A0A087XZM1_POEFO Loading...

Probable N-acetyltransferase 14

Probable acetyltransferase.

AlphaFold DB , UniProt , Accession A0A087XZM1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 276 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	55.7	Low	84.1	Confident	177 Å²	177	70 Å²	70	87%	0.872	33%	0.333	S	S	*	.				0	116.3	0	-164.4	155.1	169	0	0	105.8	R3 E197	M1-R3 PolarHBondContact O-N 2.75Å; M1-E197 WeakPolarHBondContact CE-OE1 3.26Å
2	V	72.2	Confident	84.8	Confident	68 Å²	68	67.1 Å²	67.1	41%	0.412	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-80.6	118.2	-176.6	-179.9	0	0	0	0	106.8	L4 Y194	V2-L4 PolarHBondContact O-N 3.2Å; V2-Y194 HydrophobicContact CB-CE1 4.38Å; V2-Y194 HydrophobicContact CG1-CE1 3.88Å
3	R	79.6	Confident	85.1	Confident	220 Å²	220	62.7 Å²	62.7	83%	0.83	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-78.8	120.2	177.8	-171.5	175.1	-178.4	175.7	-1.4	108.2	M1	M1-R3 PolarHBondContact O-N 2.75Å
4	L	84.6	Confident	85.4	Confident	15 Å²	15	58.4 Å²	58.4	8%	0.079	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-93.4	123	176.9	-173.7	65.2	0	0	0	109.7	V2 L6 V9 C164 Y194 E197 L199	V2-L4 PolarHBondContact O-N 3.2Å; L4-L6 HydrophobicContact CD2-CD2 4.08Å; L4-L6 HydrophobicContact CG-CD2 4.4Å; L4-L6 PolarHBondContact O-N 3.17Å; L4-V9 HydrophobicContact CD1-CG2 4.09Å; L4-V9 HydrophobicContact CD2-CG2 3.96Å; L4-V9 HydrophobicContact CG-CG2 4.03Å; L4-C164 HydrophobicContact CD1-CB 4.33Å; L4-Y194 HydrophobicContact CB-CD1 3.99Å; L4-Y194 HydrophobicContact CD1-CD1 4.1Å; L4-Y194 HydrophobicContact CD1-CE1 4.04Å; L4-Y194 HydrophobicContact CD2-CD1 4.1Å; L4-Y194 HydrophobicContact CD2-CG 4.4Å; L4-Y194 HydrophobicContact CG-CD1 4.3Å; L4-E197 HydrophobicContact CB-CB 4.18Å; L4-E197 HydrophobicContact CB-CG 4.5Å; L4-L199 HydrophobicContact CD2-CB 4.03Å; L4-L199 HydrophobicContact CD2-CD1 3.99Å; L4-L199 HydrophobicContact CD2-CD2 4.06Å; L4-L199 HydrophobicContact CD2-CG 4.25Å
5	E	88.9	Confident	85.4	Confident	95 Å²	95	57.7 Å²	57.7	44%	0.444	27%	0.271	S	S	.	.			trans	-79.7	98.7	171.5	-68	-167.7	-173.4	0	0	109.2	D7 Q8	E5-D7 WeakPolarHBondContact CB-OD1 3.4Å; E5-D7 PolarHBondContact O-N 3.37Å; E5-D7 VanDerWaalsContact O-N 3.16Å; E5-Q8 HydrophobicContact CB-CB 4.45Å; E5-Q8 HydrophobicContact CB-CG 3.88Å; E5-Q8 WeakPolarHBondContact O-CB 3.44Å; E5-Q8 PolarHBondContact O-N 2.99Å; E5-Q8 PolarHBondContact OE2-NE2 2.79Å
6	L	89.6	Confident	85.2	Confident	23 Å²	23	61.4 Å²	61.4	12%	0.12	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.4	-173.4	-64.5	179	0	0	0	113.7	L4 Q8 V9 N115 Y117 L202	L4-L6 HydrophobicContact CD2-CD2 4.08Å; L4-L6 HydrophobicContact CG-CD2 4.4Å; L4-L6 PolarHBondContact O-N 3.17Å; L6-Q8 VanDerWaalsContact C-N 3.3Å; L6-V9 PolarHBondContact O-N 3.33Å; L6-N115 PolarHBondContact O-ND2 3.19Å; L6-Y117 HydrophobicContact CB-CD1 4.36Å; L6-Y117 HydrophobicContact CB-CD2 4.4Å; L6-Y117 HydrophobicContact CB-CG 4.13Å; L6-Y117 HydrophobicContact CD1-CD1 4.28Å; L6-Y117 HydrophobicContact CD1-CE1 3.93Å; L6-Y117 HydrophobicContact CD1-CE2 4.22Å; L6-L202 HydrophobicContact CB-CD2 4.42Å; L6-L202 HydrophobicContact CD2-CD2 4.17Å
7	D	88.3	Confident	85.2	Confident	30 Å²	30	65.8 Å²	65.8	16%	0.16	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-20	176.4	62.3	-38	0	0	0	113.2	E5 C118 S121	E5-D7 WeakPolarHBondContact CB-OD1 3.4Å; E5-D7 PolarHBondContact O-N 3.37Å; E5-D7 VanDerWaalsContact O-N 3.16Å; D7-C118 PolarHBondContact O-SG 3.42Å; D7-S121 VanDerWaalsContact OD2-CB 3.28Å; D7-S121 WeakPolarHBondContact OD2-CB 3.23Å; D7-S121 PolarHBondContact OD2-OG 2.75Å
8	Q	88.8	Confident	85.3	Confident	80 Å²	80	63 Å²	63	37%	0.374	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-15.2	176.2	-56.9	-169.4	4.2	0	0	113.2	E5 L6 V10	E5-Q8 HydrophobicContact CB-CB 4.45Å; E5-Q8 HydrophobicContact CB-CG 3.88Å; E5-Q8 WeakPolarHBondContact O-CB 3.44Å; E5-Q8 PolarHBondContact O-N 2.99Å; E5-Q8 PolarHBondContact OE2-NE2 2.79Å; L6-Q8 VanDerWaalsContact C-N 3.3Å; Q8-V10 PolarHBondContact O-N 2.99Å
9	V	92.6	Very high	85.2	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.012	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-72.6	122.6	-179	178.9	0	0	0	0	109.8	L4 L6 N115 A162 C164 L199 L202	L4-V9 HydrophobicContact CD1-CG2 4.09Å; L4-V9 HydrophobicContact CD2-CG2 3.96Å; L4-V9 HydrophobicContact CG-CG2 4.03Å; L6-V9 PolarHBondContact O-N 3.33Å; V9-N115 PolarHBondContact O-ND2 2.86Å; V9-A162 HydrophobicContact CG1-CB 3.68Å; V9-C164 HydrophobicContact CG2-CB 4.48Å; V9-L199 HydrophobicContact CG1-CD1 4.12Å; V9-L199 HydrophobicContact CG2-CD1 4.49Å; V9-L202 HydrophobicContact CB-CD2 3.81Å; V9-L202 HydrophobicContact CG1-CD2 3.84Å; V9-L202 HydrophobicContact CG2-CD2 4.35Å
10	V	92.6	Very high	85.2	Confident	59 Å²	59	63.9 Å²	63.9	36%	0.358	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.7	174.4	-178.7	0	0	0	0	108.5	Q8 D163	Q8-V10 PolarHBondContact O-N 2.99Å; V10-D163 PolarHBondContact N-O 3.5Å; V10-D163 PolarHBondContact O-N 3.37Å
11	M	92.6	Very high	85.3	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	118.2	173	-69.9	168	-62.2	0	0	109.3	T112 L113 N115 V161 L202 L203 S206	M11-T112 CarbonylContact O-C 3.45Å; M11-T112 VanDerWaalsContact O-CA 3.3Å; M11-T112 WeakPolarHBondContact O-CA 2.98Å; M11-T112 WeakPolarHBondContact O-CB 3.09Å; M11-L113 HydrophobicContact CB-CB 3.83Å; M11-L113 HydrophobicContact CB-CD1 4.3Å; M11-L113 HydrophobicContact CB-CG 4.29Å; M11-L113 HydrophobicContact CE-CB 4.21Å; M11-L113 PolarHBondContact O-N 3.37Å; M11-N115 HydrophobicContact CE-CB 3.82Å; M11-V161 VanDerWaalsContact CA-O 3.31Å; M11-V161 WeakPolarHBondContact CA-O 3.25Å; M11-L202 HydrophobicContact CE-CD1 3.77Å; M11-L202 HydrophobicContact CE-CG 4.14Å; M11-L202 HydrophobicContact SD-CD1 4.08Å; M11-L202 HydrophobicContact SD-CG 3.82Å; M11-L203 HydrophobicContact CG-CD2 4.09Å; M11-L203 HydrophobicContact SD-CD2 4.21Å; M11-S206 WeakPolarHBondContact CE-OG 3.42Å; M11-S206 WeakPolarHBondContact SD-CB 3.46Å; M11-S206 PolarHBondContact SD-OG 3.11Å; M11-S206 VanDerWaalsContact SD-OG 3.34Å
12	R	91.8	Very high	86.8	Confident	35 Å²	35	55.9 Å²	55.9	13%	0.132	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	166.5	-174.9	63.1	172.9	-179.4	77	-3.1	111.6	D18 T112 V161 D163	R12-D18 IonicContact CZ-OD1 3.48Å; R12-D18 IonicContact CZ-OD2 2.71Å; R12-D18 IonicContact NH1-OD1 3.3Å; R12-D18 IonicContact NH1-OD2 3.77Å; R12-D18 PolarHBondContact NH1-OD2 3.32Å; R12-D18 IonicContact NH2-OD1 3.76Å; R12-D18 PolarHBondContact NH2-OD1 2.9Å; R12-D18 IonicContact NH2-OD2 3.36Å; R12-D18 PolarHBondContact NH2-OD2 2.9Å; R12-T112 HydrophobicContact CB-CG2 4.1Å; R12-V161 HydrophobicContact CG-CG2 3.77Å; R12-V161 PolarHBondContact N-O 2.88Å; R12-V161 WeakPolarHBondContact O-CG2 3.34Å; R12-V161 PolarHBondContact O-N 3.27Å; R12-D163 HydrophobicContact CG-CB 4.44Å; R12-D163 IonicContact CZ-OD2 3.97Å; R12-D163 IonicContact NE-OD2 2.62Å; R12-D163 PolarHBondContact NE-OD2 2.74Å; R12-D163 IonicContact NH2-OD2 3.72Å; R12-D163 PolarHBondContact NH2-OD2 2.85Å
13	R	89.6	Confident	87.4	Confident	10 Å²	10	54.4 Å²	54.4	4%	0.038	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	140.3	169.1	-164.8	68.6	-164.5	164.7	-8.3	111.1	S104 E111 V159 W160	R13-S104 PolarHBondContact NH2-O 3.21Å; R13-E111 PolarHBondContact N-O 3.38Å; R13-V159 VanDerWaalsContact CZ-N 3.32Å; R13-V159 PolarHBondContact NH1-O 3.29Å; R13-V159 VanDerWaalsContact NH1-O 3.1Å; R13-W160 HydrophobicContact CB-CZ3 4.38Å
14	M	88.4	Confident	87.7	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	24%	0.242	C	C	.	.			trans	-66.5	135.7	172.3	-168.8	-171.4	77.1	0	0	110.5	D18 I19 V22 V101 V159 V161	M14-D18 HydrophobicContact CG-CB 3.76Å; M14-I19 HydrophobicContact CE-CG1 3.84Å; M14-V22 HydrophobicContact CG-CG2 4.18Å; M14-V22 HydrophobicContact SD-CB 4.06Å; M14-V22 HydrophobicContact SD-CG1 4.13Å; M14-V22 HydrophobicContact SD-CG2 3.84Å; M14-V101 HydrophobicContact CE-CG1 3.55Å; M14-V101 WeakPolarHBondContact CE-O 3.39Å; M14-V101 HydrophobicContact SD-CG1 3.7Å; M14-V159 HydrophobicContact CB-CB 3.89Å; M14-V159 HydrophobicContact CB-CG1 3.94Å; M14-V159 HydrophobicContact CE-CB 4.49Å; M14-V159 HydrophobicContact CG-CG1 4.31Å; M14-V159 PolarHBondContact N-O 3.47Å; M14-V159 HydrophobicContact SD-CB 4.03Å; M14-V159 HydrophobicContact SD-CG1 3.74Å; M14-V159 HydrophobicContact SD-CG2 4.42Å; M14-V161 HydrophobicContact CB-CG1 3.97Å; M14-V161 HydrophobicContact CG-CG1 4Å
15	K	86.4	Confident	87.8	Confident	49 Å²	49	46.8 Å²	46.8	21%	0.213	24%	0.242	C	C	.	.			trans	-105.5	168.1	175.9	-61	-175.9	178.7	-160.4	0	110.3	D17 D18 D110	K15-D17 VanDerWaalsContact C-N 3.28Å; K15-D17 PolarHBondContact O-N 2.98Å; K15-D18 WeakPolarHBondContact CB-OD2 3.31Å; K15-D18 PolarHBondContact N-OD2 3.48Å; K15-D18 WeakPolarHBondContact O-CB 3.41Å; K15-D18 PolarHBondContact O-N 3.34Å; K15-D110 IonicContact NZ-OD1 2.8Å; K15-D110 PolarHBondContact NZ-OD1 2.86Å
16	E	82.3	Confident	87.5	Confident	117 Å²	117	42.4 Å²	42.4	55%	0.547	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-58.1	-41.3	179.4	-170.7	162.7	-143.6	0	0	112.2	D18 I19 Y105	E16-D18 PolarHBondContact O-N 3Å; E16-I19 HydrophobicContact CB-CD1 4.47Å; E16-I19 HydrophobicContact CG-CD1 4.11Å; E16-I19 WeakPolarHBondContact O-CB 3.15Å; E16-I19 VanDerWaalsContact O-CG1 3.22Å; E16-I19 WeakPolarHBondContact O-CG1 3.28Å; E16-I19 PolarHBondContact O-N 3.49Å; E16-I19 VanDerWaalsContact O-N 3.14Å; E16-Y105 HydrophobicContact CB-CD2 3.99Å; E16-Y105 HydrophobicContact CB-CE2 3.92Å; E16-Y105 HydrophobicContact CG-CE2 4.05Å; E16-Y105 PolarHBondContact OE1-OH 3.41Å
17	D	85.1	Confident	87.2	Confident	136 Å²	136	48 Å²	48	73%	0.727	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-62.6	-23.8	177.1	-61.6	-24.4	0	0	0	113.4	K15	K15-D17 VanDerWaalsContact C-N 3.28Å; K15-D17 PolarHBondContact O-N 2.98Å
18	D	86.6	Confident	87	Confident	15 Å²	15	50.1 Å²	50.1	8%	0.08	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-83.6	-13.8	-178.9	-53.3	-48.2	0	0	0	112.4	R12 M14 K15 E16 E20 V21 V22 I168	R12-D18 IonicContact CZ-OD1 3.48Å; R12-D18 IonicContact CZ-OD2 2.71Å; R12-D18 IonicContact NH1-OD1 3.3Å; R12-D18 IonicContact NH1-OD2 3.77Å; R12-D18 PolarHBondContact NH1-OD2 3.32Å; R12-D18 IonicContact NH2-OD1 3.76Å; R12-D18 PolarHBondContact NH2-OD1 2.9Å; R12-D18 IonicContact NH2-OD2 3.36Å; R12-D18 PolarHBondContact NH2-OD2 2.9Å; M14-D18 HydrophobicContact CG-CB 3.76Å; K15-D18 WeakPolarHBondContact CB-OD2 3.31Å; K15-D18 PolarHBondContact N-OD2 3.48Å; K15-D18 WeakPolarHBondContact O-CB 3.41Å; K15-D18 PolarHBondContact O-N 3.34Å; E16-D18 PolarHBondContact O-N 3Å; D18-E20 VanDerWaalsContact C-N 3.34Å; D18-E20 PolarHBondContact O-N 3.33Å; D18-V21 PolarHBondContact O-N 2.96Å; D18-V21 VanDerWaalsContact O-N 3.1Å; D18-V22 HydrophobicContact CB-CG2 4.38Å; D18-V22 WeakPolarHBondContact O-CG2 3.07Å; D18-V22 PolarHBondContact O-N 2.8Å; D18-I168 HydrophobicContact CB-CG1 4.47Å
19	I	83.8	Confident	86.5	Confident	18 Å²	18	47.6 Å²	47.6	9%	0.092	25%	0.249	C	C	.	.	H	α-helix	trans	-55.2	-46.6	-169.6	-71.4	174.2	0	0	0	111.8	M14 E16 K23 V101 Y105	M14-I19 HydrophobicContact CE-CG1 3.84Å; E16-I19 HydrophobicContact CB-CD1 4.47Å; E16-I19 HydrophobicContact CG-CD1 4.11Å; E16-I19 WeakPolarHBondContact O-CB 3.15Å; E16-I19 VanDerWaalsContact O-CG1 3.22Å; E16-I19 WeakPolarHBondContact O-CG1 3.28Å; E16-I19 PolarHBondContact O-N 3.49Å; E16-I19 VanDerWaalsContact O-N 3.14Å; I19-K23 HydrophobicContact CG2-CD 4.06Å; I19-K23 VanDerWaalsContact CG2-CE 3.42Å; I19-K23 WeakPolarHBondContact O-CA 3.32Å; I19-K23 WeakPolarHBondContact O-CD 3.35Å; I19-K23 WeakPolarHBondContact O-CG 3.35Å; I19-K23 PolarHBondContact O-N 2.62Å; I19-V101 HydrophobicContact CB-CG1 4.27Å; I19-V101 HydrophobicContact CG1-CG1 4.14Å; I19-V101 HydrophobicContact CG2-CG1 3.88Å; I19-Y105 HydrophobicContact CD1-CD1 3.68Å; I19-Y105 HydrophobicContact CD1-CE1 3.84Å; I19-Y105 HydrophobicContact CD1-CG 4.38Å
20	E	83.9	Confident	85.8	Confident	126 Å²	126	48.9 Å²	48.9	59%	0.589	26%	0.258	S	S	*	.	H	α-helix	trans	-70.4	-34.5	-177.5	-66.1	-53.6	128.2	0	0	112.1	D18 K23 A24	D18-E20 VanDerWaalsContact C-N 3.34Å; D18-E20 PolarHBondContact O-N 3.33Å; E20-K23 WeakPolarHBondContact O-CA 3.35Å; E20-K23 PolarHBondContact O-N 2.99Å; E20-K23 IonicContact OE1-NZ 3.77Å; E20-K23 PolarHBondContact OE1-NZ 3.25Å; E20-K23 IonicContact OE2-NZ 3.93Å; E20-A24 PolarHBondContact O-N 3.32Å
21	V	88.6	Confident	85.1	Confident	72 Å²	72	53.5 Å²	53.5	44%	0.436	28%	0.276	S	S	.	.	H	α-helix	trans	-69.7	-45.7	177.4	-176.5	0	0	0	0	110.5	D18 K23 A24 L25 I168	D18-V21 PolarHBondContact O-N 2.96Å; D18-V21 VanDerWaalsContact O-N 3.1Å; V21-K23 VanDerWaalsContact C-N 3.31Å; V21-K23 PolarHBondContact O-N 3.46Å; V21-A24 PolarHBondContact O-N 3.09Å; V21-L25 WeakPolarHBondContact O-CB 3.43Å; V21-L25 PolarHBondContact O-N 2.99Å; V21-I168 HydrophobicContact CG1-CB 3.92Å; V21-I168 HydrophobicContact CG1-CG1 4.47Å
22	V	87.2	Confident	84.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-40.7	173.7	175.5	0	0	0	0	110.5	M14 D18 A24 L25 V26 V159 V161 I168 F173	M14-V22 HydrophobicContact CG-CG2 4.18Å; M14-V22 HydrophobicContact SD-CB 4.06Å; M14-V22 HydrophobicContact SD-CG1 4.13Å; M14-V22 HydrophobicContact SD-CG2 3.84Å; D18-V22 HydrophobicContact CB-CG2 4.38Å; D18-V22 WeakPolarHBondContact O-CG2 3.07Å; D18-V22 PolarHBondContact O-N 2.8Å; V22-A24 PolarHBondContact O-N 2.84Å; V22-L25 PolarHBondContact O-N 3.35Å; V22-V26 HydrophobicContact CG1-CG2 4.24Å; V22-V26 WeakPolarHBondContact O-CG2 3.23Å; V22-V26 PolarHBondContact O-N 2.88Å; V22-V159 HydrophobicContact CG1-CG1 4.43Å; V22-V161 HydrophobicContact CG2-CG1 3.72Å; V22-I168 HydrophobicContact CG2-CG2 4.45Å; V22-F173 HydrophobicContact CG1-CE2 4.23Å; V22-F173 HydrophobicContact CG1-CZ 4.01Å
23	K	84.1	Confident	83.8	Confident	38 Å²	38	54.5 Å²	54.5	17%	0.165	29%	0.291	C	S	.	.	H	α-helix	trans	-31.5	-68.5	159.5	64	70.9	164.6	175.9	0	112.5	I19 E20 V21 K27 Y97 W98 V101	I19-K23 HydrophobicContact CG2-CD 4.06Å; I19-K23 VanDerWaalsContact CG2-CE 3.42Å; I19-K23 WeakPolarHBondContact O-CA 3.32Å; I19-K23 WeakPolarHBondContact O-CD 3.35Å; I19-K23 WeakPolarHBondContact O-CG 3.35Å; I19-K23 PolarHBondContact O-N 2.62Å; E20-K23 WeakPolarHBondContact O-CA 3.35Å; E20-K23 PolarHBondContact O-N 2.99Å; E20-K23 IonicContact OE1-NZ 3.77Å; E20-K23 PolarHBondContact OE1-NZ 3.25Å; E20-K23 IonicContact OE2-NZ 3.93Å; V21-K23 VanDerWaalsContact C-N 3.31Å; V21-K23 PolarHBondContact O-N 3.46Å; K23-K27 WeakPolarHBondContact O-CB 3.31Å; K23-K27 PolarHBondContact O-N 3.23Å; K23-Y97 HydrophobicContact CB-CD2 4.48Å; K23-Y97 HydrophobicContact CB-CE2 3.84Å; K23-Y97 HydrophobicContact CG-CE2 4.4Å; K23-W98 HydrophobicContact CB-CE3 4.09Å; K23-W98 HydrophobicContact CB-CZ3 3.98Å; K23-W98 HydrophobicContact CD-CE3 3.78Å; K23-W98 HydrophobicContact CD-CZ3 3.98Å; K23-W98 HydrophobicContact CG-CE3 3.9Å; K23-W98 HydrophobicContact CG-CZ3 4.2Å; K23-V101 HydrophobicContact CG-CB 4.43Å; K23-V101 HydrophobicContact CG-CG1 4.27Å; K23-V101 HydrophobicContact CG-CG2 4.31Å
24	A	85.1	Confident	83.2	Confident	60 Å²	60	57.4 Å²	57.4	50%	0.496	31%	0.305	S	S	.	.	H	α-helix	trans	-67.3	-42.8	-174.7	0	0	0	0	0	112	E20 V21 V22 V26 K27 E28	E20-A24 PolarHBondContact O-N 3.32Å; V21-A24 PolarHBondContact O-N 3.09Å; V22-A24 PolarHBondContact O-N 2.84Å; A24-V26 PolarHBondContact O-N 3.17Å; A24-K27 WeakPolarHBondContact O-CB 3.24Å; A24-K27 PolarHBondContact O-N 3.33Å; A24-E28 PolarHBondContact O-N 3.47Å
25	L	86.8	Confident	83	Confident	15 Å²	15	61.7 Å²	61.7	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-60.8	-47.3	-178.6	-169.9	74.4	0	0	0	111.7	V21 V22 K27 E28 G29 C171 V189	V21-L25 WeakPolarHBondContact O-CB 3.43Å; V21-L25 PolarHBondContact O-N 2.99Å; V22-L25 PolarHBondContact O-N 3.35Å; L25-K27 VanDerWaalsContact C-N 3.35Å; L25-K27 PolarHBondContact O-N 3.33Å; L25-E28 PolarHBondContact O-N 3.33Å; L25-G29 PolarHBondContact O-N 3.35Å; L25-C171 HydrophobicContact CD2-CB 4.35Å; L25-V189 HydrophobicContact CD2-CG1 4.45Å; L25-V189 HydrophobicContact CG-CB 4.47Å; L25-V189 HydrophobicContact CG-CG1 3.93Å; L25-V189 WeakPolarHBondContact O-CG1 3.5Å
26	V	84.4	Confident	83	Confident	3 Å²	3	66.7 Å²	66.7	2%	0.018	35%	0.346	C	S	.	.	H	α-helix	trans	-63.7	-42.9	177.7	173	0	0	0	0	110.8	V22 A24 E28 G29 C30 Y97 F173 V189	V22-V26 HydrophobicContact CG1-CG2 4.24Å; V22-V26 WeakPolarHBondContact O-CG2 3.23Å; V22-V26 PolarHBondContact O-N 2.88Å; A24-V26 PolarHBondContact O-N 3.17Å; V26-E28 PolarHBondContact O-N 3.45Å; V26-G29 PolarHBondContact O-N 2.83Å; V26-C30 WeakPolarHBondContact O-CB 3.33Å; V26-C30 PolarHBondContact O-N 2.94Å; V26-C30 PolarHBondContact O-SG 3.39Å; V26-Y97 HydrophobicContact CG1-CD2 4.48Å; V26-F173 HydrophobicContact CG2-CE2 4.11Å; V26-F173 HydrophobicContact CG2-CZ 4.3Å; V26-V189 HydrophobicContact CG2-CG2 4.42Å
27	K	82.4	Confident	83.1	Confident	141 Å²	141	61.5 Å²	61.5	61%	0.613	32%	0.322	S	S	*	.	H	α-helix	trans	-59	-46	177.2	-174.8	-178.2	177.6	-174.7	0	111.7	K23 A24 L25 C30 E31	K23-K27 WeakPolarHBondContact O-CB 3.31Å; K23-K27 PolarHBondContact O-N 3.23Å; A24-K27 WeakPolarHBondContact O-CB 3.24Å; A24-K27 PolarHBondContact O-N 3.33Å; L25-K27 VanDerWaalsContact C-N 3.35Å; L25-K27 PolarHBondContact O-N 3.33Å; K27-C30 PolarHBondContact O-N 3.34Å; K27-E31 PolarHBondContact O-N 2.67Å; K27-E31 VanDerWaalsContact O-N 3.17Å
28	E	83.8	Confident	83.1	Confident	74 Å²	74	55.5 Å²	55.5	35%	0.346	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-45.1	175.8	-172.4	-164.4	147.5	0	0	111.6	A24 L25 V26 C30 E31 C192	A24-E28 PolarHBondContact O-N 3.47Å; L25-E28 PolarHBondContact O-N 3.33Å; V26-E28 PolarHBondContact O-N 3.45Å; E28-C30 PolarHBondContact O-N 2.75Å; E28-E31 WeakPolarHBondContact O-CB 3.44Å; E28-E31 PolarHBondContact O-N 3.07Å; E28-C192 VanDerWaalsContact OE1-CB 3.24Å; E28-C192 WeakPolarHBondContact OE1-CB 3.47Å; E28-C192 PolarHBondContact OE1-SG 3.4Å
29	G	79.1	Confident	83.1	Confident	27 Å²	27	60 Å²	60	28%	0.278	31%	0.313	S	S	.	.	H	α-helix	trans	-63.4	-29.6	-180	0	0	0	0	0	114	L25 V26	L25-G29 PolarHBondContact O-N 3.35Å; V26-G29 PolarHBondContact O-N 2.83Å
30	C	76.8	Confident	83.2	Confident	29 Å²	29	60.7 Å²	60.7	20%	0.196	32%	0.316	C	S	.	.	H	α-helix	trans	-95.2	-4.7	-178.7	-58.6	0	0	0	0	113.1	V26 K27 E28 G32 T33 V90	V26-C30 WeakPolarHBondContact O-CB 3.33Å; V26-C30 PolarHBondContact O-N 2.94Å; V26-C30 PolarHBondContact O-SG 3.39Å; K27-C30 PolarHBondContact O-N 3.34Å; E28-C30 PolarHBondContact O-N 2.75Å; C30-G32 PolarHBondContact O-N 3.3Å; C30-T33 VanDerWaalsContact O-CB 3.25Å; C30-T33 WeakPolarHBondContact O-CB 3.25Å; C30-T33 PolarHBondContact O-N 3.28Å; C30-T33 PolarHBondContact O-OG1 2.91Å; C30-V90 HydrophobicContact CB-CG1 3.79Å; C30-V90 WeakPolarHBondContact SG-CG1 3.24Å
31	E	79.2	Confident	83.3	Confident	156 Å²	156	55.3 Å²	55.3	73%	0.729	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	130.7	-178.3	-168.9	174.6	-173	0	0	111.3	K27 E28 T33	K27-E31 PolarHBondContact O-N 2.67Å; K27-E31 VanDerWaalsContact O-N 3.17Å; E28-E31 WeakPolarHBondContact O-CB 3.44Å; E28-E31 PolarHBondContact O-N 3.07Å; E31-T33 PolarHBondContact O-N 2.88Å; E31-T33 VanDerWaalsContact O-N 3.09Å
32	G	76.4	Confident	83.3	Confident	29 Å²	29	53 Å²	53	30%	0.299	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	-10.4	-178.6	0	0	0	0	0	115.6	C30 N35 R36	C30-G32 PolarHBondContact O-N 3.3Å; G32-N35 PolarHBondContact O-N 2.97Å; G32-R36 WeakPolarHBondContact O-CG 3.21Å; G32-R36 PolarHBondContact O-N 2.89Å; G32-R36 VanDerWaalsContact O-N 3.11Å
33	T	79.3	Confident	83.3	Confident	27 Å²	27	56.9 Å²	56.9	17%	0.166	30%	0.3	C	S	.	.	H	α-helix	trans	-65.1	-41.2	176.1	-59.2	0	0	0	0	110.9	C30 E31 N35 R36 L37 L91 P224	C30-T33 VanDerWaalsContact O-CB 3.25Å; C30-T33 WeakPolarHBondContact O-CB 3.25Å; C30-T33 PolarHBondContact O-N 3.28Å; C30-T33 PolarHBondContact O-OG1 2.91Å; E31-T33 PolarHBondContact O-N 2.88Å; E31-T33 VanDerWaalsContact O-N 3.09Å; T33-N35 PolarHBondContact O-N 3.39Å; T33-R36 PolarHBondContact O-N 3.44Å; T33-L37 HydrophobicContact CG2-CD1 4.1Å; T33-L37 HydrophobicContact CG2-CG 4.47Å; T33-L37 WeakPolarHBondContact O-CB 3.41Å; T33-L37 WeakPolarHBondContact O-CG 3.13Å; T33-L37 PolarHBondContact O-N 3.28Å; T33-L91 HydrophobicContact CG2-CD1 4.37Å; T33-P224 HydrophobicContact CG2-CB 4.02Å; T33-P224 HydrophobicContact CG2-CG 4.18Å
34	E	78.4	Confident	83.6	Confident	71 Å²	71	58.4 Å²	58.4	33%	0.332	31%	0.305	S	S	.	.	H	α-helix	trans	-57	-48.7	174.2	-64.8	179.3	-177.9	0	0	112.2	R36 L37 I38 K81	E34-R36 VanDerWaalsContact C-N 3.28Å; E34-R36 PolarHBondContact O-N 2.85Å; E34-L37 WeakPolarHBondContact O-CB 3.36Å; E34-L37 PolarHBondContact O-N 3.24Å; E34-L37 VanDerWaalsContact O-N 3.12Å; E34-I38 WeakPolarHBondContact O-CG1 3.28Å; E34-I38 PolarHBondContact O-N 2.94Å; E34-K81 IonicContact OE2-NZ 3.33Å; E34-K81 PolarHBondContact OE2-NZ 3.24Å
35	N	83.8	Confident	83.8	Confident	92 Å²	92	60.3 Å²	60.3	49%	0.492	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-37.2	-177.5	-66.1	-5.7	0	0	0	110.8	G32 T33 L39 K81	G32-N35 PolarHBondContact O-N 2.97Å; T33-N35 PolarHBondContact O-N 3.39Å; N35-L39 WeakPolarHBondContact O-CB 3.41Å; N35-L39 PolarHBondContact O-N 3.18Å; N35-K81 WeakPolarHBondContact OD1-CE 3.42Å; N35-K81 PolarHBondContact OD1-NZ 3.34Å
36	R	86.4	Confident	83.8	Confident	155 Å²	155	64.5 Å²	64.5	59%	0.585	33%	0.334	S	S	*	.	H	α-helix	trans	-67.8	-36.3	174	-68.9	174.3	-177.2	178.4	2.8	112.2	G32 T33 E34 H40 P226	G32-R36 WeakPolarHBondContact O-CG 3.21Å; G32-R36 PolarHBondContact O-N 2.89Å; G32-R36 VanDerWaalsContact O-N 3.11Å; T33-R36 PolarHBondContact O-N 3.44Å; E34-R36 VanDerWaalsContact C-N 3.28Å; E34-R36 PolarHBondContact O-N 2.85Å; R36-H40 VanDerWaalsContact O-CB 3.25Å; R36-H40 WeakPolarHBondContact O-CB 3.26Å; R36-H40 PolarHBondContact O-N 2.78Å; R36-P226 HydrophobicContact CB-CB 3.88Å; R36-P226 HydrophobicContact CB-CG 4Å
37	L	83.3	Confident	84	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-67.6	-44.9	174.3	-79.8	168.5	0	0	0	111.6	T33 E34 L39 H40 I41 M84 L91 P226	T33-L37 HydrophobicContact CG2-CD1 4.1Å; T33-L37 HydrophobicContact CG2-CG 4.47Å; T33-L37 WeakPolarHBondContact O-CB 3.41Å; T33-L37 WeakPolarHBondContact O-CG 3.13Å; T33-L37 PolarHBondContact O-N 3.28Å; E34-L37 WeakPolarHBondContact O-CB 3.36Å; E34-L37 PolarHBondContact O-N 3.24Å; E34-L37 VanDerWaalsContact O-N 3.12Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L39 PolarHBondContact O-N 2.9Å; L37-H40 WeakPolarHBondContact O-CA 3.13Å; L37-H40 WeakPolarHBondContact O-CB 3.2Å; L37-H40 PolarHBondContact O-N 2.95Å; L37-H40 VanDerWaalsContact O-N 3.12Å; L37-I41 WeakPolarHBondContact O-CG1 3.47Å; L37-I41 PolarHBondContact O-N 3.03Å; L37-M84 HydrophobicContact CB-CE 4.38Å; L37-L91 HydrophobicContact CD1-CD1 3.98Å; L37-L91 HydrophobicContact CD1-CD2 4.2Å; L37-P226 HydrophobicContact CD2-CG 3.72Å; L37-P226 HydrophobicContact CG-CG 3.77Å
38	I	85.6	Confident	84.5	Confident	10 Å²	10	62.3 Å²	62.3	5%	0.051	33%	0.328	C	S	.	.	H	α-helix	trans	-58.4	-49.6	174.7	-68.5	167.3	0	0	0	109.6	E34 H40 I41 L42 I77 L80 K81 M84	E34-I38 WeakPolarHBondContact O-CG1 3.28Å; E34-I38 PolarHBondContact O-N 2.94Å; I38-H40 VanDerWaalsContact C-N 3.27Å; I38-H40 PolarHBondContact O-N 3.21Å; I38-I41 PolarHBondContact O-N 3.43Å; I38-I41 VanDerWaalsContact O-N 3.14Å; I38-L42 HydrophobicContact CG2-CD1 3.71Å; I38-L42 HydrophobicContact CG2-CG 4.18Å; I38-L42 WeakPolarHBondContact O-CB 3.46Å; I38-L42 VanDerWaalsContact O-CG 3.3Å; I38-L42 WeakPolarHBondContact O-CG 3.49Å; I38-L42 PolarHBondContact O-N 3.24Å; I38-I77 HydrophobicContact CG2-CG1 4.35Å; I38-L80 HydrophobicContact CG1-CB 4.12Å; I38-L80 HydrophobicContact CG2-CD1 4.14Å; I38-K81 HydrophobicContact CD1-CD 3.96Å; I38-K81 HydrophobicContact CD1-CG 3.76Å; I38-M84 HydrophobicContact CD1-SD 4.37Å; I38-M84 HydrophobicContact CG1-CE 4.09Å; I38-M84 HydrophobicContact CG1-SD 3.6Å
39	L	87.8	Confident	84.8	Confident	109 Å²	109	65.2 Å²	65.2	57%	0.571	34%	0.34	S	S	*	.	H	α-helix	trans	-58.8	-40.7	175.7	-177	63.7	0	0	0	111.6	N35 L37 I41 L42 T43	N35-L39 WeakPolarHBondContact O-CB 3.41Å; N35-L39 PolarHBondContact O-N 3.18Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L39 PolarHBondContact O-N 2.9Å; L39-I41 VanDerWaalsContact C-N 3.33Å; L39-I41 PolarHBondContact O-N 3.32Å; L39-L42 PolarHBondContact O-N 2.89Å; L39-T43 HydrophobicContact CD1-CG2 4.07Å; L39-T43 HydrophobicContact CG-CG2 4.43Å; L39-T43 WeakPolarHBondContact O-CB 3.47Å; L39-T43 VanDerWaalsContact O-CG2 3.27Å; L39-T43 WeakPolarHBondContact O-CG2 3.28Å; L39-T43 PolarHBondContact O-N 2.9Å; L39-T43 PolarHBondContact O-OG1 2.91Å
40	H	85.3	Confident	85.4	Confident	33 Å²	33	67.3 Å²	67.3	15%	0.153	34%	0.344	C	S	.	.	H	α-helix	trans	-61.1	-39.6	176.7	-177.2	68.2	0	0	0	112.6	R36 L37 I38 T43 R44 Y225	R36-H40 VanDerWaalsContact O-CB 3.25Å; R36-H40 WeakPolarHBondContact O-CB 3.26Å; R36-H40 PolarHBondContact O-N 2.78Å; L37-H40 WeakPolarHBondContact O-CA 3.13Å; L37-H40 WeakPolarHBondContact O-CB 3.2Å; L37-H40 PolarHBondContact O-N 2.95Å; L37-H40 VanDerWaalsContact O-N 3.12Å; I38-H40 VanDerWaalsContact C-N 3.27Å; I38-H40 PolarHBondContact O-N 3.21Å; H40-T43 PolarHBondContact O-OG1 3.37Å; H40-R44 PolarHBondContact CE1-NH2 3.48Å; H40-R44 PolarHBondContact NE2-NE 2.7Å; H40-R44 PolarHBondContact NE2-NH2 2.71Å; H40-R44 WeakPolarHBondContact O-CG 3.43Å; H40-Y225 AromaticContact CE1-CD1 3.24Å; H40-Y225 WeakPolarHBondContact CE1-CD1 3.46Å; H40-Y225 AromaticContact CE1-CE1 3.4Å; H40-Y225 VanDerWaalsContact CE1-CE1 3.4Å; H40-Y225 WeakPolarHBondContact CE1-CE1 3.41Å; H40-Y225 AromaticContact ND1-CD1 3.92Å; H40-Y225 AromaticContact NE2-CD1 3.39Å; H40-Y225 WeakPolarHBondContact NE2-CD1 3.39Å; H40-Y225 AromaticContact NE2-CE1 3.77Å; H40-Y225 AromaticContact NE2-CG 3.86Å
41	I	85.6	Confident	86.2	Confident	13 Å²	13	66.7 Å²	66.7	7%	0.067	34%	0.339	C	S	.	.	H	α-helix	trans	-72	-46.8	176.7	-65.8	-179.7	0	0	0	110.9	L37 I38 L39 T43 R44 C47 L80 M84 L268	L37-I41 WeakPolarHBondContact O-CG1 3.47Å; L37-I41 PolarHBondContact O-N 3.03Å; I38-I41 PolarHBondContact O-N 3.43Å; I38-I41 VanDerWaalsContact O-N 3.14Å; L39-I41 VanDerWaalsContact C-N 3.33Å; L39-I41 PolarHBondContact O-N 3.32Å; I41-T43 PolarHBondContact O-N 3.02Å; I41-R44 WeakPolarHBondContact O-CB 3.4Å; I41-R44 PolarHBondContact O-N 3.22Å; I41-C47 VanDerWaalsContact O-CB 3.31Å; I41-C47 WeakPolarHBondContact O-CB 3.22Å; I41-L80 HydrophobicContact CG2-CD1 4.35Å; I41-M84 HydrophobicContact CD1-CE 3.15Å; I41-M84 HydrophobicContact CG1-CE 4.26Å; I41-L268 HydrophobicContact CD1-CD2 3.73Å; I41-L268 HydrophobicContact CG1-CD2 4.3Å
42	L	88.3	Confident	86.9	Confident	24 Å²	24	62 Å²	62	13%	0.126	33%	0.327	C	S	.	.	H	α-helix	trans	-61.1	-28.4	-178.5	-71.9	176	0	0	0	112.9	I38 L39 R44 L48 L51 L76 I77	I38-L42 HydrophobicContact CG2-CD1 3.71Å; I38-L42 HydrophobicContact CG2-CG 4.18Å; I38-L42 WeakPolarHBondContact O-CB 3.46Å; I38-L42 VanDerWaalsContact O-CG 3.3Å; I38-L42 WeakPolarHBondContact O-CG 3.49Å; I38-L42 PolarHBondContact O-N 3.24Å; L39-L42 PolarHBondContact O-N 2.89Å; L42-R44 VanDerWaalsContact C-N 3.31Å; L42-L48 WeakPolarHBondContact O-CD2 3.33Å; L42-L48 WeakPolarHBondContact O-CG 3.45Å; L42-L51 HydrophobicContact CD2-CD1 4.16Å; L42-L76 HydrophobicContact CD2-CD2 3.44Å; L42-L76 VanDerWaalsContact CD2-CD2 3.44Å; L42-L76 HydrophobicContact CD2-CG 4.03Å; L42-I77 HydrophobicContact CD1-CD1 4.25Å; L42-I77 HydrophobicContact CD1-CG1 3.85Å
43	T	88.6	Confident	87.7	Confident	81 Å²	81	63.7 Å²	63.7	50%	0.497	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	1.3	179.2	50.7	0	0	0	0	113.7	L39 H40 I41	L39-T43 HydrophobicContact CD1-CG2 4.07Å; L39-T43 HydrophobicContact CG-CG2 4.43Å; L39-T43 WeakPolarHBondContact O-CB 3.47Å; L39-T43 VanDerWaalsContact O-CG2 3.27Å; L39-T43 WeakPolarHBondContact O-CG2 3.28Å; L39-T43 PolarHBondContact O-N 2.9Å; L39-T43 PolarHBondContact O-OG1 2.91Å; H40-T43 PolarHBondContact O-OG1 3.37Å; I41-T43 PolarHBondContact O-N 3.02Å
44	R	88.5	Confident	88.4	Confident	71 Å²	71	68.2 Å²	68.2	27%	0.268	35%	0.349	S	S	.	.	S	Bend	trans	-76.9	138.2	176.8	-67.6	-57.2	-172	160.6	3.4	111.6	H40 I41 L42 L46 C47 L48	H40-R44 PolarHBondContact CE1-NH2 3.48Å; H40-R44 PolarHBondContact NE2-NE 2.7Å; H40-R44 PolarHBondContact NE2-NH2 2.71Å; H40-R44 WeakPolarHBondContact O-CG 3.43Å; I41-R44 WeakPolarHBondContact O-CB 3.4Å; I41-R44 PolarHBondContact O-N 3.22Å; L42-R44 VanDerWaalsContact C-N 3.31Å; R44-L46 VanDerWaalsContact C-N 3.3Å; R44-L46 PolarHBondContact O-N 3.15Å; R44-C47 HydrophobicContact CB-CB 4.31Å; R44-C47 WeakPolarHBondContact O-CB 3.25Å; R44-C47 PolarHBondContact O-N 3.07Å; R44-L48 PolarHBondContact O-N 3.4Å
45	P	89.4	Confident	89.1	Confident	100 Å²	100	65.4 Å²	65.4	65%	0.649	34%	0.337	S	S	*	.	H	α-helix	trans	-52.4	-43.5	-177	-28.7	34.2	0	0	0	114.2	L48 F49	P45-L48 PolarHBondContact O-N 3.02Å; P45-F49 WeakPolarHBondContact O-CB 3.42Å; P45-F49 PolarHBondContact O-N 3.43Å
46	L	87.4	Confident	89.6	Confident	102 Å²	102	64.7 Å²	64.7	53%	0.534	34%	0.339	S	S	.	.	H	α-helix	trans	-70.5	-33.4	179.5	-73.1	174.8	0	0	0	112.9	R44 F49 I50 M264 Y266	R44-L46 VanDerWaalsContact C-N 3.3Å; R44-L46 PolarHBondContact O-N 3.15Å; L46-F49 PolarHBondContact O-N 3.14Å; L46-I50 VanDerWaalsContact O-CG1 3.3Å; L46-I50 WeakPolarHBondContact O-CG1 3.5Å; L46-I50 PolarHBondContact O-N 3.07Å; L46-M264 HydrophobicContact CB-CE 4.37Å; L46-Y266 WeakPolarHBondContact CB-OH 3.38Å; L46-Y266 WeakPolarHBondContact CD1-OH 3.41Å
47	C	89.3	Confident	89.9	Confident	3 Å²	3	62 Å²	62	2%	0.02	34%	0.335	C	S	.	.	H	α-helix	trans	-67.7	-45	174.3	-172.9	0	0	0	0	110.5	I41 R44 F49 I50 L51 M264	I41-C47 VanDerWaalsContact O-CB 3.31Å; I41-C47 WeakPolarHBondContact O-CB 3.22Å; R44-C47 HydrophobicContact CB-CB 4.31Å; R44-C47 WeakPolarHBondContact O-CB 3.25Å; R44-C47 PolarHBondContact O-N 3.07Å; C47-F49 VanDerWaalsContact C-N 3.31Å; C47-F49 PolarHBondContact O-N 2.95Å; C47-I50 PolarHBondContact O-N 2.98Å; C47-L51 WeakPolarHBondContact O-CG 3.32Å; C47-L51 PolarHBondContact O-N 3Å; C47-M264 HydrophobicContact CB-SD 4.4Å
48	L	91.6	Very high	90.3	Very high	95 Å²	95	63.2 Å²	63.2	50%	0.497	34%	0.342	S	S	.	.	H	α-helix	trans	-60.5	-40.5	174.4	-67.4	175.2	0	0	0	112.2	L42 R44 P45 L51 A52	L42-L48 WeakPolarHBondContact O-CD2 3.33Å; L42-L48 WeakPolarHBondContact O-CG 3.45Å; R44-L48 PolarHBondContact O-N 3.4Å; P45-L48 PolarHBondContact O-N 3.02Å; L48-L51 PolarHBondContact O-N 3.41Å; L48-A52 WeakPolarHBondContact O-CB 2.91Å; L48-A52 PolarHBondContact O-N 3.16Å
49	F	92.1	Very high	90.5	Very high	136 Å²	136	69.8 Å²	69.8	60%	0.596	37%	0.366	S	S	*	.	H	α-helix	trans	-61.6	-47.9	175.7	178.8	-104.7	0	0	0	111.8	P45 L46 C47 L51 A52 V53	P45-F49 WeakPolarHBondContact O-CB 3.42Å; P45-F49 PolarHBondContact O-N 3.43Å; L46-F49 PolarHBondContact O-N 3.14Å; C47-F49 VanDerWaalsContact C-N 3.31Å; C47-F49 PolarHBondContact O-N 2.95Å; F49-L51 VanDerWaalsContact C-N 3.35Å; F49-L51 PolarHBondContact O-N 3.27Å; F49-A52 WeakPolarHBondContact O-CB 3.26Å; F49-A52 PolarHBondContact O-N 3.49Å; F49-V53 HydrophobicContact CD1-CG2 4.48Å; F49-V53 HydrophobicContact CE1-CG2 4.08Å; F49-V53 HydrophobicContact CE2-CG2 4.35Å; F49-V53 HydrophobicContact CZ-CG2 4.02Å; F49-V53 WeakPolarHBondContact O-CG2 3.37Å; F49-V53 PolarHBondContact O-N 2.86Å
50	I	91.1	Very high	90.6	Very high	70 Å²	70	70 Å²	70	36%	0.359	38%	0.375	S	S	.	.	H	α-helix	trans	-61.2	-44.7	177	-70.9	174.9	0	0	0	111.1	L46 C47 A52 V53 F54 M264	L46-I50 VanDerWaalsContact O-CG1 3.3Å; L46-I50 WeakPolarHBondContact O-CG1 3.5Å; L46-I50 PolarHBondContact O-N 3.07Å; C47-I50 PolarHBondContact O-N 2.98Å; I50-A52 VanDerWaalsContact C-N 3.3Å; I50-A52 PolarHBondContact O-N 2.79Å; I50-V53 PolarHBondContact O-N 2.84Å; I50-F54 HydrophobicContact CG2-CD2 3.54Å; I50-F54 HydrophobicContact CG2-CE2 3.44Å; I50-F54 VanDerWaalsContact CG2-CE2 3.44Å; I50-F54 VanDerWaalsContact O-CD2 3.25Å; I50-F54 WeakPolarHBondContact O-CD2 3.28Å; I50-F54 PolarHBondContact O-N 3.26Å; I50-M264 HydrophobicContact CD1-CE 3.3Å; I50-M264 HydrophobicContact CD1-SD 4.38Å
51	L	92.9	Very high	90.8	Very high	17 Å²	17	75.2 Å²	75.2	9%	0.089	40%	0.403	C	S	.	.	H	α-helix	trans	-59.1	-42.2	175.5	-75.4	169.8	0	0	0	111.6	L42 C47 L48 F49 F54 S55 P72 V73 L76	L42-L51 HydrophobicContact CD2-CD1 4.16Å; C47-L51 WeakPolarHBondContact O-CG 3.32Å; C47-L51 PolarHBondContact O-N 3Å; L48-L51 PolarHBondContact O-N 3.41Å; F49-L51 VanDerWaalsContact C-N 3.35Å; F49-L51 PolarHBondContact O-N 3.27Å; L51-F54 PolarHBondContact O-N 3.03Å; L51-S55 WeakPolarHBondContact O-CB 3.47Å; L51-S55 PolarHBondContact O-N 3.44Å; L51-S55 PolarHBondContact O-OG 2.99Å; L51-P72 HydrophobicContact CD2-CB 4.01Å; L51-V73 HydrophobicContact CD1-CG2 4.31Å; L51-V73 HydrophobicContact CD2-CG2 4.3Å; L51-L76 HydrophobicContact CD1-CD2 4Å; L51-L76 HydrophobicContact CD2-CB 4.33Å; L51-L76 HydrophobicContact CD2-CD2 3.79Å; L51-L76 HydrophobicContact CG-CD2 4.04Å
52	A	93.3	Very high	91.1	Very high	58 Å²	58	76.1 Å²	76.1	48%	0.479	41%	0.409	S	S	.	.	H	α-helix	trans	-63.2	-41.7	177	0	0	0	0	0	112.2	L48 F49 I50 S55 S56	L48-A52 WeakPolarHBondContact O-CB 2.91Å; L48-A52 PolarHBondContact O-N 3.16Å; F49-A52 WeakPolarHBondContact O-CB 3.26Å; F49-A52 PolarHBondContact O-N 3.49Å; I50-A52 VanDerWaalsContact C-N 3.3Å; I50-A52 PolarHBondContact O-N 2.79Å; A52-S55 PolarHBondContact O-N 3.24Å; A52-S56 WeakPolarHBondContact O-CB 3.3Å; A52-S56 PolarHBondContact O-N 3.34Å
53	V	94.1	Very high	91	Very high	63 Å²	63	84.7 Å²	84.7	38%	0.382	45%	0.449	S	S	.	.	H	α-helix	trans	-61.8	-49.1	174.9	173.1	0	0	0	0	110.7	F49 I50 S55 S56 I57	F49-V53 HydrophobicContact CD1-CG2 4.48Å; F49-V53 HydrophobicContact CE1-CG2 4.08Å; F49-V53 HydrophobicContact CE2-CG2 4.35Å; F49-V53 HydrophobicContact CZ-CG2 4.02Å; F49-V53 WeakPolarHBondContact O-CG2 3.37Å; F49-V53 PolarHBondContact O-N 2.86Å; I50-V53 PolarHBondContact O-N 2.84Å; V53-S55 PolarHBondContact O-N 3.37Å; V53-S56 WeakPolarHBondContact O-CB 3.27Å; V53-S56 PolarHBondContact O-N 3.18Å; V53-I57 HydrophobicContact CG1-CD1 4.04Å; V53-I57 WeakPolarHBondContact O-CG1 3.43Å; V53-I57 PolarHBondContact O-N 3.12Å
54	F	93.8	Very high	91.1	Very high	123 Å²	123	83.4 Å²	83.4	54%	0.539	44%	0.443	S	S	.	.	H	α-helix	trans	-61.9	-42	177.3	-82.2	-64.8	0	0	0	112.5	I50 L51 S56 I57 L58 P72	I50-F54 HydrophobicContact CG2-CD2 3.54Å; I50-F54 HydrophobicContact CG2-CE2 3.44Å; I50-F54 VanDerWaalsContact CG2-CE2 3.44Å; I50-F54 VanDerWaalsContact O-CD2 3.25Å; I50-F54 WeakPolarHBondContact O-CD2 3.28Å; I50-F54 PolarHBondContact O-N 3.26Å; L51-F54 PolarHBondContact O-N 3.03Å; F54-S56 VanDerWaalsContact C-N 3.31Å; F54-S56 PolarHBondContact O-N 2.85Å; F54-I57 PolarHBondContact O-N 2.7Å; F54-L58 VanDerWaalsContact O-CB 3.28Å; F54-L58 WeakPolarHBondContact O-CB 3.42Å; F54-L58 PolarHBondContact O-N 2.89Å; F54-P72 HydrophobicContact CB-CB 4.27Å; F54-P72 HydrophobicContact CB-CG 4.42Å
55	S	93.7	Very high	91.2	Very high	11 Å²	11	85.5 Å²	85.5	8%	0.077	45%	0.454	C	S	.	.	H	α-helix	trans	-62.8	-37.6	174.9	-75	0	0	0	0	112.4	L51 A52 V53 L58 R59 A68	L51-S55 WeakPolarHBondContact O-CB 3.47Å; L51-S55 PolarHBondContact O-N 3.44Å; L51-S55 PolarHBondContact O-OG 2.99Å; A52-S55 PolarHBondContact O-N 3.24Å; V53-S55 PolarHBondContact O-N 3.37Å; S55-L58 PolarHBondContact O-N 3.13Å; S55-R59 WeakPolarHBondContact O-CB 3.34Å; S55-R59 PolarHBondContact O-N 2.85Å; S55-A68 WeakPolarHBondContact CA-O 3.48Å; S55-A68 WeakPolarHBondContact CB-O 3.45Å; S55-A68 PolarHBondContact OG-O 2.66Å
56	S	93.4	Very high	91.2	Very high	77 Å²	77	87 Å²	87	54%	0.538	46%	0.455	S	S	.	.	H	α-helix	trans	-65.2	-43.1	175.8	-170.1	0	0	0	0	111.9	A52 V53 F54 R59	A52-S56 WeakPolarHBondContact O-CB 3.3Å; A52-S56 PolarHBondContact O-N 3.34Å; V53-S56 WeakPolarHBondContact O-CB 3.27Å; V53-S56 PolarHBondContact O-N 3.18Å; F54-S56 VanDerWaalsContact C-N 3.31Å; F54-S56 PolarHBondContact O-N 2.85Å; S56-R59 WeakPolarHBondContact O-CB 3.4Å; S56-R59 PolarHBondContact O-N 2.79Å
57	I	92.6	Very high	91.4	Very high	98 Å²	98	86 Å²	86	50%	0.503	45%	0.45	S	S	.	.	H	α-helix	trans	-64.4	-46.1	175.9	-65.4	166.4	0	0	0	110.1	V53 F54 R59 C60	V53-I57 HydrophobicContact CG1-CD1 4.04Å; V53-I57 WeakPolarHBondContact O-CG1 3.43Å; V53-I57 PolarHBondContact O-N 3.12Å; F54-I57 PolarHBondContact O-N 2.7Å; I57-R59 PolarHBondContact O-N 2.85Å; I57-C60 WeakPolarHBondContact O-CB 3.38Å; I57-C60 PolarHBondContact O-N 3.19Å
58	L	92.3	Very high	91.5	Very high	34 Å²	34	86 Å²	86	18%	0.178	45%	0.45	C	S	.	.	H	α-helix	trans	-65	-30.1	-177.8	-168.4	62.7	0	0	0	112.1	F54 S55 C60 L61 V62 I71 P72	F54-L58 VanDerWaalsContact O-CB 3.28Å; F54-L58 WeakPolarHBondContact O-CB 3.42Å; F54-L58 PolarHBondContact O-N 2.89Å; S55-L58 PolarHBondContact O-N 3.13Å; L58-C60 PolarHBondContact O-N 2.87Å; L58-L61 PolarHBondContact O-N 2.82Å; L58-V62 HydrophobicContact CD1-CG2 3.76Å; L58-V62 HydrophobicContact CG-CG2 3.82Å; L58-V62 WeakPolarHBondContact O-CB 3.44Å; L58-V62 PolarHBondContact O-N 2.77Å; L58-I71 HydrophobicContact CD2-CB 3.82Å; L58-I71 HydrophobicContact CD2-CD1 4.33Å; L58-I71 HydrophobicContact CD2-CG2 3.86Å; L58-P72 HydrophobicContact CD2-CG 3.9Å
59	R	90	Very high	91.5	Very high	147 Å²	147	85.2 Å²	85.2	56%	0.555	45%	0.446	S	S	*	.	H	α-helix	trans	-61	-29	173.3	-173.9	175.2	-177.1	139.7	6.1	113.1	S55 S56 I57 L61 A68	S55-R59 WeakPolarHBondContact O-CB 3.34Å; S55-R59 PolarHBondContact O-N 2.85Å; S56-R59 WeakPolarHBondContact O-CB 3.4Å; S56-R59 PolarHBondContact O-N 2.79Å; I57-R59 PolarHBondContact O-N 2.85Å; R59-L61 PolarHBondContact O-N 3.26Å; R59-A68 HydrophobicContact CB-CB 4.24Å
60	C	89.4	Confident	91.5	Very high	115 Å²	115	81.1 Å²	81.1	78%	0.777	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.5	174.5	-60.9	0	0	0	0	112.6	I57 L58	I57-C60 WeakPolarHBondContact O-CB 3.38Å; I57-C60 PolarHBondContact O-N 3.19Å; L58-C60 PolarHBondContact O-N 2.87Å
61	L	90.1	Very high	91.6	Very high	141 Å²	141	80.4 Å²	80.4	74%	0.738	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-31.5	-177.2	-58.5	176.1	0	0	0	112.6	L58 R59	L58-L61 PolarHBondContact O-N 2.82Å; R59-L61 PolarHBondContact O-N 3.26Å
62	V	90.9	Very high	91.6	Very high	32 Å²	32	80.3 Å²	80.3	19%	0.194	43%	0.434	C	S	.	.			trans	-111.2	125.7	-171.9	-178.7	0	0	0	0	110.2	L58 S64 L67	L58-V62 HydrophobicContact CD1-CG2 3.76Å; L58-V62 HydrophobicContact CG-CG2 3.82Å; L58-V62 WeakPolarHBondContact O-CB 3.44Å; L58-V62 PolarHBondContact O-N 2.77Å; V62-S64 PolarHBondContact O-N 3.36Å; V62-L67 HydrophobicContact CG1-CB 4Å; V62-L67 HydrophobicContact CG1-CD2 3.71Å; V62-L67 HydrophobicContact CG1-CG 4.09Å
63	H	86.8	Confident	91.5	Very high	205 Å²	205	80.1 Å²	80.1	95%	0.949	43%	0.427	S	S	*	.	S	Bend	trans	-71.8	-12.2	-176.5	-142.3	-69.1	0	0	0	114.1
64	S	91.6	Very high	91.5	Very high	54 Å²	54	83.4 Å²	83.4	38%	0.378	44%	0.436	S	S	.	.			trans	-105.5	122.5	-178.7	176.1	0	0	0	0	112	V62 L67 A68	V62-S64 PolarHBondContact O-N 3.36Å; S64-L67 PolarHBondContact O-N 2.8Å; S64-A68 PolarHBondContact O-N 3.33Å; S64-A68 VanDerWaalsContact O-N 3.1Å
65	F	89	Confident	91.4	Very high	115 Å²	115	82.5 Å²	82.5	50%	0.504	44%	0.437	S	S	.	.	H	α-helix	trans	-61.7	-44.6	177.4	176	-111.2	0	0	0	113	L67 A68 L69	F65-L67 VanDerWaalsContact C-N 3.28Å; F65-L67 PolarHBondContact O-N 2.62Å; F65-A68 PolarHBondContact O-N 2.99Å; F65-L69 HydrophobicContact CD1-CD1 4.25Å; F65-L69 HydrophobicContact CE1-CD1 3.59Å; F65-L69 HydrophobicContact CE2-CD1 3.97Å; F65-L69 HydrophobicContact CE2-CG 4.35Å; F65-L69 HydrophobicContact CZ-CD1 3.46Å; F65-L69 VanDerWaalsContact CZ-CD1 3.46Å; F65-L69 HydrophobicContact CZ-CG 4.32Å; F65-L69 PolarHBondContact O-N 2.77Å
66	I	90.9	Very high	91.3	Very high	130 Å²	130	83.7 Å²	83.7	67%	0.667	44%	0.442	S	S	*	.	H	α-helix	trans	-62.4	-42.3	-178.6	-61.5	173.1	0	0	0	109.7	L69 A70	I66-L69 PolarHBondContact O-N 3.28Å; I66-A70 WeakPolarHBondContact O-CB 3.48Å; I66-A70 PolarHBondContact O-N 3.48Å
67	L	90.9	Very high	91.1	Very high	82 Å²	82	83 Å²	83	43%	0.429	43%	0.431	S	S	.	.	H	α-helix	trans	-68.3	-37.9	-178.7	-167.1	64.3	0	0	0	111.7	V62 S64 F65 L69 A70 I71	V62-L67 HydrophobicContact CG1-CB 4Å; V62-L67 HydrophobicContact CG1-CD2 3.71Å; V62-L67 HydrophobicContact CG1-CG 4.09Å; S64-L67 PolarHBondContact O-N 2.8Å; F65-L67 VanDerWaalsContact C-N 3.28Å; F65-L67 PolarHBondContact O-N 2.62Å; L67-L69 PolarHBondContact O-N 3.12Å; L67-A70 PolarHBondContact O-N 3.22Å; L67-I71 HydrophobicContact CD1-CD1 3.68Å; L67-I71 HydrophobicContact CD1-CG1 3.75Å; L67-I71 HydrophobicContact CD2-CD1 4.09Å; L67-I71 HydrophobicContact CG-CD1 3.49Å; L67-I71 VanDerWaalsContact CG-CD1 3.49Å; L67-I71 HydrophobicContact CG-CG1 3.98Å; L67-I71 WeakPolarHBondContact O-CB 3.5Å; L67-I71 VanDerWaalsContact O-CG1 3.32Å; L67-I71 WeakPolarHBondContact O-CG1 3.5Å; L67-I71 PolarHBondContact O-N 3.45Å
68	A	91.4	Very high	91	Very high	2 Å²	2	81 Å²	81	2%	0.017	42%	0.423	C	S	.	.	H	α-helix	trans	-64.2	-26.4	175.9	0	0	0	0	0	113.6	S55 R59 S64 F65 P72	S55-A68 WeakPolarHBondContact CA-O 3.48Å; S55-A68 WeakPolarHBondContact CB-O 3.45Å; S55-A68 PolarHBondContact OG-O 2.66Å; R59-A68 HydrophobicContact CB-CB 4.24Å; S64-A68 PolarHBondContact O-N 3.33Å; S64-A68 VanDerWaalsContact O-N 3.1Å; F65-A68 PolarHBondContact O-N 2.99Å; A68-P72 WeakPolarHBondContact O-CD 3.5Å; A68-P72 WeakPolarHBondContact O-CG 3.49Å
69	L	90.8	Very high	90.8	Very high	79 Å²	79	83.2 Å²	83.2	41%	0.414	43%	0.432	S	S	.	.	H	α-helix	trans	-86	-43.4	173.3	-71.4	176.5	0	0	0	112.7	F65 I66 L67 V73	F65-L69 HydrophobicContact CD1-CD1 4.25Å; F65-L69 HydrophobicContact CE1-CD1 3.59Å; F65-L69 HydrophobicContact CE2-CD1 3.97Å; F65-L69 HydrophobicContact CE2-CG 4.35Å; F65-L69 HydrophobicContact CZ-CD1 3.46Å; F65-L69 VanDerWaalsContact CZ-CD1 3.46Å; F65-L69 HydrophobicContact CZ-CG 4.32Å; F65-L69 PolarHBondContact O-N 2.77Å; I66-L69 PolarHBondContact O-N 3.28Å; L67-L69 PolarHBondContact O-N 3.12Å; L69-V73 WeakPolarHBondContact O-CG2 3.32Å
70	A	92.3	Very high	90.4	Very high	50 Å²	50	76.5 Å²	76.5	41%	0.413	41%	0.407	S	S	.	.	H	α-helix	trans	-71.3	-39.9	-173.7	0	0	0	0	0	112.8	I66 L67 V73 F74	I66-A70 WeakPolarHBondContact O-CB 3.48Å; I66-A70 PolarHBondContact O-N 3.48Å; L67-A70 PolarHBondContact O-N 3.22Å; A70-V73 PolarHBondContact O-N 3.34Å; A70-F74 VanDerWaalsContact O-CB 3.28Å; A70-F74 WeakPolarHBondContact O-CB 3.43Å; A70-F74 PolarHBondContact O-N 3.22Å
71	I	92.9	Very high	90.2	Very high	55 Å²	55	74.7 Å²	74.7	28%	0.282	39%	0.386	S	S	.	.	H	α-helix	trans	-60.5	-52.4	-175.7	-72.1	176.1	0	0	0	112	L58 L67 V73 F74 L75	L58-I71 HydrophobicContact CD2-CB 3.82Å; L58-I71 HydrophobicContact CD2-CD1 4.33Å; L58-I71 HydrophobicContact CD2-CG2 3.86Å; L67-I71 HydrophobicContact CD1-CD1 3.68Å; L67-I71 HydrophobicContact CD1-CG1 3.75Å; L67-I71 HydrophobicContact CD2-CD1 4.09Å; L67-I71 HydrophobicContact CG-CD1 3.49Å; L67-I71 VanDerWaalsContact CG-CD1 3.49Å; L67-I71 HydrophobicContact CG-CG1 3.98Å; L67-I71 WeakPolarHBondContact O-CB 3.5Å; L67-I71 VanDerWaalsContact O-CG1 3.32Å; L67-I71 WeakPolarHBondContact O-CG1 3.5Å; L67-I71 PolarHBondContact O-N 3.45Å; I71-V73 VanDerWaalsContact C-N 3.31Å; I71-V73 PolarHBondContact O-N 3.47Å; I71-F74 PolarHBondContact O-N 2.8Å; I71-L75 HydrophobicContact CG2-CD1 3.69Å; I71-L75 HydrophobicContact CG2-CG 4.14Å; I71-L75 WeakPolarHBondContact O-CB 3.26Å; I71-L75 WeakPolarHBondContact O-CG 3.33Å; I71-L75 PolarHBondContact O-N 3.49Å
72	P	92.9	Very high	89.6	Confident	15 Å²	15	72.1 Å²	72.1	10%	0.097	37%	0.372	C	S	.	.	H	α-helix	trans	-61.5	-40	-177.9	-26.7	38.1	0	0	0	112.7	L51 F54 L58 A68 L76	L51-P72 HydrophobicContact CD2-CB 4.01Å; F54-P72 HydrophobicContact CB-CB 4.27Å; F54-P72 HydrophobicContact CB-CG 4.42Å; L58-P72 HydrophobicContact CD2-CG 3.9Å; A68-P72 WeakPolarHBondContact O-CD 3.5Å; A68-P72 WeakPolarHBondContact O-CG 3.49Å; P72-L76 VanDerWaalsContact O-CB 3.29Å; P72-L76 WeakPolarHBondContact O-CB 3.31Å; P72-L76 PolarHBondContact O-N 3.36Å
73	V	92.7	Very high	88.7	Confident	55 Å²	55	72.6 Å²	72.6	33%	0.333	38%	0.375	S	S	.	.	H	α-helix	trans	-65.1	-46.1	177	178.2	0	0	0	0	110.8	L51 L69 A70 I71 L76 I77	L51-V73 HydrophobicContact CD1-CG2 4.31Å; L51-V73 HydrophobicContact CD2-CG2 4.3Å; L69-V73 WeakPolarHBondContact O-CG2 3.32Å; A70-V73 PolarHBondContact O-N 3.34Å; I71-V73 VanDerWaalsContact C-N 3.31Å; I71-V73 PolarHBondContact O-N 3.47Å; V73-L76 PolarHBondContact O-N 2.67Å; V73-I77 HydrophobicContact CG1-CD1 3.91Å; V73-I77 VanDerWaalsContact O-CG1 3.32Å; V73-I77 WeakPolarHBondContact O-CG1 3.49Å; V73-I77 PolarHBondContact O-N 3.09Å
74	F	93.3	Very high	87.8	Confident	132 Å²	132	63.4 Å²	63.4	58%	0.579	33%	0.333	S	S	*	.	H	α-helix	trans	-63	-47.9	179.3	179.7	-99.6	0	0	0	112	A70 I71 L76 I77 V78	A70-F74 VanDerWaalsContact O-CB 3.28Å; A70-F74 WeakPolarHBondContact O-CB 3.43Å; A70-F74 PolarHBondContact O-N 3.22Å; I71-F74 PolarHBondContact O-N 2.8Å; F74-L76 VanDerWaalsContact C-N 3.29Å; F74-L76 PolarHBondContact O-N 2.89Å; F74-I77 PolarHBondContact O-N 3.21Å; F74-V78 HydrophobicContact CD1-CG2 4.25Å; F74-V78 HydrophobicContact CE1-CG2 3.84Å; F74-V78 HydrophobicContact CE2-CG2 4.24Å; F74-V78 HydrophobicContact CZ-CG2 3.83Å; F74-V78 WeakPolarHBondContact O-CG2 3.47Å; F74-V78 PolarHBondContact O-N 3.01Å
75	L	92.6	Very high	86.1	Confident	104 Å²	104	63.3 Å²	63.3	55%	0.545	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-40.4	177	-70.9	178.3	0	0	0	111.5	I71 V78 F79	I71-L75 HydrophobicContact CG2-CD1 3.69Å; I71-L75 HydrophobicContact CG2-CG 4.14Å; I71-L75 WeakPolarHBondContact O-CB 3.26Å; I71-L75 WeakPolarHBondContact O-CG 3.33Å; I71-L75 PolarHBondContact O-N 3.49Å; L75-V78 PolarHBondContact O-N 3.37Å; L75-F79 VanDerWaalsContact O-CB 3.23Å; L75-F79 WeakPolarHBondContact O-CB 3.3Å; L75-F79 PolarHBondContact O-N 3.48Å
76	L	90.1	Very high	84.3	Confident	36 Å²	36	66.6 Å²	66.6	19%	0.188	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-42.4	176	-177.5	59.9	0	0	0	111.9	L42 L51 P72 V73 F74 V78 F79 L80	L42-L76 HydrophobicContact CD2-CD2 3.44Å; L42-L76 VanDerWaalsContact CD2-CD2 3.44Å; L42-L76 HydrophobicContact CD2-CG 4.03Å; L51-L76 HydrophobicContact CD1-CD2 4Å; L51-L76 HydrophobicContact CD2-CB 4.33Å; L51-L76 HydrophobicContact CD2-CD2 3.79Å; L51-L76 HydrophobicContact CG-CD2 4.04Å; P72-L76 VanDerWaalsContact O-CB 3.29Å; P72-L76 WeakPolarHBondContact O-CB 3.31Å; P72-L76 PolarHBondContact O-N 3.36Å; V73-L76 PolarHBondContact O-N 2.67Å; F74-L76 VanDerWaalsContact C-N 3.29Å; F74-L76 PolarHBondContact O-N 2.89Å; L76-V78 PolarHBondContact O-N 2.72Å; L76-F79 HydrophobicContact CD1-CD1 4.3Å; L76-F79 PolarHBondContact O-N 3.42Å; L76-L80 HydrophobicContact CD1-CD1 4.17Å; L76-L80 HydrophobicContact CD1-CD2 4.48Å; L76-L80 HydrophobicContact CD1-CG 4.03Å; L76-L80 HydrophobicContact CG-CD1 4.02Å; L76-L80 HydrophobicContact CG-CG 4.31Å; L76-L80 WeakPolarHBondContact O-CB 3.47Å; L76-L80 VanDerWaalsContact O-CG 3.23Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 2.93Å
77	I	90.1	Very high	81.9	Confident	62 Å²	62	63.7 Å²	63.7	32%	0.318	33%	0.331	S	S	.	.	H	α-helix	trans	-60.5	-46.3	175.5	-70.5	165.7	0	0	0	110.6	I38 L42 V73 F74 L80 K81	I38-I77 HydrophobicContact CG2-CG1 4.35Å; L42-I77 HydrophobicContact CD1-CD1 4.25Å; L42-I77 HydrophobicContact CD1-CG1 3.85Å; V73-I77 HydrophobicContact CG1-CD1 3.91Å; V73-I77 VanDerWaalsContact O-CG1 3.32Å; V73-I77 WeakPolarHBondContact O-CG1 3.49Å; V73-I77 PolarHBondContact O-N 3.09Å; F74-I77 PolarHBondContact O-N 3.21Å; I77-L80 PolarHBondContact O-N 2.92Å; I77-K81 VanDerWaalsContact O-CB 3.29Å; I77-K81 WeakPolarHBondContact O-CB 3.48Å; I77-K81 PolarHBondContact O-N 2.85Å
78	V	90	Very high	80	Confident	55 Å²	55	60.6 Å²	60.6	33%	0.333	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-45.7	177.3	172.4	0	0	0	0	110.5	F74 L75 L76 L80 K81 I82	F74-V78 HydrophobicContact CD1-CG2 4.25Å; F74-V78 HydrophobicContact CE1-CG2 3.84Å; F74-V78 HydrophobicContact CE2-CG2 4.24Å; F74-V78 HydrophobicContact CZ-CG2 3.83Å; F74-V78 WeakPolarHBondContact O-CG2 3.47Å; F74-V78 PolarHBondContact O-N 3.01Å; L75-V78 PolarHBondContact O-N 3.37Å; L76-V78 PolarHBondContact O-N 2.72Å; V78-L80 PolarHBondContact O-N 2.98Å; V78-K81 CarbonylContact O-C 3.6Å; V78-K81 PolarHBondContact O-N 2.88Å; V78-I82 HydrophobicContact CG1-CD1 3.67Å; V78-I82 HydrophobicContact CG1-CG1 4.43Å; V78-I82 WeakPolarHBondContact O-CB 3.21Å; V78-I82 VanDerWaalsContact O-CG1 3.27Å; V78-I82 WeakPolarHBondContact O-CG1 2.96Å; V78-I82 PolarHBondContact O-N 3.41Å
79	F	87.4	Confident	78	Confident	81 Å²	81	60.5 Å²	60.5	36%	0.355	32%	0.315	S	S	.	.	H	α-helix	trans	-58.2	-48.3	176	175.5	-97.2	0	0	0	111.7	L75 L76 I82 T83 F263	L75-F79 VanDerWaalsContact O-CB 3.23Å; L75-F79 WeakPolarHBondContact O-CB 3.3Å; L75-F79 PolarHBondContact O-N 3.48Å; L76-F79 HydrophobicContact CD1-CD1 4.3Å; L76-F79 PolarHBondContact O-N 3.42Å; F79-I82 PolarHBondContact O-N 2.86Å; F79-T83 HydrophobicContact CD1-CG2 4.39Å; F79-T83 HydrophobicContact CD2-CG2 4.03Å; F79-T83 HydrophobicContact CE1-CG2 4.08Å; F79-T83 HydrophobicContact CE2-CG2 3.69Å; F79-T83 HydrophobicContact CG-CG2 4.38Å; F79-T83 HydrophobicContact CZ-CG2 3.72Å; F79-T83 WeakPolarHBondContact O-CB 3.4Å; F79-T83 WeakPolarHBondContact O-CG2 3.28Å; F79-T83 PolarHBondContact O-N 3.08Å; F79-T83 PolarHBondContact O-OG1 3.42Å; F79-F263 HydrophobicContact CE1-CD1 4.19Å; F79-F263 HydrophobicContact CE1-CD2 4.17Å; F79-F263 HydrophobicContact CE1-CE1 4.4Å; F79-F263 HydrophobicContact CE1-CE2 4.36Å; F79-F263 HydrophobicContact CE1-CG 4.08Å; F79-F263 HydrophobicContact CE1-CZ 4.48Å; F79-F263 HydrophobicContact CZ-CD2 4.06Å; F79-F263 AromaticContact CZ-CE2 3.98Å; F79-F263 HydrophobicContact CZ-CE2 3.98Å; F79-F263 HydrophobicContact CZ-CG 4.44Å; F79-F263 HydrophobicContact CZ-CZ 4.3Å
80	L	83.4	Confident	75.8	Confident	7 Å²	7	57.9 Å²	57.9	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-40	177.5	-67.3	174.6	0	0	0	111.3	I38 I41 L76 I77 V78 I82 T83 M84	I38-L80 HydrophobicContact CG1-CB 4.12Å; I38-L80 HydrophobicContact CG2-CD1 4.14Å; I41-L80 HydrophobicContact CG2-CD1 4.35Å; L76-L80 HydrophobicContact CD1-CD1 4.17Å; L76-L80 HydrophobicContact CD1-CD2 4.48Å; L76-L80 HydrophobicContact CD1-CG 4.03Å; L76-L80 HydrophobicContact CG-CD1 4.02Å; L76-L80 HydrophobicContact CG-CG 4.31Å; L76-L80 WeakPolarHBondContact O-CB 3.47Å; L76-L80 VanDerWaalsContact O-CG 3.23Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 2.93Å; I77-L80 PolarHBondContact O-N 2.92Å; V78-L80 PolarHBondContact O-N 2.98Å; L80-I82 VanDerWaalsContact C-N 3.26Å; L80-I82 PolarHBondContact O-N 3.37Å; L80-T83 WeakPolarHBondContact CA-OG1 3.37Å; L80-T83 PolarHBondContact O-N 2.89Å; L80-M84 HydrophobicContact CB-CE 4.46Å; L80-M84 HydrophobicContact CB-SD 4.43Å; L80-M84 HydrophobicContact CD2-CE 4.24Å; L80-M84 WeakPolarHBondContact O-CB 2.9Å; L80-M84 VanDerWaalsContact O-CG 3.22Å; L80-M84 WeakPolarHBondContact O-CG 3.34Å; L80-M84 PolarHBondContact O-N 3.33Å
81	K	83.4	Confident	73.7	Confident	76 Å²	76	56 Å²	56	33%	0.33	29%	0.285	S	S	.	.	H	α-helix	trans	-64.7	-25.8	174.2	-88.4	-73.5	177.8	-178.8	0	113.6	E34 N35 I38 I77 V78 P85	E34-K81 IonicContact OE2-NZ 3.33Å; E34-K81 PolarHBondContact OE2-NZ 3.24Å; N35-K81 WeakPolarHBondContact OD1-CE 3.42Å; N35-K81 PolarHBondContact OD1-NZ 3.34Å; I38-K81 HydrophobicContact CD1-CD 3.96Å; I38-K81 HydrophobicContact CD1-CG 3.76Å; I77-K81 VanDerWaalsContact O-CB 3.29Å; I77-K81 WeakPolarHBondContact O-CB 3.48Å; I77-K81 PolarHBondContact O-N 2.85Å; V78-K81 CarbonylContact O-C 3.6Å; V78-K81 PolarHBondContact O-N 2.88Å; K81-P85 WeakPolarHBondContact O-CD 3.01Å; K81-P85 WeakPolarHBondContact O-CG 3.45Å
82	I	79	Confident	71.4	Confident	88 Å²	88	53.5 Å²	53.5	45%	0.451	27%	0.273	S	S	.	.	H	α-helix	trans	-89.2	-36.8	178	-71	171	0	0	0	111.4	V78 F79 L80	V78-I82 HydrophobicContact CG1-CD1 3.67Å; V78-I82 HydrophobicContact CG1-CG1 4.43Å; V78-I82 WeakPolarHBondContact O-CB 3.21Å; V78-I82 VanDerWaalsContact O-CG1 3.27Å; V78-I82 WeakPolarHBondContact O-CG1 2.96Å; V78-I82 PolarHBondContact O-N 3.41Å; F79-I82 PolarHBondContact O-N 2.86Å; L80-I82 VanDerWaalsContact C-N 3.26Å; L80-I82 PolarHBondContact O-N 3.37Å
83	T	72	Confident	69.3	Low	41 Å²	41	53 Å²	53	25%	0.252	27%	0.269	S	S	.	.	H	α-helix	trans	-84	-44.7	-175.4	53.1	0	0	0	0	112.2	F79 L80 R86 S87	F79-T83 HydrophobicContact CD1-CG2 4.39Å; F79-T83 HydrophobicContact CD2-CG2 4.03Å; F79-T83 HydrophobicContact CE1-CG2 4.08Å; F79-T83 HydrophobicContact CE2-CG2 3.69Å; F79-T83 HydrophobicContact CG-CG2 4.38Å; F79-T83 HydrophobicContact CZ-CG2 3.72Å; F79-T83 WeakPolarHBondContact O-CB 3.4Å; F79-T83 WeakPolarHBondContact O-CG2 3.28Å; F79-T83 PolarHBondContact O-N 3.08Å; F79-T83 PolarHBondContact O-OG1 3.42Å; L80-T83 WeakPolarHBondContact CA-OG1 3.37Å; L80-T83 PolarHBondContact O-N 2.89Å; T83-R86 PolarHBondContact O-N 2.85Å; T83-R86 VanDerWaalsContact O-N 3.1Å; T83-S87 WeakPolarHBondContact O-CB 3.39Å; T83-S87 PolarHBondContact O-N 2.72Å; T83-S87 PolarHBondContact O-OG 2.9Å
84	M	66.1	Low	67.2	Low	13 Å²	13	54.9 Å²	54.9	6%	0.064	29%	0.285	C	S	.	.	H	α-helix	trans	-57.6	-44.7	-179.8	-72	-179.3	167.2	0	0	114.2	L37 I38 I41 L80 R86 T88	L37-M84 HydrophobicContact CB-CE 4.38Å; I38-M84 HydrophobicContact CD1-SD 4.37Å; I38-M84 HydrophobicContact CG1-CE 4.09Å; I38-M84 HydrophobicContact CG1-SD 3.6Å; I41-M84 HydrophobicContact CD1-CE 3.15Å; I41-M84 HydrophobicContact CG1-CE 4.26Å; L80-M84 HydrophobicContact CB-CE 4.46Å; L80-M84 HydrophobicContact CB-SD 4.43Å; L80-M84 HydrophobicContact CD2-CE 4.24Å; L80-M84 WeakPolarHBondContact O-CB 2.9Å; L80-M84 VanDerWaalsContact O-CG 3.22Å; L80-M84 WeakPolarHBondContact O-CG 3.34Å; L80-M84 PolarHBondContact O-N 3.33Å; M84-R86 PolarHBondContact O-N 3.38Å; M84-T88 WeakPolarHBondContact O-CB 3.4Å; M84-T88 PolarHBondContact O-N 2.84Å; M84-T88 PolarHBondContact O-OG1 3.1Å
85	P	56.9	Low	65.5	Low	52 Å²	52	53 Å²	53	34%	0.338	27%	0.274	S	S	.	.	H	α-helix	trans	-67.6	-19.8	179.9	-12	24.5	0	0	0	113.3	K81	K81-P85 WeakPolarHBondContact O-CD 3.01Å; K81-P85 WeakPolarHBondContact O-CG 3.45Å
86	R	50.3	Low	63.8	Low	183 Å²	183	50.4 Å²	50.4	69%	0.691	26%	0.264	S	S	*	.	H	α-helix	trans	-96.4	-36.4	-178.9	-73	-170.2	167.3	95.9	-3.9	113.1	T83 M84	T83-R86 PolarHBondContact O-N 2.85Å; T83-R86 VanDerWaalsContact O-N 3.1Å; M84-R86 PolarHBondContact O-N 3.38Å
87	S	41.6	Very low	62.1	Low	69 Å²	69	50 Å²	50	48%	0.483	26%	0.26	S	S	.	.	H	α-helix	trans	-92.4	-22.7	-178.4	64.8	0	0	0	0	113.5	T83	T83-S87 WeakPolarHBondContact O-CB 3.39Å; T83-S87 PolarHBondContact O-N 2.72Å; T83-S87 PolarHBondContact O-OG 2.9Å
88	T	50	Low	60.5	Low	18 Å²	18	53.4 Å²	53.4	11%	0.11	27%	0.269	C	S	.	.			trans	-115.1	104.2	175.1	66.8	0	0	0	0	107.4	M84 V90 L268	M84-T88 WeakPolarHBondContact O-CB 3.4Å; M84-T88 PolarHBondContact O-N 2.84Å; M84-T88 PolarHBondContact O-OG1 3.1Å; T88-V90 PolarHBondContact O-N 2.99Å; T88-L268 HydrophobicContact CG2-CD1 3.78Å
89	G	49.6	Very low	59.2	Low	0 Å²	0	53 Å²	53	0%	0	27%	0.265	C	S	.	.	S	Bend	trans	-66.2	52.7	165.8	0	0	0	0	0	111.9	L91 S93 R95 R187	G89-L91 VanDerWaalsContact C-N 3.26Å; G89-L91 PolarHBondContact O-N 2.73Å; G89-S93 WeakPolarHBondContact CA-O 3.39Å; G89-S93 PolarHBondContact N-O 3.2Å; G89-R95 WeakPolarHBondContact CA-O 3.24Å; G89-R95 PolarHBondContact N-O 2.78Å; G89-R187 PolarHBondContact O-NE 3.33Å; G89-R187 PolarHBondContact O-NH2 2.9Å
90	V	44.8	Very low	58	Low	24 Å²	24	49.8 Å²	49.8	15%	0.145	25%	0.25	C	S	.	.	S	Bend	trans	40.8	52.5	-173.4	-157.9	0	0	0	0	113.6	C30 T88 Y97	C30-V90 HydrophobicContact CB-CG1 3.79Å; C30-V90 WeakPolarHBondContact SG-CG1 3.24Å; T88-V90 PolarHBondContact O-N 2.99Å; V90-Y97 HydrophobicContact CG2-CD1 4.04Å
91	L	48.7	Very low	57.2	Low	9 Å²	9	49.4 Å²	49.4	5%	0.047	25%	0.249	C	C	.	.	S	Bend	trans	85	93.2	153.9	-57	133.7	0	0	0	115	T33 L37 G89 P224 E260 L268 T269	T33-L91 HydrophobicContact CG2-CD1 4.37Å; L37-L91 HydrophobicContact CD1-CD1 3.98Å; L37-L91 HydrophobicContact CD1-CD2 4.2Å; G89-L91 VanDerWaalsContact C-N 3.26Å; G89-L91 PolarHBondContact O-N 2.73Å; L91-P224 HydrophobicContact CB-CG 4.2Å; L91-P224 HydrophobicContact CD1-CB 3.83Å; L91-P224 HydrophobicContact CD1-CG 3.31Å; L91-P224 HydrophobicContact CD2-CB 4.36Å; L91-P224 HydrophobicContact CD2-CG 4.34Å; L91-P224 HydrophobicContact CG-CG 4.09Å; L91-E260 WeakPolarHBondContact CA-OE2 3.27Å; L91-L268 HydrophobicContact CD2-CB 4.3Å; L91-T269 HydrophobicContact CB-CG2 3.9Å; L91-T269 HydrophobicContact CD2-CG2 3.4Å; L91-T269 VanDerWaalsContact CD2-CG2 3.4Å; L91-T269 HydrophobicContact CG-CG2 4.26Å
92	G	44.3	Very low	56.4	Low	3 Å²	3	46.9 Å²	46.9	3%	0.031	24%	0.244	C	C	.	.	S	Bend	trans	143.6	-33.1	179.3	0	0	0	0	0	113.3	E175 R184 E260	G92-E175 VanDerWaalsContact O-OE2 3.11Å; G92-R184 PolarHBondContact O-NH1 3.14Å; G92-E260 WeakPolarHBondContact CA-OE1 3.47Å; G92-E260 PolarHBondContact N-OE1 2.76Å; G92-E260 PolarHBondContact N-OE2 3.25Å
93	S	48.1	Very low	55.8	Low	4 Å²	4	42.7 Å²	42.7	3%	0.028	22%	0.223	C	C	.	.			trans	-133.2	147.7	-172.8	85.2	0	0	0	0	113.8	G89 R95 Y100 E175 R187 E260	G89-S93 WeakPolarHBondContact CA-O 3.39Å; G89-S93 PolarHBondContact N-O 3.2Å; S93-R95 PolarHBondContact O-N 3.44Å; S93-Y100 VanDerWaalsContact CB-OH 3.24Å; S93-Y100 WeakPolarHBondContact CB-OH 3.32Å; S93-Y100 WeakPolarHBondContact OG-CE2 3.5Å; S93-Y100 PolarHBondContact OG-OH 3.45Å; S93-E175 WeakPolarHBondContact CB-OE1 3.38Å; S93-R187 PolarHBondContact OG-NH2 3.33Å; S93-E260 PolarHBondContact N-OE1 3.16Å
94	S	48.8	Very low	55.7	Low	95 Å²	95	40.8 Å²	40.8	66%	0.664	21%	0.211	S	C	*	.	S	Bend	trans	-74.5	-11.1	-177.4	56.4	0	0	0	0	116
95	R	58.1	Low	55.9	Low	93 Å²	93	41.7 Å²	41.7	35%	0.351	21%	0.214	S	C	.	.	S	Bend	trans	-100.7	158.5	179.7	-44.8	179.5	173.4	163.2	-0.2	112.2	G89 S93 Y100	G89-R95 WeakPolarHBondContact CA-O 3.24Å; G89-R95 PolarHBondContact N-O 2.78Å; S93-R95 PolarHBondContact O-N 3.44Å; R95-Y100 HydrophobicContact CB-CD2 4.42Å; R95-Y100 HydrophobicContact CB-CE2 3.41Å; R95-Y100 VanDerWaalsContact CB-CE2 3.41Å; R95-Y100 VanDerWaalsContact CB-OH 3.25Å; R95-Y100 WeakPolarHBondContact CB-OH 3.2Å; R95-Y100 HydrophobicContact CG-CE2 4.3Å; R95-Y100 VanDerWaalsContact CG-OH 3.23Å; R95-Y100 WeakPolarHBondContact CG-OH 3.49Å; R95-Y100 PolarHBondContact N-OH 3.3Å; R95-Y100 VanDerWaalsContact O-CE2 3.31Å; R95-Y100 WeakPolarHBondContact O-CE2 3.26Å
96	P	57.9	Low	56.4	Low	50 Å²	50	44.7 Å²	44.7	33%	0.325	22%	0.219	S	C	.	.			trans	-66.6	144.3	178.7	23.5	-31.2	0	0	0	112	W98 D99 Y100	P96-W98 PolarHBondContact O-N 3.32Å; P96-W98 VanDerWaalsContact O-N 3.1Å; P96-D99 HydrophobicContact CG-CB 4.17Å; P96-D99 WeakPolarHBondContact O-CB 3.4Å; P96-D99 PolarHBondContact O-N 3.27Å; P96-Y100 WeakPolarHBondContact O-CD2 3.17Å
97	Y	53.9	Low	56.9	Low	28 Å²	28	37.2 Å²	37.2	11%	0.11	20%	0.198	C	C	.	.	H	α-helix	trans	-58.9	-30.5	-171.8	76.1	-93.6	0	0	0	114.5	K23 V26 V90 D99 Y100	K23-Y97 HydrophobicContact CB-CD2 4.48Å; K23-Y97 HydrophobicContact CB-CE2 3.84Å; K23-Y97 HydrophobicContact CG-CE2 4.4Å; V26-Y97 HydrophobicContact CG1-CD2 4.48Å; V90-Y97 HydrophobicContact CG2-CD1 4.04Å; Y97-D99 PolarHBondContact O-N 2.69Å; Y97-Y100 PolarHBondContact O-N 2.94Å
98	W	55.9	Low	58	Low	132 Å²	132	41.3 Å²	41.3	50%	0.5	21%	0.21	S	C	.	.	H	α-helix	trans	-64.2	-27.5	178.3	-39.7	97.8	0	0	0	113	K23 P96 Y100	K23-W98 HydrophobicContact CB-CE3 4.09Å; K23-W98 HydrophobicContact CB-CZ3 3.98Å; K23-W98 HydrophobicContact CD-CE3 3.78Å; K23-W98 HydrophobicContact CD-CZ3 3.98Å; K23-W98 HydrophobicContact CG-CE3 3.9Å; K23-W98 HydrophobicContact CG-CZ3 4.2Å; P96-W98 PolarHBondContact O-N 3.32Å; P96-W98 VanDerWaalsContact O-N 3.1Å; W98-Y100 VanDerWaalsContact C-N 3.35Å
99	D	62.4	Low	58.6	Low	48 Å²	48	46.1 Å²	46.1	26%	0.257	23%	0.231	S	C	.	.	H	α-helix	trans	-74.5	-28.8	-177.8	-157.3	18.6	0	0	0	111.7	P96 Y97 R152	P96-D99 HydrophobicContact CG-CB 4.17Å; P96-D99 WeakPolarHBondContact O-CB 3.4Å; P96-D99 PolarHBondContact O-N 3.27Å; Y97-D99 PolarHBondContact O-N 2.69Å; D99-R152 IonicContact OD1-CZ 3.34Å; D99-R152 IonicContact OD1-NE 2.81Å; D99-R152 PolarHBondContact OD1-NE 3.14Å; D99-R152 IonicContact OD1-NH2 2.79Å; D99-R152 PolarHBondContact OD1-NH2 2.76Å
100	Y	62.2	Low	59.7	Low	12 Å²	12	52.3 Å²	52.3	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-78.8	-43.9	-179.8	-71.7	-85.5	0	0	0	113.2	S93 R95 P96 Y97 W98 G102 S103 S104 A156	S93-Y100 VanDerWaalsContact CB-OH 3.24Å; S93-Y100 WeakPolarHBondContact CB-OH 3.32Å; S93-Y100 WeakPolarHBondContact OG-CE2 3.5Å; S93-Y100 PolarHBondContact OG-OH 3.45Å; R95-Y100 HydrophobicContact CB-CD2 4.42Å; R95-Y100 HydrophobicContact CB-CE2 3.41Å; R95-Y100 VanDerWaalsContact CB-CE2 3.41Å; R95-Y100 VanDerWaalsContact CB-OH 3.25Å; R95-Y100 WeakPolarHBondContact CB-OH 3.2Å; R95-Y100 HydrophobicContact CG-CE2 4.3Å; R95-Y100 VanDerWaalsContact CG-OH 3.23Å; R95-Y100 WeakPolarHBondContact CG-OH 3.49Å; R95-Y100 PolarHBondContact N-OH 3.3Å; R95-Y100 VanDerWaalsContact O-CE2 3.31Å; R95-Y100 WeakPolarHBondContact O-CE2 3.26Å; P96-Y100 WeakPolarHBondContact O-CD2 3.17Å; Y97-Y100 PolarHBondContact O-N 2.94Å; W98-Y100 VanDerWaalsContact C-N 3.35Å; Y100-G102 VanDerWaalsContact C-N 3.35Å; Y100-G102 PolarHBondContact O-N 2.89Å; Y100-S103 PolarHBondContact O-N 2.89Å; Y100-S104 WeakPolarHBondContact O-CB 3.46Å; Y100-S104 PolarHBondContact O-N 3.5Å; Y100-S104 PolarHBondContact O-OG 3.39Å; Y100-A156 VanDerWaalsContact CD1-CA 3.48Å; Y100-A156 HydrophobicContact CD1-CB 4.13Å; Y100-A156 WeakPolarHBondContact CD1-O 3.47Å
101	V	66.9	Low	61.6	Low	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-46.5	-172.1	-179.2	0	0	0	0	109.7	M14 I19 K23 S103 S104 F173	M14-V101 HydrophobicContact CE-CG1 3.55Å; M14-V101 WeakPolarHBondContact CE-O 3.39Å; M14-V101 HydrophobicContact SD-CG1 3.7Å; I19-V101 HydrophobicContact CB-CG1 4.27Å; I19-V101 HydrophobicContact CG1-CG1 4.14Å; I19-V101 HydrophobicContact CG2-CG1 3.88Å; K23-V101 HydrophobicContact CG-CB 4.43Å; K23-V101 HydrophobicContact CG-CG1 4.27Å; K23-V101 HydrophobicContact CG-CG2 4.31Å; V101-S103 VanDerWaalsContact C-N 3.35Å; V101-S103 PolarHBondContact O-N 2.84Å; V101-S104 PolarHBondContact O-N 3.38Å; V101-S104 PolarHBondContact O-OG 2.94Å; V101-F173 HydrophobicContact CG2-CE1 3.95Å; V101-F173 HydrophobicContact CG2-CZ 3.95Å
102	G	66.6	Low	63.5	Low	22 Å²	22	58.1 Å²	58.1	23%	0.227	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-25.7	178.1	0	0	0	0	0	114.8	Y100 Y105 I148	Y100-G102 VanDerWaalsContact C-N 3.35Å; Y100-G102 PolarHBondContact O-N 2.89Å; G102-Y105 WeakPolarHBondContact O-CD1 3.27Å; G102-Y105 WeakPolarHBondContact O-CE1 3.41Å; G102-I148 WeakPolarHBondContact O-CD1 3.25Å
103	S	67.1	Low	65.6	Low	1 Å²	1	58.3 Å²	58.3	1%	0.007	30%	0.296	C	S	.	.	H	α-helix	trans	-89.6	-21.1	177.3	-63.3	0	0	0	0	113.3	Y100 V101 Y105 I148 E153 A156	Y100-S103 PolarHBondContact O-N 2.89Å; V101-S103 VanDerWaalsContact C-N 3.35Å; V101-S103 PolarHBondContact O-N 2.84Å; S103-Y105 PolarHBondContact O-N 3.43Å; S103-I148 WeakPolarHBondContact OG-CG2 3.48Å; S103-E153 WeakPolarHBondContact O-CG 3.31Å; S103-A156 VanDerWaalsContact CB-CB 3.48Å
104	S	70.3	Confident	67.5	Low	1 Å²	1	61.8 Å²	61.8	1%	0.007	31%	0.312	C	S	.	.	H	α-helix	trans	-76	-15.1	-175.9	69.2	0	0	0	0	115.9	R13 Y100 V101 G157 V159	R13-S104 PolarHBondContact NH2-O 3.21Å; Y100-S104 WeakPolarHBondContact O-CB 3.46Å; Y100-S104 PolarHBondContact O-N 3.5Å; Y100-S104 PolarHBondContact O-OG 3.39Å; V101-S104 PolarHBondContact O-N 3.38Å; V101-S104 PolarHBondContact O-OG 2.94Å; S104-G157 WeakPolarHBondContact CB-O 3.49Å; S104-V159 VanDerWaalsContact OG-CG2 3.24Å; S104-V159 WeakPolarHBondContact OG-CG2 3.4Å
105	Y	70	Confident	69.5	Low	31 Å²	31	57.9 Å²	57.9	12%	0.122	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-10	-170.9	76.4	-94.5	0	0	0	115.1	E16 I19 G102 S103 G107	E16-Y105 HydrophobicContact CB-CD2 3.99Å; E16-Y105 HydrophobicContact CB-CE2 3.92Å; E16-Y105 HydrophobicContact CG-CE2 4.05Å; E16-Y105 PolarHBondContact OE1-OH 3.41Å; I19-Y105 HydrophobicContact CD1-CD1 3.68Å; I19-Y105 HydrophobicContact CD1-CE1 3.84Å; I19-Y105 HydrophobicContact CD1-CG 4.38Å; G102-Y105 WeakPolarHBondContact O-CD1 3.27Å; G102-Y105 WeakPolarHBondContact O-CE1 3.41Å; S103-Y105 PolarHBondContact O-N 3.43Å; Y105-G107 VanDerWaalsContact C-N 3.34Å; Y105-G107 PolarHBondContact O-N 3.04Å
106	R	66.1	Low	70.8	Confident	116 Å²	116	55.2 Å²	55.2	44%	0.438	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-9.4	-174.3	-81.2	-172.1	174.8	-169.6	-1.5	115	E153	R106-E153 WeakPolarHBondContact CA-OE1 3.18Å; R106-E153 WeakPolarHBondContact CB-OE1 3.44Å; R106-E153 WeakPolarHBondContact CB-OE2 3.29Å
107	G	62.3	Low	72	Confident	26 Å²	26	56 Å²	56	27%	0.268	28%	0.275	S	S	.	.	S	Bend	trans	-66.1	178.2	173.9	0	0	0	0	0	114	Y105 Q109 E153	Y105-G107 VanDerWaalsContact C-N 3.34Å; Y105-G107 PolarHBondContact O-N 3.04Å; G107-Q109 VanDerWaalsContact O-CG 3.31Å; G107-Q109 WeakPolarHBondContact O-CG 3.45Å; G107-Q109 PolarHBondContact O-N 3.04Å; G107-E153 PolarHBondContact N-OE1 3.2Å
108	Q	63.6	Low	73.1	Confident	155 Å²	155	55.7 Å²	55.7	72%	0.724	28%	0.277	S	S	*	.			trans	-50	107.6	-179	-121.4	173.5	-8.2	0	0	111.3	D110 E111	Q108-D110 VanDerWaalsContact C-N 3.25Å; Q108-D110 PolarHBondContact O-N 2.89Å; Q108-D110 VanDerWaalsContact O-N 3.14Å; Q108-E111 HydrophobicContact CB-CG 4.23Å; Q108-E111 PolarHBondContact OE1-OE1 2.83Å
109	Q	63.4	Low	73.4	Confident	119 Å²	119	58.6 Å²	58.6	56%	0.556	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-8.7	-159.2	-68.2	-172.6	-15.5	0	0	115.4	G107	G107-Q109 VanDerWaalsContact O-CG 3.31Å; G107-Q109 WeakPolarHBondContact O-CG 3.45Å; G107-Q109 PolarHBondContact O-N 3.04Å
110	D	71.3	Confident	73.4	Confident	130 Å²	130	63 Å²	63	70%	0.695	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	18.2	-172.6	-69.4	-36.9	0	0	0	114	K15 Q108	K15-D110 IonicContact NZ-OD1 2.8Å; K15-D110 PolarHBondContact NZ-OD1 2.86Å; Q108-D110 VanDerWaalsContact C-N 3.25Å; Q108-D110 PolarHBondContact O-N 2.89Å; Q108-D110 VanDerWaalsContact O-N 3.14Å
111	E	85.1	Confident	73.3	Confident	61 Å²	61	64.7 Å²	64.7	29%	0.285	32%	0.323	S	S	.	.			trans	-69.1	135.5	171	-66.4	-172.3	174.8	0	0	111.6	R13 Q108 W160 K210	R13-E111 PolarHBondContact N-O 3.38Å; Q108-E111 HydrophobicContact CB-CG 4.23Å; Q108-E111 PolarHBondContact OE1-OE1 2.83Å; E111-W160 HydrophobicContact CB-CH2 3.7Å; E111-W160 HydrophobicContact CB-CZ3 4.11Å; E111-W160 WeakPolarHBondContact OE2-CH2 3.5Å; E111-K210 IonicContact OE2-NZ 2.91Å; E111-K210 PolarHBondContact OE2-NZ 3.43Å
112	T	89.4	Confident	72.6	Confident	93 Å²	93	68 Å²	68	57%	0.571	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	147.9	173.7	54.5	0	0	0	0	109.9	M11 R12	M11-T112 CarbonylContact O-C 3.45Å; M11-T112 VanDerWaalsContact O-CA 3.3Å; M11-T112 WeakPolarHBondContact O-CA 2.98Å; M11-T112 WeakPolarHBondContact O-CB 3.09Å; R12-T112 HydrophobicContact CB-CG2 4.1Å
113	L	88.4	Confident	72	Confident	8 Å²	8	73.3 Å²	73.3	4%	0.042	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	143.6	171.1	-56.5	-179.9	0	0	0	109.2	M11 N115 W160 L207 K210	M11-L113 HydrophobicContact CB-CB 3.83Å; M11-L113 HydrophobicContact CB-CD1 4.3Å; M11-L113 HydrophobicContact CB-CG 4.29Å; M11-L113 HydrophobicContact CE-CB 4.21Å; M11-L113 PolarHBondContact O-N 3.37Å; L113-N115 PolarHBondContact O-N 2.89Å; L113-W160 HydrophobicContact CD1-CB 4.13Å; L113-W160 HydrophobicContact CD1-CD2 3.75Å; L113-W160 HydrophobicContact CD1-CE3 3.83Å; L113-W160 HydrophobicContact CD1-CG 3.88Å; L113-W160 HydrophobicContact CD2-CD2 3.88Å; L113-W160 HydrophobicContact CD2-CE3 3.73Å; L113-W160 HydrophobicContact CD2-CH2 3.81Å; L113-W160 HydrophobicContact CD2-CZ2 3.94Å; L113-W160 HydrophobicContact CD2-CZ3 3.67Å; L113-W160 HydrophobicContact CG-CD2 3.81Å; L113-W160 HydrophobicContact CG-CE3 3.43Å; L113-W160 VanDerWaalsContact CG-CE3 3.43Å; L113-W160 HydrophobicContact CG-CG 4.46Å; L113-W160 HydrophobicContact CG-CH2 4.39Å; L113-W160 HydrophobicContact CG-CZ3 3.74Å; L113-L207 HydrophobicContact CD1-CB 4.22Å; L113-L207 HydrophobicContact CD1-CD1 4.34Å; L113-K210 HydrophobicContact CD2-CB 3.95Å; L113-K210 HydrophobicContact CD2-CD 3.24Å; L113-K210 HydrophobicContact CD2-CG 4.21Å
114	Q	88.5	Confident	71	Confident	76 Å²	76	79.4 Å²	79.4	36%	0.355	41%	0.412	S	S	.	.			trans	-65.3	125.2	175	-173.6	173.2	41.2	0	0	110.4	P116 S206	Q114-P116 WeakPolarHBondContact O-CD 3.49Å; Q114-S206 VanDerWaalsContact O-CB 3.25Å; Q114-S206 WeakPolarHBondContact O-CB 3.24Å; Q114-S206 PolarHBondContact O-OG 3.37Å
115	N	89.9	Confident	70	Confident	14 Å²	14	82.9 Å²	82.9	8%	0.075	43%	0.434	C	S	.	.			trans	-87.9	113.4	172.2	-177.8	-16.1	0	0	0	110.3	L6 V9 M11 L113 Y117 C118 L202	L6-N115 PolarHBondContact O-ND2 3.19Å; V9-N115 PolarHBondContact O-ND2 2.86Å; M11-N115 HydrophobicContact CE-CB 3.82Å; L113-N115 PolarHBondContact O-N 2.89Å; N115-Y117 PolarHBondContact O-N 2.91Å; N115-Y117 WeakPolarHBondContact OD1-CB 3.24Å; N115-Y117 PolarHBondContact OD1-N 3.24Å; N115-C118 VanDerWaalsContact CB-SG 3.59Å; N115-C118 PolarHBondContact O-N 3.36Å; N115-L202 VanDerWaalsContact OD1-CD1 3.26Å; N115-L202 WeakPolarHBondContact OD1-CD1 3.43Å
116	P	85.7	Confident	68.8	Low	36 Å²	36	84.3 Å²	84.3	23%	0.234	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-21	-178.8	25.1	-33	0	0	0	113.6	Q114 L202 S206	Q114-P116 WeakPolarHBondContact O-CD 3.49Å; P116-L202 HydrophobicContact CG-CD1 4.25Å; P116-S206 WeakPolarHBondContact CD-OG 3.04Å
117	Y	82.9	Confident	67.6	Low	68 Å²	68	85.9 Å²	85.9	27%	0.267	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-22.2	-178.9	-66	-96.6	0	0	0	113.1	L6 N115 R119 I120 S121 L202	L6-Y117 HydrophobicContact CB-CD1 4.36Å; L6-Y117 HydrophobicContact CB-CD2 4.4Å; L6-Y117 HydrophobicContact CB-CG 4.13Å; L6-Y117 HydrophobicContact CD1-CD1 4.28Å; L6-Y117 HydrophobicContact CD1-CE1 3.93Å; L6-Y117 HydrophobicContact CD1-CE2 4.22Å; N115-Y117 PolarHBondContact O-N 2.91Å; N115-Y117 WeakPolarHBondContact OD1-CB 3.24Å; N115-Y117 PolarHBondContact OD1-N 3.24Å; Y117-R119 VanDerWaalsContact C-N 3.26Å; Y117-R119 PolarHBondContact O-N 2.91Å; Y117-I120 PolarHBondContact O-N 2.92Å; Y117-I120 VanDerWaalsContact O-N 3.17Å; Y117-S121 PolarHBondContact O-N 3.1Å; Y117-L202 HydrophobicContact CD2-CD1 3.73Å; Y117-L202 HydrophobicContact CE2-CB 4.37Å; Y117-L202 HydrophobicContact CE2-CD1 4.05Å
118	C	76.2	Confident	66.6	Low	21 Å²	21	94.1 Å²	94.1	14%	0.142	51%	0.509	C	S	.	.	H	α-helix	trans	-62.5	-34.2	176.1	-64	0	0	0	0	112.2	D7 N115 I120 S121 G122	D7-C118 PolarHBondContact O-SG 3.42Å; N115-C118 VanDerWaalsContact CB-SG 3.59Å; N115-C118 PolarHBondContact O-N 3.36Å; C118-I120 PolarHBondContact O-N 2.84Å; C118-S121 PolarHBondContact O-N 2.91Å; C118-G122 PolarHBondContact O-N 3.26Å
119	R	64	Low	65.4	Low	192 Å²	192	96.2 Å²	96.2	73%	0.725	52%	0.516	S	S	*	.	H	α-helix	trans	-64.6	-29.3	178	-73.5	-176.7	173.6	170.9	-3.6	112.9	Y117	Y117-R119 VanDerWaalsContact C-N 3.26Å; Y117-R119 PolarHBondContact O-N 2.91Å
120	I	62.3	Low	64.2	Low	142 Å²	142	97.6 Å²	97.6	73%	0.728	52%	0.523	S	S	*	.	H	α-helix	trans	-83.4	-33.5	-175.8	-56.2	171.5	0	0	0	110.7	Y117 C118 G122	Y117-I120 PolarHBondContact O-N 2.92Å; Y117-I120 VanDerWaalsContact O-N 3.17Å; C118-I120 PolarHBondContact O-N 2.84Å; I120-G122 VanDerWaalsContact C-N 3.34Å
121	S	59.4	Low	62.7	Low	46 Å²	46	102.7 Å²	102.7	32%	0.322	53%	0.532	S	S	.	.	H	α-helix	trans	-77.1	-19.2	-178.2	-168.8	0	0	0	0	113	D7 Y117 C118 K123	D7-S121 VanDerWaalsContact OD2-CB 3.28Å; D7-S121 WeakPolarHBondContact OD2-CB 3.23Å; D7-S121 PolarHBondContact OD2-OG 2.75Å; Y117-S121 PolarHBondContact O-N 3.1Å; C118-S121 PolarHBondContact O-N 2.91Å; S121-K123 PolarHBondContact O-N 2.98Å
122	G	52.8	Low	60.5	Low	69 Å²	69	111 Å²	111	71%	0.711	56%	0.561	S	S	*	*			trans	66.6	-3.2	-174.8	0	0	0	0	0	114.1	C118 I120	C118-G122 PolarHBondContact O-N 3.26Å; I120-G122 VanDerWaalsContact C-N 3.34Å
123	K	53.2	Low	58.2	Low	134 Å²	134	115.7 Å²	115.7	58%	0.583	57%	0.568	S	S	*	*			trans	-87.3	115.2	173.9	-65.2	176.7	-174.2	170.1	0	108.6	S121	S121-K123 PolarHBondContact O-N 2.98Å
124	T	46.9	Very low	55.9	Low	130 Å²	130	123.3 Å²	123.3	80%	0.798	61%	0.607	S	S	*	*			trans	-59.3	130	163.1	18.3	0	0	0	0	108.2	G126	T124-G126 PolarHBondContact O-N 2.84Å
125	P	49	Very low	53.4	Low	73 Å²	73	123 Å²	123	47%	0.474	63%	0.625	S	S	.	*			trans	-61.3	106.5	172.8	22.9	-28.6	0	0	0	106.8	T127	P125-T127 PolarHBondContact O-N 3.29Å; P125-T127 VanDerWaalsContact O-N 3.12Å
126	G	43.7	Very low	50.8	Low	62 Å²	62	128.1 Å²	128.1	64%	0.639	66%	0.661	S	S	*	*			trans	-58.3	121.7	-178.7	0	0	0	0	0	108.4	T124 K128	T124-G126 PolarHBondContact O-N 2.84Å; G126-K128 PolarHBondContact O-N 2.93Å
127	T	41	Very low	48.6	Very low	149 Å²	149	135.5 Å²	135.5	91%	0.914	69%	0.69	S	S	*	*			trans	-61.8	73.5	164.4	43.5	0	0	0	0	108.7	P125 K129	P125-T127 PolarHBondContact O-N 3.29Å; P125-T127 VanDerWaalsContact O-N 3.12Å; T127-K129 PolarHBondContact O-N 2.83Å
128	K	42.2	Very low	46.5	Very low	198 Å²	198	138.9 Å²	138.9	86%	0.861	71%	0.712	S	S	*	*			trans	-76.5	118	168.5	-82.2	-175.6	178.3	174.6	0	106.6	G126 Q130	G126-K128 PolarHBondContact O-N 2.93Å; K128-Q130 PolarHBondContact O-N 3.06Å
129	K	38.2	Very low	44.6	Very low	199 Å²	199	147.2 Å²	147.2	87%	0.865	75%	0.746	S	S	*	*			trans	-38.2	125.4	172.9	-86.9	177.3	172.5	175.6	0	110.1	T127 R131	T127-K129 PolarHBondContact O-N 2.83Å; K129-R131 PolarHBondContact O-N 2.96Å
130	Q	38.7	Very low	43.3	Very low	148 Å²	148	146.3 Å²	146.3	69%	0.692	76%	0.756	S	S	*	*			trans	-41.9	106	168.8	-168.3	179	-1.5	0	0	108.8	K128 R132	K128-Q130 PolarHBondContact O-N 3.06Å; Q130-R132 PolarHBondContact O-N 2.91Å
131	R	38.9	Very low	42.2	Very low	237 Å²	237	148 Å²	148	89%	0.894	76%	0.758	S	S	*	*			trans	-72.2	99.5	179	-165.3	176.4	178.7	-175.1	-0.8	105.6	K129 R133	K129-R131 PolarHBondContact O-N 2.96Å; R131-R133 PolarHBondContact O-N 3.04Å
132	R	39	Very low	41.3	Very low	235 Å²	235	154.9 Å²	154.9	89%	0.887	79%	0.785	S	S	*	*			trans	-48.2	105.8	171.8	-75.3	-178.8	176.2	176.5	-2.3	107.6	Q130 I134	Q130-R132 PolarHBondContact O-N 2.91Å; R132-I134 PolarHBondContact O-N 2.8Å
133	R	41.5	Very low	40.8	Very low	192 Å²	192	157.5 Å²	157.5	73%	0.725	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-65.8	134.6	170.8	-96.4	-176.3	173	156.9	2.8	107.2	R131 D167	R131-R133 PolarHBondContact O-N 3.04Å; R133-D167 IonicContact CZ-OD1 3.3Å; R133-D167 VanDerWaalsContact CZ-OD1 3.28Å; R133-D167 IonicContact NH1-OD1 2.65Å; R133-D167 PolarHBondContact NH1-OD1 2.93Å; R133-D167 IonicContact NH2-OD1 3.32Å; R133-D167 PolarHBondContact NH2-OD1 3.32Å; R133-D167 IonicContact NH2-OD2 2.71Å
134	I	39.2	Very low	40.2	Very low	168 Å²	168	156 Å²	156	86%	0.862	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-60	131	-175.4	-70.7	159.6	0	0	0	108.9	R132	R132-I134 PolarHBondContact O-N 2.8Å
135	G	36.9	Very low	40.4	Very low	70 Å²	70	155.1 Å²	155.1	72%	0.722	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.9	132.1	-172.5	0	0	0	0	0	113.5	K137	G135-K137 PolarHBondContact O-N 3.18Å
136	S	35.3	Very low	40.7	Very low	121 Å²	121	157.2 Å²	157.2	85%	0.846	80%	0.796	S	S	*	*			trans	-81	98.1	149.9	54.2	0	0	0	0	107.5
137	K	40.1	Very low	41.4	Very low	191 Å²	191	163.5 Å²	163.5	83%	0.83	81%	0.806	S	S	*	*			trans	-60.7	144.9	163.2	-152.3	176.3	-178.7	-178.9	0	108.3	G135	G135-K137 PolarHBondContact O-N 3.18Å
138	D	38.7	Very low	42.6	Very low	139 Å²	139	157.8 Å²	157.8	74%	0.743	77%	0.77	S	S	*	*			trans	87.9	83.9	172.4	-53.6	-23	0	0	0	117.6
139	K	35.8	Very low	43.9	Very low	196 Å²	196	152.2 Å²	152.2	85%	0.852	75%	0.752	S	S	*	*				-179.7	117.9	92.6	-96.1	177.7	180	176.9	0	108.5	K141	K139-K141 PolarHBondContact O-N 3.17Å
140	D	35.8	Very low	45.5	Very low	174 Å²	174	150.1 Å²	150.1	93%	0.93	75%	0.746	S	S	*	*			trans	-55.5	90	158.1	-68	-43	0	0	0	107.9
141	K	41.2	Very low	47.1	Very low	176 Å²	176	150.1 Å²	150.1	77%	0.765	75%	0.746	S	S	*	*			trans	-100.7	94.4	161.1	-146.5	178.3	-173.7	-176.5	0	103.6	K139 T143	K139-K141 PolarHBondContact O-N 3.17Å; K141-T143 PolarHBondContact O-N 3.18Å; K141-T143 PolarHBondContact O-OG1 2.68Å
142	E	39.7	Very low	48.5	Very low	191 Å²	191	141.3 Å²	141.3	89%	0.893	71%	0.712	S	S	*	*			trans	-44.8	89.4	161.8	-75.7	180	142.3	0	0	107.8	S144	E142-S144 PolarHBondContact O-N 2.83Å; E142-S144 VanDerWaalsContact O-N 3.16Å
143	T	42.4	Very low	50	Low	124 Å²	124	132.4 Å²	132.4	76%	0.761	68%	0.681	S	S	*	*			trans	-82.6	92	162.8	24.5	0	0	0	0	102	K141 S145	K141-T143 PolarHBondContact O-N 3.18Å; K141-T143 PolarHBondContact O-OG1 2.68Å; T143-S145 PolarHBondContact O-N 2.8Å
144	S	40.5	Very low	51.5	Low	104 Å²	104	130 Å²	130	73%	0.727	68%	0.678	S	S	*	*			trans	-21	110.8	170.9	52.3	0	0	0	0	110.4	E142 E146	E142-S144 PolarHBondContact O-N 2.83Å; E142-S144 VanDerWaalsContact O-N 3.16Å; S144-E146 PolarHBondContact O-N 3.4Å
145	S	50.4	Low	53	Low	110 Å²	110	123.2 Å²	123.2	77%	0.769	65%	0.647	S	S	*	*			trans	-66.8	76.3	173.6	47.7	0	0	0	0	108.1	T143 K147	T143-S145 PolarHBondContact O-N 2.8Å; S145-K147 PolarHBondContact O-N 3.03Å; S145-K147 VanDerWaalsContact O-N 3.17Å
146	E	56.6	Low	54.7	Low	117 Å²	117	120.1 Å²	120.1	55%	0.547	62%	0.615	S	S	.	*			trans	-51.5	125.2	170.2	-156.7	-174.2	165.2	0	0	106.1	S144 I148 R152	S144-E146 PolarHBondContact O-N 3.4Å; E146-I148 VanDerWaalsContact C-N 3.28Å; E146-I148 PolarHBondContact O-N 3.38Å; E146-R152 IonicContact OE1-CZ 3.33Å; E146-R152 IonicContact OE1-NH1 2.89Å; E146-R152 PolarHBondContact OE1-NH1 3.47Å; E146-R152 IonicContact OE1-NH2 3.22Å; E146-R152 IonicContact OE2-CZ 3.49Å; E146-R152 IonicContact OE2-NH1 2.8Å; E146-R152 PolarHBondContact OE2-NH1 3.09Å; E146-R152 IonicContact OE2-NH2 3.97Å; E146-R152 PolarHBondContact OE2-NH2 2.9Å
147	K	58.4	Low	56.9	Low	194 Å²	194	114.9 Å²	114.9	84%	0.843	58%	0.58	S	S	*	*			trans	-67.3	92.6	179.5	-73.6	-176.9	-179.5	-179.7	0	107.9	S145 T149	S145-K147 PolarHBondContact O-N 3.03Å; S145-K147 VanDerWaalsContact O-N 3.17Å; K147-T149 PolarHBondContact O-N 3.44Å
148	I	64.1	Low	59.1	Low	29 Å²	29	108.1 Å²	108.1	15%	0.149	55%	0.551	C	S	.	*			trans	-65.1	116.8	173.2	-59.5	172.8	0	0	0	107.2	G102 S103 E146 R152 E153	G102-I148 WeakPolarHBondContact O-CD1 3.25Å; S103-I148 WeakPolarHBondContact OG-CG2 3.48Å; E146-I148 VanDerWaalsContact C-N 3.28Å; E146-I148 PolarHBondContact O-N 3.38Å; I148-R152 HydrophobicContact CG2-CB 4.25Å; I148-R152 HydrophobicContact CG2-CG 4.41Å; I148-E153 HydrophobicContact CG2-CB 4.43Å
149	T	70.5	Confident	61.4	Low	81 Å²	81	101.5 Å²	101.5	50%	0.497	52%	0.516	S	S	.	.			trans	-75	150.4	175.2	51.4	0	0	0	0	110.4	K147 E151 R152 E153	K147-T149 PolarHBondContact O-N 3.44Å; T149-E151 PolarHBondContact O-N 2.88Å; T149-R152 WeakPolarHBondContact O-CA 3.37Å; T149-R152 WeakPolarHBondContact O-CB 2.97Å; T149-R152 PolarHBondContact O-N 3.36Å; T149-R152 WeakPolarHBondContact OG1-CB 3.34Å; T149-R152 PolarHBondContact OG1-N 3.4Å; T149-E153 PolarHBondContact O-N 3.31Å; T149-E153 VanDerWaalsContact O-N 3.09Å
150	E	71.6	Confident	64.1	Low	156 Å²	156	92.2 Å²	92.2	73%	0.729	48%	0.475	S	S	*	.	H	α-helix	trans	-56.9	-35.8	177.3	-65.4	-178.9	176.3	0	0	112	R152 E153 Q154	E150-R152 VanDerWaalsContact C-N 3.32Å; E150-R152 PolarHBondContact O-N 3Å; E150-E153 PolarHBondContact O-N 3.09Å; E150-Q154 WeakPolarHBondContact O-CB 3.23Å; E150-Q154 WeakPolarHBondContact O-CG 3.18Å; E150-Q154 PolarHBondContact O-N 3.44Å
151	E	71.6	Confident	66.9	Low	147 Å²	147	83.9 Å²	83.9	69%	0.687	43%	0.431	S	S	*	.	H	α-helix	trans	-62.6	-37.3	174.1	-170.3	-175.7	176.3	0	0	112.4	T149 A155	T149-E151 PolarHBondContact O-N 2.88Å; E151-A155 WeakPolarHBondContact O-CB 3.41Å; E151-A155 PolarHBondContact O-N 3.47Å
152	R	69.9	Low	69.5	Low	52 Å²	52	75.5 Å²	75.5	20%	0.196	39%	0.394	C	S	.	.	H	α-helix	trans	-70.5	-38.6	177.1	-173.2	177.4	178.8	177.8	-5.9	111.1	D99 E146 I148 T149 E150 A156	D99-R152 IonicContact OD1-CZ 3.34Å; D99-R152 IonicContact OD1-NE 2.81Å; D99-R152 PolarHBondContact OD1-NE 3.14Å; D99-R152 IonicContact OD1-NH2 2.79Å; D99-R152 PolarHBondContact OD1-NH2 2.76Å; E146-R152 IonicContact OE1-CZ 3.33Å; E146-R152 IonicContact OE1-NH1 2.89Å; E146-R152 PolarHBondContact OE1-NH1 3.47Å; E146-R152 IonicContact OE1-NH2 3.22Å; E146-R152 IonicContact OE2-CZ 3.49Å; E146-R152 IonicContact OE2-NH1 2.8Å; E146-R152 PolarHBondContact OE2-NH1 3.09Å; E146-R152 IonicContact OE2-NH2 3.97Å; E146-R152 PolarHBondContact OE2-NH2 2.9Å; I148-R152 HydrophobicContact CG2-CB 4.25Å; I148-R152 HydrophobicContact CG2-CG 4.41Å; T149-R152 WeakPolarHBondContact O-CA 3.37Å; T149-R152 WeakPolarHBondContact O-CB 2.97Å; T149-R152 PolarHBondContact O-N 3.36Å; T149-R152 WeakPolarHBondContact OG1-CB 3.34Å; T149-R152 PolarHBondContact OG1-N 3.4Å; E150-R152 VanDerWaalsContact C-N 3.32Å; E150-R152 PolarHBondContact O-N 3Å; R152-A156 VanDerWaalsContact O-CB 3.23Å; R152-A156 WeakPolarHBondContact O-CB 3.39Å; R152-A156 PolarHBondContact O-N 3.1Å
153	E	69.9	Low	72.1	Confident	49 Å²	49	67.7 Å²	67.7	23%	0.229	36%	0.359	C	S	.	.	H	α-helix	trans	-66.2	-46.7	174.1	173.4	165.8	-166.3	0	0	112.1	S103 R106 G107 I148 T149 E150 A155 A156 G157	S103-E153 WeakPolarHBondContact O-CG 3.31Å; R106-E153 WeakPolarHBondContact CA-OE1 3.18Å; R106-E153 WeakPolarHBondContact CB-OE1 3.44Å; R106-E153 WeakPolarHBondContact CB-OE2 3.29Å; G107-E153 PolarHBondContact N-OE1 3.2Å; I148-E153 HydrophobicContact CG2-CB 4.43Å; T149-E153 PolarHBondContact O-N 3.31Å; T149-E153 VanDerWaalsContact O-N 3.09Å; E150-E153 PolarHBondContact O-N 3.09Å; E153-A155 VanDerWaalsContact C-N 3.34Å; E153-A155 PolarHBondContact O-N 3.23Å; E153-A156 WeakPolarHBondContact O-CB 3.39Å; E153-A156 PolarHBondContact O-N 2.88Å; E153-A156 VanDerWaalsContact O-N 3.09Å; E153-G157 PolarHBondContact O-N 3.33Å
154	Q	72.4	Confident	74.4	Confident	142 Å²	142	62.6 Å²	62.6	66%	0.664	33%	0.328	S	S	*	.	H	α-helix	trans	-58.9	-47.6	174.4	-74.8	179.6	4.7	0	0	110.7	E150 A156 G157 S176	E150-Q154 WeakPolarHBondContact O-CB 3.23Å; E150-Q154 WeakPolarHBondContact O-CG 3.18Å; E150-Q154 PolarHBondContact O-N 3.44Å; Q154-A156 PolarHBondContact O-N 2.93Å; Q154-G157 PolarHBondContact O-N 3.16Å; Q154-S176 WeakPolarHBondContact O-CB 3.37Å
155	A	71.8	Confident	76.7	Confident	24 Å²	24	65.7 Å²	65.7	20%	0.198	33%	0.331	C	S	.	.	H	α-helix	trans	-63.3	-29.4	176.8	0	0	0	0	0	112.7	E151 E153 G157 S176	E151-A155 WeakPolarHBondContact O-CB 3.41Å; E151-A155 PolarHBondContact O-N 3.47Å; E153-A155 VanDerWaalsContact C-N 3.34Å; E153-A155 PolarHBondContact O-N 3.23Å; A155-G157 PolarHBondContact O-N 3.29Å; A155-S176 VanDerWaalsContact C-OG 3.32Å; A155-S176 WeakPolarHBondContact CA-OG 3.35Å; A155-S176 PolarHBondContact O-OG 2.91Å
156	A	71.7	Confident	78.4	Confident	6 Å²	6	62.8 Å²	62.8	5%	0.05	32%	0.318	C	S	.	.	H	α-helix	trans	-70.6	-19.1	-178.2	0	0	0	0	0	113.5	Y100 S103 R152 E153 Q154	Y100-A156 VanDerWaalsContact CD1-CA 3.48Å; Y100-A156 HydrophobicContact CD1-CB 4.13Å; Y100-A156 WeakPolarHBondContact CD1-O 3.47Å; S103-A156 VanDerWaalsContact CB-CB 3.48Å; R152-A156 VanDerWaalsContact O-CB 3.23Å; R152-A156 WeakPolarHBondContact O-CB 3.39Å; R152-A156 PolarHBondContact O-N 3.1Å; E153-A156 WeakPolarHBondContact O-CB 3.39Å; E153-A156 PolarHBondContact O-N 2.88Å; E153-A156 VanDerWaalsContact O-N 3.09Å; Q154-A156 PolarHBondContact O-N 2.93Å
157	G	81.1	Confident	80.1	Confident	11 Å²	11	60.7 Å²	60.7	11%	0.113	31%	0.31	C	S	.	.			trans	64.8	-147.9	-178.8	0	0	0	0	0	111.9	S104 E153 Q154 A155 R174	S104-G157 WeakPolarHBondContact CB-O 3.49Å; E153-G157 PolarHBondContact O-N 3.33Å; Q154-G157 PolarHBondContact O-N 3.16Å; A155-G157 PolarHBondContact O-N 3.29Å; G157-R174 CarbonylContact C-O 3.55Å; G157-R174 WeakPolarHBondContact CA-O 3.4Å
158	Q	86.4	Confident	81.7	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.229	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.2	-158.6	-81.1	-164.6	-0.8	0	0	114.2	F173 R174	Q158-F173 CarbonylContact O-C 3.43Å; Q158-F173 VanDerWaalsContact O-CA 3.28Å; Q158-F173 WeakPolarHBondContact O-CA 3.04Å; Q158-R174 HydrophobicContact CB-CB 3.93Å; Q158-R174 HydrophobicContact CB-CG 4.4Å; Q158-R174 PolarHBondContact N-O 2.86Å; Q158-R174 PolarHBondContact O-N 3.31Å
159	V	88.6	Confident	83.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.3	174.4	-169.6	0	0	0	0	112	R13 M14 V22 S104 V161 F173	R13-V159 VanDerWaalsContact CZ-N 3.32Å; R13-V159 PolarHBondContact NH1-O 3.29Å; R13-V159 VanDerWaalsContact NH1-O 3.1Å; M14-V159 HydrophobicContact CB-CB 3.89Å; M14-V159 HydrophobicContact CB-CG1 3.94Å; M14-V159 HydrophobicContact CE-CB 4.49Å; M14-V159 HydrophobicContact CG-CG1 4.31Å; M14-V159 PolarHBondContact N-O 3.47Å; M14-V159 HydrophobicContact SD-CB 4.03Å; M14-V159 HydrophobicContact SD-CG1 3.74Å; M14-V159 HydrophobicContact SD-CG2 4.42Å; V22-V159 HydrophobicContact CG1-CG1 4.43Å; S104-V159 VanDerWaalsContact OG-CG2 3.24Å; S104-V159 WeakPolarHBondContact OG-CG2 3.4Å; V159-V161 HydrophobicContact CG1-CG1 4.41Å; V159-F173 HydrophobicContact CB-CE1 4.47Å; V159-F173 HydrophobicContact CG1-CD2 4.18Å; V159-F173 HydrophobicContact CG1-CE1 4.33Å; V159-F173 HydrophobicContact CG1-CE2 3.87Å; V159-F173 HydrophobicContact CG1-CZ 3.94Å; V159-F173 HydrophobicContact CG2-CD1 3.46Å; V159-F173 VanDerWaalsContact CG2-CD1 3.46Å; V159-F173 HydrophobicContact CG2-CD2 4.43Å; V159-F173 HydrophobicContact CG2-CE1 3.33Å; V159-F173 HydrophobicContact CG2-CE2 4.32Å; V159-F173 HydrophobicContact CG2-CG 4.03Å; V159-F173 HydrophobicContact CG2-CZ 3.78Å
160	W	91.8	Very high	84.3	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.5	174.7	-62.8	95.8	0	0	0	109.3	R13 E111 L113 C171 V172 K210	R13-W160 HydrophobicContact CB-CZ3 4.38Å; E111-W160 HydrophobicContact CB-CH2 3.7Å; E111-W160 HydrophobicContact CB-CZ3 4.11Å; E111-W160 WeakPolarHBondContact OE2-CH2 3.5Å; L113-W160 HydrophobicContact CD1-CB 4.13Å; L113-W160 HydrophobicContact CD1-CD2 3.75Å; L113-W160 HydrophobicContact CD1-CE3 3.83Å; L113-W160 HydrophobicContact CD1-CG 3.88Å; L113-W160 HydrophobicContact CD2-CD2 3.88Å; L113-W160 HydrophobicContact CD2-CE3 3.73Å; L113-W160 HydrophobicContact CD2-CH2 3.81Å; L113-W160 HydrophobicContact CD2-CZ2 3.94Å; L113-W160 HydrophobicContact CD2-CZ3 3.67Å; L113-W160 HydrophobicContact CG-CD2 3.81Å; L113-W160 HydrophobicContact CG-CE3 3.43Å; L113-W160 VanDerWaalsContact CG-CE3 3.43Å; L113-W160 HydrophobicContact CG-CG 4.46Å; L113-W160 HydrophobicContact CG-CH2 4.39Å; L113-W160 HydrophobicContact CG-CZ3 3.74Å; W160-C171 CarbonylContact O-C 3.5Å; W160-C171 WeakPolarHBondContact O-CA 3.24Å; W160-C171 WeakPolarHBondContact O-CB 3.48Å; W160-V172 HydrophobicContact CB-CG1 3.79Å; W160-V172 PolarHBondContact N-O 3.49Å; W160-V172 PolarHBondContact O-N 2.98Å; W160-K210 HydrophobicContact CH2-CD 4.37Å; W160-K210 HydrophobicContact CZ2-CD 4.1Å
161	V	93.9	Very high	85.3	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	143.7	-178.9	-62.6	0	0	0	0	110.5	M11 R12 M14 V22 V159 I168 G170 C171	M11-V161 VanDerWaalsContact CA-O 3.31Å; M11-V161 WeakPolarHBondContact CA-O 3.25Å; R12-V161 HydrophobicContact CG-CG2 3.77Å; R12-V161 PolarHBondContact N-O 2.88Å; R12-V161 WeakPolarHBondContact O-CG2 3.34Å; R12-V161 PolarHBondContact O-N 3.27Å; M14-V161 HydrophobicContact CB-CG1 3.97Å; M14-V161 HydrophobicContact CG-CG1 4Å; V22-V161 HydrophobicContact CG2-CG1 3.72Å; V159-V161 HydrophobicContact CG1-CG1 4.41Å; V161-I168 HydrophobicContact CB-CD1 4Å; V161-I168 HydrophobicContact CB-CG2 4.05Å; V161-I168 HydrophobicContact CG1-CG2 4.22Å; V161-I168 HydrophobicContact CG2-CD1 3.79Å; V161-G170 WeakPolarHBondContact CA-O 2.94Å; V161-C171 HydrophobicContact CG1-CB 4.27Å
162	A	95.6	Very high	86.3	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	109.5	166.9	0	0	0	0	0	108.7	V9 I168 V169 G170 L199 L203	V9-A162 HydrophobicContact CG1-CB 3.68Å; A162-I168 WeakPolarHBondContact O-CA 3.25Å; A162-V169 HydrophobicContact CB-CG2 3.96Å; A162-V169 WeakPolarHBondContact O-CG2 3.37Å; A162-V169 PolarHBondContact O-N 3.44Å; A162-G170 PolarHBondContact N-O 2.88Å; A162-L199 HydrophobicContact CB-CD1 3.78Å; A162-L203 HydrophobicContact CB-CD1 4.49Å; A162-L203 HydrophobicContact CB-CD2 3.96Å; A162-L203 HydrophobicContact CB-CG 4.4Å
163	D	94.4	Very high	87.2	Confident	27 Å²	27	30.7 Å²	30.7	14%	0.144	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124.1	176.2	-169.9	-30.2	0	0	0	108.9	V10 R12 G166 I168	V10-D163 PolarHBondContact N-O 3.5Å; V10-D163 PolarHBondContact O-N 3.37Å; R12-D163 HydrophobicContact CG-CB 4.44Å; R12-D163 IonicContact CZ-OD2 3.97Å; R12-D163 IonicContact NE-OD2 2.62Å; R12-D163 PolarHBondContact NE-OD2 2.74Å; R12-D163 IonicContact NH2-OD2 3.72Å; R12-D163 PolarHBondContact NH2-OD2 2.85Å; D163-G166 WeakPolarHBondContact OD1-CA 3.41Å; D163-G166 PolarHBondContact OD1-N 2.85Å; D163-I168 HydrophobicContact CB-CD1 4.06Å
164	C	92.1	Very high	88	Confident	16 Å²	16	30.7 Å²	30.7	11%	0.108	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	114	173.6	-171.2	0	0	0	0	108	L4 V9 G166 D167 V169	L4-C164 HydrophobicContact CD1-CB 4.33Å; V9-C164 HydrophobicContact CG2-CB 4.48Å; C164-G166 PolarHBondContact O-N 3.18Å; C164-G166 VanDerWaalsContact O-N 3.1Å; C164-D167 PolarHBondContact N-O 3.12Å; C164-D167 PolarHBondContact O-N 2.8Å; C164-V169 HydrophobicContact CB-CG1 4.07Å; C164-V169 HydrophobicContact CB-CG2 4.05Å
165	E	88.6	Confident	88.5	Confident	170 Å²	170	25 Å²	25	79%	0.794	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	26.5	-179.6	-53.9	-166.9	140.8	0	0	115.2
166	G	86.3	Confident	88.7	Confident	48 Å²	48	26.2 Å²	26.2	50%	0.495	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	2.6	-178.6	0	0	0	0	0	114.4	D163 C164	D163-G166 WeakPolarHBondContact OD1-CA 3.41Å; D163-G166 PolarHBondContact OD1-N 2.85Å; C164-G166 PolarHBondContact O-N 3.18Å; C164-G166 VanDerWaalsContact O-N 3.1Å
167	D	91.2	Very high	88.8	Confident	73 Å²	73	27.4 Å²	27.4	39%	0.39	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.8	173.1	-67.4	-37.7	0	0	0	110.4	R133 C164 V169	R133-D167 IonicContact CZ-OD1 3.3Å; R133-D167 VanDerWaalsContact CZ-OD1 3.28Å; R133-D167 IonicContact NH1-OD1 2.65Å; R133-D167 PolarHBondContact NH1-OD1 2.93Å; R133-D167 IonicContact NH2-OD1 3.32Å; R133-D167 PolarHBondContact NH2-OD1 3.32Å; R133-D167 IonicContact NH2-OD2 2.71Å; C164-D167 PolarHBondContact N-O 3.12Å; C164-D167 PolarHBondContact O-N 2.8Å; D167-V169 PolarHBondContact O-N 2.89Å
168	I	93.2	Very high	88.2	Confident	21 Å²	21	33.4 Å²	33.4	11%	0.108	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	112.8	177.1	-57.6	-53	0	0	0	109.4	D18 V21 V22 V161 A162 D163	D18-I168 HydrophobicContact CB-CG1 4.47Å; V21-I168 HydrophobicContact CG1-CB 3.92Å; V21-I168 HydrophobicContact CG1-CG1 4.47Å; V22-I168 HydrophobicContact CG2-CG2 4.45Å; V161-I168 HydrophobicContact CB-CD1 4Å; V161-I168 HydrophobicContact CB-CG2 4.05Å; V161-I168 HydrophobicContact CG1-CG2 4.22Å; V161-I168 HydrophobicContact CG2-CD1 3.79Å; A162-I168 WeakPolarHBondContact O-CA 3.25Å; D163-I168 HydrophobicContact CB-CD1 4.06Å
169	V	94.4	Very high	87.9	Confident	6 Å²	6	34.7 Å²	34.7	4%	0.036	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-10	-173.9	-63.6	0	0	0	0	113.6	A162 C164 D167 G191 Y194 L199	A162-V169 HydrophobicContact CB-CG2 3.96Å; A162-V169 WeakPolarHBondContact O-CG2 3.37Å; A162-V169 PolarHBondContact O-N 3.44Å; C164-V169 HydrophobicContact CB-CG1 4.07Å; C164-V169 HydrophobicContact CB-CG2 4.05Å; D167-V169 PolarHBondContact O-N 2.89Å; V169-G191 PolarHBondContact O-N 3.2Å; V169-Y194 HydrophobicContact CB-CD2 3.72Å; V169-Y194 HydrophobicContact CB-CE2 3.7Å; V169-Y194 HydrophobicContact CB-CG 4.41Å; V169-Y194 HydrophobicContact CG1-CD2 3.94Å; V169-Y194 HydrophobicContact CG1-CE2 3.37Å; V169-L199 HydrophobicContact CB-CD2 4.17Å; V169-L199 HydrophobicContact CG2-CD1 4.39Å; V169-L199 HydrophobicContact CG2-CD2 3.79Å; V169-L199 WeakPolarHBondContact O-CD2 3.4Å
170	G	93.6	Very high	87.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	160.8	-178.1	0	0	0	0	0	112.3	V161 A162 V189	V161-G170 WeakPolarHBondContact CA-O 2.94Å; A162-G170 PolarHBondContact N-O 2.88Å; G170-V189 CarbonylContact C-O 3.53Å; G170-V189 VanDerWaalsContact CA-O 3.26Å; G170-V189 WeakPolarHBondContact CA-O 2.91Å
171	C	92.9	Very high	86.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	157.8	171.7	66.4	0	0	0	0	112	L25 W160 V161 F173 L188 V189	L25-C171 HydrophobicContact CD2-CB 4.35Å; W160-C171 CarbonylContact O-C 3.5Å; W160-C171 WeakPolarHBondContact O-CA 3.24Å; W160-C171 WeakPolarHBondContact O-CB 3.48Å; V161-C171 HydrophobicContact CG1-CB 4.27Å; C171-F173 HydrophobicContact CB-CE2 4.5Å; C171-L188 WeakPolarHBondContact O-CA 3.22Å; C171-V189 PolarHBondContact N-O 3.42Å; C171-V189 PolarHBondContact O-N 2.99Å
172	V	91.9	Very high	86.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	139.4	172.6	64.8	0	0	0	0	109.1	W160 I185 L188 L203 L207	W160-V172 HydrophobicContact CB-CG1 3.79Å; W160-V172 PolarHBondContact N-O 3.49Å; W160-V172 PolarHBondContact O-N 2.98Å; V172-I185 HydrophobicContact CG2-CG2 3.3Å; V172-L188 HydrophobicContact CB-CD1 3.85Å; V172-L188 HydrophobicContact CG2-CB 4.35Å; V172-L188 HydrophobicContact CG2-CD1 4Å; V172-L203 HydrophobicContact CB-CB 4.38Å; V172-L203 HydrophobicContact CG1-CB 4.18Å; V172-L203 HydrophobicContact CG1-CD2 4.02Å; V172-L207 HydrophobicContact CG1-CD2 4.02Å; V172-L207 HydrophobicContact CG2-CD2 4.01Å
173	F	88.6	Confident	85.9	Confident	3 Å²	3	42.1 Å²	42.1	1%	0.013	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	141.5	-180	-67.8	-128.5	0	0	0	108.9	V22 V26 V101 Q158 V159 C171 I185 C186 R187	V22-F173 HydrophobicContact CG1-CE2 4.23Å; V22-F173 HydrophobicContact CG1-CZ 4.01Å; V26-F173 HydrophobicContact CG2-CE2 4.11Å; V26-F173 HydrophobicContact CG2-CZ 4.3Å; V101-F173 HydrophobicContact CG2-CE1 3.95Å; V101-F173 HydrophobicContact CG2-CZ 3.95Å; Q158-F173 CarbonylContact O-C 3.43Å; Q158-F173 VanDerWaalsContact O-CA 3.28Å; Q158-F173 WeakPolarHBondContact O-CA 3.04Å; V159-F173 HydrophobicContact CB-CE1 4.47Å; V159-F173 HydrophobicContact CG1-CD2 4.18Å; V159-F173 HydrophobicContact CG1-CE1 4.33Å; V159-F173 HydrophobicContact CG1-CE2 3.87Å; V159-F173 HydrophobicContact CG1-CZ 3.94Å; V159-F173 HydrophobicContact CG2-CD1 3.46Å; V159-F173 VanDerWaalsContact CG2-CD1 3.46Å; V159-F173 HydrophobicContact CG2-CD2 4.43Å; V159-F173 HydrophobicContact CG2-CE1 3.33Å; V159-F173 HydrophobicContact CG2-CE2 4.32Å; V159-F173 HydrophobicContact CG2-CG 4.03Å; V159-F173 HydrophobicContact CG2-CZ 3.78Å; C171-F173 HydrophobicContact CB-CE2 4.5Å; F173-I185 CarbonylContact O-C 3.53Å; F173-I185 VanDerWaalsContact O-CA 3.3Å; F173-I185 WeakPolarHBondContact O-CA 3.45Å; F173-I185 WeakPolarHBondContact O-CG2 3.22Å; F173-C186 WeakPolarHBondContact CA-O 3.31Å; F173-C186 VanDerWaalsContact CB-O 3.32Å; F173-C186 WeakPolarHBondContact CB-O 3.35Å; F173-C186 VanDerWaalsContact CB-SG 3.57Å; F173-C186 PolarHBondContact N-O 3.36Å; F173-C186 PolarHBondContact O-N 3.05Å; F173-C186 VanDerWaalsContact O-O 3.11Å; F173-R187 HydrophobicContact CB-CB 4.1Å; F173-R187 HydrophobicContact CD1-CB 4.44Å; F173-R187 HydrophobicContact CD2-CB 3.44Å; F173-R187 VanDerWaalsContact CD2-CB 3.44Å; F173-R187 HydrophobicContact CD2-CG 4.4Å; F173-R187 HydrophobicContact CE2-CB 3.92Å; F173-R187 HydrophobicContact CG-CB 3.76Å; F173-R187 HydrophobicContact CG-CG 4.34Å
174	R	87.3	Confident	85.6	Confident	48 Å²	48	42.4 Å²	42.4	18%	0.181	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121.3	165.6	168.6	-163.8	166	-176.1	-2.1	106.7	G157 Q158 R184 L207 E211	G157-R174 CarbonylContact C-O 3.55Å; G157-R174 WeakPolarHBondContact CA-O 3.4Å; Q158-R174 HydrophobicContact CB-CB 3.93Å; Q158-R174 HydrophobicContact CB-CG 4.4Å; Q158-R174 PolarHBondContact N-O 2.86Å; Q158-R174 PolarHBondContact O-N 3.31Å; R174-R184 CarbonylContact C-O 3.49Å; R174-R184 WeakPolarHBondContact CA-O 3.33Å; R174-L207 HydrophobicContact CB-CD2 4.35Å; R174-E211 WeakPolarHBondContact CD-OE1 3.33Å; R174-E211 IonicContact CZ-OE1 3.29Å; R174-E211 IonicContact CZ-OE2 3.76Å; R174-E211 IonicContact NE-OE1 2.83Å; R174-E211 IonicContact NE-OE2 3.82Å; R174-E211 IonicContact NH1-OE1 3.06Å; R174-E211 PolarHBondContact NH1-OE1 2.82Å; R174-E211 IonicContact NH1-OE2 3.8Å
175	E	82.8	Confident	85.4	Confident	24 Å²	24	41.8 Å²	41.8	11%	0.112	23%	0.23	C	C	.	.			trans	-74	157.1	175.4	-166.4	161.5	-166.4	0	0	111	G92 S93 E177 R184	G92-E175 VanDerWaalsContact O-OE2 3.11Å; S93-E175 WeakPolarHBondContact CB-OE1 3.38Å; E175-E177 PolarHBondContact O-N 2.63Å; E175-E177 VanDerWaalsContact O-N 3.12Å; E175-R184 HydrophobicContact CB-CB 4.2Å; E175-R184 PolarHBondContact N-O 3.26Å; E175-R184 IonicContact OE1-NH1 3.72Å; E175-R184 WeakPolarHBondContact OE2-CD 3.21Å; E175-R184 IonicContact OE2-CZ 2.7Å; E175-R184 IonicContact OE2-NE 3.57Å; E175-R184 IonicContact OE2-NH1 3.88Å; E175-R184 PolarHBondContact OE2-NH1 3.18Å
176	S	75.9	Confident	85.2	Confident	48 Å²	48	34 Å²	34	34%	0.336	20%	0.195	S	C	.	.			trans	-71.8	102.2	171.5	58.5	0	0	0	0	109	Q154 A155	Q154-S176 WeakPolarHBondContact O-CB 3.37Å; A155-S176 VanDerWaalsContact C-OG 3.32Å; A155-S176 WeakPolarHBondContact CA-OG 3.35Å; A155-S176 PolarHBondContact O-OG 2.91Å
177	E	74.9	Confident	85	Confident	32 Å²	32	32.9 Å²	32.9	15%	0.15	18%	0.175	C	C	.	.			trans	-100.7	127.5	179	-175.4	52.6	-105.8	0	0	108.9	E175 R179 A182	E175-E177 PolarHBondContact O-N 2.63Å; E175-E177 VanDerWaalsContact O-N 3.12Å; E177-R179 VanDerWaalsContact C-N 3.32Å; E177-R179 HydrophobicContact CG-CB 4.04Å; E177-R179 WeakPolarHBondContact OE1-CG 3.43Å; E177-R179 PolarHBondContact OE1-N 3.24Å; E177-R179 IonicContact OE1-NE 3.58Å; E177-A182 HydrophobicContact CG-CB 4.39Å; E177-A182 WeakPolarHBondContact CG-O 3.46Å
178	T	68.4	Low	85	Confident	136 Å²	136	31.5 Å²	31.5	83%	0.834	17%	0.168	S	C	*	.			trans	-80.2	-21.5	179.6	54.3	0	0	0	0	111.4
179	R	79.3	Confident	84.9	Confident	76 Å²	76	31.1 Å²	31.1	29%	0.287	17%	0.166	S	C	.	.			trans	-77	127.6	178.9	-61.5	174.3	-163.5	169.8	8.6	111.1	E177 S181 A182 R183 N256	E177-R179 VanDerWaalsContact C-N 3.32Å; E177-R179 HydrophobicContact CG-CB 4.04Å; E177-R179 WeakPolarHBondContact OE1-CG 3.43Å; E177-R179 PolarHBondContact OE1-N 3.24Å; E177-R179 IonicContact OE1-NE 3.58Å; R179-S181 PolarHBondContact O-N 2.71Å; R179-A182 HydrophobicContact CB-CB 4.08Å; R179-A182 VanDerWaalsContact O-O 3.07Å; R179-R183 PolarHBondContact O-NH1 3.43Å; R179-N256 VanDerWaalsContact CZ-CB 3.45Å; R179-N256 PolarHBondContact NH1-O 3.35Å; R179-N256 PolarHBondContact NH2-O 2.99Å
180	P	73.5	Confident	84.8	Confident	106 Å²	106	32 Å²	32	69%	0.688	17%	0.172	S	C	*	.	S	Bend	trans	-67.3	-36.1	-177.7	24.1	-31.8	0	0	0	112.9	R183	P180-R183 PolarHBondContact O-NH1 2.96Å; P180-R183 PolarHBondContact O-NH2 2.89Å
181	S	81.5	Confident	84.6	Confident	21 Å²	21	32.3 Å²	32.3	15%	0.147	18%	0.175	C	C	.	.	S	Bend	trans	-83.5	-18.1	-175.7	53.3	0	0	0	0	114.7	R179 R217 R218 E253	R179-S181 PolarHBondContact O-N 2.71Å; S181-R217 PolarHBondContact O-N 3.2Å; S181-R218 PolarHBondContact O-N 2.94Å; S181-E253 PolarHBondContact OG-OE1 2.93Å
182	A	85.1	Confident	84.3	Confident	3 Å²	3	34.9 Å²	34.9	3%	0.025	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	148.8	-174	0	0	0	0	0	111.7	E177 R179 R218 Y220	E177-A182 HydrophobicContact CG-CB 4.39Å; E177-A182 WeakPolarHBondContact CG-O 3.46Å; R179-A182 HydrophobicContact CB-CB 4.08Å; R179-A182 VanDerWaalsContact O-O 3.07Å; A182-R218 CarbonylContact C-O 3.55Å; A182-R218 WeakPolarHBondContact CA-O 3.47Å; A182-Y220 HydrophobicContact CB-CD2 4.17Å; A182-Y220 HydrophobicContact CB-CE2 3.76Å
183	R	88.1	Confident	84.1	Confident	26 Å²	26	43.5 Å²	43.5	10%	0.098	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.1	171.2	-63.4	-68.3	-177.3	-89.2	-9.5	109.6	R179 P180 E211 A216 R218 V219 Y220	R179-R183 PolarHBondContact O-NH1 3.43Å; P180-R183 PolarHBondContact O-NH1 2.96Å; P180-R183 PolarHBondContact O-NH2 2.89Å; R183-E211 HydrophobicContact CB-CG 4.3Å; R183-E211 WeakPolarHBondContact CD-OE2 3.48Å; R183-E211 HydrophobicContact CG-CB 4.14Å; R183-E211 HydrophobicContact CG-CG 4Å; R183-E211 VanDerWaalsContact CG-OE2 3.26Å; R183-E211 WeakPolarHBondContact CG-OE2 2.9Å; R183-E211 IonicContact NE-OE2 2.99Å; R183-E211 PolarHBondContact NE-OE2 2.83Å; R183-A216 HydrophobicContact CG-CB 3.59Å; R183-R218 PolarHBondContact N-O 2.85Å; R183-V219 HydrophobicContact CB-CG2 4.41Å; R183-V219 CarbonylContact O-C 3.57Å; R183-V219 VanDerWaalsContact O-CA 3.28Å; R183-V219 WeakPolarHBondContact O-CA 3.37Å; R183-Y220 PolarHBondContact O-N 2.71Å
184	R	87.6	Confident	84.1	Confident	34 Å²	34	46 Å²	46	13%	0.128	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	126.6	176.6	-171.3	-169.9	-76.1	172.2	1.8	110.3	G92 R174 E175 Y220 E257	G92-R184 PolarHBondContact O-NH1 3.14Å; R174-R184 CarbonylContact C-O 3.49Å; R174-R184 WeakPolarHBondContact CA-O 3.33Å; E175-R184 HydrophobicContact CB-CB 4.2Å; E175-R184 PolarHBondContact N-O 3.26Å; E175-R184 IonicContact OE1-NH1 3.72Å; E175-R184 WeakPolarHBondContact OE2-CD 3.21Å; E175-R184 IonicContact OE2-CZ 2.7Å; E175-R184 IonicContact OE2-NE 3.57Å; E175-R184 IonicContact OE2-NH1 3.88Å; E175-R184 PolarHBondContact OE2-NH1 3.18Å; R184-Y220 WeakPolarHBondContact CA-O 3.48Å; R184-E257 IonicContact CZ-OE1 3.81Å; R184-E257 IonicContact CZ-OE2 3.4Å; R184-E257 IonicContact NE-OE2 3.66Å; R184-E257 PolarHBondContact NE-OE2 3.42Å; R184-E257 IonicContact NH2-OE1 3.81Å; R184-E257 PolarHBondContact NH2-OE1 3.49Å; R184-E257 IonicContact NH2-OE2 2.68Å; R184-E257 PolarHBondContact NH2-OE2 3.01Å
185	I	89.2	Confident	84.1	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	133	172.3	-62.4	177.5	0	0	0	108	V172 F173 L207 V219 Y220	V172-I185 HydrophobicContact CG2-CG2 3.3Å; F173-I185 CarbonylContact O-C 3.53Å; F173-I185 VanDerWaalsContact O-CA 3.3Å; F173-I185 WeakPolarHBondContact O-CA 3.45Å; F173-I185 WeakPolarHBondContact O-CG2 3.22Å; I185-L207 HydrophobicContact CD1-CB 4.47Å; I185-L207 HydrophobicContact CD1-CD2 3.72Å; I185-L207 HydrophobicContact CD1-CG 4.13Å; I185-L207 HydrophobicContact CG1-CD2 3.75Å; I185-L207 HydrophobicContact CG1-CG 4.48Å; I185-L207 HydrophobicContact CG2-CD2 4.43Å; I185-V219 HydrophobicContact CB-CG1 4.38Å; I185-V219 HydrophobicContact CD1-CG1 3.45Å; I185-V219 VanDerWaalsContact CD1-CG1 3.45Å; I185-V219 HydrophobicContact CG1-CG1 3.62Å; I185-Y220 PolarHBondContact N-O 2.96Å
186	C	84.4	Confident	84.4	Confident	7 Å²	7	59 Å²	59	5%	0.047	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	170.3	175.4	63	0	0	0	0	110.7	F173 L188	F173-C186 WeakPolarHBondContact CA-O 3.31Å; F173-C186 VanDerWaalsContact CB-O 3.32Å; F173-C186 WeakPolarHBondContact CB-O 3.35Å; F173-C186 VanDerWaalsContact CB-SG 3.57Å; F173-C186 PolarHBondContact N-O 3.36Å; F173-C186 PolarHBondContact O-N 3.05Å; F173-C186 VanDerWaalsContact O-O 3.11Å; C186-L188 VanDerWaalsContact C-N 3.27Å; C186-L188 PolarHBondContact O-N 3.38Å; C186-L188 VanDerWaalsContact O-N 3.08Å
187	R	82.3	Confident	85.1	Confident	23 Å²	23	58.7 Å²	58.7	9%	0.087	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	49.6	43.3	170.6	-55.5	174.8	-172.2	136.7	4.8	114.3	G89 S93 F173 V189	G89-R187 PolarHBondContact O-NE 3.33Å; G89-R187 PolarHBondContact O-NH2 2.9Å; S93-R187 PolarHBondContact OG-NH2 3.33Å; F173-R187 HydrophobicContact CB-CB 4.1Å; F173-R187 HydrophobicContact CD1-CB 4.44Å; F173-R187 HydrophobicContact CD2-CB 3.44Å; F173-R187 VanDerWaalsContact CD2-CB 3.44Å; F173-R187 HydrophobicContact CD2-CG 4.4Å; F173-R187 HydrophobicContact CE2-CB 3.92Å; F173-R187 HydrophobicContact CG-CB 3.76Å; F173-R187 HydrophobicContact CG-CG 4.34Å; R187-V189 PolarHBondContact O-N 3.1Å
188	L	90.1	Very high	85.9	Confident	44 Å²	44	58.4 Å²	58.4	23%	0.23	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	113	169.7	176.6	68	0	0	0	109.1	C171 V172 C186 L203 V204 F233 F234	C171-L188 WeakPolarHBondContact O-CA 3.22Å; V172-L188 HydrophobicContact CB-CD1 3.85Å; V172-L188 HydrophobicContact CG2-CB 4.35Å; V172-L188 HydrophobicContact CG2-CD1 4Å; C186-L188 VanDerWaalsContact C-N 3.27Å; C186-L188 PolarHBondContact O-N 3.38Å; C186-L188 VanDerWaalsContact O-N 3.08Å; L188-L203 HydrophobicContact CD1-CB 3.93Å; L188-L203 HydrophobicContact CD1-CD1 3.89Å; L188-V204 HydrophobicContact CD1-CG2 4.19Å; L188-V204 HydrophobicContact CD2-CG2 3.6Å; L188-V204 HydrophobicContact CG-CG2 4.49Å; L188-F233 HydrophobicContact CD2-CD1 4.07Å; L188-F233 HydrophobicContact CD2-CE1 3.26Å; L188-F233 HydrophobicContact CD2-CZ 3.55Å; L188-F234 HydrophobicContact CD2-CZ 4.35Å
189	V	90.4	Very high	87.1	Confident	13 Å²	13	52 Å²	52	8%	0.079	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.7	179.2	-172.9	0	0	0	0	110.3	L25 V26 G170 C171 R187	L25-V189 HydrophobicContact CD2-CG1 4.45Å; L25-V189 HydrophobicContact CG-CB 4.47Å; L25-V189 HydrophobicContact CG-CG1 3.93Å; L25-V189 WeakPolarHBondContact O-CG1 3.5Å; V26-V189 HydrophobicContact CG2-CG2 4.42Å; G170-V189 CarbonylContact C-O 3.53Å; G170-V189 VanDerWaalsContact CA-O 3.26Å; G170-V189 WeakPolarHBondContact CA-O 2.91Å; C171-V189 PolarHBondContact N-O 3.42Å; C171-V189 PolarHBondContact O-N 2.99Å; R187-V189 PolarHBondContact O-N 3.1Å
190	T	92.6	Very high	87.8	Confident	25 Å²	25	48.8 Å²	48.8	15%	0.153	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	142.1	173.3	51.9	0	0	0	0	108.9	L199 L203	T190-L199 HydrophobicContact CG2-CB 4.14Å; T190-L199 HydrophobicContact CG2-CD2 3.88Å; T190-L199 HydrophobicContact CG2-CG 3.86Å; T190-L203 HydrophobicContact CG2-CD1 4.31Å
191	G	89.9	Confident	88.8	Confident	7 Å²	7	47 Å²	47	7%	0.072	21%	0.213	C	C	.	.			trans	-56.3	141.1	176.3	0	0	0	0	0	110.5	V169 W193 Y194 R195	V169-G191 PolarHBondContact O-N 3.2Å; G191-W193 PolarHBondContact O-N 2.8Å; G191-W193 VanDerWaalsContact O-N 3.1Å; G191-Y194 PolarHBondContact O-N 3.22Å; G191-R195 PolarHBondContact O-N 3.1Å
192	C	86.9	Confident	89.5	Confident	53 Å²	53	46 Å²	46	36%	0.358	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-53.7	-35.3	-173.3	54.6	0	0	0	0	113.8	E28 Y194	E28-C192 VanDerWaalsContact OE1-CB 3.24Å; E28-C192 WeakPolarHBondContact OE1-CB 3.47Å; E28-C192 PolarHBondContact OE1-SG 3.4Å; C192-Y194 VanDerWaalsContact C-N 3.29Å; C192-Y194 PolarHBondContact O-N 2.79Å
193	W	87.6	Confident	89.9	Confident	182 Å²	182	45.8 Å²	45.8	69%	0.689	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-68.3	-22	178.6	-59.1	98.5	0	0	0	114.7	G191	G191-W193 PolarHBondContact O-N 2.8Å; G191-W193 VanDerWaalsContact O-N 3.1Å
194	Y	88.7	Confident	90.3	Very high	56 Å²	56	44.6 Å²	44.6	22%	0.22	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-109.5	6.7	-175.4	-52.4	-69.8	0	0	0	112.9	V2 L4 V169 G191 C192 E197	V2-Y194 HydrophobicContact CB-CE1 4.38Å; V2-Y194 HydrophobicContact CG1-CE1 3.88Å; L4-Y194 HydrophobicContact CB-CD1 3.99Å; L4-Y194 HydrophobicContact CD1-CD1 4.1Å; L4-Y194 HydrophobicContact CD1-CE1 4.04Å; L4-Y194 HydrophobicContact CD2-CD1 4.1Å; L4-Y194 HydrophobicContact CD2-CG 4.4Å; L4-Y194 HydrophobicContact CG-CD1 4.3Å; V169-Y194 HydrophobicContact CB-CD2 3.72Å; V169-Y194 HydrophobicContact CB-CE2 3.7Å; V169-Y194 HydrophobicContact CB-CG 4.41Å; V169-Y194 HydrophobicContact CG1-CD2 3.94Å; V169-Y194 HydrophobicContact CG1-CE2 3.37Å; G191-Y194 PolarHBondContact O-N 3.22Å; C192-Y194 VanDerWaalsContact C-N 3.29Å; C192-Y194 PolarHBondContact O-N 2.79Å; Y194-E197 WeakPolarHBondContact O-CB 2.8Å; Y194-E197 PolarHBondContact O-N 3.04Å
195	R	87.8	Confident	90.6	Very high	113 Å²	113	45.4 Å²	45.4	43%	0.426	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	138.3	175.4	-68.6	179.5	-171.2	166.7	6.1	109.6	G191 E197	G191-R195 PolarHBondContact O-N 3.1Å; R195-E197 PolarHBondContact O-N 2.76Å
196	R	88	Confident	90.8	Very high	230 Å²	230	45.3 Å²	45.3	87%	0.868	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.5	4	-176.1	-51.9	-176.5	-70.6	-130.3	0.5	115.7	G198	R196-G198 VanDerWaalsContact C-N 3.26Å; R196-G198 PolarHBondContact O-N 3.04Å
197	E	90.9	Very high	91.2	Very high	42 Å²	42	45 Å²	45	20%	0.196	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-0.1	171.7	-61	-59.7	130	0	0	113.3	M1 L4 Y194 R195	M1-E197 WeakPolarHBondContact CE-OE1 3.26Å; L4-E197 HydrophobicContact CB-CB 4.18Å; L4-E197 HydrophobicContact CB-CG 4.5Å; Y194-E197 WeakPolarHBondContact O-CB 2.8Å; Y194-E197 PolarHBondContact O-N 3.04Å; R195-E197 PolarHBondContact O-N 2.76Å
198	G	91.6	Very high	91.8	Very high	26 Å²	26	44.5 Å²	44.5	27%	0.268	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	-4.4	-178.8	0	0	0	0	0	115	R196 G200 R201 L202	R196-G198 VanDerWaalsContact C-N 3.26Å; R196-G198 PolarHBondContact O-N 3.04Å; G198-G200 VanDerWaalsContact C-N 3.33Å; G198-G200 PolarHBondContact O-N 3.2Å; G198-R201 WeakPolarHBondContact O-CA 3.27Å; G198-R201 WeakPolarHBondContact O-CB 3.33Å; G198-R201 PolarHBondContact O-N 3.43Å; G198-L202 PolarHBondContact O-N 3.14Å
199	L	93.9	Very high	91.9	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-54.2	-43.3	179.2	-178.7	59.2	0	0	0	113.8	L4 V9 A162 V169 T190 R201 L202 L203	L4-L199 HydrophobicContact CD2-CB 4.03Å; L4-L199 HydrophobicContact CD2-CD1 3.99Å; L4-L199 HydrophobicContact CD2-CD2 4.06Å; L4-L199 HydrophobicContact CD2-CG 4.25Å; V9-L199 HydrophobicContact CG1-CD1 4.12Å; V9-L199 HydrophobicContact CG2-CD1 4.49Å; A162-L199 HydrophobicContact CB-CD1 3.78Å; V169-L199 HydrophobicContact CB-CD2 4.17Å; V169-L199 HydrophobicContact CG2-CD1 4.39Å; V169-L199 HydrophobicContact CG2-CD2 3.79Å; V169-L199 WeakPolarHBondContact O-CD2 3.4Å; T190-L199 HydrophobicContact CG2-CB 4.14Å; T190-L199 HydrophobicContact CG2-CD2 3.88Å; T190-L199 HydrophobicContact CG2-CG 3.86Å; L199-R201 VanDerWaalsContact C-N 3.3Å; L199-R201 PolarHBondContact O-N 2.92Å; L199-L202 HydrophobicContact CD1-CD2 4.29Å; L199-L202 WeakPolarHBondContact O-CB 3.35Å; L199-L202 PolarHBondContact O-N 3.41Å; L199-L203 HydrophobicContact CG-CD1 4.37Å; L199-L203 PolarHBondContact O-N 2.85Å
200	G	94.1	Very high	91.9	Very high	10 Å²	10	46.4 Å²	46.4	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-37.3	177.5	0	0	0	0	0	112.6	G198 V204 F233	G198-G200 VanDerWaalsContact C-N 3.33Å; G198-G200 PolarHBondContact O-N 3.2Å; G200-V204 WeakPolarHBondContact O-CG2 3.34Å; G200-V204 PolarHBondContact O-N 3.12Å; G200-V204 VanDerWaalsContact O-N 3.13Å; G200-F233 WeakPolarHBondContact O-CZ 3.23Å
201	R	94.9	Very high	91.9	Very high	67 Å²	67	45.3 Å²	45.3	25%	0.253	20%	0.202	S	C	.	.	H	α-helix	trans	-66.6	-44	175.6	175.9	-174	-64.5	-85.3	-6.2	110.4	G198 L199 V204 Q205 K236	G198-R201 WeakPolarHBondContact O-CA 3.27Å; G198-R201 WeakPolarHBondContact O-CB 3.33Å; G198-R201 PolarHBondContact O-N 3.43Å; L199-R201 VanDerWaalsContact C-N 3.3Å; L199-R201 PolarHBondContact O-N 2.92Å; R201-V204 PolarHBondContact O-N 2.94Å; R201-Q205 HydrophobicContact CG-CG 4.08Å; R201-Q205 WeakPolarHBondContact O-CB 3.46Å; R201-Q205 WeakPolarHBondContact O-CG 3.3Å; R201-Q205 PolarHBondContact O-N 2.88Å; R201-K236 PolarHBondContact NH2-O 3.2Å
202	L	94.8	Very high	91.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-55.5	-51.5	176.3	170.1	63.3	0	0	0	111.2	L6 V9 M11 N115 P116 Y117 G198 L199 V204 S206	L6-L202 HydrophobicContact CB-CD2 4.42Å; L6-L202 HydrophobicContact CD2-CD2 4.17Å; V9-L202 HydrophobicContact CB-CD2 3.81Å; V9-L202 HydrophobicContact CG1-CD2 3.84Å; V9-L202 HydrophobicContact CG2-CD2 4.35Å; M11-L202 HydrophobicContact CE-CD1 3.77Å; M11-L202 HydrophobicContact CE-CG 4.14Å; M11-L202 HydrophobicContact SD-CD1 4.08Å; M11-L202 HydrophobicContact SD-CG 3.82Å; N115-L202 VanDerWaalsContact OD1-CD1 3.26Å; N115-L202 WeakPolarHBondContact OD1-CD1 3.43Å; P116-L202 HydrophobicContact CG-CD1 4.25Å; Y117-L202 HydrophobicContact CD2-CD1 3.73Å; Y117-L202 HydrophobicContact CE2-CB 4.37Å; Y117-L202 HydrophobicContact CE2-CD1 4.05Å; G198-L202 PolarHBondContact O-N 3.14Å; L199-L202 HydrophobicContact CD1-CD2 4.29Å; L199-L202 WeakPolarHBondContact O-CB 3.35Å; L199-L202 PolarHBondContact O-N 3.41Å; L202-V204 PolarHBondContact O-N 3.48Å; L202-S206 WeakPolarHBondContact O-CB 3.15Å; L202-S206 PolarHBondContact O-N 3.12Å; L202-S206 VanDerWaalsContact O-N 3.07Å; L202-S206 PolarHBondContact O-OG 3.35Å
203	L	95.3	Very high	92.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.2	-48.5	178.8	-78.3	167	0	0	0	112.1	M11 A162 V172 L188 T190 L199 L207	M11-L203 HydrophobicContact CG-CD2 4.09Å; M11-L203 HydrophobicContact SD-CD2 4.21Å; A162-L203 HydrophobicContact CB-CD1 4.49Å; A162-L203 HydrophobicContact CB-CD2 3.96Å; A162-L203 HydrophobicContact CB-CG 4.4Å; V172-L203 HydrophobicContact CB-CB 4.38Å; V172-L203 HydrophobicContact CG1-CB 4.18Å; V172-L203 HydrophobicContact CG1-CD2 4.02Å; L188-L203 HydrophobicContact CD1-CB 3.93Å; L188-L203 HydrophobicContact CD1-CD1 3.89Å; T190-L203 HydrophobicContact CG2-CD1 4.31Å; L199-L203 HydrophobicContact CG-CD1 4.37Å; L199-L203 PolarHBondContact O-N 2.85Å; L203-L207 WeakPolarHBondContact O-CB 3.48Å; L203-L207 PolarHBondContact O-N 3.47Å
204	V	95	Very high	92.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.8	-49.7	-178.3	171.6	0	0	0	0	111.4	L188 G200 R201 L202 S206 L207 E208 F233 V237 Y239	L188-V204 HydrophobicContact CD1-CG2 4.19Å; L188-V204 HydrophobicContact CD2-CG2 3.6Å; L188-V204 HydrophobicContact CG-CG2 4.49Å; G200-V204 WeakPolarHBondContact O-CG2 3.34Å; G200-V204 PolarHBondContact O-N 3.12Å; G200-V204 VanDerWaalsContact O-N 3.13Å; R201-V204 PolarHBondContact O-N 2.94Å; L202-V204 PolarHBondContact O-N 3.48Å; V204-S206 VanDerWaalsContact C-N 3.27Å; V204-S206 PolarHBondContact O-N 2.87Å; V204-L207 PolarHBondContact O-N 3.38Å; V204-E208 HydrophobicContact CG1-CG 4.15Å; V204-E208 WeakPolarHBondContact CG1-OE1 3.3Å; V204-E208 WeakPolarHBondContact O-CB 3.35Å; V204-E208 VanDerWaalsContact O-CG 3.23Å; V204-E208 WeakPolarHBondContact O-CG 3.37Å; V204-E208 PolarHBondContact O-N 3.09Å; V204-F233 HydrophobicContact CG2-CE1 4.04Å; V204-F233 HydrophobicContact CG2-CZ 4.01Å; V204-V237 HydrophobicContact CG1-CG1 3.91Å; V204-Y239 HydrophobicContact CG1-CE2 4.03Å
205	Q	94.2	Very high	92.1	Very high	52 Å²	52	51 Å²	51	24%	0.243	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-36.7	-178.1	-75	-179	-28.5	0	0	112.8	R201 E208 L209	R201-Q205 HydrophobicContact CG-CG 4.08Å; R201-Q205 WeakPolarHBondContact O-CB 3.46Å; R201-Q205 WeakPolarHBondContact O-CG 3.3Å; R201-Q205 PolarHBondContact O-N 2.88Å; Q205-E208 PolarHBondContact O-N 3Å; Q205-L209 VanDerWaalsContact O-CG 3.31Å; Q205-L209 WeakPolarHBondContact O-CG 3.43Å; Q205-L209 PolarHBondContact O-N 3.46Å
206	S	93.8	Very high	92.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-74.8	-34.1	-177.8	-50.3	0	0	0	0	111.8	M11 Q114 P116 L202 V204 K210	M11-S206 WeakPolarHBondContact CE-OG 3.42Å; M11-S206 WeakPolarHBondContact SD-CB 3.46Å; M11-S206 PolarHBondContact SD-OG 3.11Å; M11-S206 VanDerWaalsContact SD-OG 3.34Å; Q114-S206 VanDerWaalsContact O-CB 3.25Å; Q114-S206 WeakPolarHBondContact O-CB 3.24Å; Q114-S206 PolarHBondContact O-OG 3.37Å; P116-S206 WeakPolarHBondContact CD-OG 3.04Å; L202-S206 WeakPolarHBondContact O-CB 3.15Å; L202-S206 PolarHBondContact O-N 3.12Å; L202-S206 VanDerWaalsContact O-N 3.07Å; L202-S206 PolarHBondContact O-OG 3.35Å; V204-S206 VanDerWaalsContact C-N 3.27Å; V204-S206 PolarHBondContact O-N 2.87Å; S206-K210 PolarHBondContact O-N 3.29Å
207	L	93.1	Very high	92.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-70.1	-42.7	171	-172.1	56.9	0	0	0	111	L113 V172 R174 I185 L203 V204 L209 K210 E211	L113-L207 HydrophobicContact CD1-CB 4.22Å; L113-L207 HydrophobicContact CD1-CD1 4.34Å; V172-L207 HydrophobicContact CG1-CD2 4.02Å; V172-L207 HydrophobicContact CG2-CD2 4.01Å; R174-L207 HydrophobicContact CB-CD2 4.35Å; I185-L207 HydrophobicContact CD1-CB 4.47Å; I185-L207 HydrophobicContact CD1-CD2 3.72Å; I185-L207 HydrophobicContact CD1-CG 4.13Å; I185-L207 HydrophobicContact CG1-CD2 3.75Å; I185-L207 HydrophobicContact CG1-CG 4.48Å; I185-L207 HydrophobicContact CG2-CD2 4.43Å; L203-L207 WeakPolarHBondContact O-CB 3.48Å; L203-L207 PolarHBondContact O-N 3.47Å; V204-L207 PolarHBondContact O-N 3.38Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 2.91Å; L207-K210 PolarHBondContact O-N 3.25Å; L207-E211 HydrophobicContact CD1-CG 4.34Å; L207-E211 HydrophobicContact CG-CG 4.41Å; L207-E211 WeakPolarHBondContact O-CG 3.45Å; L207-E211 PolarHBondContact O-N 3.04Å
208	E	93.9	Very high	92.2	Very high	13 Å²	13	42.6 Å²	42.6	6%	0.061	21%	0.213	C	C	.	.	H	α-helix	trans	-55.1	-46	174.1	-74.9	172.6	177.8	0	0	112.2	V204 Q205 E211 R212 Y239 K274 L276	V204-E208 HydrophobicContact CG1-CG 4.15Å; V204-E208 WeakPolarHBondContact CG1-OE1 3.3Å; V204-E208 WeakPolarHBondContact O-CB 3.35Å; V204-E208 VanDerWaalsContact O-CG 3.23Å; V204-E208 WeakPolarHBondContact O-CG 3.37Å; V204-E208 PolarHBondContact O-N 3.09Å; Q205-E208 PolarHBondContact O-N 3Å; E208-E211 PolarHBondContact O-N 3.33Å; E208-R212 WeakPolarHBondContact O-CB 3.48Å; E208-R212 PolarHBondContact O-N 3.24Å; E208-Y239 WeakPolarHBondContact OE1-CE2 3.46Å; E208-Y239 VanDerWaalsContact OE1-CZ 3.25Å; E208-Y239 PolarHBondContact OE1-OH 3.17Å; E208-K274 IonicContact OE1-NZ 3.3Å; E208-K274 PolarHBondContact OE1-NZ 3.05Å; E208-K274 IonicContact OE2-NZ 2.79Å; E208-K274 PolarHBondContact OE2-NZ 3.31Å; E208-L276 HydrophobicContact CB-CD2 3.71Å; E208-L276 HydrophobicContact CG-CD2 3.87Å
209	L	92.6	Very high	92.2	Very high	62 Å²	62	41.3 Å²	41.3	33%	0.325	20%	0.2	S	C	.	.	H	α-helix	trans	-59.4	-47.3	177	-76	168.9	0	0	0	111.7	Q205 L207 E211 R212 E213	Q205-L209 VanDerWaalsContact O-CG 3.31Å; Q205-L209 WeakPolarHBondContact O-CG 3.43Å; Q205-L209 PolarHBondContact O-N 3.46Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 2.91Å; L209-E211 PolarHBondContact O-N 3.48Å; L209-R212 WeakPolarHBondContact O-CB 3.22Å; L209-R212 PolarHBondContact O-N 3.22Å; L209-E213 WeakPolarHBondContact O-CG 3.31Å; L209-E213 PolarHBondContact O-N 3.4Å
210	K	91.6	Very high	92.1	Very high	36 Å²	36	41.4 Å²	41.4	16%	0.157	20%	0.201	C	C	.	.	H	α-helix	trans	-62.4	-43.9	177.1	174.8	170.7	179.3	160.9	0	112.3	E111 L113 W160 S206 L207 R212 E213 S214	E111-K210 IonicContact OE2-NZ 2.91Å; E111-K210 PolarHBondContact OE2-NZ 3.43Å; L113-K210 HydrophobicContact CD2-CB 3.95Å; L113-K210 HydrophobicContact CD2-CD 3.24Å; L113-K210 HydrophobicContact CD2-CG 4.21Å; W160-K210 HydrophobicContact CH2-CD 4.37Å; W160-K210 HydrophobicContact CZ2-CD 4.1Å; S206-K210 PolarHBondContact O-N 3.29Å; L207-K210 PolarHBondContact O-N 3.25Å; K210-R212 VanDerWaalsContact C-N 3.3Å; K210-R212 PolarHBondContact O-N 2.88Å; K210-E213 PolarHBondContact O-N 2.8Å; K210-S214 WeakPolarHBondContact O-CB 3.46Å; K210-S214 PolarHBondContact O-N 3.48Å; K210-S214 PolarHBondContact O-OG 2.88Å
211	E	91.1	Very high	91.9	Very high	1 Å²	1	41 Å²	41	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-35.7	180	-66.3	-48.2	136.9	0	0	111.2	R174 R183 L207 E208 L209 S214 G215 A216 L276	R174-E211 WeakPolarHBondContact CD-OE1 3.33Å; R174-E211 IonicContact CZ-OE1 3.29Å; R174-E211 IonicContact CZ-OE2 3.76Å; R174-E211 IonicContact NE-OE1 2.83Å; R174-E211 IonicContact NE-OE2 3.82Å; R174-E211 IonicContact NH1-OE1 3.06Å; R174-E211 PolarHBondContact NH1-OE1 2.82Å; R174-E211 IonicContact NH1-OE2 3.8Å; R183-E211 HydrophobicContact CB-CG 4.3Å; R183-E211 WeakPolarHBondContact CD-OE2 3.48Å; R183-E211 HydrophobicContact CG-CB 4.14Å; R183-E211 HydrophobicContact CG-CG 4Å; R183-E211 VanDerWaalsContact CG-OE2 3.26Å; R183-E211 WeakPolarHBondContact CG-OE2 2.9Å; R183-E211 IonicContact NE-OE2 2.99Å; R183-E211 PolarHBondContact NE-OE2 2.83Å; L207-E211 HydrophobicContact CD1-CG 4.34Å; L207-E211 HydrophobicContact CG-CG 4.41Å; L207-E211 WeakPolarHBondContact O-CG 3.45Å; L207-E211 PolarHBondContact O-N 3.04Å; E208-E211 PolarHBondContact O-N 3.33Å; L209-E211 PolarHBondContact O-N 3.48Å; E211-S214 CarbonylContact O-C 3.53Å; E211-S214 WeakPolarHBondContact O-CA 3.33Å; E211-S214 WeakPolarHBondContact O-CB 3.48Å; E211-S214 PolarHBondContact O-N 3.43Å; E211-G215 PolarHBondContact O-N 2.99Å; E211-A216 HydrophobicContact CB-CB 3.99Å; E211-A216 WeakPolarHBondContact O-CB 3.16Å; E211-A216 PolarHBondContact O-N 2.98Å; E211-L276 HydrophobicContact CB-CD1 4.07Å
212	R	91.3	Very high	91.5	Very high	152 Å²	152	38.4 Å²	38.4	57%	0.574	19%	0.187	S	C	*	.	H	α-helix	trans	-62.2	-46.4	172.6	-177.9	-179.3	169.2	151	-6.5	111.8	E208 L209 K210 S214 G215 L276	E208-R212 WeakPolarHBondContact O-CB 3.48Å; E208-R212 PolarHBondContact O-N 3.24Å; L209-R212 WeakPolarHBondContact O-CB 3.22Å; L209-R212 PolarHBondContact O-N 3.22Å; K210-R212 VanDerWaalsContact C-N 3.3Å; K210-R212 PolarHBondContact O-N 2.88Å; R212-S214 PolarHBondContact O-N 3.18Å; R212-G215 PolarHBondContact O-N 2.95Å; R212-L276 HydrophobicContact CB-CB 4.19Å; R212-L276 HydrophobicContact CB-CD1 4.13Å; R212-L276 WeakPolarHBondContact CD-OXT 3.48Å; R212-L276 HydrophobicContact CG-CB 4.35Å; R212-L276 PolarHBondContact NH1-OXT 3.48Å
213	E	90.7	Very high	91.2	Very high	150 Å²	150	38.6 Å²	38.6	70%	0.701	19%	0.188	S	C	*	.	H	α-helix	trans	-62.1	-30.7	174.9	-72	173.9	173.1	0	0	112	L209 K210 G215	L209-E213 WeakPolarHBondContact O-CG 3.31Å; L209-E213 PolarHBondContact O-N 3.4Å; K210-E213 PolarHBondContact O-N 2.8Å; E213-G215 PolarHBondContact O-N 3.1Å
214	S	87.4	Confident	90.7	Very high	66 Å²	66	39.7 Å²	39.7	46%	0.462	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	4.2	174.9	-52.9	0	0	0	0	113.4	K210 E211 R212	K210-S214 WeakPolarHBondContact O-CB 3.46Å; K210-S214 PolarHBondContact O-N 3.48Å; K210-S214 PolarHBondContact O-OG 2.88Å; E211-S214 CarbonylContact O-C 3.53Å; E211-S214 WeakPolarHBondContact O-CA 3.33Å; E211-S214 WeakPolarHBondContact O-CB 3.48Å; E211-S214 PolarHBondContact O-N 3.43Å; R212-S214 PolarHBondContact O-N 3.18Å
215	G	88.1	Confident	90.1	Very high	50 Å²	50	43.5 Å²	43.5	52%	0.515	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	9.9	176.2	0	0	0	0	0	115.6	E211 R212 E213	E211-G215 PolarHBondContact O-N 2.99Å; R212-G215 PolarHBondContact O-N 2.95Å; E213-G215 PolarHBondContact O-N 3.1Å
216	A	89	Confident	89.5	Confident	5 Å²	5	42.3 Å²	42.3	4%	0.041	21%	0.207	C	C	.	.			trans	-68.8	137.1	172.6	0	0	0	0	0	110.2	R183 E211 L276	R183-A216 HydrophobicContact CG-CB 3.59Å; E211-A216 HydrophobicContact CB-CB 3.99Å; E211-A216 WeakPolarHBondContact O-CB 3.16Å; E211-A216 PolarHBondContact O-N 2.98Å; A216-L276 HydrophobicContact CB-CD1 3.92Å
217	R	89.4	Confident	89.2	Confident	184 Å²	184	43.8 Å²	43.8	69%	0.694	22%	0.217	S	C	*	.			trans	-97.6	-26.1	177.1	-65.5	-177.8	179.5	-178.6	-1.4	112.2	S181 D275 L276	S181-R217 PolarHBondContact O-N 3.2Å; R217-D275 WeakPolarHBondContact O-CA 3.35Å; R217-L276 PolarHBondContact O-N 2.85Å
218	R	89.9	Confident	89	Confident	19 Å²	19	50.2 Å²	50.2	7%	0.072	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	144	-174.6	-170.8	172.9	-74.8	163.5	3.5	112	S181 A182 R183 Y220 D251 K274 D275	S181-R218 PolarHBondContact O-N 2.94Å; A182-R218 CarbonylContact C-O 3.55Å; A182-R218 WeakPolarHBondContact CA-O 3.47Å; R183-R218 PolarHBondContact N-O 2.85Å; R218-Y220 HydrophobicContact CB-CE2 4.49Å; R218-Y220 WeakPolarHBondContact CD-OH 3.21Å; R218-Y220 HydrophobicContact CG-CE1 4.46Å; R218-Y220 HydrophobicContact CG-CE2 3.98Å; R218-D251 IonicContact NH2-OD2 2.9Å; R218-K274 WeakPolarHBondContact CA-O 3.45Å; R218-D275 IonicContact CZ-OD1 3.38Å; R218-D275 VanDerWaalsContact CZ-OD1 3.3Å; R218-D275 IonicContact NE-OD1 3.7Å; R218-D275 PolarHBondContact NE-OD1 3.42Å; R218-D275 IonicContact NH2-OD1 2.78Å; R218-D275 PolarHBondContact NH2-OD1 3.21Å
219	V	91.9	Very high	88.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.3	174.5	-178.3	0	0	0	0	110.2	R183 I185 Y239 Y273 K274 L276	R183-V219 HydrophobicContact CB-CG2 4.41Å; R183-V219 CarbonylContact O-C 3.57Å; R183-V219 VanDerWaalsContact O-CA 3.28Å; R183-V219 WeakPolarHBondContact O-CA 3.37Å; I185-V219 HydrophobicContact CB-CG1 4.38Å; I185-V219 HydrophobicContact CD1-CG1 3.45Å; I185-V219 VanDerWaalsContact CD1-CG1 3.45Å; I185-V219 HydrophobicContact CG1-CG1 3.62Å; V219-Y239 HydrophobicContact CB-CE1 4.46Å; V219-Y239 HydrophobicContact CG1-CE1 4.24Å; V219-Y239 WeakPolarHBondContact CG1-OH 3.35Å; V219-Y273 CarbonylContact O-C 3.46Å; V219-Y273 VanDerWaalsContact O-CA 3.24Å; V219-Y273 WeakPolarHBondContact O-CA 3.35Å; V219-K274 PolarHBondContact N-O 3.02Å; V219-K274 PolarHBondContact O-N 3.45Å; V219-L276 HydrophobicContact CG2-CD1 3.49Å; V219-L276 VanDerWaalsContact CG2-CD1 3.49Å; V219-L276 HydrophobicContact CG2-CD2 3.79Å; V219-L276 HydrophobicContact CG2-CG 3.73Å
220	Y	91.2	Very high	88.5	Confident	2 Å²	2	53 Å²	53	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	146.7	176.2	-64	-82.5	0	0	0	111.3	A182 R183 R184 I185 R218 E257 V271 F272 Y273	A182-Y220 HydrophobicContact CB-CD2 4.17Å; A182-Y220 HydrophobicContact CB-CE2 3.76Å; R183-Y220 PolarHBondContact O-N 2.71Å; R184-Y220 WeakPolarHBondContact CA-O 3.48Å; I185-Y220 PolarHBondContact N-O 2.96Å; R218-Y220 HydrophobicContact CB-CE2 4.49Å; R218-Y220 WeakPolarHBondContact CD-OH 3.21Å; R218-Y220 HydrophobicContact CG-CE1 4.46Å; R218-Y220 HydrophobicContact CG-CE2 3.98Å; Y220-E257 HydrophobicContact CD1-CB 4.1Å; Y220-E257 HydrophobicContact CD1-CG 3.85Å; Y220-E257 HydrophobicContact CE1-CB 3.9Å; Y220-E257 HydrophobicContact CE1-CG 4.19Å; Y220-E257 HydrophobicContact CG-CG 4.1Å; Y220-V271 HydrophobicContact CD1-CG1 3.95Å; Y220-F272 CarbonylContact C-O 3.59Å; Y220-F272 VanDerWaalsContact CA-O 3.28Å; Y220-F272 WeakPolarHBondContact CA-O 3.28Å; Y220-Y273 HydrophobicContact CE1-CG 4.45Å
221	A	90.4	Very high	88.5	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.008	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	128.5	173.4	0	0	0	0	0	110.2	F234 Y239 F272	A221-F234 HydrophobicContact CB-CD1 3.87Å; A221-F234 HydrophobicContact CB-CE1 3.4Å; A221-F234 VanDerWaalsContact CB-CE1 3.4Å; A221-F234 HydrophobicContact CB-CE2 4.1Å; A221-F234 HydrophobicContact CB-CG 4.41Å; A221-F234 HydrophobicContact CB-CZ 3.53Å; A221-Y239 HydrophobicContact CB-CD1 4.4Å; A221-Y239 HydrophobicContact CB-CE1 4.21Å; A221-F272 HydrophobicContact CB-CB 4.37Å; A221-F272 PolarHBondContact N-O 3.1Å; A221-F272 PolarHBondContact O-N 3.32Å
222	H	87.4	Confident	88.6	Confident	14 Å²	14	55 Å²	55	7%	0.065	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.7	177.4	-73.7	-133.7	0	0	0	108.7	E257 T269	H222-E257 IonicContact CE1-OE1 3.58Å; H222-E257 PolarHBondContact CE1-OE1 2.83Å; H222-E257 IonicContact NE2-OE1 3.66Å; H222-E257 PolarHBondContact NE2-OE1 3.1Å; H222-E257 IonicContact NE2-OE2 3.77Å; H222-T269 HydrophobicContact CB-CG2 4.18Å
223	V	87.5	Confident	88.8	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.024	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.6	-177.9	-179.6	0	0	0	0	108.9	Y225 F234 T269 K270 F272	V223-Y225 PolarHBondContact O-N 3.3Å; V223-F234 HydrophobicContact CG2-CD2 3.35Å; V223-F234 HydrophobicContact CG2-CE2 3.65Å; V223-F234 HydrophobicContact CG2-CG 4.28Å; V223-T269 CarbonylContact O-C 3.5Å; V223-T269 WeakPolarHBondContact O-CA 3.32Å; V223-K270 PolarHBondContact N-O 2.97Å; V223-K270 PolarHBondContact O-N 3.46Å; V223-F272 HydrophobicContact CB-CD2 3.97Å; V223-F272 HydrophobicContact CB-CE2 3.91Å; V223-F272 HydrophobicContact CG2-CD2 3.51Å; V223-F272 HydrophobicContact CG2-CE2 3.83Å; V223-F272 HydrophobicContact CG2-CG 4.44Å
224	P	84.3	Confident	88.9	Confident	22 Å²	22	43.8 Å²	43.8	14%	0.143	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	135.7	178.3	-23.3	35.1	0	0	0	110.8	T33 L91 P226 S227	T33-P224 HydrophobicContact CG2-CB 4.02Å; T33-P224 HydrophobicContact CG2-CG 4.18Å; L91-P224 HydrophobicContact CB-CG 4.2Å; L91-P224 HydrophobicContact CD1-CB 3.83Å; L91-P224 HydrophobicContact CD1-CG 3.31Å; L91-P224 HydrophobicContact CD2-CB 4.36Å; L91-P224 HydrophobicContact CD2-CG 4.34Å; L91-P224 HydrophobicContact CG-CG 4.09Å; P224-P226 VanDerWaalsContact C-CD 3.41Å; P224-P226 VanDerWaalsContact C-N 3.33Å; P224-S227 WeakPolarHBondContact O-CA 3.39Å; P224-S227 VanDerWaalsContact O-CB 3.24Å; P224-S227 WeakPolarHBondContact O-CB 3.29Å; P224-S227 PolarHBondContact O-N 3.34Å
225	Y	83.3	Confident	89.3	Confident	80 Å²	80	45.8 Å²	45.8	31%	0.314	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-41.3	-176.4	-156.9	-84.3	0	0	0	114.9	H40 V223 S227 L268 K270	H40-Y225 AromaticContact CE1-CD1 3.24Å; H40-Y225 WeakPolarHBondContact CE1-CD1 3.46Å; H40-Y225 AromaticContact CE1-CE1 3.4Å; H40-Y225 VanDerWaalsContact CE1-CE1 3.4Å; H40-Y225 WeakPolarHBondContact CE1-CE1 3.41Å; H40-Y225 AromaticContact ND1-CD1 3.92Å; H40-Y225 AromaticContact NE2-CD1 3.39Å; H40-Y225 WeakPolarHBondContact NE2-CD1 3.39Å; H40-Y225 AromaticContact NE2-CE1 3.77Å; H40-Y225 AromaticContact NE2-CG 3.86Å; V223-Y225 PolarHBondContact O-N 3.3Å; Y225-S227 VanDerWaalsContact C-N 3.26Å; Y225-S227 PolarHBondContact O-N 3.3Å; Y225-L268 PolarHBondContact N-O 2.65Å; Y225-K270 HydrophobicContact CD2-CD 4.46Å; Y225-K270 HydrophobicContact CD2-CG 3.78Å; Y225-K270 HydrophobicContact CE2-CG 4.19Å; Y225-K270 HydrophobicContact CG-CG 4.49Å
226	P	82.6	Confident	89.6	Confident	28 Å²	28	51.1 Å²	51.1	18%	0.182	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.1	177.5	30	-34.3	0	0	0	114	R36 L37 P224 K228	R36-P226 HydrophobicContact CB-CB 3.88Å; R36-P226 HydrophobicContact CB-CG 4Å; L37-P226 HydrophobicContact CD2-CG 3.72Å; L37-P226 HydrophobicContact CG-CG 3.77Å; P224-P226 VanDerWaalsContact C-CD 3.41Å; P224-P226 VanDerWaalsContact C-N 3.33Å; P226-K228 PolarHBondContact O-N 3.17Å
227	S	86.1	Confident	89.8	Confident	30 Å²	30	51.3 Å²	51.3	21%	0.21	25%	0.248	C	C	.	.			trans	-81.5	85.7	-176.4	-170.6	0	0	0	0	112.1	P224 Y225 V229 G230 E231	P224-S227 WeakPolarHBondContact O-CA 3.39Å; P224-S227 VanDerWaalsContact O-CB 3.24Å; P224-S227 WeakPolarHBondContact O-CB 3.29Å; P224-S227 PolarHBondContact O-N 3.34Å; Y225-S227 VanDerWaalsContact C-N 3.26Å; Y225-S227 PolarHBondContact O-N 3.3Å; S227-V229 VanDerWaalsContact C-N 3.27Å; S227-V229 PolarHBondContact O-N 2.7Å; S227-G230 PolarHBondContact O-N 2.81Å; S227-G230 PolarHBondContact OG-N 2.87Å; S227-E231 WeakPolarHBondContact O-CB 3.25Å; S227-E231 PolarHBondContact O-N 2.97Å; S227-E231 VanDerWaalsContact O-N 3.09Å
228	K	88.4	Confident	90	Very high	136 Å²	136	44.7 Å²	44.7	59%	0.591	24%	0.237	S	C	*	.	H	α-helix	trans	-63.8	-32.5	172.7	-64.8	-58.9	-178.3	-178.2	0	113.5	P226 E231 A232	P226-K228 PolarHBondContact O-N 3.17Å; K228-E231 WeakPolarHBondContact CD-OE2 3.47Å; K228-E231 IonicContact NZ-OE2 2.8Å; K228-E231 PolarHBondContact NZ-OE2 2.89Å; K228-A232 WeakPolarHBondContact O-CB 3.23Å; K228-A232 PolarHBondContact O-N 3.46Å
229	V	88.8	Confident	90.2	Very high	119 Å²	119	44 Å²	44	72%	0.721	24%	0.235	S	C	*	.	H	α-helix	trans	-68.3	-44.9	177.7	179.6	0	0	0	0	110.6	S227 A232 F233	S227-V229 VanDerWaalsContact C-N 3.27Å; S227-V229 PolarHBondContact O-N 2.7Å; V229-A232 PolarHBondContact O-N 3.41Å; V229-F233 VanDerWaalsContact O-CB 3.26Å; V229-F233 WeakPolarHBondContact O-CB 3.4Å; V229-F233 PolarHBondContact O-N 3.29Å
230	G	89.2	Confident	90.2	Very high	13 Å²	13	50 Å²	50	13%	0.134	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-45.2	176.4	0	0	0	0	0	112	S227 A232 F233 F234	S227-G230 PolarHBondContact O-N 2.81Å; S227-G230 PolarHBondContact OG-N 2.87Å; G230-A232 PolarHBondContact O-N 2.93Å; G230-F233 WeakPolarHBondContact O-CB 3.32Å; G230-F233 PolarHBondContact O-N 2.81Å; G230-F234 WeakPolarHBondContact O-CD2 3.29Å; G230-F234 PolarHBondContact O-N 3.37Å
231	E	91.4	Very high	90.2	Very high	20 Å²	20	51.9 Å²	51.9	9%	0.093	27%	0.266	C	S	.	.	H	α-helix	trans	-56.7	-51.1	176	170.3	171.6	-160.4	0	0	111.7	S227 K228 F233 R235 K270 F272	S227-E231 WeakPolarHBondContact O-CB 3.25Å; S227-E231 PolarHBondContact O-N 2.97Å; S227-E231 VanDerWaalsContact O-N 3.09Å; K228-E231 WeakPolarHBondContact CD-OE2 3.47Å; K228-E231 IonicContact NZ-OE2 2.8Å; K228-E231 PolarHBondContact NZ-OE2 2.89Å; E231-F233 VanDerWaalsContact C-N 3.31Å; E231-F233 PolarHBondContact O-N 3.24Å; E231-R235 WeakPolarHBondContact O-CB 3Å; E231-R235 WeakPolarHBondContact O-CG 2.91Å; E231-R235 PolarHBondContact O-N 2.79Å; E231-R235 VanDerWaalsContact O-N 3.14Å; E231-R235 IonicContact OE1-CZ 2.74Å; E231-R235 IonicContact OE1-NH2 3.84Å; E231-R235 PolarHBondContact OE1-NH2 2.71Å; E231-K270 IonicContact OE1-NZ 2.85Å; E231-K270 PolarHBondContact OE1-NZ 3.19Å; E231-K270 IonicContact OE2-NZ 3.28Å; E231-K270 PolarHBondContact OE2-NZ 3.41Å; E231-F272 HydrophobicContact CB-CZ 4.27Å; E231-F272 HydrophobicContact CG-CZ 4.06Å
232	A	93.2	Very high	89.9	Confident	60 Å²	60	53.7 Å²	53.7	50%	0.496	28%	0.276	S	S	.	.	H	α-helix	trans	-63.8	-37.3	177.8	0	0	0	0	0	112.5	K228 V229 G230 K236	K228-A232 WeakPolarHBondContact O-CB 3.23Å; K228-A232 PolarHBondContact O-N 3.46Å; V229-A232 PolarHBondContact O-N 3.41Å; G230-A232 PolarHBondContact O-N 2.93Å; A232-K236 VanDerWaalsContact O-CB 3.28Å; A232-K236 WeakPolarHBondContact O-CB 3.47Å; A232-K236 PolarHBondContact O-N 2.82Å; A232-K236 VanDerWaalsContact O-N 3.07Å
233	F	94.1	Very high	89.4	Confident	51 Å²	51	56.9 Å²	56.9	22%	0.224	31%	0.312	C	S	.	.	H	α-helix	trans	-63.2	-54.8	177.9	170	-94.6	0	0	0	111.7	L188 G200 V204 V229 G230 E231 R235 K236 V237	L188-F233 HydrophobicContact CD2-CD1 4.07Å; L188-F233 HydrophobicContact CD2-CE1 3.26Å; L188-F233 HydrophobicContact CD2-CZ 3.55Å; G200-F233 WeakPolarHBondContact O-CZ 3.23Å; V204-F233 HydrophobicContact CG2-CE1 4.04Å; V204-F233 HydrophobicContact CG2-CZ 4.01Å; V229-F233 VanDerWaalsContact O-CB 3.26Å; V229-F233 WeakPolarHBondContact O-CB 3.4Å; V229-F233 PolarHBondContact O-N 3.29Å; G230-F233 WeakPolarHBondContact O-CB 3.32Å; G230-F233 PolarHBondContact O-N 2.81Å; E231-F233 VanDerWaalsContact C-N 3.31Å; E231-F233 PolarHBondContact O-N 3.24Å; F233-R235 PolarHBondContact O-N 3.41Å; F233-K236 PolarHBondContact O-N 3.47Å; F233-K236 VanDerWaalsContact O-N 3.07Å; F233-V237 HydrophobicContact CD2-CG2 4.3Å; F233-V237 HydrophobicContact CE1-CG2 4.06Å; F233-V237 HydrophobicContact CE2-CG2 3.83Å; F233-V237 HydrophobicContact CZ-CG2 3.69Å; F233-V237 WeakPolarHBondContact O-CG2 3.37Å; F233-V237 PolarHBondContact O-N 3.32Å
234	F	94.3	Very high	88.7	Confident	16 Å²	16	61.8 Å²	61.8	7%	0.07	34%	0.335	C	S	.	.	H	α-helix	trans	-64.8	-39.3	-176.5	-82.1	-71.9	0	0	0	111.9	L188 A221 V223 G230 K236 V237 G238 Y239 F272	L188-F234 HydrophobicContact CD2-CZ 4.35Å; A221-F234 HydrophobicContact CB-CD1 3.87Å; A221-F234 HydrophobicContact CB-CE1 3.4Å; A221-F234 VanDerWaalsContact CB-CE1 3.4Å; A221-F234 HydrophobicContact CB-CE2 4.1Å; A221-F234 HydrophobicContact CB-CG 4.41Å; A221-F234 HydrophobicContact CB-CZ 3.53Å; V223-F234 HydrophobicContact CG2-CD2 3.35Å; V223-F234 HydrophobicContact CG2-CE2 3.65Å; V223-F234 HydrophobicContact CG2-CG 4.28Å; G230-F234 WeakPolarHBondContact O-CD2 3.29Å; G230-F234 PolarHBondContact O-N 3.37Å; F234-K236 VanDerWaalsContact C-N 3.33Å; F234-K236 PolarHBondContact O-N 2.87Å; F234-V237 PolarHBondContact O-N 3.35Å; F234-V237 VanDerWaalsContact O-N 3.15Å; F234-G238 PolarHBondContact O-N 2.91Å; F234-Y239 HydrophobicContact CB-CG 4.29Å; F234-Y239 HydrophobicContact CD1-CD1 4.05Å; F234-Y239 AromaticContact CD1-CD2 3.75Å; F234-Y239 HydrophobicContact CD1-CD2 3.75Å; F234-Y239 HydrophobicContact CD1-CE1 4.24Å; F234-Y239 AromaticContact CD1-CE2 3.95Å; F234-Y239 HydrophobicContact CD1-CE2 3.95Å; F234-Y239 AromaticContact CD1-CG 3.84Å; F234-Y239 HydrophobicContact CD1-CG 3.84Å; F234-Y239 HydrophobicContact CE1-CE1 4.45Å; F234-Y239 HydrophobicContact CE1-CE2 4.38Å; F234-Y239 WeakPolarHBondContact O-CB 3.46Å; F234-Y239 PolarHBondContact O-N 3.4Å; F234-F272 HydrophobicContact CB-CB 4.43Å; F234-F272 HydrophobicContact CB-CD1 4.11Å; F234-F272 HydrophobicContact CB-CG 4.15Å
235	R	94.3	Very high	87.3	Confident	107 Å²	107	63.4 Å²	63.4	40%	0.404	35%	0.35	S	S	.	.	H	α-helix	trans	-57.1	-44.8	170.4	-72.1	-179.6	178.8	-163.3	-3.2	112	E231 F233 V237 G238 E244 F272	E231-R235 WeakPolarHBondContact O-CB 3Å; E231-R235 WeakPolarHBondContact O-CG 2.91Å; E231-R235 PolarHBondContact O-N 2.79Å; E231-R235 VanDerWaalsContact O-N 3.14Å; E231-R235 IonicContact OE1-CZ 2.74Å; E231-R235 IonicContact OE1-NH2 3.84Å; E231-R235 PolarHBondContact OE1-NH2 2.71Å; F233-R235 PolarHBondContact O-N 3.41Å; R235-V237 VanDerWaalsContact C-N 3.26Å; R235-V237 PolarHBondContact O-N 2.95Å; R235-G238 PolarHBondContact O-N 3.45Å; R235-G238 VanDerWaalsContact O-N 3.09Å; R235-E244 IonicContact CZ-OE1 3.41Å; R235-E244 IonicContact CZ-OE2 2.9Å; R235-E244 IonicContact NE-OE2 3.39Å; R235-E244 IonicContact NH1-OE1 2.93Å; R235-E244 IonicContact NH2-OE1 3.38Å; R235-E244 PolarHBondContact NH2-OE1 3.21Å; R235-E244 IonicContact NH2-OE2 2.75Å; R235-E244 PolarHBondContact NH2-OE2 3.25Å; R235-F272 HydrophobicContact CG-CE1 3.95Å
236	K	94.4	Very high	85.5	Confident	162 Å²	162	64.3 Å²	64.3	70%	0.704	37%	0.374	S	S	*	.	H	α-helix	trans	-69.9	-19.5	179.2	-165.2	179.9	178.8	175.1	0	113.9	R201 A232 F233 F234	R201-K236 PolarHBondContact NH2-O 3.2Å; A232-K236 VanDerWaalsContact O-CB 3.28Å; A232-K236 WeakPolarHBondContact O-CB 3.47Å; A232-K236 PolarHBondContact O-N 2.82Å; A232-K236 VanDerWaalsContact O-N 3.07Å; F233-K236 PolarHBondContact O-N 3.47Å; F233-K236 VanDerWaalsContact O-N 3.07Å; F234-K236 VanDerWaalsContact C-N 3.33Å; F234-K236 PolarHBondContact O-N 2.87Å
237	V	93.4	Very high	83.9	Confident	9 Å²	9	69.2 Å²	69.2	6%	0.055	40%	0.399	C	S	.	.	H	α-helix	trans	-89.4	-7.8	174.2	179.3	0	0	0	0	111.6	V204 F233 F234 R235 Y239 K274	V204-V237 HydrophobicContact CG1-CG1 3.91Å; F233-V237 HydrophobicContact CD2-CG2 4.3Å; F233-V237 HydrophobicContact CE1-CG2 4.06Å; F233-V237 HydrophobicContact CE2-CG2 3.83Å; F233-V237 HydrophobicContact CZ-CG2 3.69Å; F233-V237 WeakPolarHBondContact O-CG2 3.37Å; F233-V237 PolarHBondContact O-N 3.32Å; F234-V237 PolarHBondContact O-N 3.35Å; F234-V237 VanDerWaalsContact O-N 3.15Å; R235-V237 VanDerWaalsContact C-N 3.26Å; R235-V237 PolarHBondContact O-N 2.95Å; V237-Y239 HydrophobicContact CB-CD2 4.29Å; V237-Y239 HydrophobicContact CB-CE2 4.48Å; V237-Y239 HydrophobicContact CG1-CD2 4.23Å; V237-Y239 HydrophobicContact CG1-CE2 3.96Å; V237-K274 PolarHBondContact O-NZ 3.4Å
238	G	93.3	Very high	82	Confident	45 Å²	45	76.8 Å²	76.8	46%	0.464	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.1	14.7	174.7	0	0	0	0	0	114.5	F234 R235	F234-G238 PolarHBondContact O-N 2.91Å; R235-G238 PolarHBondContact O-N 3.45Å; R235-G238 VanDerWaalsContact O-N 3.09Å
239	Y	93.9	Very high	80	Confident	6 Å²	6	78.6 Å²	78.6	2%	0.024	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-80.4	143.7	173.8	-71.3	-115.4	0	0	0	110.8	V204 E208 V219 A221 F234 V237 F272 Y273 K274	V204-Y239 HydrophobicContact CG1-CE2 4.03Å; E208-Y239 WeakPolarHBondContact OE1-CE2 3.46Å; E208-Y239 VanDerWaalsContact OE1-CZ 3.25Å; E208-Y239 PolarHBondContact OE1-OH 3.17Å; V219-Y239 HydrophobicContact CB-CE1 4.46Å; V219-Y239 HydrophobicContact CG1-CE1 4.24Å; V219-Y239 WeakPolarHBondContact CG1-OH 3.35Å; A221-Y239 HydrophobicContact CB-CD1 4.4Å; A221-Y239 HydrophobicContact CB-CE1 4.21Å; F234-Y239 HydrophobicContact CB-CG 4.29Å; F234-Y239 HydrophobicContact CD1-CD1 4.05Å; F234-Y239 AromaticContact CD1-CD2 3.75Å; F234-Y239 HydrophobicContact CD1-CD2 3.75Å; F234-Y239 HydrophobicContact CD1-CE1 4.24Å; F234-Y239 AromaticContact CD1-CE2 3.95Å; F234-Y239 HydrophobicContact CD1-CE2 3.95Å; F234-Y239 AromaticContact CD1-CG 3.84Å; F234-Y239 HydrophobicContact CD1-CG 3.84Å; F234-Y239 HydrophobicContact CE1-CE1 4.45Å; F234-Y239 HydrophobicContact CE1-CE2 4.38Å; F234-Y239 WeakPolarHBondContact O-CB 3.46Å; F234-Y239 PolarHBondContact O-N 3.4Å; V237-Y239 HydrophobicContact CB-CD2 4.29Å; V237-Y239 HydrophobicContact CB-CE2 4.48Å; V237-Y239 HydrophobicContact CG1-CD2 4.23Å; V237-Y239 HydrophobicContact CG1-CE2 3.96Å; Y239-F272 HydrophobicContact CD1-CB 4.07Å; Y239-F272 HydrophobicContact CG-CB 4.42Å; Y239-Y273 CarbonylContact C-O 3.57Å; Y239-Y273 VanDerWaalsContact CA-O 3.31Å; Y239-Y273 WeakPolarHBondContact CA-O 3.42Å; Y239-K274 HydrophobicContact CD1-CB 3.75Å; Y239-K274 HydrophobicContact CD2-CB 4.01Å; Y239-K274 HydrophobicContact CD2-CD 3.93Å; Y239-K274 HydrophobicContact CE1-CB 3.77Å; Y239-K274 HydrophobicContact CE2-CB 4.02Å; Y239-K274 HydrophobicContact CE2-CD 3.7Å; Y239-K274 HydrophobicContact CG-CB 3.85Å
240	R	92.2	Very high	78	Confident	124 Å²	124	77.9 Å²	77.9	47%	0.468	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	141.2	172.9	-65.6	-175.1	-80.2	179.8	-3.5	109.6	F272 Y273 D275	R240-F272 CarbonylContact O-C 3.49Å; R240-F272 VanDerWaalsContact O-CA 3.25Å; R240-F272 WeakPolarHBondContact O-CA 3.37Å; R240-Y273 HydrophobicContact CB-CD1 4.38Å; R240-Y273 HydrophobicContact CB-CE1 3.86Å; R240-Y273 HydrophobicContact CB-CE2 4.37Å; R240-Y273 PolarHBondContact N-O 3.04Å; R240-Y273 PolarHBondContact NE-OH 2.89Å; R240-Y273 WeakPolarHBondContact O-CD1 3.47Å; R240-Y273 PolarHBondContact O-N 2.67Å; R240-D275 IonicContact CZ-OD2 3.97Å; R240-D275 IonicContact NH2-OD2 3.98Å; R240-D275 PolarHBondContact NH2-OD2 2.99Å
241	Q	90.6	Very high	76.3	Confident	42 Å²	42	81.7 Å²	81.7	20%	0.196	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.6	173.5	-163.7	-173	-67.7	0	0	109.1	G243 E244 F272	Q241-G243 PolarHBondContact O-N 3.18Å; Q241-E244 HydrophobicContact CB-CB 4.03Å; Q241-E244 VanDerWaalsContact CB-OE2 3.22Å; Q241-E244 WeakPolarHBondContact CB-OE2 3.42Å; Q241-E244 PolarHBondContact O-N 3.46Å; Q241-F272 HydrophobicContact CB-CD1 4.1Å; Q241-F272 HydrophobicContact CB-CE1 3.68Å; Q241-F272 HydrophobicContact CB-CZ 4.02Å; Q241-F272 HydrophobicContact CG-CE1 4.04Å; Q241-F272 HydrophobicContact CG-CE2 4.22Å; Q241-F272 HydrophobicContact CG-CZ 3.87Å
242	L	85.3	Confident	74.4	Confident	40 Å²	40	86.5 Å²	86.5	21%	0.209	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	132	173.6	-165.6	70.1	0	0	0	109.6	M254 E257 V271 Y273	L242-M254 HydrophobicContact CD1-CB 4.36Å; L242-M254 HydrophobicContact CD1-CG 4.34Å; L242-M254 HydrophobicContact CD1-SD 4.17Å; L242-E257 VanDerWaalsContact CD2-O 3.27Å; L242-E257 WeakPolarHBondContact CD2-O 3.28Å; L242-V271 HydrophobicContact CB-CB 4.01Å; L242-V271 HydrophobicContact CB-CG1 4.23Å; L242-V271 HydrophobicContact CD2-CB 4.17Å; L242-V271 HydrophobicContact CD2-CG1 4.12Å; L242-V271 PolarHBondContact N-O 3.43Å; L242-Y273 HydrophobicContact CB-CD1 4.38Å; L242-Y273 HydrophobicContact CD1-CD1 4.07Å; L242-Y273 HydrophobicContact CD1-CE1 4.09Å
243	G	76.6	Confident	72.5	Confident	80 Å²	80	87.5 Å²	87.5	83%	0.825	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	7.8	-178.8	0	0	0	0	0	116.1	Q241	Q241-G243 PolarHBondContact O-N 3.18Å
244	E	72.2	Confident	70.5	Confident	107 Å²	107	87 Å²	87	50%	0.5	47%	0.47	S	S	.	.	S	Bend	trans	-95.3	-20.9	173.6	-169	170.6	-162.6	0	0	113	R235 Q241	R235-E244 IonicContact CZ-OE1 3.41Å; R235-E244 IonicContact CZ-OE2 2.9Å; R235-E244 IonicContact NE-OE2 3.39Å; R235-E244 IonicContact NH1-OE1 2.93Å; R235-E244 IonicContact NH2-OE1 3.38Å; R235-E244 PolarHBondContact NH2-OE1 3.21Å; R235-E244 IonicContact NH2-OE2 2.75Å; R235-E244 PolarHBondContact NH2-OE2 3.25Å; Q241-E244 HydrophobicContact CB-CB 4.03Å; Q241-E244 VanDerWaalsContact CB-OE2 3.22Å; Q241-E244 WeakPolarHBondContact CB-OE2 3.42Å; Q241-E244 PolarHBondContact O-N 3.46Å
245	A	54.6	Low	68.6	Low	57 Å²	57	91.6 Å²	91.6	47%	0.471	49%	0.49	S	S	.	.			trans	-92.4	128	172.5	0	0	0	0	0	109.8	D247	A245-D247 PolarHBondContact O-N 2.84Å
246	A	46.8	Very low	67.2	Low	99 Å²	99	90.5 Å²	90.5	82%	0.818	49%	0.493	S	S	*	.			trans	-80.3	26.4	172.4	0	0	0	0	0	112.1	E248	A246-E248 PolarHBondContact O-N 2.89Å
247	D	47.9	Very low	66.2	Low	130 Å²	130	83.2 Å²	83.2	70%	0.695	46%	0.461	S	S	*	.			trans	-85.9	108.6	-179.4	-68.7	-30	0	0	0	108.3	A245 E249	A245-D247 PolarHBondContact O-N 2.84Å; D247-E249 PolarHBondContact O-N 3.37Å
248	E	46.4	Very low	65.3	Low	189 Å²	189	86.8 Å²	86.8	88%	0.883	48%	0.483	S	S	*	.			trans	-69.4	20.6	-178.2	-62.2	-180	157.2	0	0	114.1	A246 D250	A246-E248 PolarHBondContact O-N 2.89Å; E248-D250 VanDerWaalsContact C-N 3.26Å; E248-D250 PolarHBondContact O-N 3.45Å
249	E	46.9	Very low	64.6	Low	175 Å²	175	86.6 Å²	86.6	82%	0.818	47%	0.473	S	S	*	.			trans	-93	72	170.2	-71.6	-174.6	-179.8	0	0	108.7	D247 D251	D247-E249 PolarHBondContact O-N 3.37Å; E249-D251 PolarHBondContact O-N 3.19Å
250	D	47.1	Very low	63.7	Low	103 Å²	103	87.9 Å²	87.9	55%	0.551	48%	0.48	S	S	*	.			trans	-61.9	79.7	172.5	-102.5	-12	0	0	0	110.1	E248 D252 K255	E248-D250 VanDerWaalsContact C-N 3.26Å; E248-D250 PolarHBondContact O-N 3.45Å; D250-D252 PolarHBondContact O-N 3.35Å; D250-K255 WeakPolarHBondContact OD2-CE 3.38Å; D250-K255 IonicContact OD2-NZ 3.75Å; D250-K255 PolarHBondContact OD2-NZ 3.45Å
251	D	53.2	Low	62.8	Low	93 Å²	93	90.5 Å²	90.5	50%	0.497	49%	0.489	S	S	.	.			trans	-55.8	124.8	161.4	-98.2	-21.1	0	0	0	107.9	R218 E249 E253 M254	R218-D251 IonicContact NH2-OD2 2.9Å; E249-D251 PolarHBondContact O-N 3.19Å; D251-E253 PolarHBondContact O-N 3.39Å; D251-M254 HydrophobicContact CB-CG 4.31Å; D251-M254 WeakPolarHBondContact O-CB 3.32Å; D251-M254 PolarHBondContact O-N 2.92Å
252	D	52.6	Low	61.7	Low	121 Å²	121	89.4 Å²	89.4	65%	0.647	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-21.3	177.2	-74.8	-42.1	0	0	0	112.6	D250 N256	D250-D252 PolarHBondContact O-N 3.35Å; D252-N256 PolarHBondContact O-ND2 2.88Å
253	E	52	Low	60.8	Low	81 Å²	81	95.2 Å²	95.2	38%	0.379	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-31.3	171.2	-74.2	-167.6	160.7	0	0	114	S181 D251 K255 N256	S181-E253 PolarHBondContact OG-OE1 2.93Å; D251-E253 PolarHBondContact O-N 3.39Å; E253-K255 VanDerWaalsContact C-N 3.31Å; E253-N256 PolarHBondContact O-N 2.9Å
254	M	52.3	Low	60.4	Low	40 Å²	40	94.4 Å²	94.4	20%	0.197	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-67.8	-30.9	175	-80.4	-160.6	-174.7	0	0	112.2	L242 D251 N256 Y273	L242-M254 HydrophobicContact CD1-CB 4.36Å; L242-M254 HydrophobicContact CD1-CG 4.34Å; L242-M254 HydrophobicContact CD1-SD 4.17Å; D251-M254 HydrophobicContact CB-CG 4.31Å; D251-M254 WeakPolarHBondContact O-CB 3.32Å; D251-M254 PolarHBondContact O-N 2.92Å; M254-N256 PolarHBondContact O-N 3.24Å; M254-Y273 HydrophobicContact CE-CE1 4.17Å; M254-Y273 HydrophobicContact CE-CE2 3.69Å; M254-Y273 VanDerWaalsContact CE-CZ 3.45Å; M254-Y273 VanDerWaalsContact CE-OH 3.26Å; M254-Y273 WeakPolarHBondContact CE-OH 3.4Å
255	K	55.1	Low	60.3	Low	114 Å²	114	91 Å²	91	50%	0.496	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-67.2	-16.6	177.6	-75.6	174.7	176.7	155	0	113.6	D250 E253	D250-K255 WeakPolarHBondContact OD2-CE 3.38Å; D250-K255 IonicContact OD2-NZ 3.75Å; D250-K255 PolarHBondContact OD2-NZ 3.45Å; E253-K255 VanDerWaalsContact C-N 3.31Å
256	N	63.6	Low	61.2	Low	84 Å²	84	90.4 Å²	90.4	45%	0.449	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-93.9	-14	-169.5	-66.6	-32.5	0	0	0	114.1	R179 D252 E253 M254	R179-N256 VanDerWaalsContact CZ-CB 3.45Å; R179-N256 PolarHBondContact NH1-O 3.35Å; R179-N256 PolarHBondContact NH2-O 2.99Å; D252-N256 PolarHBondContact O-ND2 2.88Å; E253-N256 PolarHBondContact O-N 2.9Å; M254-N256 PolarHBondContact O-N 3.24Å
257	E	74.4	Confident	62.6	Low	9 Å²	9	87.9 Å²	87.9	4%	0.042	44%	0.443	C	S	.	.			trans	-101.3	118.4	174.4	-170.9	58.2	-97.5	0	0	110.3	R184 Y220 H222 L242 V271	R184-E257 IonicContact CZ-OE1 3.81Å; R184-E257 IonicContact CZ-OE2 3.4Å; R184-E257 IonicContact NE-OE2 3.66Å; R184-E257 PolarHBondContact NE-OE2 3.42Å; R184-E257 IonicContact NH2-OE1 3.81Å; R184-E257 PolarHBondContact NH2-OE1 3.49Å; R184-E257 IonicContact NH2-OE2 2.68Å; R184-E257 PolarHBondContact NH2-OE2 3.01Å; Y220-E257 HydrophobicContact CD1-CB 4.1Å; Y220-E257 HydrophobicContact CD1-CG 3.85Å; Y220-E257 HydrophobicContact CE1-CB 3.9Å; Y220-E257 HydrophobicContact CE1-CG 4.19Å; Y220-E257 HydrophobicContact CG-CG 4.1Å; H222-E257 IonicContact CE1-OE1 3.58Å; H222-E257 PolarHBondContact CE1-OE1 2.83Å; H222-E257 IonicContact NE2-OE1 3.66Å; H222-E257 PolarHBondContact NE2-OE1 3.1Å; H222-E257 IonicContact NE2-OE2 3.77Å; L242-E257 VanDerWaalsContact CD2-O 3.27Å; L242-E257 WeakPolarHBondContact CD2-O 3.28Å; E257-V271 HydrophobicContact CG-CG1 3.72Å; E257-V271 HydrophobicContact CG-CG2 4.47Å
258	T	75.4	Confident	64.1	Low	83 Å²	83	82 Å²	82	51%	0.509	41%	0.412	S	S	.	.			trans	-118.2	141.7	-173.7	59.6	0	0	0	0	111.1	E260	T258-E260 PolarHBondContact O-N 3.33Å
259	P	78.3	Confident	65.9	Low	41 Å²	41	73.1 Å²	73.1	27%	0.266	37%	0.37	S	S	.	.			trans	-50.8	138.4	168.4	-26.7	34.3	0	0	0	111.5	R261 P267 T269 V271	P259-R261 PolarHBondContact O-N 2.88Å; P259-P267 HydrophobicContact CB-CB 3.71Å; P259-P267 HydrophobicContact CG-CB 4.47Å; P259-T269 WeakPolarHBondContact CB-O 3.41Å; P259-V271 HydrophobicContact CB-CG2 4.44Å; P259-V271 HydrophobicContact CG-CG2 4.07Å
260	E	73.7	Confident	67.8	Low	34 Å²	34	65.7 Å²	65.7	16%	0.159	34%	0.335	C	S	.	.			trans	-62.3	133.1	171.2	-68.6	-173	141.9	0	0	109.4	L91 G92 S93 T258 P267 L268 T269	L91-E260 WeakPolarHBondContact CA-OE2 3.27Å; G92-E260 WeakPolarHBondContact CA-OE1 3.47Å; G92-E260 PolarHBondContact N-OE1 2.76Å; G92-E260 PolarHBondContact N-OE2 3.25Å; S93-E260 PolarHBondContact N-OE1 3.16Å; T258-E260 PolarHBondContact O-N 3.33Å; E260-P267 CarbonylContact O-C 3.51Å; E260-P267 VanDerWaalsContact O-CA 3.32Å; E260-P267 WeakPolarHBondContact O-CA 3.18Å; E260-L268 PolarHBondContact O-N 3.27Å; E260-T269 HydrophobicContact CB-CG2 4.47Å; E260-T269 PolarHBondContact N-OG1 2.82Å
261	R	73.4	Confident	69.8	Low	178 Å²	178	60.9 Å²	60.9	67%	0.672	31%	0.31	S	S	*	.	B	Isolated β-bridge	trans	-107.8	135.7	-177.7	-65.9	-178	178.5	-166.2	1	111.1	P259 G265 Y266	P259-R261 PolarHBondContact O-N 2.88Å; R261-G265 VanDerWaalsContact CD-O 3.29Å; R261-G265 WeakPolarHBondContact CD-O 3.47Å; R261-G265 WeakPolarHBondContact CG-O 3.34Å; R261-Y266 CarbonylContact C-O 3.54Å; R261-Y266 VanDerWaalsContact CA-O 3.27Å; R261-Y266 WeakPolarHBondContact CA-O 3.41Å
262	G	68.5	Low	71.6	Confident	19 Å²	19	56.5 Å²	56.5	20%	0.196	29%	0.286	C	S	.	.			trans	-79.7	-175	174.4	0	0	0	0	0	112.7	M264 G265 Y266	G262-M264 PolarHBondContact O-N 3.3Å; G262-G265 PolarHBondContact O-N 2.9Å; G262-Y266 PolarHBondContact N-O 3.38Å
263	F	66.1	Low	73.5	Confident	163 Å²	163	51.2 Å²	51.2	72%	0.715	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-23.9	-175.7	177.2	-106.8	0	0	0	115.6	F79	F79-F263 HydrophobicContact CE1-CD1 4.19Å; F79-F263 HydrophobicContact CE1-CD2 4.17Å; F79-F263 HydrophobicContact CE1-CE1 4.4Å; F79-F263 HydrophobicContact CE1-CE2 4.36Å; F79-F263 HydrophobicContact CE1-CG 4.08Å; F79-F263 HydrophobicContact CE1-CZ 4.48Å; F79-F263 HydrophobicContact CZ-CD2 4.06Å; F79-F263 AromaticContact CZ-CE2 3.98Å; F79-F263 HydrophobicContact CZ-CE2 3.98Å; F79-F263 HydrophobicContact CZ-CG 4.44Å; F79-F263 HydrophobicContact CZ-CZ 4.3Å
264	M	67.7	Low	75.4	Confident	62 Å²	62	49.4 Å²	49.4	31%	0.305	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	18.5	179.8	-62.3	177.6	68.5	0	0	113.2	L46 C47 I50 G262 Y266	L46-M264 HydrophobicContact CB-CE 4.37Å; C47-M264 HydrophobicContact CB-SD 4.4Å; I50-M264 HydrophobicContact CD1-CE 3.3Å; I50-M264 HydrophobicContact CD1-SD 4.38Å; G262-M264 PolarHBondContact O-N 3.3Å; M264-Y266 HydrophobicContact CB-CD2 3.6Å; M264-Y266 HydrophobicContact CB-CE2 3.39Å; M264-Y266 HydrophobicContact CE-CE2 3.88Å; M264-Y266 HydrophobicContact CG-CE2 4.24Å; M264-Y266 PolarHBondContact O-N 3.41Å; M264-Y266 HydrophobicContact SD-CE2 3.9Å
265	G	70.6	Confident	77.2	Confident	35 Å²	35	50.5 Å²	50.5	36%	0.361	26%	0.255	S	S	.	.	S	Bend	trans	77.2	1.8	-177.1	0	0	0	0	0	114.7	R261 G262	R261-G265 VanDerWaalsContact CD-O 3.29Å; R261-G265 WeakPolarHBondContact CD-O 3.47Å; R261-G265 WeakPolarHBondContact CG-O 3.34Å; G262-G265 PolarHBondContact O-N 2.9Å
266	Y	73.7	Confident	78.8	Confident	46 Å²	46	47.8 Å²	47.8	18%	0.18	25%	0.246	C	C	.	.			trans	-72.6	136.6	178.8	-65	-60.4	0	0	0	112.3	L46 R261 G262 M264 L268	L46-Y266 WeakPolarHBondContact CB-OH 3.38Å; L46-Y266 WeakPolarHBondContact CD1-OH 3.41Å; R261-Y266 CarbonylContact C-O 3.54Å; R261-Y266 VanDerWaalsContact CA-O 3.27Å; R261-Y266 WeakPolarHBondContact CA-O 3.41Å; G262-Y266 PolarHBondContact N-O 3.38Å; M264-Y266 HydrophobicContact CB-CD2 3.6Å; M264-Y266 HydrophobicContact CB-CE2 3.39Å; M264-Y266 HydrophobicContact CE-CE2 3.88Å; M264-Y266 HydrophobicContact CG-CE2 4.24Å; M264-Y266 PolarHBondContact O-N 3.41Å; M264-Y266 HydrophobicContact SD-CE2 3.9Å; Y266-L268 PolarHBondContact O-N 3.3Å
267	P	76	Confident	79.5	Confident	45 Å²	45	46 Å²	46	29%	0.292	24%	0.235	S	C	.	.	B	Isolated β-bridge	trans	-63.5	123.5	173.7	27.7	-33.7	0	0	0	110.4	P259 E260	P259-P267 HydrophobicContact CB-CB 3.71Å; P259-P267 HydrophobicContact CG-CB 4.47Å; E260-P267 CarbonylContact O-C 3.51Å; E260-P267 VanDerWaalsContact O-CA 3.32Å; E260-P267 WeakPolarHBondContact O-CA 3.18Å
268	L	78.5	Confident	79.8	Confident	8 Å²	8	47.9 Å²	47.9	4%	0.042	25%	0.246	C	C	.	.	S	Bend	trans	-88.2	-22.7	172.8	-59	-178.2	0	0	0	111.6	I41 T88 L91 Y225 E260 Y266	I41-L268 HydrophobicContact CD1-CD2 3.73Å; I41-L268 HydrophobicContact CG1-CD2 4.3Å; T88-L268 HydrophobicContact CG2-CD1 3.78Å; L91-L268 HydrophobicContact CD2-CB 4.3Å; Y225-L268 PolarHBondContact N-O 2.65Å; E260-L268 PolarHBondContact O-N 3.27Å; Y266-L268 PolarHBondContact O-N 3.3Å
269	T	84.1	Confident	80	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	157	-179.6	50.7	0	0	0	0	111.5	L91 H222 V223 P259 E260	L91-T269 HydrophobicContact CB-CG2 3.9Å; L91-T269 HydrophobicContact CD2-CG2 3.4Å; L91-T269 VanDerWaalsContact CD2-CG2 3.4Å; L91-T269 HydrophobicContact CG-CG2 4.26Å; H222-T269 HydrophobicContact CB-CG2 4.18Å; V223-T269 CarbonylContact O-C 3.5Å; V223-T269 WeakPolarHBondContact O-CA 3.32Å; P259-T269 WeakPolarHBondContact CB-O 3.41Å; E260-T269 HydrophobicContact CB-CG2 4.47Å; E260-T269 PolarHBondContact N-OG1 2.82Å
270	K	87.1	Confident	80.1	Confident	19 Å²	19	46.2 Å²	46.2	8%	0.083	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	134.9	162.7	-63.7	176.1	172.9	-164	0	106.8	V223 Y225 E231 F272	V223-K270 PolarHBondContact N-O 2.97Å; V223-K270 PolarHBondContact O-N 3.46Å; Y225-K270 HydrophobicContact CD2-CD 4.46Å; Y225-K270 HydrophobicContact CD2-CG 3.78Å; Y225-K270 HydrophobicContact CE2-CG 4.19Å; Y225-K270 HydrophobicContact CG-CG 4.49Å; E231-K270 IonicContact OE1-NZ 2.85Å; E231-K270 PolarHBondContact OE1-NZ 3.19Å; E231-K270 IonicContact OE2-NZ 3.28Å; E231-K270 PolarHBondContact OE2-NZ 3.41Å; K270-F272 HydrophobicContact CB-CD2 4.33Å; K270-F272 HydrophobicContact CB-CE2 3.75Å; K270-F272 HydrophobicContact CD-CE2 4.36Å
271	V	89	Confident	80.5	Confident	3 Å²	3	47 Å²	47	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128.5	177.1	-178.4	0	0	0	0	108.5	Y220 L242 E257 P259	Y220-V271 HydrophobicContact CD1-CG1 3.95Å; L242-V271 HydrophobicContact CB-CB 4.01Å; L242-V271 HydrophobicContact CB-CG1 4.23Å; L242-V271 HydrophobicContact CD2-CB 4.17Å; L242-V271 HydrophobicContact CD2-CG1 4.12Å; L242-V271 PolarHBondContact N-O 3.43Å; E257-V271 HydrophobicContact CG-CG1 3.72Å; E257-V271 HydrophobicContact CG-CG2 4.47Å; P259-V271 HydrophobicContact CB-CG2 4.44Å; P259-V271 HydrophobicContact CG-CG2 4.07Å
272	F	91.6	Very high	81	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.6	172.8	-76.3	-92.4	0	0	0	108.8	Y220 A221 V223 E231 F234 R235 Y239 R240 Q241 K270	Y220-F272 CarbonylContact C-O 3.59Å; Y220-F272 VanDerWaalsContact CA-O 3.28Å; Y220-F272 WeakPolarHBondContact CA-O 3.28Å; A221-F272 HydrophobicContact CB-CB 4.37Å; A221-F272 PolarHBondContact N-O 3.1Å; A221-F272 PolarHBondContact O-N 3.32Å; V223-F272 HydrophobicContact CB-CD2 3.97Å; V223-F272 HydrophobicContact CB-CE2 3.91Å; V223-F272 HydrophobicContact CG2-CD2 3.51Å; V223-F272 HydrophobicContact CG2-CE2 3.83Å; V223-F272 HydrophobicContact CG2-CG 4.44Å; E231-F272 HydrophobicContact CB-CZ 4.27Å; E231-F272 HydrophobicContact CG-CZ 4.06Å; F234-F272 HydrophobicContact CB-CB 4.43Å; F234-F272 HydrophobicContact CB-CD1 4.11Å; F234-F272 HydrophobicContact CB-CG 4.15Å; R235-F272 HydrophobicContact CG-CE1 3.95Å; Y239-F272 HydrophobicContact CD1-CB 4.07Å; Y239-F272 HydrophobicContact CG-CB 4.42Å; R240-F272 CarbonylContact O-C 3.49Å; R240-F272 VanDerWaalsContact O-CA 3.25Å; R240-F272 WeakPolarHBondContact O-CA 3.37Å; Q241-F272 HydrophobicContact CB-CD1 4.1Å; Q241-F272 HydrophobicContact CB-CE1 3.68Å; Q241-F272 HydrophobicContact CB-CZ 4.02Å; Q241-F272 HydrophobicContact CG-CE1 4.04Å; Q241-F272 HydrophobicContact CG-CE2 4.22Å; Q241-F272 HydrophobicContact CG-CZ 3.87Å; K270-F272 HydrophobicContact CB-CD2 4.33Å; K270-F272 HydrophobicContact CB-CE2 3.75Å; K270-F272 HydrophobicContact CD-CE2 4.36Å
273	Y	92	Very high	81.9	Confident	10 Å²	10	39.6 Å²	39.6	4%	0.039	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	154.6	176.7	74.1	-87	0	0	0	112	V219 Y220 Y239 R240 L242 M254	V219-Y273 CarbonylContact O-C 3.46Å; V219-Y273 VanDerWaalsContact O-CA 3.24Å; V219-Y273 WeakPolarHBondContact O-CA 3.35Å; Y220-Y273 HydrophobicContact CE1-CG 4.45Å; Y239-Y273 CarbonylContact C-O 3.57Å; Y239-Y273 VanDerWaalsContact CA-O 3.31Å; Y239-Y273 WeakPolarHBondContact CA-O 3.42Å; R240-Y273 HydrophobicContact CB-CD1 4.38Å; R240-Y273 HydrophobicContact CB-CE1 3.86Å; R240-Y273 HydrophobicContact CB-CE2 4.37Å; R240-Y273 PolarHBondContact N-O 3.04Å; R240-Y273 PolarHBondContact NE-OH 2.89Å; R240-Y273 WeakPolarHBondContact O-CD1 3.47Å; R240-Y273 PolarHBondContact O-N 2.67Å; L242-Y273 HydrophobicContact CB-CD1 4.38Å; L242-Y273 HydrophobicContact CD1-CD1 4.07Å; L242-Y273 HydrophobicContact CD1-CE1 4.09Å; M254-Y273 HydrophobicContact CE-CE1 4.17Å; M254-Y273 HydrophobicContact CE-CE2 3.69Å; M254-Y273 VanDerWaalsContact CE-CZ 3.45Å; M254-Y273 VanDerWaalsContact CE-OH 3.26Å; M254-Y273 WeakPolarHBondContact CE-OH 3.4Å
274	K	92.5	Very high	83.1	Confident	44 Å²	44	30.2 Å²	30.2	19%	0.191	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	132.4	174	-177.3	178	171.7	-171.7	0	109.7	E208 R218 V219 V237 Y239	E208-K274 IonicContact OE1-NZ 3.3Å; E208-K274 PolarHBondContact OE1-NZ 3.05Å; E208-K274 IonicContact OE2-NZ 2.79Å; E208-K274 PolarHBondContact OE2-NZ 3.31Å; R218-K274 WeakPolarHBondContact CA-O 3.45Å; V219-K274 PolarHBondContact N-O 3.02Å; V219-K274 PolarHBondContact O-N 3.45Å; V237-K274 PolarHBondContact O-NZ 3.4Å; Y239-K274 HydrophobicContact CD1-CB 3.75Å; Y239-K274 HydrophobicContact CD2-CB 4.01Å; Y239-K274 HydrophobicContact CD2-CD 3.93Å; Y239-K274 HydrophobicContact CE1-CB 3.77Å; Y239-K274 HydrophobicContact CE2-CB 4.02Å; Y239-K274 HydrophobicContact CE2-CD 3.7Å; Y239-K274 HydrophobicContact CG-CB 3.85Å
275	D	90.4	Very high	84.4	Confident	63 Å²	63	27.5 Å²	27.5	34%	0.337	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	137.7	173	-51.6	-62.9	0	0	0	109.2	R217 R218 R240	R217-D275 WeakPolarHBondContact O-CA 3.35Å; R218-D275 IonicContact CZ-OD1 3.38Å; R218-D275 VanDerWaalsContact CZ-OD1 3.3Å; R218-D275 IonicContact NE-OD1 3.7Å; R218-D275 PolarHBondContact NE-OD1 3.42Å; R218-D275 IonicContact NH2-OD1 2.78Å; R218-D275 PolarHBondContact NH2-OD1 3.21Å; R240-D275 IonicContact CZ-OD2 3.97Å; R240-D275 IonicContact NH2-OD2 3.98Å; R240-D275 PolarHBondContact NH2-OD2 2.99Å
276	L	87.2	Confident	85.6	Confident	56 Å²	56	26.8 Å²	26.8	29%	0.293	14%	0.135	S	C	.	.			trans	-95.7	0	-171.2	-70.4	-177.7	0	0	0	114.5	E208 E211 R212 A216 R217 V219	E208-L276 HydrophobicContact CB-CD2 3.71Å; E208-L276 HydrophobicContact CG-CD2 3.87Å; E211-L276 HydrophobicContact CB-CD1 4.07Å; R212-L276 HydrophobicContact CB-CB 4.19Å; R212-L276 HydrophobicContact CB-CD1 4.13Å; R212-L276 WeakPolarHBondContact CD-OXT 3.48Å; R212-L276 HydrophobicContact CG-CB 4.35Å; R212-L276 PolarHBondContact NH1-OXT 3.48Å; A216-L276 HydrophobicContact CB-CD1 3.92Å; R217-L276 PolarHBondContact O-N 2.85Å; V219-L276 HydrophobicContact CG2-CD1 3.49Å; V219-L276 VanDerWaalsContact CG2-CD1 3.49Å; V219-L276 HydrophobicContact CG2-CD2 3.79Å; V219-L276 HydrophobicContact CG2-CG 3.73Å

Retrieved 276 of 276 residues in 207.4 ms (Link to these results)

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