobicContact CD1-CB 4.08Å; Y174-L178 WeakPolarHBondContact O-CB 3.42Å; Y174-L178 WeakPolarHBondContact O-CG 3.33Å; Y174-L178 PolarHBondContact O-N 3.15Å; G175-L178 PolarHBondContact O-N 3Å; L178-L181 PolarHBondContact O-N 2.97Å; L178-M182 WeakPolarHBondContact O-CB 3.21Å; L178-M182 VanDerWaalsContact O-CG 3.29Å; L178-M182 WeakPolarHBondContact O-CG 3.47Å; L178-M182 PolarHBondContact O-N 3.26Å
179	K	98.2	Very high	95.8	Very high	71 Å²	71	56.5 Å²	56.5	31%	0.309	28%	0.278	S	S	.	.	H	α-helix	trans	-59.8	-45.6	172	174.6	166.5	-179.1	154.4	0	111.7	G175 P176 L177 L181 M182 Q183 V189 V191	G175-K179 WeakPolarHBondContact O-CB 3.35Å; G175-K179 PolarHBondContact O-N 3.4Å; P176-K179 PolarHBondContact O-N 3.19Å; L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 3.09Å; K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 2.65Å; K179-M182 PolarHBondContact O-N 2.85Å; K179-Q183 HydrophobicContact CG-CB 4.41Å; K179-Q183 WeakPolarHBondContact O-CB 3.3Å; K179-Q183 PolarHBondContact O-N 3.29Å; K179-V189 HydrophobicContact CB-CG1 4.25Å; K179-V189 VanDerWaalsContact CE-O 3.23Å; K179-V189 WeakPolarHBondContact CE-O 3.41Å; K179-V189 HydrophobicContact CG-CB 4.13Å; K179-V189 HydrophobicContact CG-CG1 4.12Å; K179-V189 PolarHBondContact NZ-O 2.69Å; K179-V191 HydrophobicContact CB-CG2 3.88Å; K179-V191 HydrophobicContact CD-CG2 4.1Å
180	E	97.4	Very high	95.9	Very high	65 Å²	65	59.1 Å²	59.1	30%	0.304	29%	0.294	S	S	.	.	H	α-helix	trans	-65.3	-36.2	176.7	-74.4	-176.6	-148.7	0	0	112.8	N26 K32 F33 P176 L177 M182	N26-E180 PolarHBondContact ND2-O 3.28Å; K32-E180 VanDerWaalsContact CD-OE2 3.25Å; K32-E180 WeakPolarHBondContact CD-OE2 3.37Å; K32-E180 WeakPolarHBondContact CE-OE2 3.48Å; K32-E180 IonicContact NZ-OE1 3.52Å; K32-E180 PolarHBondContact NZ-OE1 2.95Å; K32-E180 IonicContact NZ-OE2 2.85Å; K32-E180 PolarHBondContact NZ-OE2 3.21Å; F33-E180 HydrophobicContact CE2-CB 4.43Å; P176-E180 PolarHBondContact O-N 3.15Å; L177-E180 PolarHBondContact O-N 2.98Å; E180-M182 VanDerWaalsContact C-N 3.32Å; E180-M182 PolarHBondContact O-N 2.97Å
181	L	98.5	Very high	96.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.8	-37.5	176.4	-174.9	60.4	0	0	0	112.3	V7 I23 N26 F33 I89 I91 L177 L178 K179	V7-L181 HydrophobicContact CG1-CD2 4.08Å; V7-L181 HydrophobicContact CG2-CD1 4.04Å; V7-L181 HydrophobicContact CG2-CD2 4.15Å; I23-L181 HydrophobicContact CG1-CG 4.42Å; I23-L181 HydrophobicContact CG2-CD1 4.09Å; N26-L181 WeakPolarHBondContact CB-O 3.28Å; N26-L181 PolarHBondContact ND2-O 3.38Å; F33-L181 HydrophobicContact CD1-CD1 4.02Å; F33-L181 HydrophobicContact CD2-CD1 4.13Å; F33-L181 HydrophobicContact CE1-CB 4.11Å; F33-L181 HydrophobicContact CE1-CD1 4Å; F33-L181 HydrophobicContact CE1-CG 4.45Å; F33-L181 HydrophobicContact CE2-CB 4.2Å; F33-L181 HydrophobicContact CE2-CD1 4.12Å; F33-L181 HydrophobicContact CG-CD1 4.1Å; F33-L181 HydrophobicContact CZ-CB 3.71Å; F33-L181 HydrophobicContact CZ-CD1 4.07Å; F33-L181 HydrophobicContact CZ-CG 4.43Å; I89-L181 HydrophobicContact CD1-CD2 4.08Å; I89-L181 HydrophobicContact CG2-CD2 4.09Å; I91-L181 HydrophobicContact CD1-CD2 4.47Å; L177-L181 PolarHBondContact O-N 2.79Å; L178-L181 PolarHBondContact O-N 2.97Å; K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 2.65Å
182	M	98.4	Very high	96.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-100.6	-27.8	-171.2	-60.1	-57.1	-84.3	0	0	114.1	I19 I22 I23 M117 L119 L148 I167 L178 K179 E180 F187 V189	I19-M182 HydrophobicContact CD1-CE 3.84Å; I19-M182 HydrophobicContact CG2-CE 3.83Å; I22-M182 WeakPolarHBondContact CG2-O 3.43Å; I23-M182 HydrophobicContact CD1-CE 4.43Å; I23-M182 HydrophobicContact CD1-SD 3.83Å; I23-M182 HydrophobicContact CG1-SD 3.65Å; M117-M182 HydrophobicContact CE-CE 3.94Å; M117-M182 HydrophobicContact CE-CG 3.72Å; M117-M182 HydrophobicContact CE-SD 3.75Å; L119-M182 HydrophobicContact CD2-CE 4.24Å; L148-M182 HydrophobicContact CD1-CB 4.33Å; L148-M182 HydrophobicContact CD1-CE 3.44Å; L148-M182 VanDerWaalsContact CD1-CE 3.44Å; L148-M182 HydrophobicContact CD1-CG 4.05Å; I167-M182 HydrophobicContact CD1-CB 4.43Å; I167-M182 HydrophobicContact CD1-CG 4.27Å; L178-M182 WeakPolarHBondContact O-CB 3.21Å; L178-M182 VanDerWaalsContact O-CG 3.29Å; L178-M182 WeakPolarHBondContact O-CG 3.47Å; L178-M182 PolarHBondContact O-N 3.26Å; K179-M182 PolarHBondContact O-N 2.85Å; E180-M182 VanDerWaalsContact C-N 3.32Å; E180-M182 PolarHBondContact O-N 2.97Å; M182-F187 HydrophobicContact CB-CE1 4.47Å; M182-F187 VanDerWaalsContact O-CD1 3.25Å; M182-F187 WeakPolarHBondContact O-CD1 3.47Å; M182-V189 HydrophobicContact CB-CG2 4.13Å
183	Q	98.5	Very high	97.1	Very high	42 Å²	42	48.2 Å²	48.2	20%	0.196	25%	0.25	C	S	.	.			trans	-75.2	136.9	-171.1	-174.3	173.7	-101.8	0	0	112	N26 K179 F187 V189	N26-Q183 PolarHBondContact ND2-O 3.48Å; K179-Q183 HydrophobicContact CG-CB 4.41Å; K179-Q183 WeakPolarHBondContact O-CB 3.3Å; K179-Q183 PolarHBondContact O-N 3.29Å; Q183-F187 WeakPolarHBondContact CA-O 3.48Å; Q183-V189 HydrophobicContact CB-CB 4.25Å; Q183-V189 HydrophobicContact CB-CG2 3.88Å; Q183-V189 HydrophobicContact CG-CG2 4.43Å
184	T	98.3	Very high	97.4	Very high	42 Å²	42	43.5 Å²	43.5	26%	0.258	22%	0.221	S	C	.	.			trans	-125.3	-174.1	167.5	79.1	0	0	0	0	110.3	I22 N186 F187 R188	I22-T184 HydrophobicContact CB-CG2 4.44Å; I22-T184 HydrophobicContact CD1-CG2 4.42Å; I22-T184 HydrophobicContact CG1-CG2 4.07Å; I22-T184 HydrophobicContact CG2-CG2 3.86Å; T184-N186 VanDerWaalsContact C-N 3.26Å; T184-N186 PolarHBondContact OG1-N 3.34Å; T184-N186 VanDerWaalsContact OG1-N 3.16Å; T184-F187 HydrophobicContact CG2-CB 4.31Å; T184-F187 PolarHBondContact N-O 2.87Å; T184-F187 WeakPolarHBondContact OG1-CB 3.41Å; T184-F187 PolarHBondContact OG1-N 2.9Å; T184-R188 WeakPolarHBondContact O-CD 3.34Å; T184-R188 PolarHBondContact O-NH1 2.81Å
185	N	97.3	Very high	97.4	Very high	134 Å²	134	41.1 Å²	41.1	72%	0.717	22%	0.215	S	C	*	.	S	Bend	trans	-65.4	-34.2	171.6	-69.7	-16.7	0	0	0	111.7	R188	N185-R188 WeakPolarHBondContact O-CD 3.46Å
186	N	97.6	Very high	97.3	Very high	59 Å²	59	41.6 Å²	41.6	32%	0.316	22%	0.217	S	C	.	.	S	Bend	trans	-109.5	-4.3	-174.3	-61.6	-18.7	0	0	0	113	E160 F162 C163 T184	E160-N186 VanDerWaalsContact O-CB 3.25Å; E160-N186 WeakPolarHBondContact O-CB 3.36Å; E160-N186 VanDerWaalsContact O-CG 3.27Å; E160-N186 PolarHBondContact O-ND2 3.15Å; F162-N186 CarbonylContact C-O 3.51Å; F162-N186 WeakPolarHBondContact CA-O 3.31Å; C163-N186 PolarHBondContact N-O 3.28Å; C163-N186 VanDerWaalsContact O-O 3.06Å; T184-N186 VanDerWaalsContact C-N 3.26Å; T184-N186 PolarHBondContact OG1-N 3.34Å; T184-N186 VanDerWaalsContact OG1-N 3.16Å
187	F	98.4	Very high	97.3	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.013	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	90.3	172.4	-168.6	-100.9	0	0	0	108.7	W15 I22 L148 N152 V157 C163 T165 M182 Q183 T184 V189	W15-F187 HydrophobicContact CH2-CE2 4.07Å; W15-F187 HydrophobicContact CH2-CZ 4.3Å; I22-F187 HydrophobicContact CD1-CB 3.96Å; I22-F187 HydrophobicContact CD1-CD1 3.92Å; I22-F187 HydrophobicContact CD1-CD2 4.13Å; I22-F187 HydrophobicContact CD1-CE1 4.4Å; I22-F187 HydrophobicContact CD1-CG 3.74Å; L148-F187 HydrophobicContact CD1-CE1 4.36Å; L148-F187 HydrophobicContact CD2-CZ 4.33Å; N152-F187 HydrophobicContact CB-CE2 4.27Å; V157-F187 HydrophobicContact CG1-CD2 4.06Å; V157-F187 HydrophobicContact CG1-CE2 4.36Å; V157-F187 HydrophobicContact CG2-CD2 4.16Å; V157-F187 HydrophobicContact CG2-CE2 4.16Å; C163-F187 VanDerWaalsContact SG-CD2 3.57Å; T165-F187 HydrophobicContact CG2-CD1 4.23Å; T165-F187 HydrophobicContact CG2-CE1 3.38Å; T165-F187 HydrophobicContact CG2-CE2 4.27Å; T165-F187 HydrophobicContact CG2-CZ 3.4Å; M182-F187 HydrophobicContact CB-CE1 4.47Å; M182-F187 VanDerWaalsContact O-CD1 3.25Å; M182-F187 WeakPolarHBondContact O-CD1 3.47Å; Q183-F187 WeakPolarHBondContact CA-O 3.48Å; T184-F187 HydrophobicContact CG2-CB 4.31Å; T184-F187 PolarHBondContact N-O 2.87Å; T184-F187 WeakPolarHBondContact OG1-CB 3.41Å; T184-F187 PolarHBondContact OG1-N 2.9Å; F187-V189 HydrophobicContact CD1-CG2 4.11Å; F187-V189 HydrophobicContact CE1-CG2 4.19Å
188	R	98.4	Very high	97.3	Very high	95 Å²	95	36.5 Å²	36.5	36%	0.358	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	137.9	-173.6	-56.6	-52.9	-60.5	175.7	-9.3	110.9	F162 C163 E164 T165 T184 N185	F162-R188 HydrophobicContact CE2-CG 3.65Å; F162-R188 HydrophobicContact CZ-CG 4.17Å; C163-R188 PolarHBondContact O-N 3.39Å; E164-R188 CarbonylContact C-O 3.27Å; E164-R188 WeakPolarHBondContact CA-O 3.04Å; E164-R188 HydrophobicContact CB-CB 4.23Å; T165-R188 PolarHBondContact N-O 3.24Å; T184-R188 WeakPolarHBondContact O-CD 3.34Å; T184-R188 PolarHBondContact O-NH1 2.81Å; N185-R188 WeakPolarHBondContact O-CD 3.46Å
189	V	98.4	Very high	97.2	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.024	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.6	-171.8	178.1	0	0	0	0	110.9	T165 I167 K179 M182 Q183 F187 V191	T165-V189 HydrophobicContact CG2-CB 4.4Å; T165-V189 HydrophobicContact CG2-CG1 4.46Å; T165-V189 HydrophobicContact CG2-CG2 3.79Å; T165-V189 WeakPolarHBondContact O-CA 3.35Å; I167-V189 HydrophobicContact CB-CG1 4.32Å; I167-V189 HydrophobicContact CD1-CG1 3.54Å; I167-V189 HydrophobicContact CG1-CG1 3.73Å; K179-V189 HydrophobicContact CB-CG1 4.25Å; K179-V189 VanDerWaalsContact CE-O 3.23Å; K179-V189 WeakPolarHBondContact CE-O 3.41Å; K179-V189 HydrophobicContact CG-CB 4.13Å; K179-V189 HydrophobicContact CG-CG1 4.12Å; K179-V189 PolarHBondContact NZ-O 2.69Å; M182-V189 HydrophobicContact CB-CG2 4.13Å; Q183-V189 HydrophobicContact CB-CB 4.25Å; Q183-V189 HydrophobicContact CB-CG2 3.88Å; Q183-V189 HydrophobicContact CG-CG2 4.43Å; F187-V189 HydrophobicContact CD1-CG2 4.11Å; F187-V189 HydrophobicContact CE1-CG2 4.19Å; V189-V191 HydrophobicContact CG1-CG2 4.34Å
190	T	98.2	Very high	97	Very high	59 Å²	59	33.2 Å²	33.2	36%	0.362	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.7	165	-58.7	0	0	0	0	109.3	T165 T166 I167 V192 E256	T165-T190 PolarHBondContact O-N 2.79Å; T166-T190 CarbonylContact C-O 3.57Å; T166-T190 WeakPolarHBondContact CA-O 3.44Å; I167-T190 PolarHBondContact N-O 3.16Å; T190-V192 HydrophobicContact CG2-CG1 4.19Å; T190-E256 WeakPolarHBondContact CG2-OE2 3.47Å
191	V	97.8	Very high	97	Very high	50 Å²	50	30.1 Å²	30.1	30%	0.303	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.2	176.6	-176.8	0	0	0	0	108.3	I167 C169 K179 V189	I167-V191 HydrophobicContact CB-CG2 4.29Å; I167-V191 HydrophobicContact CG2-CG1 4.48Å; I167-V191 CarbonylContact O-C 3.48Å; I167-V191 WeakPolarHBondContact O-CA 3.44Å; C169-V191 HydrophobicContact CB-CG1 4.24Å; K179-V191 HydrophobicContact CB-CG2 3.88Å; K179-V191 HydrophobicContact CD-CG2 4.1Å; V189-V191 HydrophobicContact CG1-CG2 4.34Å
192	V	96.7	Very high	96.7	Very high	17 Å²	17	30.1 Å²	30.1	10%	0.103	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	158.8	176.8	-55.7	0	0	0	0	110.1	T166 I167 G168 C169 T190 V198 T253 E256	T166-V192 HydrophobicContact CG2-CB 4.48Å; T166-V192 HydrophobicContact CG2-CG1 4.04Å; T166-V192 HydrophobicContact CG2-CG2 3.64Å; I167-V192 PolarHBondContact O-N 3.32Å; G168-V192 WeakPolarHBondContact CA-O 3.49Å; C169-V192 PolarHBondContact N-O 2.64Å; T190-V192 HydrophobicContact CG2-CG1 4.19Å; V192-V198 HydrophobicContact CG2-CG2 3.27Å; V192-T253 HydrophobicContact CG2-CG2 4.32Å; V192-E256 HydrophobicContact CG1-CG 4.16Å
193	E	95.1	Very high	96.4	Very high	90 Å²	90	30.1 Å²	30.1	42%	0.421	16%	0.157	S	C	.	.	S	Bend	trans	-85.7	-23.3	-174.9	-64.3	-178.3	168.7	0	0	112.3	K172 A195	K172-E193 VanDerWaalsContact CE-OE1 3.25Å; K172-E193 WeakPolarHBondContact CE-OE1 3.32Å; K172-E193 IonicContact NZ-OE1 2.65Å; E193-A195 VanDerWaalsContact C-N 3.31Å; E193-A195 PolarHBondContact O-N 3.33Å
194	E	95.1	Very high	96.3	Very high	11 Å²	11	28.1 Å²	28.1	5%	0.051	15%	0.148	C	C	.	.			trans	-80.8	64.1	-173.3	-58.8	76.2	-166.7	0	0	113	D196 V197 V198 P248 K250 T253	E194-D196 VanDerWaalsContact C-N 3.34Å; E194-D196 PolarHBondContact O-N 2.99Å; E194-V197 HydrophobicContact CB-CB 3.95Å; E194-V197 HydrophobicContact CB-CG2 3.95Å; E194-V197 PolarHBondContact O-N 3.07Å; E194-V197 VanDerWaalsContact O-N 3.07Å; E194-V198 WeakPolarHBondContact O-CG2 3.34Å; E194-V198 PolarHBondContact O-N 3.16Å; E194-P248 WeakPolarHBondContact CG-O 3.09Å; E194-K250 WeakPolarHBondContact OE1-CD 3.36Å; E194-K250 WeakPolarHBondContact OE1-CE 3.43Å; E194-K250 IonicContact OE1-NZ 3.72Å; E194-K250 PolarHBondContact OE1-NZ 2.84Å; E194-T253 HydrophobicContact CB-CG2 4.33Å
195	A	94.8	Very high	96.2	Very high	14 Å²	14	26.7 Å²	26.7	12%	0.116	14%	0.138	C	C	.	.	H	α-helix	trans	-53.7	-44.8	-175.7	0	0	0	0	0	113.9	V147 E193 V197 V198 E199	V147-A195 HydrophobicContact CG2-CB 4.26Å; V147-A195 WeakPolarHBondContact CG2-O 3.3Å; E193-A195 VanDerWaalsContact C-N 3.31Å; E193-A195 PolarHBondContact O-N 3.33Å; A195-V197 VanDerWaalsContact C-N 3.27Å; A195-V197 PolarHBondContact O-N 3.47Å; A195-V198 PolarHBondContact O-N 2.98Å; A195-E199 WeakPolarHBondContact O-CB 3.39Å; A195-E199 PolarHBondContact O-N 3.42Å
196	D	94.6	Very high	96	Very high	11 Å²	11	20.4 Å²	20.4	6%	0.059	10%	0.104	C	C	.	.	H	α-helix	trans	-60.6	-38.9	179.2	-58.6	16.3	0	0	0	111.7	L132 E194 E199 I200 C244 N246	L132-D196 HydrophobicContact CD1-CB 3.63Å; E194-D196 VanDerWaalsContact C-N 3.34Å; E194-D196 PolarHBondContact O-N 2.99Å; D196-E199 PolarHBondContact O-N 3.33Å; D196-I200 WeakPolarHBondContact O-CB 3.46Å; D196-I200 WeakPolarHBondContact O-CG2 2.99Å; D196-I200 PolarHBondContact O-N 3.37Å; D196-C244 HydrophobicContact CB-CB 4Å; D196-N246 VanDerWaalsContact OD2-CB 3.25Å; D196-N246 WeakPolarHBondContact OD2-CB 3.33Å; D196-N246 PolarHBondContact OD2-ND2 3.38Å
197	V	96.1	Very high	96	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-70.8	-40.6	179.2	-176.5	0	0	0	0	110.7	E194 A195 E199 I200 C201 V249 T253 F254	E194-V197 HydrophobicContact CB-CB 3.95Å; E194-V197 HydrophobicContact CB-CG2 3.95Å; E194-V197 PolarHBondContact O-N 3.07Å; E194-V197 VanDerWaalsContact O-N 3.07Å; A195-V197 VanDerWaalsContact C-N 3.27Å; A195-V197 PolarHBondContact O-N 3.47Å; V197-E199 VanDerWaalsContact C-N 3.32Å; V197-E199 PolarHBondContact O-N 3.11Å; V197-I200 WeakPolarHBondContact O-CG2 3.33Å; V197-C201 PolarHBondContact O-N 3.03Å; V197-C201 PolarHBondContact O-SG 3.1Å; V197-V249 HydrophobicContact CG2-CB 4.22Å; V197-V249 HydrophobicContact CG2-CG1 4.05Å; V197-V249 HydrophobicContact CG2-CG2 3.9Å; V197-T253 HydrophobicContact CB-CG2 4.05Å; V197-T253 HydrophobicContact CG1-CG2 3.7Å; V197-F254 HydrophobicContact CG1-CD2 4.31Å; V197-F254 HydrophobicContact CG1-CE1 4.34Å; V197-F254 HydrophobicContact CG1-CE2 3.6Å; V197-F254 HydrophobicContact CG1-CZ 3.6Å
198	V	97	Very high	96	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61	-45.3	175.3	173.8	0	0	0	0	110.3	V147 M149 T166 V192 E194 A195 T253 C258	V147-V198 HydrophobicContact CG2-CB 3.88Å; V147-V198 HydrophobicContact CG2-CG1 3.71Å; M149-V198 HydrophobicContact CB-CG1 3.78Å; M149-V198 HydrophobicContact CG-CG1 3.91Å; M149-V198 VanDerWaalsContact CG-O 3.28Å; M149-V198 WeakPolarHBondContact CG-O 3.25Å; T166-V198 HydrophobicContact CG2-CG1 4.28Å; T166-V198 HydrophobicContact CG2-CG2 3.85Å; V192-V198 HydrophobicContact CG2-CG2 3.27Å; E194-V198 WeakPolarHBondContact O-CG2 3.34Å; E194-V198 PolarHBondContact O-N 3.16Å; A195-V198 PolarHBondContact O-N 2.98Å; V198-T253 HydrophobicContact CG2-CG2 3.98Å; V198-C258 HydrophobicContact CG1-CB 3.89Å
199	E	96.2	Very high	95.9	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-66.6	-49.5	-178.4	-168.7	168.1	-169.7	0	0	112.7	L132 I133 S134 V147 M149 A195 D196 V197 C201 G202	L132-E199 WeakPolarHBondContact CB-OE2 3.41Å; L132-E199 HydrophobicContact CD1-CB 4.49Å; L132-E199 HydrophobicContact CD2-CB 4.47Å; L132-E199 HydrophobicContact CD2-CG 4.26Å; I133-E199 PolarHBondContact N-OE1 2.75Å; I133-E199 VanDerWaalsContact N-OE1 3.1Å; S134-E199 WeakPolarHBondContact CB-OE2 3.39Å; S134-E199 PolarHBondContact N-OE1 3.13Å; S134-E199 PolarHBondContact OG-OE2 3.19Å; V147-E199 HydrophobicContact CB-CB 4.47Å; V147-E199 HydrophobicContact CG1-CB 4.08Å; V147-E199 HydrophobicContact CG1-CG 4.17Å; V147-E199 HydrophobicContact CG2-CB 4.29Å; M149-E199 HydrophobicContact CE-CB 4.44Å; M149-E199 HydrophobicContact CE-CG 3.89Å; A195-E199 WeakPolarHBondContact O-CB 3.39Å; A195-E199 PolarHBondContact O-N 3.42Å; D196-E199 PolarHBondContact O-N 3.33Å; V197-E199 VanDerWaalsContact C-N 3.32Å; V197-E199 PolarHBondContact O-N 3.11Å; E199-C201 VanDerWaalsContact C-N 3.28Å; E199-C201 PolarHBondContact O-N 2.93Å; E199-G202 PolarHBondContact O-N 3.2Å; E199-G202 VanDerWaalsContact O-N 3.13Å
200	I	95.2	Very high	95.9	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.2	-34.3	-176.6	-164	56.6	0	0	0	111.8	V123 L130 L132 D196 V197 G202 A203 L204 F239 A240	V123-I200 HydrophobicContact CG1-CD1 3.39Å; L130-I200 HydrophobicContact CD1-CD1 4.17Å; L130-I200 HydrophobicContact CD2-CD1 3.89Å; L132-I200 HydrophobicContact CD2-CB 4.19Å; L132-I200 HydrophobicContact CD2-CD1 3.96Å; D196-I200 WeakPolarHBondContact O-CB 3.46Å; D196-I200 WeakPolarHBondContact O-CG2 2.99Å; D196-I200 PolarHBondContact O-N 3.37Å; V197-I200 WeakPolarHBondContact O-CG2 3.33Å; I200-G202 VanDerWaalsContact C-N 3.28Å; I200-G202 PolarHBondContact O-N 2.79Å; I200-A203 PolarHBondContact O-N 3.39Å; I200-L204 HydrophobicContact CD1-CD1 4.37Å; I200-L204 HydrophobicContact CD1-CD2 4.37Å; I200-L204 HydrophobicContact CD1-CG 4.09Å; I200-L204 HydrophobicContact CG1-CD1 3.75Å; I200-L204 HydrophobicContact CG1-CG 3.94Å; I200-L204 WeakPolarHBondContact O-CG 3.33Å; I200-L204 PolarHBondContact O-N 2.89Å; I200-F239 HydrophobicContact CD1-CD1 4.4Å; I200-F239 HydrophobicContact CD1-CE1 4.07Å; I200-F239 HydrophobicContact CG1-CD1 4.19Å; I200-F239 HydrophobicContact CG1-CE1 4.34Å; I200-A240 HydrophobicContact CG2-CB 3.95Å
201	C	96.3	Very high	95.9	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-57.7	-43.1	175.7	-73.2	0	0	0	0	111.6	V197 E199 A203 K205 M236 F254 C258	V197-C201 PolarHBondContact O-N 3.03Å; V197-C201 PolarHBondContact O-SG 3.1Å; E199-C201 VanDerWaalsContact C-N 3.28Å; E199-C201 PolarHBondContact O-N 2.93Å; C201-A203 PolarHBondContact O-N 3.24Å; C201-K205 WeakPolarHBondContact O-CB 3.46Å; C201-K205 WeakPolarHBondContact O-CG 3.45Å; C201-K205 PolarHBondContact O-N 2.76Å; C201-M236 HydrophobicContact CB-CE 4.12Å; C201-F254 VanDerWaalsContact SG-CE1 3.52Å; C201-C258 WeakPolarHBondContact CB-O 3.13Å
202	G	92.3	Very high	95.9	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-63.7	-28.5	-179.9	0	0	0	0	0	113.9	E199 I200 K205	E199-G202 PolarHBondContact O-N 3.2Å; E199-G202 VanDerWaalsContact O-N 3.13Å; I200-G202 VanDerWaalsContact C-N 3.28Å; I200-G202 PolarHBondContact O-N 2.79Å; G202-K205 WeakPolarHBondContact O-CE 3.29Å; G202-K205 WeakPolarHBondContact O-CG 3.38Å
203	A	92.3	Very high	95.9	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-81.1	-57.3	175.9	0	0	0	0	0	111.7	V123 I200 C201 K205 N206 T304	V123-A203 HydrophobicContact CG1-CB 3.58Å; I200-A203 PolarHBondContact O-N 3.39Å; C201-A203 PolarHBondContact O-N 3.24Å; A203-K205 VanDerWaalsContact C-N 3.31Å; A203-K205 PolarHBondContact O-N 3.38Å; A203-N206 WeakPolarHBondContact O-CB 3.28Å; A203-N206 PolarHBondContact O-N 3.28Å; A203-N206 VanDerWaalsContact O-N 3.16Å; A203-T304 HydrophobicContact CB-CG2 4.23Å
204	L	95.9	Very high	96.1	Very high	0 Å²	0	2.4 Å²	2.4	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-63.4	-34.3	-171	-64.3	179.9	0	0	0	113.4	I200 N206 I207 M236 F239 V308 F324	I200-L204 HydrophobicContact CD1-CD1 4.37Å; I200-L204 HydrophobicContact CD1-CD2 4.37Å; I200-L204 HydrophobicContact CD1-CG 4.09Å; I200-L204 HydrophobicContact CG1-CD1 3.75Å; I200-L204 HydrophobicContact CG1-CG 3.94Å; I200-L204 WeakPolarHBondContact O-CG 3.33Å; I200-L204 PolarHBondContact O-N 2.89Å; L204-N206 PolarHBondContact O-N 2.87Å; L204-I207 HydrophobicContact CD2-CD1 4.29Å; L204-I207 WeakPolarHBondContact O-CB 3.36Å; L204-I207 PolarHBondContact O-N 3.4Å; L204-M236 HydrophobicContact CB-CG 3.71Å; L204-M236 HydrophobicContact CD1-CB 4.2Å; L204-M236 HydrophobicContact CD1-CG 4.15Å; L204-F239 HydrophobicContact CD1-CB 3.93Å; L204-F239 HydrophobicContact CD1-CD1 3.67Å; L204-F239 HydrophobicContact CD1-CE1 4.48Å; L204-F239 HydrophobicContact CD1-CG 3.99Å; L204-F239 HydrophobicContact CD2-CD1 4.06Å; L204-F239 HydrophobicContact CD2-CE1 4.16Å; L204-F239 HydrophobicContact CD2-CG 4.41Å; L204-F239 HydrophobicContact CG-CD1 4.42Å; L204-V308 HydrophobicContact CD2-CG2 3.62Å; L204-F324 HydrophobicContact CB-CZ 4.17Å; L204-F324 HydrophobicContact CD1-CE2 4.31Å; L204-F324 HydrophobicContact CD1-CZ 4.33Å; L204-F324 HydrophobicContact CD2-CE2 4.1Å; L204-F324 HydrophobicContact CD2-CZ 4.34Å
205	K	95.9	Very high	96.2	Very high	12 Å²	12	2 Å²	2	5%	0.052	1%	0.012	C	C	.	.	H	α-helix	trans	-56.1	-27.8	178.6	66.9	91.3	-179.3	177.3	0	113.1	C201 G202 A203 I207 V208 A209 M236 D262 L263 T266	C201-K205 WeakPolarHBondContact O-CB 3.46Å; C201-K205 WeakPolarHBondContact O-CG 3.45Å; C201-K205 PolarHBondContact O-N 2.76Å; G202-K205 WeakPolarHBondContact O-CE 3.29Å; G202-K205 WeakPolarHBondContact O-CG 3.38Å; A203-K205 VanDerWaalsContact C-N 3.31Å; A203-K205 PolarHBondContact O-N 3.38Å; K205-I207 VanDerWaalsContact C-N 3.31Å; K205-I207 PolarHBondContact O-N 2.97Å; K205-V208 PolarHBondContact O-N 3.04Å; K205-A209 WeakPolarHBondContact O-CB 3.4Å; K205-A209 PolarHBondContact O-N 3Å; K205-M236 HydrophobicContact CB-CE 4.03Å; K205-M236 HydrophobicContact CB-SD 4.3Å; K205-D262 WeakPolarHBondContact CE-OD2 3.29Å; K205-D262 IonicContact NZ-OD1 3.13Å; K205-L263 HydrophobicContact CB-CB 4.27Å; K205-L263 HydrophobicContact CB-CD1 3.87Å; K205-T266 HydrophobicContact CD-CG2 3.88Å; K205-T266 WeakPolarHBondContact CD-OG1 3.29Å; K205-T266 VanDerWaalsContact NZ-CG2 3.29Å; K205-T266 PolarHBondContact NZ-OG1 2.96Å
206	N	94.5	Very high	96.3	Very high	2 Å²	2	2.8 Å²	2.8	1%	0.011	1%	0.014	C	C	.	.	H	α-helix	trans	-68.8	-31.1	179.3	-72.7	-40.7	0	0	0	112.1	A203 L204 A209 V210 N272	A203-N206 WeakPolarHBondContact O-CB 3.28Å; A203-N206 PolarHBondContact O-N 3.28Å; A203-N206 VanDerWaalsContact O-N 3.16Å; L204-N206 PolarHBondContact O-N 2.87Å; N206-A209 PolarHBondContact O-N 3.22Å; N206-V210 WeakPolarHBondContact O-CG2 3.35Å; N206-V210 PolarHBondContact O-N 3.39Å; N206-N272 VanDerWaalsContact CG-ND2 3.28Å; N206-N272 PolarHBondContact OD1-ND2 3.48Å
207	I	96.8	Very high	96.4	Very high	0 Å²	0	2.9 Å²	2.9	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-65.2	-49.7	174.1	-57.4	172.5	0	0	0	109.1	L204 K205 A209 V210 G211 T304 A305 V308 F324 V327	L204-I207 HydrophobicContact CD2-CD1 4.29Å; L204-I207 WeakPolarHBondContact O-CB 3.36Å; L204-I207 PolarHBondContact O-N 3.4Å; K205-I207 VanDerWaalsContact C-N 3.31Å; K205-I207 PolarHBondContact O-N 2.97Å; I207-A209 PolarHBondContact O-N 2.87Å; I207-V210 WeakPolarHBondContact O-CB 3.44Å; I207-V210 PolarHBondContact O-N 3.24Å; I207-G211 PolarHBondContact O-N 3.01Å; I207-T304 HydrophobicContact CD1-CG2 3.97Å; I207-T304 HydrophobicContact CG1-CG2 4.1Å; I207-A305 HydrophobicContact CD1-CB 4.36Å; I207-A305 HydrophobicContact CG1-CB 4.11Å; I207-A305 HydrophobicContact CG2-CB 4.21Å; I207-V308 HydrophobicContact CD1-CB 3.99Å; I207-V308 HydrophobicContact CD1-CG1 4.31Å; I207-V308 HydrophobicContact CD1-CG2 3.74Å; I207-F324 HydrophobicContact CB-CD1 4.12Å; I207-F324 HydrophobicContact CB-CE1 4.4Å; I207-F324 HydrophobicContact CD1-CD1 4.34Å; I207-F324 HydrophobicContact CD1-CG 4.36Å; I207-F324 HydrophobicContact CG2-CB 4.33Å; I207-F324 HydrophobicContact CG2-CD1 3.67Å; I207-F324 HydrophobicContact CG2-CE1 4.41Å; I207-F324 HydrophobicContact CG2-CG 4.28Å; I207-V327 HydrophobicContact CG2-CB 3.81Å; I207-V327 HydrophobicContact CG2-CG1 3.86Å; I207-V327 HydrophobicContact CG2-CG2 4.04Å
208	V	98.1	Very high	96.5	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-59.4	-38.7	178.9	-171.8	0	0	0	0	111.2	K205 V210 G211 A212 V228 M236 L263 L323 F324	K205-V208 PolarHBondContact O-N 3.04Å; V208-V210 VanDerWaalsContact C-N 3.32Å; V208-V210 PolarHBondContact O-N 3.39Å; V208-G211 PolarHBondContact O-N 3.4Å; V208-G211 VanDerWaalsContact O-N 3.16Å; V208-A212 PolarHBondContact O-N 3.13Å; V208-V228 HydrophobicContact CG1-CG1 4.24Å; V208-M236 HydrophobicContact CG2-SD 4.17Å; V208-L263 HydrophobicContact CB-CD1 3.6Å; V208-L263 HydrophobicContact CG1-CD1 3.73Å; V208-L263 HydrophobicContact CG2-CD1 4.06Å; V208-L323 HydrophobicContact CG2-CD2 4.45Å; V208-F324 HydrophobicContact CG2-CE1 3.79Å
209	A	97.5	Very high	96.4	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-64.7	-32	177.3	0	0	0	0	0	113.8	K205 N206 I207 G213 T266 C267 N272 R273	K205-A209 WeakPolarHBondContact O-CB 3.4Å; K205-A209 PolarHBondContact O-N 3Å; N206-A209 PolarHBondContact O-N 3.22Å; I207-A209 PolarHBondContact O-N 2.87Å; A209-G213 PolarHBondContact O-N 3.33Å; A209-T266 HydrophobicContact CB-CG2 3.45Å; A209-T266 VanDerWaalsContact CB-CG2 3.45Å; A209-C267 VanDerWaalsContact CA-SG 3.59Å; A209-N272 HydrophobicContact CB-CB 4Å; A209-R273 WeakPolarHBondContact O-CA 3.29Å
210	V	97.6	Very high	96.4	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.4	-46.2	171.3	177.6	0	0	0	0	109.9	N206 I207 V208 A212 G213 F214 N272 P302 V327	N206-V210 WeakPolarHBondContact O-CG2 3.35Å; N206-V210 PolarHBondContact O-N 3.39Å; I207-V210 WeakPolarHBondContact O-CB 3.44Å; I207-V210 PolarHBondContact O-N 3.24Å; V208-V210 VanDerWaalsContact C-N 3.32Å; V208-V210 PolarHBondContact O-N 3.39Å; V210-A212 VanDerWaalsContact C-N 3.34Å; V210-A212 PolarHBondContact O-N 3.26Å; V210-G213 CarbonylContact O-C 3.57Å; V210-G213 WeakPolarHBondContact O-CA 3.48Å; V210-G213 PolarHBondContact O-N 3.27Å; V210-F214 HydrophobicContact CG1-CD1 4.42Å; V210-F214 HydrophobicContact CG1-CE1 3.71Å; V210-F214 HydrophobicContact CG1-CE2 3.91Å; V210-F214 HydrophobicContact CG1-CZ 3.42Å; V210-F214 VanDerWaalsContact CG1-CZ 3.42Å; V210-F214 PolarHBondContact O-N 3.44Å; V210-N272 HydrophobicContact CG2-CB 3.92Å; V210-P302 HydrophobicContact CG2-CG 4.32Å; V210-V327 HydrophobicContact CB-CG1 3.89Å; V210-V327 HydrophobicContact CG1-CG1 3.81Å
211	G	97.7	Very high	96.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.1	-40.9	175	0	0	0	0	0	113.3	I207 V208 G213 F214 C215 F340	I207-G211 PolarHBondContact O-N 3.01Å; V208-G211 PolarHBondContact O-N 3.4Å; V208-G211 VanDerWaalsContact O-N 3.16Å; G211-G213 VanDerWaalsContact C-N 3.3Å; G211-G213 PolarHBondContact O-N 2.86Å; G211-F214 WeakPolarHBondContact O-CB 3.25Å; G211-F214 PolarHBondContact O-N 2.96Å; G211-C215 PolarHBondContact O-N 3.29Å; G211-C215 VanDerWaalsContact O-N 3.15Å; G211-F340 VanDerWaalsContact CA-CZ 3.45Å; G211-F340 WeakPolarHBondContact O-CE1 3.1Å
212	A	98.1	Very high	96.4	Very high	0 Å²	0	19 Å²	19	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-38.2	173	0	0	0	0	0	111.8	V208 V210 C215 D216 K225 V228 C267	V208-A212 PolarHBondContact O-N 3.13Å; V210-A212 VanDerWaalsContact C-N 3.34Å; V210-A212 PolarHBondContact O-N 3.26Å; A212-C215 WeakPolarHBondContact O-CB 3.4Å; A212-C215 PolarHBondContact O-N 3.48Å; A212-D216 PolarHBondContact O-N 3.4Å; A212-K225 HydrophobicContact CB-CG 4.32Å; A212-V228 HydrophobicContact CB-CG1 4.42Å; A212-C267 HydrophobicContact CB-CB 3.83Å
213	G	97.7	Very high	96.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.4	-40.9	171.7	0	0	0	0	0	113	A209 V210 G211 C215 D216 G217 R273 E277	A209-G213 PolarHBondContact O-N 3.33Å; V210-G213 CarbonylContact O-C 3.57Å; V210-G213 WeakPolarHBondContact O-CA 3.48Å; V210-G213 PolarHBondContact O-N 3.27Å; G211-G213 VanDerWaalsContact C-N 3.3Å; G211-G213 PolarHBondContact O-N 2.86Å; G213-C215 VanDerWaalsContact C-N 3.26Å; G213-C215 PolarHBondContact O-N 2.85Å; G213-D216 WeakPolarHBondContact O-CB 3.35Å; G213-D216 PolarHBondContact O-N 3.14Å; G213-D216 VanDerWaalsContact O-N 3.13Å; G213-G217 PolarHBondContact O-N 3.48Å; G213-R273 WeakPolarHBondContact CA-O 3.48Å; G213-E277 WeakPolarHBondContact O-CA 3.21Å; G213-E277 PolarHBondContact O-N 3.08Å
214	F	98.2	Very high	96.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.1	-41.3	173.4	-61.2	-26.5	0	0	0	111.7	V210 G211 D216 G217 L218 G276 F279 A280 V327 I330 V337 F340	V210-F214 HydrophobicContact CG1-CD1 4.42Å; V210-F214 HydrophobicContact CG1-CE1 3.71Å; V210-F214 HydrophobicContact CG1-CE2 3.91Å; V210-F214 HydrophobicContact CG1-CZ 3.42Å; V210-F214 VanDerWaalsContact CG1-CZ 3.42Å; V210-F214 PolarHBondContact O-N 3.44Å; G211-F214 WeakPolarHBondContact O-CB 3.25Å; G211-F214 PolarHBondContact O-N 2.96Å; F214-D216 VanDerWaalsContact C-N 3.34Å; F214-D216 PolarHBondContact O-N 3.35Å; F214-G217 PolarHBondContact O-N 3.21Å; F214-L218 WeakPolarHBondContact O-CB 3.25Å; F214-L218 VanDerWaalsContact O-CG 3.25Å; F214-L218 WeakPolarHBondContact O-CG 3.15Å; F214-L218 PolarHBondContact O-N 3.5Å; F214-G276 WeakPolarHBondContact CD1-O 3.35Å; F214-F279 HydrophobicContact CD1-CD1 4.32Å; F214-F279 HydrophobicContact CE1-CB 4.49Å; F214-F279 AromaticContact CE1-CD1 3.64Å; F214-F279 HydrophobicContact CE1-CD1 3.64Å; F214-F279 HydrophobicContact CE1-CE1 4.29Å; F214-F279 HydrophobicContact CE1-CG 4.34Å; F214-F279 HydrophobicContact CZ-CD1 4.35Å; F214-A280 HydrophobicContact CD1-CB 4.31Å; F214-V327 HydrophobicContact CE2-CG2 4.31Å; F214-I330 HydrophobicContact CD2-CD1 4.15Å; F214-I330 HydrophobicContact CD2-CG2 4.49Å; F214-I330 HydrophobicContact CE1-CG2 4.26Å; F214-I330 HydrophobicContact CE2-CB 4.05Å; F214-I330 HydrophobicContact CE2-CD1 3.98Å; F214-I330 HydrophobicContact CE2-CG2 3.75Å; F214-I330 HydrophobicContact CZ-CB 4.24Å; F214-I330 HydrophobicContact CZ-CG2 3.61Å; F214-V337 HydrophobicContact CB-CG2 3.84Å; F214-V337 HydrophobicContact CD1-CG2 3.81Å; F214-V337 HydrophobicContact CD2-CG2 4.22Å; F214-V337 HydrophobicContact CE1-CG2 4.39Å; F214-V337 HydrophobicContact CG-CG2 3.72Å; F214-F340 HydrophobicContact CB-CD1 4.21Å; F214-F340 HydrophobicContact CB-CG 4.45Å; F214-F340 HydrophobicContact CD2-CD2 4Å; F214-F340 HydrophobicContact CD2-CE2 4.28Å; F214-F340 HydrophobicContact CD2-CG 4.15Å
215	C	97.1	Very high	96.9	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.007	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-41.3	175.4	-68.8	0	0	0	0	113.2	G211 A212 G213 G217 L218 G219 F220 V228	G211-C215 PolarHBondContact O-N 3.29Å; G211-C215 VanDerWaalsContact O-N 3.15Å; A212-C215 WeakPolarHBondContact O-CB 3.4Å; A212-C215 PolarHBondContact O-N 3.48Å; G213-C215 VanDerWaalsContact C-N 3.26Å; G213-C215 PolarHBondContact O-N 2.85Å; C215-G217 VanDerWaalsContact C-N 3.33Å; C215-L218 PolarHBondContact O-N 3.03Å; C215-G219 PolarHBondContact O-N 3.35Å; C215-F220 HydrophobicContact CB-CB 4.29Å; C215-F220 HydrophobicContact CB-CD2 4.08Å; C215-F220 PolarHBondContact O-N 3.43Å; C215-V228 VanDerWaalsContact SG-CG2 3.56Å
216	D	97.5	Very high	97	Very high	31 Å²	31	30.1 Å²	30.1	17%	0.166	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-41.3	174.7	-73.3	-30.3	0	0	0	112	A212 G213 F214 L218 G219 K225 R273 E277	A212-D216 PolarHBondContact O-N 3.4Å; G213-D216 WeakPolarHBondContact O-CB 3.35Å; G213-D216 PolarHBondContact O-N 3.14Å; G213-D216 VanDerWaalsContact O-N 3.13Å; F214-D216 VanDerWaalsContact C-N 3.34Å; F214-D216 PolarHBondContact O-N 3.35Å; D216-L218 VanDerWaalsContact C-N 3.35Å; D216-G219 PolarHBondContact O-N 2.94Å; D216-K225 WeakPolarHBondContact OD1-CE 3.28Å; D216-K225 IonicContact OD1-NZ 2.74Å; D216-K225 PolarHBondContact OD1-NZ 3.17Å; D216-K225 IonicContact OD2-NZ 2.65Å; D216-K225 PolarHBondContact OD2-NZ 3.48Å; D216-K225 VanDerWaalsContact OD2-NZ 3.08Å; D216-R273 WeakPolarHBondContact OD2-CD 3.38Å; D216-R273 IonicContact OD2-CZ 3.18Å; D216-R273 IonicContact OD2-NE 2.67Å; D216-R273 IonicContact OD2-NH1 2.76Å; D216-R273 PolarHBondContact OD2-NH1 3.44Å; D216-E277 HydrophobicContact CB-CB 4.11Å; D216-E277 HydrophobicContact CB-CG 3.84Å
217	G	97	Very high	97.1	Very high	14 Å²	14	31.9 Å²	31.9	14%	0.144	21%	0.21	C	C	.	.	H	α-helix	trans	-70.8	-31.2	-179.2	0	0	0	0	0	113.9	G213 F214 C215 G219 K281	G213-G217 PolarHBondContact O-N 3.48Å; F214-G217 PolarHBondContact O-N 3.21Å; C215-G217 VanDerWaalsContact C-N 3.33Å; G217-G219 VanDerWaalsContact C-N 3.28Å; G217-K281 WeakPolarHBondContact O-CG 3.33Å
218	L	96.9	Very high	97.2	Very high	47 Å²	47	31.9 Å²	31.9	25%	0.246	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-4.5	174.9	-68.2	172.1	0	0	0	113.6	F214 C215 D216 F220 V337 T338	F214-L218 WeakPolarHBondContact O-CB 3.25Å; F214-L218 VanDerWaalsContact O-CG 3.25Å; F214-L218 WeakPolarHBondContact O-CG 3.15Å; F214-L218 PolarHBondContact O-N 3.5Å; C215-L218 PolarHBondContact O-N 3.03Å; D216-L218 VanDerWaalsContact C-N 3.35Å; L218-F220 HydrophobicContact CB-CD2 3.94Å; L218-F220 HydrophobicContact CB-CE2 3.82Å; L218-F220 HydrophobicContact CB-CZ 4.31Å; L218-F220 HydrophobicContact CD1-CD2 4.29Å; L218-F220 HydrophobicContact CD1-CE2 3.59Å; L218-F220 HydrophobicContact CD1-CZ 4.27Å; L218-F220 HydrophobicContact CG-CE2 4.37Å; L218-V337 HydrophobicContact CD1-CG2 4.39Å; L218-V337 HydrophobicContact CD2-CG1 4.2Å; L218-T338 HydrophobicContact CD2-CG2 3.96Å
219	G	96.5	Very high	97.2	Very high	65 Å²	65	32.8 Å²	32.8	67%	0.67	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.7	24.3	179.1	0	0	0	0	0	114.2	C215 D216 G217	C215-G219 PolarHBondContact O-N 3.35Å; D216-G219 PolarHBondContact O-N 2.94Å; G217-G219 VanDerWaalsContact C-N 3.28Å
220	F	96.3	Very high	97.2	Very high	73 Å²	73	37.3 Å²	37.3	32%	0.32	23%	0.231	S	C	.	.			trans	-73.7	154.6	172.5	-64	-47.2	0	0	0	111.7	C215 L218 T224 I341	C215-F220 HydrophobicContact CB-CB 4.29Å; C215-F220 HydrophobicContact CB-CD2 4.08Å; C215-F220 PolarHBondContact O-N 3.43Å; L218-F220 HydrophobicContact CB-CD2 3.94Å; L218-F220 HydrophobicContact CB-CE2 3.82Å; L218-F220 HydrophobicContact CB-CZ 4.31Å; L218-F220 HydrophobicContact CD1-CD2 4.29Å; L218-F220 HydrophobicContact CD1-CE2 3.59Å; L218-F220 HydrophobicContact CD1-CZ 4.27Å; L218-F220 HydrophobicContact CG-CE2 4.37Å; F220-T224 HydrophobicContact CB-CG2 3.93Å; F220-T224 HydrophobicContact CD2-CG2 3.94Å; F220-T224 HydrophobicContact CG-CG2 3.98Å; F220-I341 HydrophobicContact CE2-CB 4.44Å; F220-I341 HydrophobicContact CZ-CB 4.31Å; F220-I341 HydrophobicContact CZ-CG1 4.46Å
221	G	94.9	Very high	97.2	Very high	46 Å²	46	37.5 Å²	37.5	47%	0.474	23%	0.232	S	C	.	.			trans	-84.5	177.2	178.7	0	0	0	0	0	114.2	N223 T224 K225	G221-N223 VanDerWaalsContact C-N 3.26Å; G221-N223 PolarHBondContact O-N 3.36Å; G221-T224 PolarHBondContact O-N 2.92Å; G221-T224 VanDerWaalsContact O-N 3.09Å; G221-K225 PolarHBondContact O-N 3.17Å
222	D	95.8	Very high	97.2	Very high	107 Å²	107	37.5 Å²	37.5	57%	0.572	23%	0.232	S	C	*	.	H	α-helix	trans	-60.8	-30.9	-175.7	-65	-40.3	0	0	0	113.7	T224 K225 A226	D222-T224 VanDerWaalsContact C-N 3.35Å; D222-T224 PolarHBondContact O-N 3.21Å; D222-K225 PolarHBondContact O-N 2.88Å; D222-A226 VanDerWaalsContact O-CB 3.31Å; D222-A226 WeakPolarHBondContact O-CB 3.38Å; D222-A226 PolarHBondContact O-N 3.13Å
223	N	96.8	Very high	97.2	Very high	146 Å²	146	38.5 Å²	38.5	78%	0.781	24%	0.238	S	C	*	.	H	α-helix	trans	-61.4	-42.6	176	-71.3	-19.4	0	0	0	112	G221 A226 A227	G221-N223 VanDerWaalsContact C-N 3.26Å; G221-N223 PolarHBondContact O-N 3.36Å; N223-A226 PolarHBondContact O-N 3.32Å; N223-A227 PolarHBondContact O-N 3.11Å
224	T	96.9	Very high	97.2	Very high	38 Å²	38	40.8 Å²	40.8	23%	0.233	25%	0.249	C	C	.	.	H	α-helix	trans	-68.2	-42.7	177.4	-54	0	0	0	0	110.4	F220 G221 D222 A226 A227 V228 I341	F220-T224 HydrophobicContact CB-CG2 3.93Å; F220-T224 HydrophobicContact CD2-CG2 3.94Å; F220-T224 HydrophobicContact CG-CG2 3.98Å; G221-T224 PolarHBondContact O-N 2.92Å; G221-T224 VanDerWaalsContact O-N 3.09Å; D222-T224 VanDerWaalsContact C-N 3.35Å; D222-T224 PolarHBondContact O-N 3.21Å; T224-A226 VanDerWaalsContact C-N 3.34Å; T224-A226 PolarHBondContact O-N 3Å; T224-A227 WeakPolarHBondContact O-CB 3.37Å; T224-A227 PolarHBondContact O-N 3.07Å; T224-V228 WeakPolarHBondContact O-CG2 3.43Å; T224-V228 PolarHBondContact O-N 3.1Å; T224-I341 HydrophobicContact CG2-CD1 4.08Å
225	K	97.4	Very high	97.1	Very high	13 Å²	13	40.9 Å²	40.9	6%	0.057	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-42.3	175.9	-173.1	-176.9	-66.6	177.2	0	111.7	A212 D216 G221 D222 A227 V228 I229 Y268	A212-K225 HydrophobicContact CB-CG 4.32Å; D216-K225 WeakPolarHBondContact OD1-CE 3.28Å; D216-K225 IonicContact OD1-NZ 2.74Å; D216-K225 PolarHBondContact OD1-NZ 3.17Å; D216-K225 IonicContact OD2-NZ 2.65Å; D216-K225 PolarHBondContact OD2-NZ 3.48Å; D216-K225 VanDerWaalsContact OD2-NZ 3.08Å; G221-K225 PolarHBondContact O-N 3.17Å; D222-K225 PolarHBondContact O-N 2.88Å; K225-A227 VanDerWaalsContact C-N 3.32Å; K225-A227 PolarHBondContact O-N 2.89Å; K225-V228 WeakPolarHBondContact O-CB 3.19Å; K225-V228 PolarHBondContact O-N 3.3Å; K225-I229 HydrophobicContact CG-CD1 4.16Å; K225-I229 WeakPolarHBondContact O-CG1 3.39Å; K225-I229 PolarHBondContact O-N 3.33Å; K225-Y268 HydrophobicContact CD-CD1 4.5Å; K225-Y268 HydrophobicContact CD-CE1 4Å; K225-Y268 HydrophobicContact CD-CE2 4.4Å
226	A	97.5	Very high	97.2	Very high	49 Å²	49	40.8 Å²	40.8	41%	0.405	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-39.9	175.5	0	0	0	0	0	111.8	D222 N223 T224 I229 R230	D222-A226 VanDerWaalsContact O-CB 3.31Å; D222-A226 WeakPolarHBondContact O-CB 3.38Å; D222-A226 PolarHBondContact O-N 3.13Å; N223-A226 PolarHBondContact O-N 3.32Å; T224-A226 VanDerWaalsContact C-N 3.34Å; T224-A226 PolarHBondContact O-N 3Å; A226-I229 PolarHBondContact O-N 2.87Å; A226-R230 WeakPolarHBondContact O-CB 3.49Å; A226-R230 PolarHBondContact O-N 2.91Å
227	A	97.7	Very high	97.1	Very high	40 Å²	40	40.4 Å²	40.4	33%	0.331	25%	0.246	S	C	.	.	H	α-helix	trans	-62.8	-42.8	174.2	0	0	0	0	0	112.1	N223 T224 K225 R230 L231	N223-A227 PolarHBondContact O-N 3.11Å; T224-A227 WeakPolarHBondContact O-CB 3.37Å; T224-A227 PolarHBondContact O-N 3.07Å; K225-A227 VanDerWaalsContact C-N 3.32Å; K225-A227 PolarHBondContact O-N 2.89Å; A227-R230 PolarHBondContact O-N 3.43Å; A227-L231 WeakPolarHBondContact O-CB 3.19Å; A227-L231 VanDerWaalsContact O-CG 3.3Å; A227-L231 WeakPolarHBondContact O-CG 3.39Å; A227-L231 PolarHBondContact O-N 3.09Å
228	V	97.9	Very high	97	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-46.5	174.1	171.3	0	0	0	0	111.6	V208 A212 C215 T224 K225 R230 G232 L323 F340 L344	V208-V228 HydrophobicContact CG1-CG1 4.24Å; A212-V228 HydrophobicContact CB-CG1 4.42Å; C215-V228 VanDerWaalsContact SG-CG2 3.56Å; T224-V228 WeakPolarHBondContact O-CG2 3.43Å; T224-V228 PolarHBondContact O-N 3.1Å; K225-V228 WeakPolarHBondContact O-CB 3.19Å; K225-V228 PolarHBondContact O-N 3.3Å; V228-R230 PolarHBondContact O-N 3.16Å; V228-G232 PolarHBondContact O-N 2.83Å; V228-L323 HydrophobicContact CG1-CD1 4.21Å; V228-F340 HydrophobicContact CG1-CE1 4.43Å; V228-F340 HydrophobicContact CG1-CZ 4.3Å; V228-F340 HydrophobicContact CG2-CE1 3.84Å; V228-F340 HydrophobicContact CG2-CZ 4.34Å; V228-L344 HydrophobicContact CG2-CD1 3.42Å; V228-L344 VanDerWaalsContact CG2-CD1 3.42Å; V228-L344 HydrophobicContact CG2-CD2 4.19Å; V228-L344 HydrophobicContact CG2-CG 4.47Å
229	I	98.1	Very high	96.9	Very high	18 Å²	18	39.4 Å²	39.4	9%	0.092	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-46.4	178.2	-68.4	168.8	0	0	0	110.2	K225 A226 L233 L263 I264 C267 Y268	K225-I229 HydrophobicContact CG-CD1 4.16Å; K225-I229 WeakPolarHBondContact O-CG1 3.39Å; K225-I229 PolarHBondContact O-N 3.33Å; A226-I229 PolarHBondContact O-N 2.87Å; I229-L233 WeakPolarHBondContact O-CB 3.39Å; I229-L233 PolarHBondContact O-N 2.96Å; I229-L263 HydrophobicContact CG2-CD2 3.87Å; I229-L263 HydrophobicContact CG2-CG 4.1Å; I229-I264 HydrophobicContact CG2-CG1 4.44Å; I229-C267 HydrophobicContact CD1-CB 3.77Å; I229-C267 HydrophobicContact CG1-CB 3.88Å; I229-Y268 HydrophobicContact CD1-CD2 4.46Å; I229-Y268 HydrophobicContact CD1-CE2 3.82Å
230	R	97.9	Very high	96.9	Very high	96 Å²	96	36.3 Å²	36.3	36%	0.362	21%	0.209	S	C	.	.	H	α-helix	trans	-63.1	-49.5	-180	-169.4	-158.4	76.1	82.9	-7	111.9	A226 A227 V228 L233 M234 H350	A226-R230 WeakPolarHBondContact O-CB 3.49Å; A226-R230 PolarHBondContact O-N 2.91Å; A227-R230 PolarHBondContact O-N 3.43Å; V228-R230 PolarHBondContact O-N 3.16Å; R230-L233 WeakPolarHBondContact O-CB 3.45Å; R230-L233 PolarHBondContact O-N 3.36Å; R230-M234 WeakPolarHBondContact O-CG 3.49Å; R230-M234 PolarHBondContact O-N 2.92Å; R230-H350 PolarHBondContact NH2-CE1 3.31Å; R230-H350 PolarHBondContact NH2-NE2 2.82Å
231	L	97.8	Very high	96.7	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-41.7	180	-71.3	174.5	0	0	0	111.3	A227 L233 M234 E235 L323 L344 H347 E349	A227-L231 WeakPolarHBondContact O-CB 3.19Å; A227-L231 VanDerWaalsContact O-CG 3.3Å; A227-L231 WeakPolarHBondContact O-CG 3.39Å; A227-L231 PolarHBondContact O-N 3.09Å; L231-L233 VanDerWaalsContact C-N 3.31Å; L231-L233 PolarHBondContact O-N 3.22Å; L231-M234 WeakPolarHBondContact O-CB 3.5Å; L231-M234 PolarHBondContact O-N 2.89Å; L231-M234 VanDerWaalsContact O-N 3.08Å; L231-E235 PolarHBondContact O-N 2.98Å; L231-L323 HydrophobicContact CB-CD1 4.17Å; L231-L344 HydrophobicContact CD1-CB 4.07Å; L231-L344 HydrophobicContact CD1-CD2 3.88Å; L231-H347 HydrophobicContact CD1-CB 4.26Å; L231-H347 HydrophobicContact CD2-CB 4.19Å; L231-E349 HydrophobicContact CD2-CB 4.17Å; L231-E349 HydrophobicContact CD2-CG 4.46Å
232	G	97.8	Very high	96.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-40	173.3	0	0	0	0	0	112.5	V228 E235 M236	V228-G232 PolarHBondContact O-N 2.83Å; G232-E235 PolarHBondContact O-N 2.89Å; G232-M236 WeakPolarHBondContact O-CG 3.36Å; G232-M236 PolarHBondContact O-N 3.3Å
233	L	97.8	Very high	96.3	Very high	21 Å²	21	35.7 Å²	35.7	11%	0.11	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-39	173.4	-175.9	62.2	0	0	0	112.3	I229 R230 L231 M236 I237 F254 L263	I229-L233 WeakPolarHBondContact O-CB 3.39Å; I229-L233 PolarHBondContact O-N 2.96Å; R230-L233 WeakPolarHBondContact O-CB 3.45Å; R230-L233 PolarHBondContact O-N 3.36Å; L231-L233 VanDerWaalsContact C-N 3.31Å; L231-L233 PolarHBondContact O-N 3.22Å; L233-M236 HydrophobicContact CD1-CE 4.47Å; L233-M236 HydrophobicContact CD1-SD 4.36Å; L233-M236 WeakPolarHBondContact O-CB 3.25Å; L233-M236 PolarHBondContact O-N 3.45Å; L233-I237 HydrophobicContact CG-CD1 4.23Å; L233-I237 VanDerWaalsContact O-CG1 3.3Å; L233-I237 WeakPolarHBondContact O-CG1 3.33Å; L233-I237 PolarHBondContact O-N 2.99Å; L233-F254 HydrophobicContact CD1-CB 4.29Å; L233-F254 HydrophobicContact CD1-CD1 4.24Å; L233-L263 HydrophobicContact CB-CD2 3.81Å; L233-L263 HydrophobicContact CD1-CD2 4.12Å; L233-L263 HydrophobicContact CG-CD2 4.47Å
234	M	96.9	Very high	96	Very high	47 Å²	47	29.1 Å²	29.1	23%	0.232	16%	0.159	C	C	.	.	H	α-helix	trans	-64.9	-42.3	175.4	-64.3	-56.6	117.9	0	0	111.5	R230 L231 M236 I237 S238 E349	R230-M234 WeakPolarHBondContact O-CG 3.49Å; R230-M234 PolarHBondContact O-N 2.92Å; L231-M234 WeakPolarHBondContact O-CB 3.5Å; L231-M234 PolarHBondContact O-N 2.89Å; L231-M234 VanDerWaalsContact O-N 3.08Å; M234-M236 VanDerWaalsContact C-N 3.34Å; M234-M236 PolarHBondContact O-N 2.94Å; M234-I237 HydrophobicContact CE-CD1 4.04Å; M234-I237 PolarHBondContact O-N 2.81Å; M234-I237 HydrophobicContact SD-CD1 4.34Å; M234-S238 WeakPolarHBondContact O-CB 3.33Å; M234-S238 PolarHBondContact O-N 3.37Å; M234-S238 PolarHBondContact O-OG 3.46Å; M234-E349 HydrophobicContact CB-CG 3.89Å; M234-E349 HydrophobicContact CG-CG 4.15Å
235	E	97.6	Very high	95.5	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-39.6	172.6	-75.9	-166.3	-166.8	0	0	112	L231 G232 I237 S238 F239 F321 P322 L323 F324 H347	L231-E235 PolarHBondContact O-N 2.98Å; G232-E235 PolarHBondContact O-N 2.89Å; E235-I237 PolarHBondContact O-N 2.82Å; E235-S238 PolarHBondContact O-N 2.99Å; E235-F239 WeakPolarHBondContact O-CB 3.32Å; E235-F239 PolarHBondContact O-N 3.14Å; E235-F321 HydrophobicContact CB-CD1 3.98Å; E235-F321 HydrophobicContact CG-CD1 4.05Å; E235-F321 WeakPolarHBondContact O-CE1 3.5Å; E235-F321 VanDerWaalsContact OE1-C 3.25Å; E235-F321 WeakPolarHBondContact OE1-CA 3.4Å; E235-P322 WeakPolarHBondContact OE1-CD 3.27Å; E235-P322 WeakPolarHBondContact OE1-CG 3.42Å; E235-P322 VanDerWaalsContact OE1-N 3.09Å; E235-L323 WeakPolarHBondContact OE1-CB 3.42Å; E235-L323 PolarHBondContact OE1-N 3.34Å; E235-F324 HydrophobicContact CB-CD1 4.44Å; E235-F324 HydrophobicContact CB-CD2 4.29Å; E235-F324 HydrophobicContact CB-CE1 4.01Å; E235-F324 HydrophobicContact CB-CE2 3.85Å; E235-F324 HydrophobicContact CB-CZ 3.69Å; E235-F324 WeakPolarHBondContact OE2-CB 3.32Å; E235-F324 WeakPolarHBondContact OE2-CD1 3.45Å; E235-F324 WeakPolarHBondContact OE2-CG 3.32Å; E235-F324 PolarHBondContact OE2-N 3.45Å; E235-H347 IonicContact OE1-CD2 2.67Å; E235-H347 IonicContact OE1-NE2 3.39Å; E235-H347 PolarHBondContact OE1-NE2 3.18Å; E235-H347 VanDerWaalsContact OE1-NE2 3.13Å
236	M	97.4	Very high	94.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-46.2	173.5	-70	167	62.7	0	0	112	C201 L204 K205 V208 G232 L233 M234 F239 A240 F254 L263 F324	C201-M236 HydrophobicContact CB-CE 4.12Å; L204-M236 HydrophobicContact CB-CG 3.71Å; L204-M236 HydrophobicContact CD1-CB 4.2Å; L204-M236 HydrophobicContact CD1-CG 4.15Å; K205-M236 HydrophobicContact CB-CE 4.03Å; K205-M236 HydrophobicContact CB-SD 4.3Å; V208-M236 HydrophobicContact CG2-SD 4.17Å; G232-M236 WeakPolarHBondContact O-CG 3.36Å; G232-M236 PolarHBondContact O-N 3.3Å; L233-M236 HydrophobicContact CD1-CE 4.47Å; L233-M236 HydrophobicContact CD1-SD 4.36Å; L233-M236 WeakPolarHBondContact O-CB 3.25Å; L233-M236 PolarHBondContact O-N 3.45Å; M234-M236 VanDerWaalsContact C-N 3.34Å; M234-M236 PolarHBondContact O-N 2.94Å; M236-F239 PolarHBondContact O-N 3.47Å; M236-A240 WeakPolarHBondContact O-CB 3.4Å; M236-A240 PolarHBondContact O-N 2.96Å; M236-F254 HydrophobicContact CB-CE1 4.3Å; M236-L263 HydrophobicContact SD-CD1 4.14Å; M236-L263 HydrophobicContact SD-CD2 4.01Å; M236-F324 HydrophobicContact CG-CE1 4.5Å; M236-F324 HydrophobicContact CG-CZ 3.89Å
237	I	96.3	Very high	94.1	Very high	22 Å²	22	34.8 Å²	34.8	11%	0.113	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-48.4	177.9	-67.6	163.2	0	0	0	110.6	L233 M234 E235 F239 A240 K241 F254	L233-I237 HydrophobicContact CG-CD1 4.23Å; L233-I237 VanDerWaalsContact O-CG1 3.3Å; L233-I237 WeakPolarHBondContact O-CG1 3.33Å; L233-I237 PolarHBondContact O-N 2.99Å; M234-I237 HydrophobicContact CE-CD1 4.04Å; M234-I237 PolarHBondContact O-N 2.81Å; M234-I237 HydrophobicContact SD-CD1 4.34Å; E235-I237 PolarHBondContact O-N 2.82Å; I237-F239 VanDerWaalsContact C-N 3.32Å; I237-F239 PolarHBondContact O-N 3.47Å; I237-A240 PolarHBondContact O-N 3.21Å; I237-K241 HydrophobicContact CG2-CD 4.14Å; I237-K241 WeakPolarHBondContact O-CB 3.47Å; I237-K241 WeakPolarHBondContact O-CG 3.42Å; I237-K241 PolarHBondContact O-N 3.43Å; I237-F254 HydrophobicContact CB-CE1 4.28Å; I237-F254 HydrophobicContact CB-CE2 4.46Å; I237-F254 HydrophobicContact CB-CZ 4.28Å; I237-F254 HydrophobicContact CD1-CB 4.41Å; I237-F254 HydrophobicContact CD1-CD1 4.48Å; I237-F254 HydrophobicContact CD1-CG 4.23Å; I237-F254 HydrophobicContact CG1-CB 4.19Å; I237-F254 HydrophobicContact CG1-CD1 3.47Å; I237-F254 VanDerWaalsContact CG1-CD1 3.47Å; I237-F254 HydrophobicContact CG1-CD2 3.76Å; I237-F254 HydrophobicContact CG1-CE1 3.7Å; I237-F254 HydrophobicContact CG1-CE2 3.98Å; I237-F254 HydrophobicContact CG1-CG 3.51Å; I237-F254 HydrophobicContact CG1-CZ 3.96Å; I237-F254 HydrophobicContact CG2-CE2 4.47Å
238	S	95.2	Very high	93.7	Very high	41 Å²	41	37.4 Å²	37.4	29%	0.287	20%	0.201	S	C	.	.	H	α-helix	trans	-64.2	-38	-179.6	-71.8	0	0	0	0	111.9	M234 E235 V242	M234-S238 WeakPolarHBondContact O-CB 3.33Å; M234-S238 PolarHBondContact O-N 3.37Å; M234-S238 PolarHBondContact O-OG 3.46Å; E235-S238 PolarHBondContact O-N 2.99Å; S238-V242 VanDerWaalsContact O-CG2 3.25Å; S238-V242 WeakPolarHBondContact O-CG2 3.32Å; S238-V242 PolarHBondContact O-N 3.31Å
239	F	95.2	Very high	93.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.5	-51.1	177.2	-169.1	-86.5	0	0	0	110.2	L130 I200 L204 E235 M236 I237 K241 V242 F243 V308 I311 L312 F321 F324	L130-F239 HydrophobicContact CD1-CE1 4.11Å; L130-F239 HydrophobicContact CD1-CZ 4.25Å; L130-F239 HydrophobicContact CD2-CE1 3.77Å; L130-F239 HydrophobicContact CD2-CZ 4.43Å; I200-F239 HydrophobicContact CD1-CD1 4.4Å; I200-F239 HydrophobicContact CD1-CE1 4.07Å; I200-F239 HydrophobicContact CG1-CD1 4.19Å; I200-F239 HydrophobicContact CG1-CE1 4.34Å; L204-F239 HydrophobicContact CD1-CB 3.93Å; L204-F239 HydrophobicContact CD1-CD1 3.67Å; L204-F239 HydrophobicContact CD1-CE1 4.48Å; L204-F239 HydrophobicContact CD1-CG 3.99Å; L204-F239 HydrophobicContact CD2-CD1 4.06Å; L204-F239 HydrophobicContact CD2-CE1 4.16Å; L204-F239 HydrophobicContact CD2-CG 4.41Å; L204-F239 HydrophobicContact CG-CD1 4.42Å; E235-F239 WeakPolarHBondContact O-CB 3.32Å; E235-F239 PolarHBondContact O-N 3.14Å; M236-F239 PolarHBondContact O-N 3.47Å; I237-F239 VanDerWaalsContact C-N 3.32Å; I237-F239 PolarHBondContact O-N 3.47Å; F239-K241 VanDerWaalsContact C-N 3.32Å; F239-K241 PolarHBondContact O-N 2.99Å; F239-V242 PolarHBondContact O-N 3.36Å; F239-F243 HydrophobicContact CD1-CB 4.43Å; F239-F243 AromaticContact CD1-CD2 3.65Å; F239-F243 HydrophobicContact CD1-CD2 3.65Å; F239-F243 HydrophobicContact CD1-CE2 4.41Å; F239-F243 HydrophobicContact CD1-CG 4.39Å; F239-F243 AromaticContact CD2-CD2 3.62Å; F239-F243 HydrophobicContact CD2-CD2 3.62Å; F239-F243 AromaticContact CD2-CE2 3.53Å; F239-F243 HydrophobicContact CD2-CE2 3.53Å; F239-F243 HydrophobicContact CE1-CB 4.17Å; F239-F243 AromaticContact CE1-CD2 3.57Å; F239-F243 HydrophobicContact CE1-CD2 3.57Å; F239-F243 HydrophobicContact CE1-CE2 4.28Å; F239-F243 HydrophobicContact CE1-CG 4.05Å; F239-F243 AromaticContact CE2-CD2 3.51Å; F239-F243 HydrophobicContact CE2-CD2 3.51Å; F239-F243 AromaticContact CE2-CE2 3.32Å; F239-F243 HydrophobicContact CE2-CE2 3.32Å; F239-F243 HydrophobicContact CE2-CG 4.48Å; F239-F243 HydrophobicContact CE2-CZ 4.17Å; F239-F243 AromaticContact CG-CD2 3.69Å; F239-F243 HydrophobicContact CG-CD2 3.69Å; F239-F243 HydrophobicContact CG-CE2 4.08Å; F239-F243 AromaticContact CZ-CD2 3.49Å; F239-F243 HydrophobicContact CZ-CD2 3.49Å; F239-F243 VanDerWaalsContact CZ-CD2 3.49Å; F239-F243 AromaticContact CZ-CE2 3.75Å; F239-F243 HydrophobicContact CZ-CE2 3.75Å; F239-F243 HydrophobicContact CZ-CG 4.09Å; F239-F243 HydrophobicContact CZ-CZ 4.49Å; F239-F243 WeakPolarHBondContact O-CD2 3.42Å; F239-F243 PolarHBondContact O-N 3.12Å; F239-V308 HydrophobicContact CD2-CG1 4.31Å; F239-V308 HydrophobicContact CE2-CG1 3.74Å; F239-V308 HydrophobicContact CE2-CG2 4.42Å; F239-V308 HydrophobicContact CZ-CG1 4.29Å; F239-V308 HydrophobicContact CZ-CG2 4.16Å; F239-I311 HydrophobicContact CZ-CG2 4.41Å; F239-L312 HydrophobicContact CD2-CD2 4.12Å; F239-L312 HydrophobicContact CE2-CD2 3.92Å; F239-L312 HydrophobicContact CE2-CG 4.26Å; F239-F321 HydrophobicContact CB-CD1 4.43Å; F239-F321 HydrophobicContact CB-CE1 3.66Å; F239-F321 HydrophobicContact CB-CZ 4.14Å; F239-F321 HydrophobicContact CD2-CD1 4.46Å; F239-F321 HydrophobicContact CD2-CE1 4.1Å; F239-F321 HydrophobicContact CD2-CZ 4.19Å; F239-F321 HydrophobicContact CG-CE1 4.4Å; F239-F324 HydrophobicContact CB-CE2 4.21Å; F239-F324 HydrophobicContact CD2-CE2 4.41Å; F239-F324 HydrophobicContact CG-CE2 4.45Å
240	A	95.1	Very high	93.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.8	-43.1	178.1	0	0	0	0	0	112.3	I200 M236 I237 V242 F243 C244 V249 F254	I200-A240 HydrophobicContact CG2-CB 3.95Å; M236-A240 WeakPolarHBondContact O-CB 3.4Å; M236-A240 PolarHBondContact O-N 2.96Å; I237-A240 PolarHBondContact O-N 3.21Å; A240-V242 PolarHBondContact O-N 3.15Å; A240-V242 VanDerWaalsContact O-N 3.16Å; A240-F243 PolarHBondContact O-N 3.32Å; A240-C244 VanDerWaalsContact O-CB 3.22Å; A240-C244 WeakPolarHBondContact O-CB 3.39Å; A240-C244 PolarHBondContact O-N 2.64Å; A240-V249 HydrophobicContact CB-CG1 4.06Å; A240-F254 HydrophobicContact CB-CE1 4.3Å; A240-F254 HydrophobicContact CB-CZ 3.61Å
241	K	93.8	Very high	92.8	Very high	122 Å²	122	41.8 Å²	41.8	53%	0.53	23%	0.232	S	C	.	.	H	α-helix	trans	-58	-29.1	176.9	-78.3	176.3	178.8	175.4	0	113.8	I237 F239 V249	I237-K241 HydrophobicContact CG2-CD 4.14Å; I237-K241 WeakPolarHBondContact O-CB 3.47Å; I237-K241 WeakPolarHBondContact O-CG 3.42Å; I237-K241 PolarHBondContact O-N 3.43Å; F239-K241 VanDerWaalsContact C-N 3.32Å; F239-K241 PolarHBondContact O-N 2.99Å; K241-V249 HydrophobicContact CG-CB 4.1Å; K241-V249 HydrophobicContact CG-CG1 3.83Å
242	V	91.8	Very high	92.6	Very high	61 Å²	61	44.5 Å²	44.5	37%	0.37	26%	0.255	S	S	.	.	H	α-helix	trans	-87.9	-40.3	-178.7	173.4	0	0	0	0	111.2	S238 F239 A240 M317	S238-V242 VanDerWaalsContact O-CG2 3.25Å; S238-V242 WeakPolarHBondContact O-CG2 3.32Å; S238-V242 PolarHBondContact O-N 3.31Å; F239-V242 PolarHBondContact O-N 3.36Å; A240-V242 PolarHBondContact O-N 3.15Å; A240-V242 VanDerWaalsContact O-N 3.16Å; V242-M317 HydrophobicContact CB-CE 4.48Å; V242-M317 HydrophobicContact CG1-CE 3.93Å; V242-M317 HydrophobicContact CG1-SD 3.83Å; V242-M317 HydrophobicContact CG2-CE 3.82Å
243	F	90.1	Very high	92.5	Very high	30 Å²	30	44.7 Å²	44.7	13%	0.132	26%	0.256	C	S	.	.	H	α-helix	trans	-106.6	-22.2	-167.1	-63.9	-75.5	0	0	0	114.9	L130 F239 A240 T245 I311 L312 K315 M317	L130-F243 HydrophobicContact CB-CB 4.49Å; L130-F243 HydrophobicContact CB-CD1 4.43Å; L130-F243 HydrophobicContact CD2-CB 3.57Å; L130-F243 HydrophobicContact CD2-CG 4.33Å; F239-F243 HydrophobicContact CD1-CB 4.43Å; F239-F243 AromaticContact CD1-CD2 3.65Å; F239-F243 HydrophobicContact CD1-CD2 3.65Å; F239-F243 HydrophobicContact CD1-CE2 4.41Å; F239-F243 HydrophobicContact CD1-CG 4.39Å; F239-F243 AromaticContact CD2-CD2 3.62Å; F239-F243 HydrophobicContact CD2-CD2 3.62Å; F239-F243 AromaticContact CD2-CE2 3.53Å; F239-F243 HydrophobicContact CD2-CE2 3.53Å; F239-F243 HydrophobicContact CE1-CB 4.17Å; F239-F243 AromaticContact CE1-CD2 3.57Å; F239-F243 HydrophobicContact CE1-CD2 3.57Å; F239-F243 HydrophobicContact CE1-CE2 4.28Å; F239-F243 HydrophobicContact CE1-CG 4.05Å; F239-F243 AromaticContact CE2-CD2 3.51Å; F239-F243 HydrophobicContact CE2-CD2 3.51Å; F239-F243 AromaticContact CE2-CE2 3.32Å; F239-F243 HydrophobicContact CE2-CE2 3.32Å; F239-F243 HydrophobicContact CE2-CG 4.48Å; F239-F243 HydrophobicContact CE2-CZ 4.17Å; F239-F243 AromaticContact CG-CD2 3.69Å; F239-F243 HydrophobicContact CG-CD2 3.69Å; F239-F243 HydrophobicContact CG-CE2 4.08Å; F239-F243 AromaticContact CZ-CD2 3.49Å; F239-F243 HydrophobicContact CZ-CD2 3.49Å; F239-F243 VanDerWaalsContact CZ-CD2 3.49Å; F239-F243 AromaticContact CZ-CE2 3.75Å; F239-F243 HydrophobicContact CZ-CE2 3.75Å; F239-F243 HydrophobicContact CZ-CG 4.09Å; F239-F243 HydrophobicContact CZ-CZ 4.49Å; F239-F243 WeakPolarHBondContact O-CD2 3.42Å; F239-F243 PolarHBondContact O-N 3.12Å; A240-F243 PolarHBondContact O-N 3.32Å; F243-T245 PolarHBondContact O-N 3.14Å; F243-I311 HydrophobicContact CD1-CG2 3.93Å; F243-I311 HydrophobicContact CE1-CG2 3.29Å; F243-I311 HydrophobicContact CE2-CG2 4.35Å; F243-I311 HydrophobicContact CZ-CG2 3.56Å; F243-L312 HydrophobicContact CE2-CD2 4.11Å; F243-L312 HydrophobicContact CZ-CD2 4.24Å; F243-K315 HydrophobicContact CE1-CG 3.9Å; F243-K315 HydrophobicContact CZ-CG 4.15Å; F243-M317 HydrophobicContact CZ-SD 4.4Å
244	C	90.1	Very high	92.5	Very high	7 Å²	7	43.8 Å²	43.8	5%	0.047	25%	0.251	C	S	.	.			trans	-86.9	95.1	175.2	-61.1	0	0	0	0	109.8	D196 A240 V249	D196-C244 HydrophobicContact CB-CB 4Å; A240-C244 VanDerWaalsContact O-CB 3.22Å; A240-C244 WeakPolarHBondContact O-CB 3.39Å; A240-C244 PolarHBondContact O-N 2.64Å; C244-V249 HydrophobicContact CB-CG2 3.91Å
245	T	85.4	Confident	92.5	Very high	115 Å²	115	47.6 Å²	47.6	71%	0.706	27%	0.272	S	S	*	.			trans	-101.1	-15.1	-174.2	59.2	0	0	0	0	114.3	F243	F243-T245 PolarHBondContact O-N 3.14Å
246	N	83.6	Confident	92.5	Very high	84 Å²	84	50 Å²	50	45%	0.449	28%	0.284	S	S	.	.	S	Bend	trans	-83.6	-12.9	-177	-48.1	-66.9	0	0	0	114	E135 D196	E135-N246 PolarHBondContact OE1-ND2 3.39Å; D196-N246 VanDerWaalsContact OD2-CB 3.25Å; D196-N246 WeakPolarHBondContact OD2-CB 3.33Å; D196-N246 PolarHBondContact OD2-ND2 3.38Å
247	C	83.5	Confident	92.5	Very high	20 Å²	20	50.1 Å²	50.1	14%	0.135	28%	0.284	C	S	.	.	S	Bend	trans	-142.8	155.2	176.5	68.4	0	0	0	0	112.3	V249	C247-V249 PolarHBondContact O-N 3.45Å
248	P	88.2	Confident	92.5	Very high	95 Å²	95	49 Å²	49	62%	0.617	28%	0.279	S	S	*	.			trans	-62.8	131.3	174.6	-19.8	32.2	0	0	0	111.2	E194 K250	E194-P248 WeakPolarHBondContact CG-O 3.09Å; P248-K250 PolarHBondContact O-N 2.77Å
249	V	92.9	Very high	92.6	Very high	31 Å²	31	47.1 Å²	47.1	19%	0.188	27%	0.265	C	S	.	.			trans	-85.6	99.5	175.8	-175.4	0	0	0	0	109.8	V197 A240 K241 C244 C247 F254	V197-V249 HydrophobicContact CG2-CB 4.22Å; V197-V249 HydrophobicContact CG2-CG1 4.05Å; V197-V249 HydrophobicContact CG2-CG2 3.9Å; A240-V249 HydrophobicContact CB-CG1 4.06Å; K241-V249 HydrophobicContact CG-CB 4.1Å; K241-V249 HydrophobicContact CG-CG1 3.83Å; C244-V249 HydrophobicContact CB-CG2 3.91Å; C247-V249 PolarHBondContact O-N 3.45Å; V249-F254 HydrophobicContact CG1-CE2 3.76Å; V249-F254 HydrophobicContact CG1-CZ 4.1Å
250	K	93	Very high	92.7	Very high	97 Å²	97	49.1 Å²	49.1	42%	0.422	28%	0.277	S	S	.	.			trans	-89.1	126.4	176.5	-63.6	-174.3	-168.2	147.4	0	110.2	E194 P248 A252 T253	E194-K250 WeakPolarHBondContact OE1-CD 3.36Å; E194-K250 WeakPolarHBondContact OE1-CE 3.43Å; E194-K250 IonicContact OE1-NZ 3.72Å; E194-K250 PolarHBondContact OE1-NZ 2.84Å; P248-K250 PolarHBondContact O-N 2.77Å; K250-A252 PolarHBondContact O-N 3.45Å; K250-A252 VanDerWaalsContact O-N 3.12Å; K250-T253 WeakPolarHBondContact O-CB 3.36Å; K250-T253 PolarHBondContact O-N 3.36Å; K250-T253 PolarHBondContact O-OG1 3.05Å
251	P	88.9	Confident	92.8	Very high	79 Å²	79	50.4 Å²	50.4	51%	0.513	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-55.5	-30	174.6	-27.8	36	0	0	0	113.7	T253 F254	P251-T253 VanDerWaalsContact C-N 3.26Å; P251-T253 PolarHBondContact O-N 2.89Å; P251-F254 WeakPolarHBondContact O-CB 3.49Å; P251-F254 PolarHBondContact O-N 3.33Å; P251-F254 VanDerWaalsContact O-N 3.15Å
252	A	94.6	Very high	92.8	Very high	60 Å²	60	44.7 Å²	44.7	50%	0.496	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-60.3	-32.2	176.8	0	0	0	0	0	113.3	K250 F254 L255	K250-A252 PolarHBondContact O-N 3.45Å; K250-A252 VanDerWaalsContact O-N 3.12Å; A252-F254 PolarHBondContact O-N 3.32Å; A252-L255 WeakPolarHBondContact O-CB 3.31Å; A252-L255 PolarHBondContact O-N 3.01Å
253	T	95.8	Very high	93.1	Very high	4 Å²	4	41.8 Å²	41.8	3%	0.025	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-62.9	-26.2	177.9	-49.1	0	0	0	0	112	V192 E194 V197 V198 K250 P251 L255 E256	V192-T253 HydrophobicContact CG2-CG2 4.32Å; E194-T253 HydrophobicContact CB-CG2 4.33Å; V197-T253 HydrophobicContact CB-CG2 4.05Å; V197-T253 HydrophobicContact CG1-CG2 3.7Å; V198-T253 HydrophobicContact CG2-CG2 3.98Å; K250-T253 WeakPolarHBondContact O-CB 3.36Å; K250-T253 PolarHBondContact O-N 3.36Å; K250-T253 PolarHBondContact O-OG1 3.05Å; P251-T253 VanDerWaalsContact C-N 3.26Å; P251-T253 PolarHBondContact O-N 2.89Å; T253-L255 VanDerWaalsContact C-N 3.25Å; T253-L255 PolarHBondContact O-N 2.96Å; T253-E256 WeakPolarHBondContact O-CB 3.4Å; T253-E256 PolarHBondContact O-N 3.47Å
254	F	96.9	Very high	93.4	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.009	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-76.2	-14.5	175.9	-64.2	-95.2	0	0	0	113.1	V197 C201 L233 M236 I237 A240 V249 P251 A252 G259 V260	V197-F254 HydrophobicContact CG1-CD2 4.31Å; V197-F254 HydrophobicContact CG1-CE1 4.34Å; V197-F254 HydrophobicContact CG1-CE2 3.6Å; V197-F254 HydrophobicContact CG1-CZ 3.6Å; C201-F254 VanDerWaalsContact SG-CE1 3.52Å; L233-F254 HydrophobicContact CD1-CB 4.29Å; L233-F254 HydrophobicContact CD1-CD1 4.24Å; M236-F254 HydrophobicContact CB-CE1 4.3Å; I237-F254 HydrophobicContact CB-CE1 4.28Å; I237-F254 HydrophobicContact CB-CE2 4.46Å; I237-F254 HydrophobicContact CB-CZ 4.28Å; I237-F254 HydrophobicContact CD1-CB 4.41Å; I237-F254 HydrophobicContact CD1-CD1 4.48Å; I237-F254 HydrophobicContact CD1-CG 4.23Å; I237-F254 HydrophobicContact CG1-CB 4.19Å; I237-F254 HydrophobicContact CG1-CD1 3.47Å; I237-F254 VanDerWaalsContact CG1-CD1 3.47Å; I237-F254 HydrophobicContact CG1-CD2 3.76Å; I237-F254 HydrophobicContact CG1-CE1 3.7Å; I237-F254 HydrophobicContact CG1-CE2 3.98Å; I237-F254 HydrophobicContact CG1-CG 3.51Å; I237-F254 HydrophobicContact CG1-CZ 3.96Å; I237-F254 HydrophobicContact CG2-CE2 4.47Å; A240-F254 HydrophobicContact CB-CE1 4.3Å; A240-F254 HydrophobicContact CB-CZ 3.61Å; V249-F254 HydrophobicContact CG1-CE2 3.76Å; V249-F254 HydrophobicContact CG1-CZ 4.1Å; P251-F254 WeakPolarHBondContact O-CB 3.49Å; P251-F254 PolarHBondContact O-N 3.33Å; P251-F254 VanDerWaalsContact O-N 3.15Å; A252-F254 PolarHBondContact O-N 3.32Å; F254-G259 WeakPolarHBondContact O-CA 3.45Å; F254-V260 WeakPolarHBondContact O-CB 3.25Å; F254-V260 PolarHBondContact O-N 2.77Å
255	L	97.1	Very high	93.6	Very high	127 Å²	127	45.8 Å²	45.8	67%	0.665	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-86.8	-11.9	173.7	-55.9	179.9	0	0	0	112.3	A252 T253	A252-L255 WeakPolarHBondContact O-CB 3.31Å; A252-L255 PolarHBondContact O-N 3.01Å; T253-L255 VanDerWaalsContact C-N 3.25Å; T253-L255 PolarHBondContact O-N 2.96Å
256	E	98	Very high	93.9	Very high	54 Å²	54	40.7 Å²	40.7	25%	0.252	24%	0.237	S	C	.	.	S	Bend	trans	-71.6	168.1	172.8	-60.9	-68.8	165.5	0	0	111.4	T166 T190 V192 T253 C258 G259	T166-E256 HydrophobicContact CG2-CB 4.14Å; T166-E256 HydrophobicContact CG2-CG 4.48Å; T166-E256 WeakPolarHBondContact OG1-CB 3.47Å; T190-E256 WeakPolarHBondContact CG2-OE2 3.47Å; V192-E256 HydrophobicContact CG1-CG 4.16Å; T253-E256 WeakPolarHBondContact O-CB 3.4Å; T253-E256 PolarHBondContact O-N 3.47Å; E256-C258 PolarHBondContact O-N 2.79Å; E256-C258 VanDerWaalsContact O-N 3.14Å; E256-G259 PolarHBondContact O-N 3.02Å
257	S	97.1	Very high	94.5	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.007	22%	0.216	C	C	.	.	I	π-helix	trans	-54.5	-35.7	-179.1	176.7	0	0	0	0	113.6	G150 A151 E164 T166 G259 D262	G150-S257 WeakPolarHBondContact CA-OG 3.31Å; A151-S257 PolarHBondContact N-OG 3.27Å; A151-S257 VanDerWaalsContact N-OG 3.15Å; E164-S257 WeakPolarHBondContact O-CB 3.45Å; E164-S257 PolarHBondContact O-OG 2.96Å; T166-S257 PolarHBondContact OG1-N 3.02Å; S257-G259 PolarHBondContact O-N 2.85Å; S257-D262 WeakPolarHBondContact O-CB 3.46Å; S257-D262 PolarHBondContact O-N 2.91Å
258	C	96.6	Very high	94.9	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-62.6	-25.8	177	61.1	0	0	0	0	114.4	M149 T166 V198 C201 E256	M149-C258 HydrophobicContact CB-CB 3.69Å; T166-C258 PolarHBondContact OG1-N 3.09Å; V198-C258 HydrophobicContact CG1-CB 3.89Å; C201-C258 WeakPolarHBondContact CB-O 3.13Å; E256-C258 PolarHBondContact O-N 2.79Å; E256-C258 VanDerWaalsContact O-N 3.14Å
259	G	96.9	Very high	94.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-96.2	-98.7	-178.3	0	0	0	0	0	111.6	F254 E256 S257 A261 L263	F254-G259 WeakPolarHBondContact O-CA 3.45Å; E256-G259 PolarHBondContact O-N 3.02Å; S257-G259 PolarHBondContact O-N 2.85Å; G259-A261 PolarHBondContact O-N 3.31Å; G259-L263 VanDerWaalsContact O-CB 3.22Å; G259-L263 WeakPolarHBondContact O-CB 3.49Å; G259-L263 PolarHBondContact O-N 2.72Å
260	V	97.4	Very high	94.4	Very high	42 Å²	42	38 Å²	38	26%	0.255	22%	0.222	S	C	.	.	I	π-helix	trans	-61.7	-39.3	-170.6	68.5	0	0	0	0	113.1	F254 I264	F254-V260 WeakPolarHBondContact O-CB 3.25Å; F254-V260 PolarHBondContact O-N 2.77Å; V260-I264 HydrophobicContact CG2-CD1 3.78Å; V260-I264 HydrophobicContact CG2-CG1 4.38Å; V260-I264 WeakPolarHBondContact O-CB 3.18Å; V260-I264 WeakPolarHBondContact O-CG1 3.32Å; V260-I264 PolarHBondContact O-N 2.84Å
261	A	96.6	Very high	94.1	Very high	27 Å²	27	38.8 Å²	38.8	22%	0.223	22%	0.223	C	C	.	.	I	π-helix	trans	-70.3	-48.3	-177.8	0	0	0	0	0	111.8	A151 G259 L263 I264 T265	A151-A261 HydrophobicContact CB-CB 3.93Å; G259-A261 PolarHBondContact O-N 3.31Å; A261-L263 VanDerWaalsContact C-N 3.26Å; A261-L263 PolarHBondContact O-N 2.83Å; A261-I264 PolarHBondContact O-N 2.88Å; A261-T265 PolarHBondContact O-N 2.82Å
262	D	95.4	Very high	94.3	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-37	177.3	-166.4	13.2	0	0	0	110.8	K121 G150 A151 K205 S257 T265 T266	K121-D262 VanDerWaalsContact NZ-CG 3.33Å; K121-D262 IonicContact NZ-OD1 3.21Å; K121-D262 PolarHBondContact NZ-OD1 2.89Å; K121-D262 IonicContact NZ-OD2 3.86Å; K121-D262 PolarHBondContact NZ-OD2 3.25Å; G150-D262 VanDerWaalsContact O-CG 3.32Å; A151-D262 HydrophobicContact CB-CB 4.46Å; K205-D262 WeakPolarHBondContact CE-OD2 3.29Å; K205-D262 IonicContact NZ-OD1 3.13Å; S257-D262 WeakPolarHBondContact O-CB 3.46Å; S257-D262 PolarHBondContact O-N 2.91Å; D262-T265 WeakPolarHBondContact O-CG2 3.15Å; D262-T266 WeakPolarHBondContact O-CB 3.47Å; D262-T266 PolarHBondContact O-N 2.86Å; D262-T266 PolarHBondContact O-OG1 3.16Å; D262-T266 PolarHBondContact OD1-OG1 3.46Å
263	L	96.9	Very high	94.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-52.6	173.8	178.8	62.5	0	0	0	111.7	K205 V208 I229 L233 M236 G259 A261 T266 C267	K205-L263 HydrophobicContact CB-CB 4.27Å; K205-L263 HydrophobicContact CB-CD1 3.87Å; V208-L263 HydrophobicContact CB-CD1 3.6Å; V208-L263 HydrophobicContact CG1-CD1 3.73Å; V208-L263 HydrophobicContact CG2-CD1 4.06Å; I229-L263 HydrophobicContact CG2-CD2 3.87Å; I229-L263 HydrophobicContact CG2-CG 4.1Å; L233-L263 HydrophobicContact CB-CD2 3.81Å; L233-L263 HydrophobicContact CD1-CD2 4.12Å; L233-L263 HydrophobicContact CG-CD2 4.47Å; M236-L263 HydrophobicContact SD-CD1 4.14Å; M236-L263 HydrophobicContact SD-CD2 4.01Å; G259-L263 VanDerWaalsContact O-CB 3.22Å; G259-L263 WeakPolarHBondContact O-CB 3.49Å; G259-L263 PolarHBondContact O-N 2.72Å; A261-L263 VanDerWaalsContact C-N 3.26Å; A261-L263 PolarHBondContact O-N 2.83Å; L263-T266 PolarHBondContact O-N 3.35Å; L263-C267 WeakPolarHBondContact O-CB 3.48Å; L263-C267 PolarHBondContact O-N 3.34Å; L263-C267 PolarHBondContact O-SG 3.06Å
264	I	96.6	Very high	94.3	Very high	79 Å²	79	38.3 Å²	38.3	41%	0.405	20%	0.2	S	C	.	.	H	α-helix	trans	-59.9	-54.9	-179.9	-70.3	167	0	0	0	110.3	I229 V260 A261 T266 C267 Y268	I229-I264 HydrophobicContact CG2-CG1 4.44Å; V260-I264 HydrophobicContact CG2-CD1 3.78Å; V260-I264 HydrophobicContact CG2-CG1 4.38Å; V260-I264 WeakPolarHBondContact O-CB 3.18Å; V260-I264 WeakPolarHBondContact O-CG1 3.32Å; V260-I264 PolarHBondContact O-N 2.84Å; A261-I264 PolarHBondContact O-N 2.88Å; I264-T266 PolarHBondContact O-N 2.88Å; I264-C267 PolarHBondContact O-N 3.27Å; I264-C267 VanDerWaalsContact O-N 3.1Å; I264-Y268 HydrophobicContact CG2-CD2 4.02Å; I264-Y268 HydrophobicContact CG2-CE2 4.25Å; I264-Y268 WeakPolarHBondContact O-CD2 3.45Å; I264-Y268 PolarHBondContact O-N 3.1Å; I264-Y268 VanDerWaalsContact O-N 3.11Å
265	T	93.4	Very high	94.2	Very high	41 Å²	41	38.2 Å²	38.2	25%	0.252	20%	0.2	S	C	.	.	H	α-helix	trans	-59.3	-36.3	-176.4	-162.9	0	0	0	0	111.7	A151 A261 D262 Y268 G269	A151-T265 HydrophobicContact CB-CG2 3.78Å; A261-T265 PolarHBondContact O-N 2.82Å; D262-T265 WeakPolarHBondContact O-CG2 3.15Å; T265-Y268 PolarHBondContact O-N 3.47Å; T265-G269 PolarHBondContact O-N 2.8Å
266	T	92.1	Very high	94.2	Very high	8 Å²	8	32.2 Å²	32.2	5%	0.049	17%	0.168	C	C	.	.	H	α-helix	trans	-72.1	-38.1	179.1	-54	0	0	0	0	112.1	K205 A209 D262 L263 I264 Y268 G270	K205-T266 HydrophobicContact CD-CG2 3.88Å; K205-T266 WeakPolarHBondContact CD-OG1 3.29Å; K205-T266 VanDerWaalsContact NZ-CG2 3.29Å; K205-T266 PolarHBondContact NZ-OG1 2.96Å; A209-T266 HydrophobicContact CB-CG2 3.45Å; A209-T266 VanDerWaalsContact CB-CG2 3.45Å; D262-T266 WeakPolarHBondContact O-CB 3.47Å; D262-T266 PolarHBondContact O-N 2.86Å; D262-T266 PolarHBondContact O-OG1 3.16Å; D262-T266 PolarHBondContact OD1-OG1 3.46Å; L263-T266 PolarHBondContact O-N 3.35Å; I264-T266 PolarHBondContact O-N 2.88Å; T266-Y268 VanDerWaalsContact C-N 3.27Å; T266-Y268 PolarHBondContact O-N 3.35Å; T266-G270 VanDerWaalsContact O-CA 3.26Å; T266-G270 WeakPolarHBondContact O-CA 3.37Å; T266-G270 PolarHBondContact O-N 2.93Å
267	C	95.9	Very high	94.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-70.6	-19.6	177.5	-71.5	0	0	0	0	113.6	A209 A212 I229 L263 I264 R273	A209-C267 VanDerWaalsContact CA-SG 3.59Å; A212-C267 HydrophobicContact CB-CB 3.83Å; I229-C267 HydrophobicContact CD1-CB 3.77Å; I229-C267 HydrophobicContact CG1-CB 3.88Å; L263-C267 WeakPolarHBondContact O-CB 3.48Å; L263-C267 PolarHBondContact O-N 3.34Å; L263-C267 PolarHBondContact O-SG 3.06Å; I264-C267 PolarHBondContact O-N 3.27Å; I264-C267 VanDerWaalsContact O-N 3.1Å; C267-R273 WeakPolarHBondContact O-CD 3.45Å; C267-R273 WeakPolarHBondContact O-CG 3.25Å
268	Y	92.9	Very high	94.1	Very high	112 Å²	112	32.4 Å²	32.4	44%	0.439	17%	0.172	S	C	.	.	H	α-helix	trans	-102.3	-38.8	176.3	-78.5	-88.9	0	0	0	113.6	K225 I229 I264 T265 T266 R273	K225-Y268 HydrophobicContact CD-CD1 4.5Å; K225-Y268 HydrophobicContact CD-CE1 4Å; K225-Y268 HydrophobicContact CD-CE2 4.4Å; I229-Y268 HydrophobicContact CD1-CD2 4.46Å; I229-Y268 HydrophobicContact CD1-CE2 3.82Å; I264-Y268 HydrophobicContact CG2-CD2 4.02Å; I264-Y268 HydrophobicContact CG2-CE2 4.25Å; I264-Y268 WeakPolarHBondContact O-CD2 3.45Å; I264-Y268 PolarHBondContact O-N 3.1Å; I264-Y268 VanDerWaalsContact O-N 3.11Å; T265-Y268 PolarHBondContact O-N 3.47Å; T266-Y268 VanDerWaalsContact C-N 3.27Å; T266-Y268 PolarHBondContact O-N 3.35Å; Y268-R273 VanDerWaalsContact O-CD 3.28Å; Y268-R273 WeakPolarHBondContact O-CD 3.4Å; Y268-R273 PolarHBondContact O-NE 3.5Å
269	G	85.1	Confident	94.1	Very high	54 Å²	54	33.9 Å²	33.9	56%	0.557	18%	0.178	S	C	*	.	H	α-helix	trans	-122.5	-3.5	-172.4	0	0	0	0	0	115.6	T265	T265-G269 PolarHBondContact O-N 2.8Å
270	G	84.7	Confident	94.1	Very high	8 Å²	8	34.7 Å²	34.7	8%	0.082	19%	0.185	C	C	.	.			trans	-74.9	153	-172.2	0	0	0	0	0	114.7	T266 N272 R273 K274	T266-G270 VanDerWaalsContact O-CA 3.26Å; T266-G270 WeakPolarHBondContact O-CA 3.37Å; T266-G270 PolarHBondContact O-N 2.93Å; G270-N272 PolarHBondContact O-N 2.99Å; G270-R273 WeakPolarHBondContact O-CB 3.41Å; G270-R273 PolarHBondContact O-N 3.17Å; G270-R273 VanDerWaalsContact O-N 3.14Å; G270-K274 PolarHBondContact O-N 2.85Å; G270-K274 VanDerWaalsContact O-N 3.11Å
271	R	88	Confident	94.1	Very high	114 Å²	114	38.8 Å²	38.8	43%	0.43	20%	0.199	S	C	.	.	H	α-helix	trans	-56.8	-37	172.4	-67.6	168.9	-68.3	176	4.8	112.6	K274 I275 L294 Q297	R271-K274 PolarHBondContact O-N 2.96Å; R271-I275 WeakPolarHBondContact O-CG1 3.4Å; R271-I275 PolarHBondContact O-N 3.48Å; R271-L294 HydrophobicContact CB-CD2 3.95Å; R271-L294 HydrophobicContact CG-CD2 3.98Å; R271-Q297 VanDerWaalsContact CD-OE1 3.26Å
272	N	92.5	Very high	94	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.043	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-40.5	177.2	-64.3	-55.3	0	0	0	112.1	N206 A209 V210 G270 I275 G276 P299 Q300 G301	N206-N272 VanDerWaalsContact CG-ND2 3.28Å; N206-N272 PolarHBondContact OD1-ND2 3.48Å; A209-N272 HydrophobicContact CB-CB 4Å; V210-N272 HydrophobicContact CG2-CB 3.92Å; G270-N272 PolarHBondContact O-N 2.99Å; N272-I275 PolarHBondContact O-N 3.22Å; N272-G276 PolarHBondContact O-N 2.82Å; N272-P299 VanDerWaalsContact OD1-CB 3.32Å; N272-P299 WeakPolarHBondContact OD1-CB 3.37Å; N272-Q300 PolarHBondContact OD1-N 3.02Å; N272-G301 PolarHBondContact OD1-N 3.36Å
273	R	95.9	Very high	93.8	Very high	36 Å²	36	44 Å²	44	14%	0.136	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-46.7	173.9	-174.6	-140.3	71.4	72.3	5	111.3	A209 G213 D216 C267 Y268 G270 I275 G276 E277	A209-R273 WeakPolarHBondContact O-CA 3.29Å; G213-R273 WeakPolarHBondContact CA-O 3.48Å; D216-R273 WeakPolarHBondContact OD2-CD 3.38Å; D216-R273 IonicContact OD2-CZ 3.18Å; D216-R273 IonicContact OD2-NE 2.67Å; D216-R273 IonicContact OD2-NH1 2.76Å; D216-R273 PolarHBondContact OD2-NH1 3.44Å; C267-R273 WeakPolarHBondContact O-CD 3.45Å; C267-R273 WeakPolarHBondContact O-CG 3.25Å; Y268-R273 VanDerWaalsContact O-CD 3.28Å; Y268-R273 WeakPolarHBondContact O-CD 3.4Å; Y268-R273 PolarHBondContact O-NE 3.5Å; G270-R273 WeakPolarHBondContact O-CB 3.41Å; G270-R273 PolarHBondContact O-N 3.17Å; G270-R273 VanDerWaalsContact O-N 3.14Å; R273-I275 VanDerWaalsContact C-N 3.33Å; R273-I275 PolarHBondContact O-N 3.01Å; R273-G276 PolarHBondContact O-N 2.84Å; R273-E277 IonicContact CZ-OE2 3.55Å; R273-E277 IonicContact NH1-OE2 2.63Å; R273-E277 PolarHBondContact NH1-OE2 2.97Å; R273-E277 IonicContact NH2-OE2 3.85Å; R273-E277 PolarHBondContact NH2-OE2 3.31Å; R273-E277 WeakPolarHBondContact O-CB 3.05Å; R273-E277 PolarHBondContact O-N 3.33Å
274	K	94.5	Very high	93.7	Very high	89 Å²	89	47.5 Å²	47.5	39%	0.387	26%	0.257	S	S	.	.	H	α-helix	trans	-57.4	-43.9	177.4	-172.6	-174.8	179.3	-168.9	0	112.1	G270 R271 A278 L293	G270-K274 PolarHBondContact O-N 2.85Å; G270-K274 VanDerWaalsContact O-N 3.11Å; R271-K274 PolarHBondContact O-N 2.96Å; K274-A278 WeakPolarHBondContact O-CB 3.23Å; K274-A278 PolarHBondContact O-N 3.49Å; K274-A278 VanDerWaalsContact O-N 3.12Å; K274-L293 PolarHBondContact NZ-O 2.94Å
275	I	94.8	Very high	93.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.1	-47	176.4	-71.2	-69.2	0	0	0	111.2	R271 N272 R273 E277 A278 F279 L286 L289 L293 L294 P299	R271-I275 WeakPolarHBondContact O-CG1 3.4Å; R271-I275 PolarHBondContact O-N 3.48Å; N272-I275 PolarHBondContact O-N 3.22Å; R273-I275 VanDerWaalsContact C-N 3.33Å; R273-I275 PolarHBondContact O-N 3.01Å; I275-E277 VanDerWaalsContact C-N 3.3Å; I275-E277 PolarHBondContact O-N 3.07Å; I275-A278 PolarHBondContact O-N 3.04Å; I275-F279 VanDerWaalsContact O-CB 3.3Å; I275-F279 WeakPolarHBondContact O-CB 3.37Å; I275-F279 PolarHBondContact O-N 2.82Å; I275-L286 HydrophobicContact CG2-CD2 3.57Å; I275-L289 HydrophobicContact CD1-CB 3.76Å; I275-L293 HydrophobicContact CD1-CB 4.37Å; I275-L293 HydrophobicContact CD1-CD1 4.31Å; I275-L294 HydrophobicContact CD1-CD1 3.8Å; I275-L294 HydrophobicContact CD1-CD2 4.47Å; I275-L294 HydrophobicContact CD1-CG 3.95Å; I275-L294 HydrophobicContact CG1-CD1 3.72Å; I275-L294 HydrophobicContact CG1-CD2 4.35Å; I275-L294 HydrophobicContact CG1-CG 4.19Å; I275-P299 HydrophobicContact CG1-CB 4.26Å; I275-P299 HydrophobicContact CG1-CG 4.23Å
276	G	96.4	Very high	93.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.8	-42.5	177.5	0	0	0	0	0	112.5	F214 N272 R273 F279 A280	F214-G276 WeakPolarHBondContact CD1-O 3.35Å; N272-G276 PolarHBondContact O-N 2.82Å; R273-G276 PolarHBondContact O-N 2.84Å; G276-F279 PolarHBondContact O-N 2.8Å; G276-A280 WeakPolarHBondContact O-CB 3.39Å; G276-A280 PolarHBondContact O-N 3.37Å
277	E	97.7	Very high	93.1	Very high	43 Å²	43	49.3 Å²	49.3	20%	0.201	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-49.3	176	-178.1	-169.6	177.3	0	0	112	G213 D216 R273 I275 F279 A280 K281	G213-E277 WeakPolarHBondContact O-CA 3.21Å; G213-E277 PolarHBondContact O-N 3.08Å; D216-E277 HydrophobicContact CB-CB 4.11Å; D216-E277 HydrophobicContact CB-CG 3.84Å; R273-E277 IonicContact CZ-OE2 3.55Å; R273-E277 IonicContact NH1-OE2 2.63Å; R273-E277 PolarHBondContact NH1-OE2 2.97Å; R273-E277 IonicContact NH2-OE2 3.85Å; R273-E277 PolarHBondContact NH2-OE2 3.31Å; R273-E277 WeakPolarHBondContact O-CB 3.05Å; R273-E277 PolarHBondContact O-N 3.33Å; I275-E277 VanDerWaalsContact C-N 3.3Å; I275-E277 PolarHBondContact O-N 3.07Å; E277-F279 VanDerWaalsContact C-N 3.33Å; E277-F279 PolarHBondContact O-N 2.86Å; E277-A280 PolarHBondContact O-N 3.03Å; E277-K281 HydrophobicContact CG-CD 4.11Å; E277-K281 WeakPolarHBondContact O-CG 3.46Å; E277-K281 PolarHBondContact O-N 3.26Å; E277-K281 WeakPolarHBondContact OE1-CE 3.45Å; E277-K281 IonicContact OE1-NZ 2.65Å; E277-K281 PolarHBondContact OE1-NZ 3.22Å
278	A	96.7	Very high	92.8	Very high	16 Å²	16	54.2 Å²	54.2	13%	0.132	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-38	-179.5	0	0	0	0	0	112	K274 I275 K281 T282 L289 L293	K274-A278 WeakPolarHBondContact O-CB 3.23Å; K274-A278 PolarHBondContact O-N 3.49Å; K274-A278 VanDerWaalsContact O-N 3.12Å; I275-A278 PolarHBondContact O-N 3.04Å; A278-K281 PolarHBondContact O-N 3.32Å; A278-T282 WeakPolarHBondContact O-CB 3.32Å; A278-T282 WeakPolarHBondContact O-CG2 3.5Å; A278-T282 PolarHBondContact O-N 2.77Å; A278-T282 PolarHBondContact O-OG1 3.47Å; A278-L289 HydrophobicContact CB-CD1 4.1Å; A278-L289 HydrophobicContact CB-CD2 3.84Å; A278-L293 HydrophobicContact CB-CD1 3.45Å; A278-L293 VanDerWaalsContact CB-CD1 3.45Å
279	F	96.2	Very high	92.8	Very high	31 Å²	31	49 Å²	49	14%	0.136	27%	0.268	C	S	.	.	H	α-helix	trans	-58.7	-51.4	174.1	179.6	-90.8	0	0	0	110.6	F214 I275 G276 E277 K281 T282 G283 K284 L286 L289 I330 V337	F214-F279 HydrophobicContact CD1-CD1 4.32Å; F214-F279 HydrophobicContact CE1-CB 4.49Å; F214-F279 AromaticContact CE1-CD1 3.64Å; F214-F279 HydrophobicContact CE1-CD1 3.64Å; F214-F279 HydrophobicContact CE1-CE1 4.29Å; F214-F279 HydrophobicContact CE1-CG 4.34Å; F214-F279 HydrophobicContact CZ-CD1 4.35Å; I275-F279 VanDerWaalsContact O-CB 3.3Å; I275-F279 WeakPolarHBondContact O-CB 3.37Å; I275-F279 PolarHBondContact O-N 2.82Å; G276-F279 PolarHBondContact O-N 2.8Å; E277-F279 VanDerWaalsContact C-N 3.33Å; E277-F279 PolarHBondContact O-N 2.86Å; F279-K281 VanDerWaalsContact C-N 3.32Å; F279-K281 PolarHBondContact O-N 3.16Å; F279-T282 PolarHBondContact O-N 2.62Å; F279-G283 PolarHBondContact O-N 3.32Å; F279-K284 VanDerWaalsContact CD2-O 3.23Å; F279-K284 WeakPolarHBondContact CD2-O 3.32Å; F279-L286 HydrophobicContact CB-CD2 4.39Å; F279-L286 HydrophobicContact CD2-CD2 3.8Å; F279-L286 HydrophobicContact CD2-CG 4.15Å; F279-L286 HydrophobicContact CE2-CD2 4.44Å; F279-L286 HydrophobicContact CE2-CG 4.36Å; F279-L286 HydrophobicContact CG-CD2 4.27Å; F279-L289 VanDerWaalsContact CA-CD1 3.45Å; F279-L289 HydrophobicContact CB-CD1 3.76Å; F279-L289 HydrophobicContact CD2-CD1 4.41Å; F279-L289 VanDerWaalsContact N-CD1 3.34Å; F279-I330 HydrophobicContact CD1-CG2 4.41Å; F279-I330 HydrophobicContact CE1-CG2 3.59Å; F279-I330 HydrophobicContact CZ-CG2 4.33Å; F279-V337 HydrophobicContact CE1-CB 4.49Å
280	A	96.6	Very high	92.8	Very high	18 Å²	18	48.6 Å²	48.6	15%	0.149	25%	0.252	C	S	.	.	H	α-helix	trans	-64	-33.8	-179.8	0	0	0	0	0	113.5	F214 G276 E277 V337	F214-A280 HydrophobicContact CD1-CB 4.31Å; G276-A280 WeakPolarHBondContact O-CB 3.39Å; G276-A280 PolarHBondContact O-N 3.37Å; E277-A280 PolarHBondContact O-N 3.03Å; A280-V337 HydrophobicContact CB-CG1 4.32Å; A280-V337 HydrophobicContact CB-CG2 3.82Å
281	K	96.7	Very high	92.9	Very high	127 Å²	127	53.7 Å²	53.7	55%	0.552	28%	0.281	S	S	*	.	H	α-helix	trans	-77.9	-35.6	179.2	-74.7	178.5	175.2	177.9	0	114.1	G217 E277 A278 F279	G217-K281 WeakPolarHBondContact O-CG 3.33Å; E277-K281 HydrophobicContact CG-CD 4.11Å; E277-K281 WeakPolarHBondContact O-CG 3.46Å; E277-K281 PolarHBondContact O-N 3.26Å; E277-K281 WeakPolarHBondContact OE1-CE 3.45Å; E277-K281 IonicContact OE1-NZ 2.65Å; E277-K281 PolarHBondContact OE1-NZ 3.22Å; A278-K281 PolarHBondContact O-N 3.32Å; F279-K281 VanDerWaalsContact C-N 3.32Å; F279-K281 PolarHBondContact O-N 3.16Å
282	T	95.4	Very high	93	Very high	76 Å²	76	53.1 Å²	53.1	47%	0.466	28%	0.283	S	S	.	.	H	α-helix	trans	-110.7	-23.4	-165.8	66.2	0	0	0	0	114	A278 F279 K284	A278-T282 WeakPolarHBondContact O-CB 3.32Å; A278-T282 WeakPolarHBondContact O-CG2 3.5Å; A278-T282 PolarHBondContact O-N 2.77Å; A278-T282 PolarHBondContact O-OG1 3.47Å; F279-T282 PolarHBondContact O-N 2.62Å; T282-K284 PolarHBondContact O-N 2.99Å; T282-K284 PolarHBondContact OG1-N 2.91Å
283	G	91.6	Very high	92.7	Very high	65 Å²	65	55.1 Å²	55.1	67%	0.67	29%	0.294	S	S	*	.			trans	66.4	9.2	-171.9	0	0	0	0	0	114.4	F279	F279-G283 PolarHBondContact O-N 3.32Å
284	K	93.9	Very high	91.9	Very high	73 Å²	73	53.9 Å²	53.9	32%	0.317	29%	0.29	S	S	.	.			trans	-65.7	156.2	172.7	-70.7	-175.2	-179.4	-171.4	0	110.8	F279 T282 Q288 L289 E292	F279-K284 VanDerWaalsContact CD2-O 3.23Å; F279-K284 WeakPolarHBondContact CD2-O 3.32Å; T282-K284 PolarHBondContact O-N 2.99Å; T282-K284 PolarHBondContact OG1-N 2.91Å; K284-Q288 HydrophobicContact CB-CB 4.45Å; K284-L289 HydrophobicContact CB-CD1 4.36Å; K284-L289 HydrophobicContact CB-CD2 4.02Å; K284-L289 HydrophobicContact CB-CG 3.97Å; K284-L289 HydrophobicContact CD-CD2 4Å; K284-E292 IonicContact NZ-OE1 2.72Å; K284-E292 PolarHBondContact NZ-OE1 3.18Å; K284-E292 IonicContact NZ-OE2 2.7Å; K284-E292 PolarHBondContact NZ-OE2 3.21Å
285	S	91.4	Very high	90.9	Very high	44 Å²	44	56.8 Å²	56.8	31%	0.308	31%	0.31	S	S	.	.			trans	-68.2	155.4	175.6	93.3	0	0	0	0	111.3	E287 Q288 L289	S285-E287 VanDerWaalsContact C-N 3.25Å; S285-E287 WeakPolarHBondContact CB-OE2 3.36Å; S285-E287 PolarHBondContact O-N 3.26Å; S285-E287 PolarHBondContact OG-N 3.46Å; S285-E287 PolarHBondContact OG-OE2 3.43Å; S285-Q288 PolarHBondContact O-N 3.06Å; S285-Q288 PolarHBondContact OG-N 3.41Å; S285-L289 WeakPolarHBondContact O-CG 3.39Å; S285-L289 PolarHBondContact O-N 2.78Å; S285-L289 VanDerWaalsContact O-N 3.14Å
286	L	89.7	Confident	89.5	Confident	7 Å²	7	60.3 Å²	60.3	4%	0.037	35%	0.346	C	S	.	.	H	α-helix	trans	-59.1	-40.6	177.3	-69	175.2	0	0	0	110.9	I275 F279 Q288 L289 E290 P302 C331 F332	I275-L286 HydrophobicContact CG2-CD2 3.57Å; F279-L286 HydrophobicContact CB-CD2 4.39Å; F279-L286 HydrophobicContact CD2-CD2 3.8Å; F279-L286 HydrophobicContact CD2-CG 4.15Å; F279-L286 HydrophobicContact CE2-CD2 4.44Å; F279-L286 HydrophobicContact CE2-CG 4.36Å; F279-L286 HydrophobicContact CG-CD2 4.27Å; L286-Q288 VanDerWaalsContact C-N 3.32Å; L286-Q288 PolarHBondContact O-N 3.46Å; L286-L289 PolarHBondContact O-N 3.37Å; L286-E290 VanDerWaalsContact O-CG 3.24Å; L286-E290 WeakPolarHBondContact O-CG 3.44Å; L286-E290 PolarHBondContact O-N 2.75Å; L286-P302 HydrophobicContact CD1-CB 3.78Å; L286-P302 HydrophobicContact CD1-CG 3.9Å; L286-C331 HydrophobicContact CD1-CB 3.77Å; L286-F332 HydrophobicContact CD1-CE1 4.38Å; L286-F332 HydrophobicContact CD1-CZ 4.23Å
287	E	88.2	Confident	88.2	Confident	115 Å²	115	64.5 Å²	64.5	54%	0.537	37%	0.366	S	S	.	.	H	α-helix	trans	-61.2	-40.4	179.3	-56.2	74.8	-163.4	0	0	112	S285 V291	S285-E287 VanDerWaalsContact C-N 3.25Å; S285-E287 WeakPolarHBondContact CB-OE2 3.36Å; S285-E287 PolarHBondContact O-N 3.26Å; S285-E287 PolarHBondContact OG-N 3.46Å; S285-E287 PolarHBondContact OG-OE2 3.43Å; E287-V291 WeakPolarHBondContact O-CG2 3.21Å; E287-V291 PolarHBondContact O-N 3.37Å
288	Q	90.6	Very high	87.1	Confident	102 Å²	102	68.8 Å²	68.8	48%	0.477	38%	0.383	S	S	.	.	H	α-helix	trans	-64.5	-46	176	-70.1	175.3	-30.5	0	0	111	K284 S285 L286 E290 V291 E292	K284-Q288 HydrophobicContact CB-CB 4.45Å; S285-Q288 PolarHBondContact O-N 3.06Å; S285-Q288 PolarHBondContact OG-N 3.41Å; L286-Q288 VanDerWaalsContact C-N 3.32Å; L286-Q288 PolarHBondContact O-N 3.46Å; Q288-E290 VanDerWaalsContact C-N 3.32Å; Q288-E290 PolarHBondContact O-N 2.99Å; Q288-V291 PolarHBondContact O-N 2.91Å; Q288-E292 WeakPolarHBondContact O-CB 3.44Å; Q288-E292 WeakPolarHBondContact O-CG 3.38Å; Q288-E292 PolarHBondContact O-N 2.99Å
289	L	91.7	Very high	86.4	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.016	38%	0.38	C	S	.	.	H	α-helix	trans	-67.4	-33.1	-179.4	-66.2	173.5	0	0	0	112.5	I275 A278 F279 K284 S285 L286 E292 L293	I275-L289 HydrophobicContact CD1-CB 3.76Å; A278-L289 HydrophobicContact CB-CD1 4.1Å; A278-L289 HydrophobicContact CB-CD2 3.84Å; F279-L289 VanDerWaalsContact CA-CD1 3.45Å; F279-L289 HydrophobicContact CB-CD1 3.76Å; F279-L289 HydrophobicContact CD2-CD1 4.41Å; F279-L289 VanDerWaalsContact N-CD1 3.34Å; K284-L289 HydrophobicContact CB-CD1 4.36Å; K284-L289 HydrophobicContact CB-CD2 4.02Å; K284-L289 HydrophobicContact CB-CG 3.97Å; K284-L289 HydrophobicContact CD-CD2 4Å; S285-L289 WeakPolarHBondContact O-CG 3.39Å; S285-L289 PolarHBondContact O-N 2.78Å; S285-L289 VanDerWaalsContact O-N 3.14Å; L286-L289 PolarHBondContact O-N 3.37Å; L289-E292 PolarHBondContact O-N 3.13Å; L289-L293 HydrophobicContact CB-CD1 4.39Å; L289-L293 HydrophobicContact CD2-CD1 4.08Å; L289-L293 VanDerWaalsContact O-CB 3.22Å; L289-L293 WeakPolarHBondContact O-CB 3.5Å; L289-L293 WeakPolarHBondContact O-CG 3.29Å; L289-L293 PolarHBondContact O-N 3.23Å
290	E	86.6	Confident	85.8	Confident	46 Å²	46	69.2 Å²	69.2	22%	0.215	38%	0.384	C	S	.	.	H	α-helix	trans	-60.3	-47.6	173.4	-75.8	-178.4	-170	0	0	111.6	L286 Q288 L294 P299	L286-E290 VanDerWaalsContact O-CG 3.24Å; L286-E290 WeakPolarHBondContact O-CG 3.44Å; L286-E290 PolarHBondContact O-N 2.75Å; Q288-E290 VanDerWaalsContact C-N 3.32Å; Q288-E290 PolarHBondContact O-N 2.99Å; E290-L294 HydrophobicContact CG-CD1 4.35Å; E290-L294 WeakPolarHBondContact O-CB 3.28Å; E290-L294 PolarHBondContact O-N 3.3Å; E290-P299 VanDerWaalsContact CD-CD 3.4Å; E290-P299 VanDerWaalsContact CG-CD 3.49Å; E290-P299 HydrophobicContact CG-CG 3.7Å; E290-P299 VanDerWaalsContact OE1-CD 3.23Å; E290-P299 WeakPolarHBondContact OE1-CD 3.3Å; E290-P299 VanDerWaalsContact OE1-CG 3.25Å; E290-P299 WeakPolarHBondContact OE1-CG 3.34Å
291	V	86.2	Confident	85.5	Confident	115 Å²	115	68.3 Å²	68.3	70%	0.697	38%	0.377	S	S	*	.	H	α-helix	trans	-65.3	-44.7	178.3	175.3	0	0	0	0	110.9	E287 Q288	E287-V291 WeakPolarHBondContact O-CG2 3.21Å; E287-V291 PolarHBondContact O-N 3.37Å; Q288-V291 PolarHBondContact O-N 2.91Å
292	E	88.8	Confident	85.3	Confident	101 Å²	101	62.5 Å²	62.5	47%	0.472	35%	0.352	S	S	.	.	H	α-helix	trans	-72.9	-37.4	-175.5	-72.2	178.9	-171.8	0	0	113.8	K284 Q288 L289	K284-E292 IonicContact NZ-OE1 2.72Å; K284-E292 PolarHBondContact NZ-OE1 3.18Å; K284-E292 IonicContact NZ-OE2 2.7Å; K284-E292 PolarHBondContact NZ-OE2 3.21Å; Q288-E292 WeakPolarHBondContact O-CB 3.44Å; Q288-E292 WeakPolarHBondContact O-CG 3.38Å; Q288-E292 PolarHBondContact O-N 2.99Å; L289-E292 PolarHBondContact O-N 3.13Å
293	L	87.6	Confident	85	Confident	51 Å²	51	60.3 Å²	60.3	27%	0.267	34%	0.344	S	S	.	.	H	α-helix	trans	-110.4	-16.7	-165.2	-60.4	178.5	0	0	0	115	K274 I275 A278 L289	K274-L293 PolarHBondContact NZ-O 2.94Å; I275-L293 HydrophobicContact CD1-CB 4.37Å; I275-L293 HydrophobicContact CD1-CD1 4.31Å; A278-L293 HydrophobicContact CB-CD1 3.45Å; A278-L293 VanDerWaalsContact CB-CD1 3.45Å; L289-L293 HydrophobicContact CB-CD1 4.39Å; L289-L293 HydrophobicContact CD2-CD1 4.08Å; L289-L293 VanDerWaalsContact O-CB 3.22Å; L289-L293 WeakPolarHBondContact O-CB 3.5Å; L289-L293 WeakPolarHBondContact O-CG 3.29Å; L289-L293 PolarHBondContact O-N 3.23Å
294	L	78	Confident	85	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.052	31%	0.312	C	S	.	.	H	α-helix	trans	-119.7	2.4	-169.9	-56.5	-178.9	0	0	0	114.7	R271 I275 E290 G296 Q297 P299	R271-L294 HydrophobicContact CB-CD2 3.95Å; R271-L294 HydrophobicContact CG-CD2 3.98Å; I275-L294 HydrophobicContact CD1-CD1 3.8Å; I275-L294 HydrophobicContact CD1-CD2 4.47Å; I275-L294 HydrophobicContact CD1-CG 3.95Å; I275-L294 HydrophobicContact CG1-CD1 3.72Å; I275-L294 HydrophobicContact CG1-CD2 4.35Å; I275-L294 HydrophobicContact CG1-CG 4.19Å; E290-L294 HydrophobicContact CG-CD1 4.35Å; E290-L294 WeakPolarHBondContact O-CB 3.28Å; E290-L294 PolarHBondContact O-N 3.3Å; L294-G296 PolarHBondContact O-N 2.88Å; L294-G296 VanDerWaalsContact O-N 3.11Å; L294-Q297 HydrophobicContact CB-CB 4.25Å; L294-Q297 WeakPolarHBondContact CB-O 3.37Å; L294-Q297 VanDerWaalsContact CD1-O 3.27Å; L294-Q297 WeakPolarHBondContact CD1-O 3.28Å; L294-Q297 WeakPolarHBondContact O-CB 3.13Å; L294-Q297 WeakPolarHBondContact O-CG 3.41Å; L294-Q297 PolarHBondContact O-N 2.81Å; L294-P299 HydrophobicContact CD1-CB 4.11Å; L294-P299 HydrophobicContact CD1-CG 3.93Å
295	N	73.3	Confident	85	Confident	150 Å²	150	53.8 Å²	53.8	80%	0.802	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	42.5	173.4	-65.1	-12.5	0	0	0	113.3
296	G	65.3	Low	85	Confident	74 Å²	74	54.8 Å²	54.8	76%	0.763	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	1.1	-179.9	0	0	0	0	0	115.9	L294	L294-G296 PolarHBondContact O-N 2.88Å; L294-G296 VanDerWaalsContact O-N 3.11Å
297	Q	70.2	Confident	85.1	Confident	88 Å²	88	55.9 Å²	55.9	41%	0.411	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-85.7	139.6	169.6	-56.6	-177.1	13.2	0	0	111	R271 L294	R271-Q297 VanDerWaalsContact CD-OE1 3.26Å; L294-Q297 HydrophobicContact CB-CB 4.25Å; L294-Q297 WeakPolarHBondContact CB-O 3.37Å; L294-Q297 VanDerWaalsContact CD1-O 3.27Å; L294-Q297 WeakPolarHBondContact CD1-O 3.28Å; L294-Q297 WeakPolarHBondContact O-CB 3.13Å; L294-Q297 WeakPolarHBondContact O-CG 3.41Å; L294-Q297 PolarHBondContact O-N 2.81Å
298	K	74.4	Confident	85.3	Confident	132 Å²	132	50.5 Å²	50.5	57%	0.574	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-95.4	134.1	178.5	-69.4	-169.8	173	-168.4	0	112.7
299	P	81	Confident	85.4	Confident	10 Å²	10	45.7 Å²	45.7	7%	0.065	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-76.2	128.2	170	32.4	-29.4	0	0	0	109	N272 I275 E290 L294	N272-P299 VanDerWaalsContact OD1-CB 3.32Å; N272-P299 WeakPolarHBondContact OD1-CB 3.37Å; I275-P299 HydrophobicContact CG1-CB 4.26Å; I275-P299 HydrophobicContact CG1-CG 4.23Å; E290-P299 VanDerWaalsContact CD-CD 3.4Å; E290-P299 VanDerWaalsContact CG-CD 3.49Å; E290-P299 HydrophobicContact CG-CG 3.7Å; E290-P299 VanDerWaalsContact OE1-CD 3.23Å; E290-P299 WeakPolarHBondContact OE1-CD 3.3Å; E290-P299 VanDerWaalsContact OE1-CG 3.25Å; E290-P299 WeakPolarHBondContact OE1-CG 3.34Å; L294-P299 HydrophobicContact CD1-CB 4.11Å; L294-P299 HydrophobicContact CD1-CG 3.93Å
300	Q	84.9	Confident	85.4	Confident	46 Å²	46	48.2 Å²	48.2	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-83.2	-21.2	-176.5	-64	-178.4	-48.8	0	0	112.9	K121 N272 G303 T304	K121-Q300 PolarHBondContact O-NE2 2.89Å; K121-Q300 PolarHBondContact O-OE1 2.84Å; N272-Q300 PolarHBondContact OD1-N 3.02Å; Q300-G303 PolarHBondContact O-N 2.99Å; Q300-T304 PolarHBondContact O-N 3.02Å; Q300-T304 PolarHBondContact O-OG1 3.5Å; Q300-T304 VanDerWaalsContact O-OG1 3.05Å
301	G	90.9	Very high	85.7	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-53	-172.7	0	0	0	0	0	114.4	N272 G303 T304 A305	N272-G301 PolarHBondContact OD1-N 3.36Å; G301-G303 PolarHBondContact O-N 3.37Å; G301-T304 PolarHBondContact O-N 2.86Å; G301-A305 PolarHBondContact O-N 2.82Å
302	P	91.9	Very high	86	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-43.9	178.6	-25.3	35.5	0	0	0	112.8	V210 L286 T304 A305 I306 F332	V210-P302 HydrophobicContact CG2-CG 4.32Å; L286-P302 HydrophobicContact CD1-CB 3.78Å; L286-P302 HydrophobicContact CD1-CG 3.9Å; P302-T304 PolarHBondContact O-N 2.78Å; P302-A305 WeakPolarHBondContact O-CB 3.45Å; P302-A305 PolarHBondContact O-N 2.88Å; P302-A305 VanDerWaalsContact O-N 3.16Å; P302-I306 PolarHBondContact O-N 2.86Å; P302-I306 VanDerWaalsContact O-N 3.15Å; P302-F332 HydrophobicContact CB-CE2 3.91Å; P302-F332 HydrophobicContact CB-CZ 3.56Å; P302-F332 VanDerWaalsContact O-CE2 3.3Å; P302-F332 WeakPolarHBondContact O-CE2 3.34Å
303	G	89.1	Confident	86.2	Confident	30 Å²	30	40.1 Å²	40.1	31%	0.309	23%	0.225	S	C	.	.	H	α-helix	trans	-60.1	-46.6	176.5	0	0	0	0	0	112.7	Q300 G301 A305 I306 E307	Q300-G303 PolarHBondContact O-N 2.99Å; G301-G303 PolarHBondContact O-N 3.37Å; G303-A305 VanDerWaalsContact C-N 3.27Å; G303-A305 PolarHBondContact O-N 3.24Å; G303-I306 WeakPolarHBondContact O-CB 3.32Å; G303-I306 PolarHBondContact O-N 3.06Å; G303-I306 VanDerWaalsContact O-N 3.12Å; G303-E307 PolarHBondContact O-N 3.3Å
304	T	91.1	Very high	86.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.5	-32.7	175.8	-56.2	0	0	0	0	112.2	V123 A203 I207 Q300 G301 P302 I306 E307 V308	V123-T304 HydrophobicContact CG2-CG2 4.25Å; A203-T304 HydrophobicContact CB-CG2 4.23Å; I207-T304 HydrophobicContact CD1-CG2 3.97Å; I207-T304 HydrophobicContact CG1-CG2 4.1Å; Q300-T304 PolarHBondContact O-N 3.02Å; Q300-T304 PolarHBondContact O-OG1 3.5Å; Q300-T304 VanDerWaalsContact O-OG1 3.05Å; G301-T304 PolarHBondContact O-N 2.86Å; P302-T304 PolarHBondContact O-N 2.78Å; T304-I306 VanDerWaalsContact C-N 3.34Å; T304-I306 PolarHBondContact O-N 2.52Å; T304-E307 PolarHBondContact O-N 3.38Å; T304-V308 HydrophobicContact CG2-CG2 4.28Å; T304-V308 WeakPolarHBondContact O-CB 3.39Å; T304-V308 VanDerWaalsContact O-CG2 3.31Å; T304-V308 WeakPolarHBondContact O-CG2 3.11Å; T304-V308 PolarHBondContact O-N 3.13Å
305	A	94.1	Very high	86.8	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-65	-36.5	174.6	0	0	0	0	0	112.3	I207 G301 P302 G303 N309 V327	I207-A305 HydrophobicContact CD1-CB 4.36Å; I207-A305 HydrophobicContact CG1-CB 4.11Å; I207-A305 HydrophobicContact CG2-CB 4.21Å; G301-A305 PolarHBondContact O-N 2.82Å; P302-A305 WeakPolarHBondContact O-CB 3.45Å; P302-A305 PolarHBondContact O-N 2.88Å; P302-A305 VanDerWaalsContact O-N 3.16Å; G303-A305 VanDerWaalsContact C-N 3.27Å; G303-A305 PolarHBondContact O-N 3.24Å; A305-N309 WeakPolarHBondContact O-CB 3.27Å; A305-N309 PolarHBondContact O-N 2.81Å; A305-V327 HydrophobicContact CB-CG1 4.14Å
306	I	91.9	Very high	87.8	Confident	66 Å²	66	47.6 Å²	47.6	34%	0.338	26%	0.257	S	S	.	.	H	α-helix	trans	-61.3	-54	172.5	-61.1	170.4	0	0	0	110	P302 G303 T304 V308 N309 V310 Y328 F332	P302-I306 PolarHBondContact O-N 2.86Å; P302-I306 VanDerWaalsContact O-N 3.15Å; G303-I306 WeakPolarHBondContact O-CB 3.32Å; G303-I306 PolarHBondContact O-N 3.06Å; G303-I306 VanDerWaalsContact O-N 3.12Å; T304-I306 VanDerWaalsContact C-N 3.34Å; T304-I306 PolarHBondContact O-N 2.52Å; I306-V308 VanDerWaalsContact C-N 3.34Å; I306-V308 PolarHBondContact O-N 3.29Å; I306-N309 PolarHBondContact O-N 3.06Å; I306-N309 VanDerWaalsContact O-N 3.17Å; I306-V310 HydrophobicContact CG2-CG2 4.44Å; I306-V310 WeakPolarHBondContact O-CG2 3.02Å; I306-V310 PolarHBondContact O-N 2.87Å; I306-Y328 HydrophobicContact CB-CD2 4.42Å; I306-Y328 HydrophobicContact CB-CE2 4.42Å; I306-Y328 HydrophobicContact CG1-CD2 4.04Å; I306-Y328 HydrophobicContact CG1-CE2 4.07Å; I306-Y328 HydrophobicContact CG2-CE2 4.49Å; I306-F332 HydrophobicContact CD1-CD1 4.19Å; I306-F332 HydrophobicContact CD1-CD2 4.22Å; I306-F332 HydrophobicContact CD1-CE1 3.73Å; I306-F332 HydrophobicContact CD1-CE2 3.76Å; I306-F332 HydrophobicContact CD1-CG 4.42Å; I306-F332 HydrophobicContact CD1-CZ 3.48Å; I306-F332 VanDerWaalsContact CD1-CZ 3.48Å; I306-F332 HydrophobicContact CG1-CD2 3.72Å; I306-F332 HydrophobicContact CG1-CE1 4.29Å; I306-F332 HydrophobicContact CG1-CE2 3.41Å; I306-F332 VanDerWaalsContact CG1-CE2 3.41Å; I306-F332 HydrophobicContact CG1-CG 4.28Å; I306-F332 HydrophobicContact CG1-CZ 3.73Å
307	E	90.8	Very high	89.2	Confident	30 Å²	30	45.2 Å²	45.2	14%	0.14	23%	0.226	C	C	.	.	H	α-helix	trans	-56.4	-49.3	-177.8	-69.5	160.7	-177.6	0	0	110.9	V123 A125 G303 T304 N309 V310 I311	V123-E307 HydrophobicContact CG2-CB 4.15Å; V123-E307 VanDerWaalsContact CG2-OE2 3.29Å; V123-E307 WeakPolarHBondContact CG2-OE2 3.46Å; A125-E307 HydrophobicContact CB-CB 4.11Å; A125-E307 HydrophobicContact CB-CG 4.14Å; G303-E307 PolarHBondContact O-N 3.3Å; T304-E307 PolarHBondContact O-N 3.38Å; E307-N309 PolarHBondContact O-N 3.32Å; E307-V310 PolarHBondContact O-N 2.98Å; E307-I311 VanDerWaalsContact O-CD1 3.29Å; E307-I311 WeakPolarHBondContact O-CD1 3.41Å; E307-I311 VanDerWaalsContact O-CG1 3.28Å; E307-I311 WeakPolarHBondContact O-CG1 3.45Å; E307-I311 PolarHBondContact O-N 3.49Å; E307-I311 VanDerWaalsContact O-N 3.14Å
308	V	92.9	Very high	90.3	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-44.9	177.3	167.5	0	0	0	0	111.2	L204 I207 F239 T304 I306 V310 I311 L312 F324	L204-V308 HydrophobicContact CD2-CG2 3.62Å; I207-V308 HydrophobicContact CD1-CB 3.99Å; I207-V308 HydrophobicContact CD1-CG1 4.31Å; I207-V308 HydrophobicContact CD1-CG2 3.74Å; F239-V308 HydrophobicContact CD2-CG1 4.31Å; F239-V308 HydrophobicContact CE2-CG1 3.74Å; F239-V308 HydrophobicContact CE2-CG2 4.42Å; F239-V308 HydrophobicContact CZ-CG1 4.29Å; F239-V308 HydrophobicContact CZ-CG2 4.16Å; T304-V308 HydrophobicContact CG2-CG2 4.28Å; T304-V308 WeakPolarHBondContact O-CB 3.39Å; T304-V308 VanDerWaalsContact O-CG2 3.31Å; T304-V308 WeakPolarHBondContact O-CG2 3.11Å; T304-V308 PolarHBondContact O-N 3.13Å; I306-V308 VanDerWaalsContact C-N 3.34Å; I306-V308 PolarHBondContact O-N 3.29Å; V308-V310 VanDerWaalsContact C-N 3.35Å; V308-V310 PolarHBondContact O-N 3.43Å; V308-I311 PolarHBondContact O-N 2.9Å; V308-L312 HydrophobicContact CG1-CD1 3.82Å; V308-L312 HydrophobicContact CG1-CG 4.17Å; V308-L312 VanDerWaalsContact O-CG 3.25Å; V308-L312 WeakPolarHBondContact O-CG 3.11Å; V308-L312 PolarHBondContact O-N 2.63Å; V308-F324 HydrophobicContact CG1-CB 4.26Å; V308-F324 HydrophobicContact CG1-CD2 3.9Å; V308-F324 HydrophobicContact CG1-CG 4.4Å
309	N	93.4	Very high	91.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-64.4	-38.2	-179.8	-170.3	-91.6	0	0	0	112.6	A305 I306 E307 I311 L312 K313 Y328	A305-N309 WeakPolarHBondContact O-CB 3.27Å; A305-N309 PolarHBondContact O-N 2.81Å; I306-N309 PolarHBondContact O-N 3.06Å; I306-N309 VanDerWaalsContact O-N 3.17Å; E307-N309 PolarHBondContact O-N 3.32Å; N309-I311 VanDerWaalsContact C-N 3.34Å; N309-I311 PolarHBondContact O-N 3.3Å; N309-L312 PolarHBondContact O-N 3.5Å; N309-K313 WeakPolarHBondContact O-CB 3.22Å; N309-K313 WeakPolarHBondContact O-CG 3.25Å; N309-K313 PolarHBondContact O-N 3.39Å; N309-K313 VanDerWaalsContact OD1-CD 3.31Å; N309-K313 WeakPolarHBondContact OD1-CD 3.02Å; N309-K313 WeakPolarHBondContact OD1-CE 3.34Å; N309-K313 PolarHBondContact OD1-NZ 2.92Å; N309-Y328 HydrophobicContact CB-CD1 3.8Å; N309-Y328 HydrophobicContact CB-CD2 3.95Å; N309-Y328 HydrophobicContact CB-CE1 4.2Å; N309-Y328 HydrophobicContact CB-CE2 4.35Å; N309-Y328 HydrophobicContact CB-CG 3.65Å; N309-Y328 VanDerWaalsContact CG-CE1 3.47Å; N309-Y328 WeakPolarHBondContact ND2-CD1 3.48Å; N309-Y328 WeakPolarHBondContact OD1-CD1 3.41Å; N309-Y328 WeakPolarHBondContact OD1-CE1 3.42Å
310	V	91.8	Very high	91.7	Very high	57 Å²	57	51 Å²	51	35%	0.345	25%	0.254	S	S	.	.	H	α-helix	trans	-58.3	-47.4	173.2	169.5	0	0	0	0	110.6	I306 E307 V308 L312 K313 Q314	I306-V310 HydrophobicContact CG2-CG2 4.44Å; I306-V310 WeakPolarHBondContact O-CG2 3.02Å; I306-V310 PolarHBondContact O-N 2.87Å; E307-V310 PolarHBondContact O-N 2.98Å; V308-V310 VanDerWaalsContact C-N 3.35Å; V308-V310 PolarHBondContact O-N 3.43Å; V310-L312 PolarHBondContact O-N 3.28Å; V310-K313 PolarHBondContact O-N 3.06Å; V310-Q314 WeakPolarHBondContact O-CG 3.15Å; V310-Q314 PolarHBondContact O-N 3.29Å
311	I	91.3	Very high	92.3	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-43.4	179.8	-65.7	157.7	0	0	0	111.1	L130 F239 F243 E307 V308 N309 Q314 K315	L130-I311 HydrophobicContact CB-CD1 3.72Å; L130-I311 HydrophobicContact CB-CG1 4.47Å; L130-I311 HydrophobicContact CB-CG2 4.42Å; L130-I311 HydrophobicContact CD1-CD1 3.5Å; L130-I311 HydrophobicContact CG-CD1 4.24Å; F239-I311 HydrophobicContact CZ-CG2 4.41Å; F243-I311 HydrophobicContact CD1-CG2 3.93Å; F243-I311 HydrophobicContact CE1-CG2 3.29Å; F243-I311 HydrophobicContact CE2-CG2 4.35Å; F243-I311 HydrophobicContact CZ-CG2 3.56Å; E307-I311 VanDerWaalsContact O-CD1 3.29Å; E307-I311 WeakPolarHBondContact O-CD1 3.41Å; E307-I311 VanDerWaalsContact O-CG1 3.28Å; E307-I311 WeakPolarHBondContact O-CG1 3.45Å; E307-I311 PolarHBondContact O-N 3.49Å; E307-I311 VanDerWaalsContact O-N 3.14Å; V308-I311 PolarHBondContact O-N 2.9Å; N309-I311 VanDerWaalsContact C-N 3.34Å; N309-I311 PolarHBondContact O-N 3.3Å; I311-Q314 PolarHBondContact O-N 3.42Å; I311-K315 PolarHBondContact O-N 2.84Å
312	L	93.3	Very high	92.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-39.4	178.4	-68.6	177.9	0	0	0	112.4	F239 F243 V308 N309 V310 K315 N316 M317 V318 F321	F239-L312 HydrophobicContact CD2-CD2 4.12Å; F239-L312 HydrophobicContact CE2-CD2 3.92Å; F239-L312 HydrophobicContact CE2-CG 4.26Å; F243-L312 HydrophobicContact CE2-CD2 4.11Å; F243-L312 HydrophobicContact CZ-CD2 4.24Å; V308-L312 HydrophobicContact CG1-CD1 3.82Å; V308-L312 HydrophobicContact CG1-CG 4.17Å; V308-L312 VanDerWaalsContact O-CG 3.25Å; V308-L312 WeakPolarHBondContact O-CG 3.11Å; V308-L312 PolarHBondContact O-N 2.63Å; N309-L312 PolarHBondContact O-N 3.5Å; V310-L312 PolarHBondContact O-N 3.28Å; L312-K315 PolarHBondContact O-N 3Å; L312-N316 PolarHBondContact O-N 3.44Å; L312-N316 VanDerWaalsContact O-N 3.09Å; L312-M317 HydrophobicContact CD2-CB 4.04Å; L312-M317 PolarHBondContact O-N 2.65Å; L312-V318 HydrophobicContact CB-CG2 4.09Å; L312-F321 HydrophobicContact CD1-CB 3.67Å; L312-F321 HydrophobicContact CD1-CD2 3.89Å; L312-F321 HydrophobicContact CD1-CG 3.95Å; L312-F321 HydrophobicContact CD2-CD2 3.26Å; L312-F321 HydrophobicContact CD2-CE2 3.46Å; L312-F321 VanDerWaalsContact CD2-CE2 3.46Å; L312-F321 HydrophobicContact CD2-CG 4.03Å; L312-F321 HydrophobicContact CD2-CZ 4.37Å; L312-F321 HydrophobicContact CG-CD2 4.2Å
313	K	92.6	Very high	92.8	Very high	92 Å²	92	50 Å²	50	40%	0.4	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-46.8	173.8	-79.4	173.6	172.3	155.9	0	111.4	N309 V310 K315 N316 V318	N309-K313 WeakPolarHBondContact O-CB 3.22Å; N309-K313 WeakPolarHBondContact O-CG 3.25Å; N309-K313 PolarHBondContact O-N 3.39Å; N309-K313 VanDerWaalsContact OD1-CD 3.31Å; N309-K313 WeakPolarHBondContact OD1-CD 3.02Å; N309-K313 WeakPolarHBondContact OD1-CE 3.34Å; N309-K313 PolarHBondContact OD1-NZ 2.92Å; V310-K313 PolarHBondContact O-N 3.06Å; K313-K315 PolarHBondContact O-N 2.83Å; K313-N316 PolarHBondContact O-N 2.96Å; K313-N316 VanDerWaalsContact O-N 3.11Å; K313-V318 HydrophobicContact CB-CG2 4.33Å; K313-V318 HydrophobicContact CG-CG2 3.6Å
314	Q	89.9	Confident	93.2	Very high	98 Å²	98	48.7 Å²	48.7	46%	0.458	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-30.3	177.7	-72.4	173.8	-5.6	0	0	113.3	V310 I311	V310-Q314 WeakPolarHBondContact O-CG 3.15Å; V310-Q314 PolarHBondContact O-N 3.29Å; I311-Q314 PolarHBondContact O-N 3.42Å
315	K	89.8	Confident	93.5	Very high	116 Å²	116	49.5 Å²	49.5	50%	0.504	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	0.6	179	-63.5	-65.4	-176.6	179.2	0	114.3	F243 I311 L312 K313 M317	F243-K315 HydrophobicContact CE1-CG 3.9Å; F243-K315 HydrophobicContact CZ-CG 4.15Å; I311-K315 PolarHBondContact O-N 2.84Å; L312-K315 PolarHBondContact O-N 3Å; K313-K315 PolarHBondContact O-N 2.83Å; K315-M317 VanDerWaalsContact C-N 3.29Å; K315-M317 HydrophobicContact CB-CB 4.43Å; K315-M317 HydrophobicContact CB-CG 3.82Å; K315-M317 HydrophobicContact CB-SD 3.88Å; K315-M317 WeakPolarHBondContact O-CG 3.49Å; K315-M317 PolarHBondContact O-N 3.07Å
316	N	92.9	Very high	93.6	Very high	154 Å²	154	49.7 Å²	49.7	82%	0.824	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	44.1	-171.6	-60.4	-49.9	0	0	0	112.8	L312 K313	L312-N316 PolarHBondContact O-N 3.44Å; L312-N316 VanDerWaalsContact O-N 3.09Å; K313-N316 PolarHBondContact O-N 2.96Å; K313-N316 VanDerWaalsContact O-N 3.11Å
317	M	94.3	Very high	93.9	Very high	24 Å²	24	46.6 Å²	46.6	12%	0.118	23%	0.227	C	C	.	.			trans	-118.1	7.8	-176.6	-63.3	-176.2	78.2	0	0	113.8	V242 F243 L312 K315 D319 R320 F321	V242-M317 HydrophobicContact CB-CE 4.48Å; V242-M317 HydrophobicContact CG1-CE 3.93Å; V242-M317 HydrophobicContact CG1-SD 3.83Å; V242-M317 HydrophobicContact CG2-CE 3.82Å; F243-M317 HydrophobicContact CZ-SD 4.4Å; L312-M317 HydrophobicContact CD2-CB 4.04Å; L312-M317 PolarHBondContact O-N 2.65Å; K315-M317 VanDerWaalsContact C-N 3.29Å; K315-M317 HydrophobicContact CB-CB 4.43Å; K315-M317 HydrophobicContact CB-CG 3.82Å; K315-M317 HydrophobicContact CB-SD 3.88Å; K315-M317 WeakPolarHBondContact O-CG 3.49Å; K315-M317 PolarHBondContact O-N 3.07Å; M317-D319 VanDerWaalsContact C-N 3.26Å; M317-D319 PolarHBondContact O-N 2.77Å; M317-R320 WeakPolarHBondContact O-CB 3.5Å; M317-R320 PolarHBondContact O-N 3.05Å; M317-F321 HydrophobicContact CB-CD2 4.49Å; M317-F321 HydrophobicContact CB-CE2 4.24Å; M317-F321 HydrophobicContact CE-CE2 4.17Å; M317-F321 WeakPolarHBondContact O-CD2 3.46Å
318	V	93.9	Very high	94.2	Very high	32 Å²	32	46.7 Å²	46.7	19%	0.194	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-50.4	-45.7	-177.1	179.5	0	0	0	0	111.9	L312 K313 R320 F321 T325	L312-V318 HydrophobicContact CB-CG2 4.09Å; K313-V318 HydrophobicContact CB-CG2 4.33Å; K313-V318 HydrophobicContact CG-CG2 3.6Å; V318-R320 PolarHBondContact O-N 3.37Å; V318-R320 VanDerWaalsContact O-N 3.15Å; V318-F321 CarbonylContact O-C 3.59Å; V318-F321 PolarHBondContact O-N 3.4Å; V318-F321 VanDerWaalsContact O-N 3.09Å; V318-T325 HydrophobicContact CG1-CG2 3.49Å; V318-T325 VanDerWaalsContact CG1-CG2 3.49Å; V318-T325 WeakPolarHBondContact CG1-OG1 3.22Å; V318-T325 PolarHBondContact O-OG1 3.31Å
319	D	92.1	Very high	94.4	Very high	149 Å²	149	48.8 Å²	48.8	80%	0.797	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-66.3	-17.6	-178.5	-57.2	-32.8	0	0	0	114	M317 F321	M317-D319 VanDerWaalsContact C-N 3.26Å; M317-D319 PolarHBondContact O-N 2.77Å; D319-F321 VanDerWaalsContact C-N 3.33Å
320	R	93.5	Very high	94.5	Very high	171 Å²	171	48.9 Å²	48.9	65%	0.645	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-81.7	-14.1	177	-65.5	-172	174.1	-163.8	-0.6	113.3	M317 V318 P322	M317-R320 WeakPolarHBondContact O-CB 3.5Å; M317-R320 PolarHBondContact O-N 3.05Å; V318-R320 PolarHBondContact O-N 3.37Å; V318-R320 VanDerWaalsContact O-N 3.15Å; R320-P322 VanDerWaalsContact C-CD 3.43Å
321	F	96.8	Very high	94.6	Very high	4 Å²	4	47 Å²	47	2%	0.018	23%	0.226	C	C	.	.			trans	-129.5	63.8	-177.2	-58.3	-89.5	0	0	0	110.4	E235 F239 L312 M317 V318 D319 L323 F324 T325	E235-F321 HydrophobicContact CB-CD1 3.98Å; E235-F321 HydrophobicContact CG-CD1 4.05Å; E235-F321 WeakPolarHBondContact O-CE1 3.5Å; E235-F321 VanDerWaalsContact OE1-C 3.25Å; E235-F321 WeakPolarHBondContact OE1-CA 3.4Å; F239-F321 HydrophobicContact CB-CD1 4.43Å; F239-F321 HydrophobicContact CB-CE1 3.66Å; F239-F321 HydrophobicContact CB-CZ 4.14Å; F239-F321 HydrophobicContact CD2-CD1 4.46Å; F239-F321 HydrophobicContact CD2-CE1 4.1Å; F239-F321 HydrophobicContact CD2-CZ 4.19Å; F239-F321 HydrophobicContact CG-CE1 4.4Å; L312-F321 HydrophobicContact CD1-CB 3.67Å; L312-F321 HydrophobicContact CD1-CD2 3.89Å; L312-F321 HydrophobicContact CD1-CG 3.95Å; L312-F321 HydrophobicContact CD2-CD2 3.26Å; L312-F321 HydrophobicContact CD2-CE2 3.46Å; L312-F321 VanDerWaalsContact CD2-CE2 3.46Å; L312-F321 HydrophobicContact CD2-CG 4.03Å; L312-F321 HydrophobicContact CD2-CZ 4.37Å; L312-F321 HydrophobicContact CG-CD2 4.2Å; M317-F321 HydrophobicContact CB-CD2 4.49Å; M317-F321 HydrophobicContact CB-CE2 4.24Å; M317-F321 HydrophobicContact CE-CE2 4.17Å; M317-F321 WeakPolarHBondContact O-CD2 3.46Å; V318-F321 CarbonylContact O-C 3.59Å; V318-F321 PolarHBondContact O-N 3.4Å; V318-F321 VanDerWaalsContact O-N 3.09Å; D319-F321 VanDerWaalsContact C-N 3.33Å; F321-L323 VanDerWaalsContact C-N 3.32Å; F321-L323 PolarHBondContact O-N 3.34Å; F321-F324 HydrophobicContact CB-CB 4.27Å; F321-F324 HydrophobicContact CB-CD2 4.22Å; F321-F324 HydrophobicContact CD1-CD2 4Å; F321-F324 HydrophobicContact CD1-CE2 4.2Å; F321-F324 HydrophobicContact CG-CD2 4.42Å; F321-T325 VanDerWaalsContact O-CB 3.27Å; F321-T325 WeakPolarHBondContact O-CB 3.44Å; F321-T325 PolarHBondContact O-N 3.05Å; F321-T325 PolarHBondContact O-OG1 3.32Å
322	P	96.8	Very high	94.8	Very high	24 Å²	24	50.5 Å²	50.5	16%	0.156	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-32.9	-175.4	27.8	-38.6	0	0	0	113.7	E235 R320 A326 C343	E235-P322 WeakPolarHBondContact OE1-CD 3.27Å; E235-P322 WeakPolarHBondContact OE1-CG 3.42Å; E235-P322 VanDerWaalsContact OE1-N 3.09Å; R320-P322 VanDerWaalsContact C-CD 3.43Å; P322-A326 WeakPolarHBondContact O-CB 3.38Å; P322-A326 PolarHBondContact O-N 3.39Å; P322-C343 HydrophobicContact CB-CB 4.14Å
323	L	97.5	Very high	94.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-71.2	-50.7	178.9	-172.2	161.5	0	0	0	110.6	V208 V228 L231 E235 F321 T325 A326 V327 F340 L344	V208-L323 HydrophobicContact CG2-CD2 4.45Å; V228-L323 HydrophobicContact CG1-CD1 4.21Å; L231-L323 HydrophobicContact CB-CD1 4.17Å; E235-L323 WeakPolarHBondContact OE1-CB 3.42Å; E235-L323 PolarHBondContact OE1-N 3.34Å; F321-L323 VanDerWaalsContact C-N 3.32Å; F321-L323 PolarHBondContact O-N 3.34Å; L323-T325 VanDerWaalsContact C-N 3.28Å; L323-T325 PolarHBondContact O-N 3.06Å; L323-A326 PolarHBondContact O-N 2.67Å; L323-V327 HydrophobicContact CD2-CG2 4.34Å; L323-V327 WeakPolarHBondContact O-CG2 3.46Å; L323-V327 PolarHBondContact O-N 3.18Å; L323-F340 HydrophobicContact CG-CE2 4.44Å; L323-F340 HydrophobicContact CG-CZ 4.32Å; L323-L344 HydrophobicContact CD1-CD2 3.86Å; L323-L344 HydrophobicContact CG-CD2 4.35Å
324	F	97.3	Very high	94.7	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.009	28%	0.276	C	S	.	.	H	α-helix	trans	-58.9	-42.3	175.9	-67	-12.6	0	0	0	111.8	L204 I207 V208 E235 M236 F239 V308 F321 V327 Y328	L204-F324 HydrophobicContact CB-CZ 4.17Å; L204-F324 HydrophobicContact CD1-CE2 4.31Å; L204-F324 HydrophobicContact CD1-CZ 4.33Å; L204-F324 HydrophobicContact CD2-CE2 4.1Å; L204-F324 HydrophobicContact CD2-CZ 4.34Å; I207-F324 HydrophobicContact CB-CD1 4.12Å; I207-F324 HydrophobicContact CB-CE1 4.4Å; I207-F324 HydrophobicContact CD1-CD1 4.34Å; I207-F324 HydrophobicContact CD1-CG 4.36Å; I207-F324 HydrophobicContact CG2-CB 4.33Å; I207-F324 HydrophobicContact CG2-CD1 3.67Å; I207-F324 HydrophobicContact CG2-CE1 4.41Å; I207-F324 HydrophobicContact CG2-CG 4.28Å; V208-F324 HydrophobicContact CG2-CE1 3.79Å; E235-F324 HydrophobicContact CB-CD1 4.44Å; E235-F324 HydrophobicContact CB-CD2 4.29Å; E235-F324 HydrophobicContact CB-CE1 4.01Å; E235-F324 HydrophobicContact CB-CE2 3.85Å; E235-F324 HydrophobicContact CB-CZ 3.69Å; E235-F324 WeakPolarHBondContact OE2-CB 3.32Å; E235-F324 WeakPolarHBondContact OE2-CD1 3.45Å; E235-F324 WeakPolarHBondContact OE2-CG 3.32Å; E235-F324 PolarHBondContact OE2-N 3.45Å; M236-F324 HydrophobicContact CG-CE1 4.5Å; M236-F324 HydrophobicContact CG-CZ 3.89Å; F239-F324 HydrophobicContact CB-CE2 4.21Å; F239-F324 HydrophobicContact CD2-CE2 4.41Å; F239-F324 HydrophobicContact CG-CE2 4.45Å; V308-F324 HydrophobicContact CG1-CB 4.26Å; V308-F324 HydrophobicContact CG1-CD2 3.9Å; V308-F324 HydrophobicContact CG1-CG 4.4Å; F321-F324 HydrophobicContact CB-CB 4.27Å; F321-F324 HydrophobicContact CB-CD2 4.22Å; F321-F324 HydrophobicContact CD1-CD2 4Å; F321-F324 HydrophobicContact CD1-CE2 4.2Å; F321-F324 HydrophobicContact CG-CD2 4.42Å; F324-V327 PolarHBondContact O-N 2.92Å; F324-Y328 PolarHBondContact O-N 3.33Å
325	T	96.7	Very high	94.9	Very high	17 Å²	17	51.3 Å²	51.3	10%	0.104	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-46.6	177.5	-59.7	0	0	0	0	111.4	V318 F321 L323 V327 Y328 E329	V318-T325 HydrophobicContact CG1-CG2 3.49Å; V318-T325 VanDerWaalsContact CG1-CG2 3.49Å; V318-T325 WeakPolarHBondContact CG1-OG1 3.22Å; V318-T325 PolarHBondContact O-OG1 3.31Å; F321-T325 VanDerWaalsContact O-CB 3.27Å; F321-T325 WeakPolarHBondContact O-CB 3.44Å; F321-T325 PolarHBondContact O-N 3.05Å; F321-T325 PolarHBondContact O-OG1 3.32Å; L323-T325 VanDerWaalsContact C-N 3.28Å; L323-T325 PolarHBondContact O-N 3.06Å; T325-V327 VanDerWaalsContact C-N 3.3Å; T325-V327 PolarHBondContact O-N 3.12Å; T325-Y328 WeakPolarHBondContact O-CB 3.39Å; T325-Y328 PolarHBondContact O-N 3.39Å; T325-Y328 VanDerWaalsContact O-N 3.1Å; T325-E329 HydrophobicContact CG2-CG 4.02Å; T325-E329 WeakPolarHBondContact O-CG 3.25Å; T325-E329 PolarHBondContact O-N 3.02Å
326	A	97.3	Very high	95.2	Very high	6 Å²	6	49.2 Å²	49.2	5%	0.05	27%	0.265	C	S	.	.	H	α-helix	trans	-60.4	-39.8	179.2	0	0	0	0	0	112.2	P322 L323 Y328 E329 I330 F340 C343	P322-A326 WeakPolarHBondContact O-CB 3.38Å; P322-A326 PolarHBondContact O-N 3.39Å; L323-A326 PolarHBondContact O-N 2.67Å; A326-Y328 VanDerWaalsContact C-N 3.31Å; A326-Y328 PolarHBondContact O-N 3.39Å; A326-E329 PolarHBondContact O-N 3.07Å; A326-I330 WeakPolarHBondContact O-CB 3.13Å; A326-I330 WeakPolarHBondContact O-CD1 3.21Å; A326-I330 WeakPolarHBondContact O-CG1 3.46Å; A326-I330 PolarHBondContact O-N 2.83Å; A326-F340 HydrophobicContact CB-CD2 4.08Å; A326-F340 HydrophobicContact CB-CE2 4.36Å; A326-C343 HydrophobicContact CB-CB 3.84Å
327	V	97.5	Very high	95.3	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-44.2	175.4	172.7	0	0	0	0	111	I207 V210 F214 A305 L323 F324 T325 C331 F340	I207-V327 HydrophobicContact CG2-CB 3.81Å; I207-V327 HydrophobicContact CG2-CG1 3.86Å; I207-V327 HydrophobicContact CG2-CG2 4.04Å; V210-V327 HydrophobicContact CB-CG1 3.89Å; V210-V327 HydrophobicContact CG1-CG1 3.81Å; F214-V327 HydrophobicContact CE2-CG2 4.31Å; A305-V327 HydrophobicContact CB-CG1 4.14Å; L323-V327 HydrophobicContact CD2-CG2 4.34Å; L323-V327 WeakPolarHBondContact O-CG2 3.46Å; L323-V327 PolarHBondContact O-N 3.18Å; F324-V327 PolarHBondContact O-N 2.92Å; T325-V327 VanDerWaalsContact C-N 3.3Å; T325-V327 PolarHBondContact O-N 3.12Å; V327-C331 VanDerWaalsContact O-CB 3.3Å; V327-C331 WeakPolarHBondContact O-CB 3.25Å; V327-C331 PolarHBondContact O-N 2.84Å; V327-C331 VanDerWaalsContact O-N 3.08Å; V327-C331 PolarHBondContact O-SG 2.87Å; V327-F340 HydrophobicContact CG2-CE2 4.02Å
328	Y	96.8	Very high	95.4	Very high	32 Å²	32	46.2 Å²	46.2	13%	0.125	25%	0.254	C	S	.	.	H	α-helix	trans	-63.4	-49.9	176.1	164.6	-98.7	0	0	0	112.4	I306 N309 F324 T325 A326 I330 C331 F332 N333	I306-Y328 HydrophobicContact CB-CD2 4.42Å; I306-Y328 HydrophobicContact CB-CE2 4.42Å; I306-Y328 HydrophobicContact CG1-CD2 4.04Å; I306-Y328 HydrophobicContact CG1-CE2 4.07Å; I306-Y328 HydrophobicContact CG2-CE2 4.49Å; N309-Y328 HydrophobicContact CB-CD1 3.8Å; N309-Y328 HydrophobicContact CB-CD2 3.95Å; N309-Y328 HydrophobicContact CB-CE1 4.2Å; N309-Y328 HydrophobicContact CB-CE2 4.35Å; N309-Y328 HydrophobicContact CB-CG 3.65Å; N309-Y328 VanDerWaalsContact CG-CE1 3.47Å; N309-Y328 WeakPolarHBondContact ND2-CD1 3.48Å; N309-Y328 WeakPolarHBondContact OD1-CD1 3.41Å; N309-Y328 WeakPolarHBondContact OD1-CE1 3.42Å; F324-Y328 PolarHBondContact O-N 3.33Å; T325-Y328 WeakPolarHBondContact O-CB 3.39Å; T325-Y328 PolarHBondContact O-N 3.39Å; T325-Y328 VanDerWaalsContact O-N 3.1Å; A326-Y328 VanDerWaalsContact C-N 3.31Å; A326-Y328 PolarHBondContact O-N 3.39Å; Y328-I330 VanDerWaalsContact C-N 3.33Å; Y328-I330 PolarHBondContact O-N 2.85Å; Y328-C331 PolarHBondContact O-N 3.41Å; Y328-F332 HydrophobicContact CD2-CB 4.46Å; Y328-F332 AromaticContact CD2-CD2 3.69Å; Y328-F332 HydrophobicContact CD2-CD2 3.69Å; Y328-F332 HydrophobicContact CD2-CE2 4.46Å; Y328-F332 HydrophobicContact CD2-CG 4.44Å; Y328-F332 HydrophobicContact CE2-CB 4.21Å; Y328-F332 HydrophobicContact CE2-CD2 4.09Å; Y328-F332 HydrophobicContact CE2-CG 4.43Å; Y328-F332 WeakPolarHBondContact O-CD2 3.49Å; Y328-F332 PolarHBondContact O-N 3.22Å; Y328-N333 WeakPolarHBondContact CE1-ND2 3.48Å
329	E	96.8	Very high	95.4	Very high	46 Å²	46	47.5 Å²	47.5	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-39.1	-177.3	-66.9	-62.6	147.5	0	0	112.1	T325 A326 N333 G334 Q335	T325-E329 HydrophobicContact CG2-CG 4.02Å; T325-E329 WeakPolarHBondContact O-CG 3.25Å; T325-E329 PolarHBondContact O-N 3.02Å; A326-E329 PolarHBondContact O-N 3.07Å; E329-N333 CarbonylContact O-C 3.53Å; E329-N333 WeakPolarHBondContact O-CA 3.47Å; E329-N333 PolarHBondContact O-N 2.63Å; E329-N333 PolarHBondContact OE1-ND2 3.05Å; E329-N333 WeakPolarHBondContact OE2-CB 3.41Å; E329-N333 PolarHBondContact OE2-ND2 2.87Å; E329-G334 PolarHBondContact O-N 3.49Å; E329-Q335 HydrophobicContact CB-CB 4.03Å; E329-Q335 PolarHBondContact O-N 3.01Å
330	I	96.3	Very high	95.6	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.015	22%	0.219	C	C	.	.	H	α-helix	trans	-68.1	-42.7	175.9	-68.5	165.4	0	0	0	111.3	F214 F279 A326 Y328 Q335 V337 F340	F214-I330 HydrophobicContact CD2-CD1 4.15Å; F214-I330 HydrophobicContact CD2-CG2 4.49Å; F214-I330 HydrophobicContact CE1-CG2 4.26Å; F214-I330 HydrophobicContact CE2-CB 4.05Å; F214-I330 HydrophobicContact CE2-CD1 3.98Å; F214-I330 HydrophobicContact CE2-CG2 3.75Å; F214-I330 HydrophobicContact CZ-CB 4.24Å; F214-I330 HydrophobicContact CZ-CG2 3.61Å; F279-I330 HydrophobicContact CD1-CG2 4.41Å; F279-I330 HydrophobicContact CE1-CG2 3.59Å; F279-I330 HydrophobicContact CZ-CG2 4.33Å; A326-I330 WeakPolarHBondContact O-CB 3.13Å; A326-I330 WeakPolarHBondContact O-CD1 3.21Å; A326-I330 WeakPolarHBondContact O-CG1 3.46Å; A326-I330 PolarHBondContact O-N 2.83Å; Y328-I330 VanDerWaalsContact C-N 3.33Å; Y328-I330 PolarHBondContact O-N 2.85Å; I330-Q335 HydrophobicContact CG1-CB 4.01Å; I330-Q335 HydrophobicContact CG1-CG 4.18Å; I330-V337 HydrophobicContact CG2-CB 3.95Å; I330-V337 HydrophobicContact CG2-CG2 4.12Å; I330-F340 HydrophobicContact CD1-CB 3.72Å; I330-F340 HydrophobicContact CD1-CD2 3.82Å; I330-F340 HydrophobicContact CD1-CG 4.19Å
331	C	94.5	Very high	95.6	Very high	16 Å²	16	34.3 Å²	34.3	11%	0.108	20%	0.199	C	C	.	.	H	α-helix	trans	-71.3	-34.1	-177.7	-71	0	0	0	0	113.1	L286 V327 Y328	L286-C331 HydrophobicContact CD1-CB 3.77Å; V327-C331 VanDerWaalsContact O-CB 3.3Å; V327-C331 WeakPolarHBondContact O-CB 3.25Å; V327-C331 PolarHBondContact O-N 2.84Å; V327-C331 VanDerWaalsContact O-N 3.08Å; V327-C331 PolarHBondContact O-SG 2.87Å; Y328-C331 PolarHBondContact O-N 3.41Å
332	F	94.6	Very high	95.3	Very high	75 Å²	75	39 Å²	39	33%	0.329	22%	0.22	S	C	.	.	H	α-helix	trans	-127.5	-23.9	-164.7	-60.9	-70.9	0	0	0	115.7	L286 P302 I306 Y328	L286-F332 HydrophobicContact CD1-CE1 4.38Å; L286-F332 HydrophobicContact CD1-CZ 4.23Å; P302-F332 HydrophobicContact CB-CE2 3.91Å; P302-F332 HydrophobicContact CB-CZ 3.56Å; P302-F332 VanDerWaalsContact O-CE2 3.3Å; P302-F332 WeakPolarHBondContact O-CE2 3.34Å; I306-F332 HydrophobicContact CD1-CD1 4.19Å; I306-F332 HydrophobicContact CD1-CD2 4.22Å; I306-F332 HydrophobicContact CD1-CE1 3.73Å; I306-F332 HydrophobicContact CD1-CE2 3.76Å; I306-F332 HydrophobicContact CD1-CG 4.42Å; I306-F332 HydrophobicContact CD1-CZ 3.48Å; I306-F332 VanDerWaalsContact CD1-CZ 3.48Å; I306-F332 HydrophobicContact CG1-CD2 3.72Å; I306-F332 HydrophobicContact CG1-CE1 4.29Å; I306-F332 HydrophobicContact CG1-CE2 3.41Å; I306-F332 VanDerWaalsContact CG1-CE2 3.41Å; I306-F332 HydrophobicContact CG1-CG 4.28Å; I306-F332 HydrophobicContact CG1-CZ 3.73Å; Y328-F332 HydrophobicContact CD2-CB 4.46Å; Y328-F332 AromaticContact CD2-CD2 3.69Å; Y328-F332 HydrophobicContact CD2-CD2 3.69Å; Y328-F332 HydrophobicContact CD2-CE2 4.46Å; Y328-F332 HydrophobicContact CD2-CG 4.44Å; Y328-F332 HydrophobicContact CE2-CB 4.21Å; Y328-F332 HydrophobicContact CE2-CD2 4.09Å; Y328-F332 HydrophobicContact CE2-CG 4.43Å; Y328-F332 WeakPolarHBondContact O-CD2 3.49Å; Y328-F332 PolarHBondContact O-N 3.22Å
333	N	93	Very high	95.1	Very high	85 Å²	85	38.8 Å²	38.8	46%	0.455	22%	0.219	S	C	.	.	S	Bend	trans	-111.6	10.2	-175.6	-66.1	-22.6	0	0	0	113.3	Y328 E329 Q335	Y328-N333 WeakPolarHBondContact CE1-ND2 3.48Å; E329-N333 CarbonylContact O-C 3.53Å; E329-N333 WeakPolarHBondContact O-CA 3.47Å; E329-N333 PolarHBondContact O-N 2.63Å; E329-N333 PolarHBondContact OE1-ND2 3.05Å; E329-N333 WeakPolarHBondContact OE2-CB 3.41Å; E329-N333 PolarHBondContact OE2-ND2 2.87Å; N333-Q335 VanDerWaalsContact C-N 3.29Å; N333-Q335 PolarHBondContact O-N 2.82Å
334	G	90.4	Very high	94.8	Very high	65 Å²	65	39.5 Å²	39.5	67%	0.67	22%	0.222	S	C	*	.			trans	73.3	18	174.5	0	0	0	0	0	114.1	E329	E329-G334 PolarHBondContact O-N 3.49Å
335	Q	94.5	Very high	94.6	Very high	57 Å²	57	45.6 Å²	45.6	27%	0.266	25%	0.251	S	S	.	.			trans	-61.4	131	171.7	-173.7	176.4	13.7	0	0	109.5	E329 I330 N333 V337 E339	E329-Q335 HydrophobicContact CB-CB 4.03Å; E329-Q335 PolarHBondContact O-N 3.01Å; I330-Q335 HydrophobicContact CG1-CB 4.01Å; I330-Q335 HydrophobicContact CG1-CG 4.18Å; N333-Q335 VanDerWaalsContact C-N 3.29Å; N333-Q335 PolarHBondContact O-N 2.82Å; Q335-V337 PolarHBondContact O-N 3.42Å; Q335-E339 HydrophobicContact CG-CB 4.41Å; Q335-E339 PolarHBondContact NE2-OE2 3.22Å
336	P	95.9	Very high	94.2	Very high	71 Å²	71	50.1 Å²	50.1	46%	0.461	27%	0.274	S	S	.	.			trans	-61.5	129.5	178.8	-20.8	31.4	0	0	0	110.9	T338 E339	P336-T338 PolarHBondContact O-N 2.88Å; P336-T338 VanDerWaalsContact O-N 3.09Å; P336-E339 HydrophobicContact CB-CG 4.23Å; P336-E339 HydrophobicContact CG-CG 4.47Å; P336-E339 WeakPolarHBondContact O-CB 3.5Å; P336-E339 PolarHBondContact O-N 2.82Å
337	V	95.9	Very high	94.1	Very high	23 Å²	23	50 Å²	50	14%	0.139	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-58.4	-26.6	-179.7	65.7	0	0	0	0	113.2	F214 L218 F279 A280 I330 Q335 E339 F340	F214-V337 HydrophobicContact CB-CG2 3.84Å; F214-V337 HydrophobicContact CD1-CG2 3.81Å; F214-V337 HydrophobicContact CD2-CG2 4.22Å; F214-V337 HydrophobicContact CE1-CG2 4.39Å; F214-V337 HydrophobicContact CG-CG2 3.72Å; L218-V337 HydrophobicContact CD1-CG2 4.39Å; L218-V337 HydrophobicContact CD2-CG1 4.2Å; F279-V337 HydrophobicContact CE1-CB 4.49Å; A280-V337 HydrophobicContact CB-CG1 4.32Å; A280-V337 HydrophobicContact CB-CG2 3.82Å; I330-V337 HydrophobicContact CG2-CB 3.95Å; I330-V337 HydrophobicContact CG2-CG2 4.12Å; Q335-V337 PolarHBondContact O-N 3.42Å; V337-E339 PolarHBondContact O-N 2.85Å; V337-F340 WeakPolarHBondContact O-CB 3.29Å; V337-F340 PolarHBondContact O-N 3.46Å
338	T	94.5	Very high	93.7	Very high	93 Å²	93	52.1 Å²	52.1	57%	0.571	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-61.5	-20.3	174.1	51.2	0	0	0	0	113.4	L218 P336 F340	L218-T338 HydrophobicContact CD2-CG2 3.96Å; P336-T338 PolarHBondContact O-N 2.88Å; P336-T338 VanDerWaalsContact O-N 3.09Å; T338-F340 VanDerWaalsContact C-N 3.33Å
339	E	94.6	Very high	93.2	Very high	58 Å²	58	54.8 Å²	54.8	27%	0.271	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-82.3	-9	175.9	-58.4	-154.6	132.4	0	0	113.9	Q335 P336 V337 I341 K342	Q335-E339 HydrophobicContact CG-CB 4.41Å; Q335-E339 PolarHBondContact NE2-OE2 3.22Å; P336-E339 HydrophobicContact CB-CG 4.23Å; P336-E339 HydrophobicContact CG-CG 4.47Å; P336-E339 WeakPolarHBondContact O-CB 3.5Å; P336-E339 PolarHBondContact O-N 2.82Å; V337-E339 PolarHBondContact O-N 2.85Å; E339-I341 PolarHBondContact O-N 2.75Å; E339-I341 VanDerWaalsContact O-N 3.08Å; E339-K342 HydrophobicContact CB-CD 4.31Å; E339-K342 VanDerWaalsContact O-CB 3.32Å; E339-K342 WeakPolarHBondContact O-CB 3.47Å; E339-K342 PolarHBondContact O-N 2.91Å; E339-K342 IonicContact OE1-NZ 3.72Å; E339-K342 PolarHBondContact OE1-NZ 2.87Å
340	F	96.1	Very high	92.4	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-52.4	-37.4	-178.7	-177.2	-114.4	0	0	0	112.4	G211 F214 V228 L323 A326 V327 I330 V337 T338 K342 C343 L344	G211-F340 VanDerWaalsContact CA-CZ 3.45Å; G211-F340 WeakPolarHBondContact O-CE1 3.1Å; F214-F340 HydrophobicContact CB-CD1 4.21Å; F214-F340 HydrophobicContact CB-CG 4.45Å; F214-F340 HydrophobicContact CD2-CD2 4Å; F214-F340 HydrophobicContact CD2-CE2 4.28Å; F214-F340 HydrophobicContact CD2-CG 4.15Å; V228-F340 HydrophobicContact CG1-CE1 4.43Å; V228-F340 HydrophobicContact CG1-CZ 4.3Å; V228-F340 HydrophobicContact CG2-CE1 3.84Å; V228-F340 HydrophobicContact CG2-CZ 4.34Å; L323-F340 HydrophobicContact CG-CE2 4.44Å; L323-F340 HydrophobicContact CG-CZ 4.32Å; A326-F340 HydrophobicContact CB-CD2 4.08Å; A326-F340 HydrophobicContact CB-CE2 4.36Å; V327-F340 HydrophobicContact CG2-CE2 4.02Å; I330-F340 HydrophobicContact CD1-CB 3.72Å; I330-F340 HydrophobicContact CD1-CD2 3.82Å; I330-F340 HydrophobicContact CD1-CG 4.19Å; V337-F340 WeakPolarHBondContact O-CB 3.29Å; V337-F340 PolarHBondContact O-N 3.46Å; T338-F340 VanDerWaalsContact C-N 3.33Å; F340-K342 PolarHBondContact O-N 3.33Å; F340-C343 PolarHBondContact O-N 3.2Å; F340-C343 PolarHBondContact O-SG 2.85Å; F340-L344 HydrophobicContact CE1-CD1 4.22Å
341	I	93.4	Very high	91.1	Very high	44 Å²	44	67.7 Å²	67.7	23%	0.226	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-28.9	179.2	-165.4	57.5	0	0	0	113.4	F220 T224 E339 C343 L344 Q345	F220-I341 HydrophobicContact CE2-CB 4.44Å; F220-I341 HydrophobicContact CZ-CB 4.31Å; F220-I341 HydrophobicContact CZ-CG1 4.46Å; T224-I341 HydrophobicContact CG2-CD1 4.08Å; E339-I341 PolarHBondContact O-N 2.75Å; E339-I341 VanDerWaalsContact O-N 3.08Å; I341-C343 VanDerWaalsContact C-N 3.29Å; I341-C343 PolarHBondContact O-N 2.92Å; I341-L344 HydrophobicContact CD1-CD1 3.94Å; I341-L344 WeakPolarHBondContact O-CB 3.47Å; I341-L344 PolarHBondContact O-N 3.1Å; I341-Q345 WeakPolarHBondContact O-CG 3.31Å; I341-Q345 PolarHBondContact O-N 3.43Å; I341-Q345 VanDerWaalsContact O-N 3.11Å
342	K	92.1	Very high	91	Very high	103 Å²	103	70.3 Å²	70.3	45%	0.448	38%	0.375	S	S	.	.	H	α-helix	trans	-66.4	-33	-178.6	-61.5	-179.4	-174.6	173.1	0	111.6	E339 F340 L344 Q345 N346	E339-K342 HydrophobicContact CB-CD 4.31Å; E339-K342 VanDerWaalsContact O-CB 3.32Å; E339-K342 WeakPolarHBondContact O-CB 3.47Å; E339-K342 PolarHBondContact O-N 2.91Å; E339-K342 IonicContact OE1-NZ 3.72Å; E339-K342 PolarHBondContact OE1-NZ 2.87Å; F340-K342 PolarHBondContact O-N 3.33Å; K342-L344 PolarHBondContact O-N 3.31Å; K342-Q345 PolarHBondContact O-N 3.33Å; K342-N346 PolarHBondContact O-N 3.49Å; K342-N346 PolarHBondContact O-ND2 3.33Å
343	C	91.8	Very high	90.8	Very high	19 Å²	19	70 Å²	70	13%	0.128	38%	0.377	C	S	.	.	H	α-helix	trans	-67.8	-29.4	177.8	84.5	0	0	0	0	111.7	P322 A326 F340 I341	P322-C343 HydrophobicContact CB-CB 4.14Å; A326-C343 HydrophobicContact CB-CB 3.84Å; F340-C343 PolarHBondContact O-N 3.2Å; F340-C343 PolarHBondContact O-SG 2.85Å; I341-C343 VanDerWaalsContact C-N 3.29Å; I341-C343 PolarHBondContact O-N 2.92Å
344	L	91.6	Very high	90.6	Very high	14 Å²	14	69.2 Å²	69.2	7%	0.073	37%	0.373	C	S	.	.	H	α-helix	trans	-77.6	-37.4	176.6	-49.5	177.3	0	0	0	111.6	V228 L231 L323 F340 I341 K342 N346 H347	V228-L344 HydrophobicContact CG2-CD1 3.42Å; V228-L344 VanDerWaalsContact CG2-CD1 3.42Å; V228-L344 HydrophobicContact CG2-CD2 4.19Å; V228-L344 HydrophobicContact CG2-CG 4.47Å; L231-L344 HydrophobicContact CD1-CB 4.07Å; L231-L344 HydrophobicContact CD1-CD2 3.88Å; L323-L344 HydrophobicContact CD1-CD2 3.86Å; L323-L344 HydrophobicContact CG-CD2 4.35Å; F340-L344 HydrophobicContact CE1-CD1 4.22Å; I341-L344 HydrophobicContact CD1-CD1 3.94Å; I341-L344 WeakPolarHBondContact O-CB 3.47Å; I341-L344 PolarHBondContact O-N 3.1Å; K342-L344 PolarHBondContact O-N 3.31Å; L344-N346 VanDerWaalsContact C-N 3.34Å; L344-N346 PolarHBondContact O-N 3.02Å; L344-H347 WeakPolarHBondContact O-CB 3.25Å
345	Q	91.4	Very high	90.6	Very high	131 Å²	131	69.4 Å²	69.4	61%	0.612	36%	0.356	S	S	*	.	H	α-helix	trans	-65.7	-35.5	178.9	-72.5	172.8	-26.2	0	0	112.8	I341 K342	I341-Q345 WeakPolarHBondContact O-CG 3.31Å; I341-Q345 PolarHBondContact O-N 3.43Å; I341-Q345 VanDerWaalsContact O-N 3.11Å; K342-Q345 PolarHBondContact O-N 3.33Å
346	N	89.9	Confident	90.4	Very high	112 Å²	112	70.2 Å²	70.2	60%	0.599	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	24.7	-177.9	-59	-44.9	0	0	0	112.6	K342 L344	K342-N346 PolarHBondContact O-N 3.49Å; K342-N346 PolarHBondContact O-ND2 3.33Å; L344-N346 VanDerWaalsContact C-N 3.34Å; L344-N346 PolarHBondContact O-N 3.02Å
347	H	94.1	Very high	90	Very high	3 Å²	3	70.1 Å²	70.1	1%	0.014	36%	0.355	C	S	.	.			trans	-71.4	135.7	-172.6	-165.6	-74.3	0	0	0	112	L231 E235 L344 E349 H350	L231-H347 HydrophobicContact CD1-CB 4.26Å; L231-H347 HydrophobicContact CD2-CB 4.19Å; E235-H347 IonicContact OE1-CD2 2.67Å; E235-H347 IonicContact OE1-NE2 3.39Å; E235-H347 PolarHBondContact OE1-NE2 3.18Å; E235-H347 VanDerWaalsContact OE1-NE2 3.13Å; L344-H347 WeakPolarHBondContact O-CB 3.25Å; H347-E349 VanDerWaalsContact C-N 3.26Å; H347-E349 VanDerWaalsContact CE1-CG 3.43Å; H347-E349 WeakPolarHBondContact CE1-CG 3.12Å; H347-E349 WeakPolarHBondContact ND1-CB 3.23Å; H347-E349 WeakPolarHBondContact ND1-CG 3.39Å; H347-E349 PolarHBondContact ND1-N 2.67Å; H347-E349 PolarHBondContact O-N 3.44Å; H347-E349 VanDerWaalsContact O-N 3.12Å; H347-H350 PolarHBondContact O-N 2.65Å
348	P	88.9	Confident	89.6	Confident	45 Å²	45	73.5 Å²	73.5	29%	0.292	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-54.1	-32.3	-177.5	-29.3	33.7	0	0	0	116.2	H350 M351	P348-H350 PolarHBondContact O-N 3.13Å; P348-M351 HydrophobicContact CB-CE 4.15Å; P348-M351 HydrophobicContact CG-CE 4.05Å; P348-M351 PolarHBondContact O-N 2.74Å
349	E	86.1	Confident	89.2	Confident	88 Å²	88	72 Å²	72	41%	0.411	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-59.3	-9.7	173.4	-65.9	-69.1	144.8	0	0	114.9	L231 M234 H347	L231-E349 HydrophobicContact CD2-CB 4.17Å; L231-E349 HydrophobicContact CD2-CG 4.46Å; M234-E349 HydrophobicContact CB-CG 3.89Å; M234-E349 HydrophobicContact CG-CG 4.15Å; H347-E349 VanDerWaalsContact C-N 3.26Å; H347-E349 VanDerWaalsContact CE1-CG 3.43Å; H347-E349 WeakPolarHBondContact CE1-CG 3.12Å; H347-E349 WeakPolarHBondContact ND1-CB 3.23Å; H347-E349 WeakPolarHBondContact ND1-CG 3.39Å; H347-E349 PolarHBondContact ND1-N 2.67Å; H347-E349 PolarHBondContact O-N 3.44Å; H347-E349 VanDerWaalsContact O-N 3.12Å
350	H	80.7	Confident	88.8	Confident	121 Å²	121	73.2 Å²	73.2	56%	0.56	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-113.1	-1.5	177.1	-62.2	-46.3	0	0	0	113.4	R230 H347 P348	R230-H350 PolarHBondContact NH2-CE1 3.31Å; R230-H350 PolarHBondContact NH2-NE2 2.82Å; H347-H350 PolarHBondContact O-N 2.65Å; P348-H350 PolarHBondContact O-N 3.13Å
351	M	69.6	Low	88.1	Confident	198 Å²	198	79.8 Å²	79.8	98%	0.975	39%	0.394	S	S	*	.			trans	-99.2	0	-177.2	-68	-164.8	-74.4	0	0	113.5	P348	P348-M351 HydrophobicContact CB-CE 4.15Å; P348-M351 HydrophobicContact CG-CE 4.05Å; P348-M351 PolarHBondContact O-N 2.74Å

Retrieved 351 of 351 residues in 207.1 ms (Link to these results)

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