A0A2K5UFN9_MACFA Loading...

Gap junction protein

One gap junction consists of a cluster of closely packed pairs of transmembrane channels, the connexons, through which materials of low MW diffuse from one cell to a neighboring cell.

AlphaFold DB , UniProt , Accession A0A2K5UFN9, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene n/a, Length 396 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	47.5	Very low	50.9	Low	244 Å²	244	119 Å²	119	100%	1.202	58%	0.579	S	S	*	*				0	152.8	0	-71.9	-179.7	170.3	0	0	109
2	S	52.9	Low	50.6	Low	71 Å²	71	117.4 Å²	117.4	50%	0.497	57%	0.57	S	S	.	*			trans	-84.2	114	-170.3	36	0	0	0	0	113	S4 F5	S2-S4 PolarHBondContact O-N 3.13Å; S2-F5 PolarHBondContact O-N 3.42Å; S2-F5 VanDerWaalsContact O-N 3.07Å
3	W	49.6	Very low	50.7	Low	214 Å²	214	111.2 Å²	111.2	81%	0.811	54%	0.54	S	S	*	.	H	α-helix	trans	-54.9	-33.3	168.6	-84.1	83.1	0	0	0	112.3	F5 L6 T7	W3-F5 PolarHBondContact O-N 3.14Å; W3-L6 WeakPolarHBondContact O-CB 3.34Å; W3-L6 PolarHBondContact O-N 3.48Å; W3-L6 VanDerWaalsContact O-N 3.1Å; W3-T7 PolarHBondContact O-N 3.21Å; W3-T7 PolarHBondContact O-OG1 3.03Å
4	S	49.8	Very low	50.6	Low	77 Å²	77	107.4 Å²	107.4	54%	0.538	52%	0.521	S	S	.	.	H	α-helix	trans	-64.9	-18	177	52.1	0	0	0	0	115.3	S2 T7 R8	S2-S4 PolarHBondContact O-N 3.13Å; S4-T7 WeakPolarHBondContact CA-OG1 3.31Å; S4-T7 PolarHBondContact O-OG1 2.92Å; S4-R8 WeakPolarHBondContact O-CB 3.44Å; S4-R8 WeakPolarHBondContact O-CG 3.24Å; S4-R8 PolarHBondContact O-N 3.45Å
5	F	50.7	Low	50.8	Low	85 Å²	85	108 Å²	108	37%	0.373	53%	0.528	S	S	.	.	H	α-helix	trans	-82.7	-41.1	170.2	-175.8	-111.9	0	0	0	110.7	S2 W3 R8 L9 I96	S2-F5 PolarHBondContact O-N 3.42Å; S2-F5 VanDerWaalsContact O-N 3.07Å; W3-F5 PolarHBondContact O-N 3.14Å; F5-R8 PolarHBondContact O-N 2.68Å; F5-L9 HydrophobicContact CD1-CD1 3.66Å; F5-L9 HydrophobicContact CE1-CD1 3.4Å; F5-L9 HydrophobicContact CE1-CG 4.48Å; F5-L9 HydrophobicContact CE2-CD1 4.31Å; F5-L9 HydrophobicContact CG-CD1 4.24Å; F5-L9 HydrophobicContact CZ-CD1 3.76Å; F5-L9 HydrophobicContact CZ-CG 4.46Å; F5-L9 WeakPolarHBondContact O-CB 3.32Å; F5-L9 WeakPolarHBondContact O-CG 3.38Å; F5-L9 PolarHBondContact O-N 3.26Å; F5-I96 HydrophobicContact CE1-CG2 4.25Å
6	L	45	Very low	50.8	Low	98 Å²	98	107.7 Å²	107.7	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-63.9	-41.3	176.3	-115.6	168.9	0	0	0	112.4	W3 L10	W3-L6 WeakPolarHBondContact O-CB 3.34Å; W3-L6 PolarHBondContact O-N 3.48Å; W3-L6 VanDerWaalsContact O-N 3.1Å; L6-L10 WeakPolarHBondContact O-CB 3.46Å; L6-L10 PolarHBondContact O-N 2.89Å
7	T	53.2	Low	51.2	Low	71 Å²	71	102.5 Å²	102.5	44%	0.436	50%	0.502	S	S	.	.	H	α-helix	trans	-67.3	-46.5	175.4	56.3	0	0	0	0	111.9	W3 S4 L9 L10 E11	W3-T7 PolarHBondContact O-N 3.21Å; W3-T7 PolarHBondContact O-OG1 3.03Å; S4-T7 WeakPolarHBondContact CA-OG1 3.31Å; S4-T7 PolarHBondContact O-OG1 2.92Å; T7-L9 VanDerWaalsContact C-N 3.28Å; T7-L9 PolarHBondContact O-N 3.07Å; T7-L10 WeakPolarHBondContact O-CB 3.3Å; T7-L10 PolarHBondContact O-N 2.94Å; T7-L10 VanDerWaalsContact O-N 3.16Å; T7-E11 WeakPolarHBondContact O-CB 3.49Å; T7-E11 PolarHBondContact O-N 2.91Å
8	R	53.3	Low	51.9	Low	190 Å²	190	98.8 Å²	98.8	72%	0.717	49%	0.486	S	S	*	.	H	α-helix	trans	-58.9	-37.7	175.9	-81.4	-175.9	172.4	-159.7	-1.6	112.8	S4 F5 E11 E12	S4-R8 WeakPolarHBondContact O-CB 3.44Å; S4-R8 WeakPolarHBondContact O-CG 3.24Å; S4-R8 PolarHBondContact O-N 3.45Å; F5-R8 PolarHBondContact O-N 2.68Å; R8-E11 PolarHBondContact O-N 2.85Å; R8-E12 VanDerWaalsContact O-CB 3.31Å; R8-E12 WeakPolarHBondContact O-CB 3.35Å; R8-E12 PolarHBondContact O-N 3.05Å
9	L	52.1	Low	52.6	Low	17 Å²	17	100.3 Å²	100.3	9%	0.089	49%	0.49	C	S	.	.	H	α-helix	trans	-68.6	-45	174.1	-77.2	165.3	0	0	0	112.2	F5 T7 E11 E12 I13 I96 I99	F5-L9 HydrophobicContact CD1-CD1 3.66Å; F5-L9 HydrophobicContact CE1-CD1 3.4Å; F5-L9 HydrophobicContact CE1-CG 4.48Å; F5-L9 HydrophobicContact CE2-CD1 4.31Å; F5-L9 HydrophobicContact CG-CD1 4.24Å; F5-L9 HydrophobicContact CZ-CD1 3.76Å; F5-L9 HydrophobicContact CZ-CG 4.46Å; F5-L9 WeakPolarHBondContact O-CB 3.32Å; F5-L9 WeakPolarHBondContact O-CG 3.38Å; F5-L9 PolarHBondContact O-N 3.26Å; T7-L9 VanDerWaalsContact C-N 3.28Å; T7-L9 PolarHBondContact O-N 3.07Å; L9-E11 PolarHBondContact O-N 3.08Å; L9-E12 PolarHBondContact O-N 3.48Å; L9-I13 HydrophobicContact CB-CD1 4.47Å; L9-I13 VanDerWaalsContact O-CB 3.23Å; L9-I13 WeakPolarHBondContact O-CB 3.31Å; L9-I13 VanDerWaalsContact O-CD1 3.23Å; L9-I13 WeakPolarHBondContact O-CD1 3.44Å; L9-I13 WeakPolarHBondContact O-CG1 3.45Å; L9-I13 PolarHBondContact O-N 3.25Å; L9-I96 HydrophobicContact CD1-CD1 4.16Å; L9-I96 HydrophobicContact CD1-CG1 3.59Å; L9-I99 HydrophobicContact CD2-CD1 3.85Å
10	L	53.6	Low	53.2	Low	117 Å²	117	100.1 Å²	100.1	61%	0.613	49%	0.494	S	S	*	.	H	α-helix	trans	-54.6	-42.7	173.1	-96.5	161.5	0	0	0	111.5	L6 T7 H14	L6-L10 WeakPolarHBondContact O-CB 3.46Å; L6-L10 PolarHBondContact O-N 2.89Å; T7-L10 WeakPolarHBondContact O-CB 3.3Å; T7-L10 PolarHBondContact O-N 2.94Å; T7-L10 VanDerWaalsContact O-N 3.16Å; L10-H14 VanDerWaalsContact O-CB 3.24Å; L10-H14 WeakPolarHBondContact O-CB 3.39Å; L10-H14 PolarHBondContact O-N 3.37Å
11	E	52.5	Low	53.9	Low	125 Å²	125	95.8 Å²	95.8	58%	0.584	48%	0.476	S	S	*	.	H	α-helix	trans	-71.3	-43.1	-179	-165.5	160.4	-145.4	0	0	112.8	T7 R8 L9 I13 H14 N15	T7-E11 WeakPolarHBondContact O-CB 3.49Å; T7-E11 PolarHBondContact O-N 2.91Å; R8-E11 PolarHBondContact O-N 2.85Å; L9-E11 PolarHBondContact O-N 3.08Å; E11-I13 VanDerWaalsContact C-N 3.35Å; E11-I13 PolarHBondContact O-N 3.15Å; E11-H14 WeakPolarHBondContact O-CB 3.26Å; E11-H14 PolarHBondContact O-N 2.86Å; E11-N15 PolarHBondContact O-N 3.24Å
12	E	47	Very low	55	Low	100 Å²	100	85.4 Å²	85.4	47%	0.467	42%	0.424	S	S	.	.	H	α-helix	trans	-62.2	-41.9	172.2	-173	67.1	-172	0	0	111.6	R8 L9 H14 N15 H16	R8-E12 VanDerWaalsContact O-CB 3.31Å; R8-E12 WeakPolarHBondContact O-CB 3.35Å; R8-E12 PolarHBondContact O-N 3.05Å; L9-E12 PolarHBondContact O-N 3.48Å; E12-H14 VanDerWaalsContact C-N 3.33Å; E12-N15 PolarHBondContact O-N 3.32Å; E12-H16 IonicContact OE1-CD2 3.98Å
13	I	52.3	Low	56.3	Low	36 Å²	36	84.9 Å²	84.9	19%	0.185	42%	0.415	C	S	.	.	H	α-helix	trans	-69.1	-33	176.1	-71.8	157.4	0	0	0	111	L9 E11 H16 K22 L92	L9-I13 HydrophobicContact CB-CD1 4.47Å; L9-I13 VanDerWaalsContact O-CB 3.23Å; L9-I13 WeakPolarHBondContact O-CB 3.31Å; L9-I13 VanDerWaalsContact O-CD1 3.23Å; L9-I13 WeakPolarHBondContact O-CD1 3.44Å; L9-I13 WeakPolarHBondContact O-CG1 3.45Å; L9-I13 PolarHBondContact O-N 3.25Å; E11-I13 VanDerWaalsContact C-N 3.35Å; E11-I13 PolarHBondContact O-N 3.15Å; I13-H16 PolarHBondContact O-N 3.09Å; I13-K22 PolarHBondContact O-NZ 3.44Å; I13-L92 HydrophobicContact CD1-CD2 3.28Å; I13-L92 HydrophobicContact CG1-CD2 4.48Å
14	H	49.6	Very low	57.6	Low	58 Å²	58	81.6 Å²	81.6	27%	0.269	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-44.1	175.8	-167.3	-132.8	0	0	0	111.5	L10 E11 E12 H16 F19 I23	L10-H14 VanDerWaalsContact O-CB 3.24Å; L10-H14 WeakPolarHBondContact O-CB 3.39Å; L10-H14 PolarHBondContact O-N 3.37Å; E11-H14 WeakPolarHBondContact O-CB 3.26Å; E11-H14 PolarHBondContact O-N 2.86Å; E12-H14 VanDerWaalsContact C-N 3.33Å; H14-H16 PolarHBondContact O-N 3.47Å; H14-F19 AromaticContact CE1-CD2 3.39Å; H14-F19 WeakPolarHBondContact CE1-CD2 3.36Å; H14-F19 AromaticContact CE1-CE2 3.28Å; H14-F19 WeakPolarHBondContact CE1-CE2 3.38Å; H14-F19 AromaticContact ND1-CD2 3.93Å; H14-F19 AromaticContact ND1-CE2 3.95Å; H14-F19 AromaticContact NE2-CD2 3.89Å; H14-I23 VanDerWaalsContact NE2-CG1 3.32Å; H14-I23 WeakPolarHBondContact NE2-CG1 3.49Å
15	N	52.5	Low	58.9	Low	117 Å²	117	78.1 Å²	78.1	63%	0.626	38%	0.378	S	S	*	.	H	α-helix	trans	-62.3	-22.1	177.2	-79.3	-28.7	0	0	0	114.5	E11 E12	E11-N15 PolarHBondContact O-N 3.24Å; E12-N15 PolarHBondContact O-N 3.32Å
16	H	51.4	Low	60.3	Low	103 Å²	103	78 Å²	78	48%	0.477	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	11.5	-167.9	-94.6	-66.3	0	0	0	117	E12 I13 H14	E12-H16 IonicContact OE1-CD2 3.98Å; I13-H16 PolarHBondContact O-N 3.09Å; H14-H16 PolarHBondContact O-N 3.47Å
17	S	58.1	Low	62.2	Low	20 Å²	20	77.1 Å²	77.1	14%	0.14	38%	0.383	C	S	.	.	S	Bend	trans	-143.3	-173.6	157.1	-164.6	0	0	0	0	109.9	F19 K22 E249	S17-F19 PolarHBondContact O-N 3.14Å; S17-K22 VanDerWaalsContact CB-CE 3.4Å; S17-E249 VanDerWaalsContact CB-OE1 3.27Å; S17-E249 WeakPolarHBondContact CB-OE1 3.27Å; S17-E249 PolarHBondContact OG-OE1 2.82Å
18	T	63.9	Low	63.7	Low	36 Å²	36	74.5 Å²	74.5	22%	0.221	37%	0.366	C	S	.	.			trans	-54.5	107.6	175.7	51.7	0	0	0	0	110.8	V20 G21 K22 H252	T18-V20 PolarHBondContact O-N 2.95Å; T18-G21 PolarHBondContact O-N 3.48Å; T18-K22 PolarHBondContact O-N 2.9Å; T18-H252 VanDerWaalsContact CG2-CE1 3.42Å; T18-H252 WeakPolarHBondContact CG2-CE1 3.4Å; T18-H252 VanDerWaalsContact CG2-ND1 3.34Å; T18-H252 WeakPolarHBondContact CG2-ND1 3.46Å
19	F	64.8	Low	65.1	Low	126 Å²	126	68.1 Å²	68.1	55%	0.553	35%	0.346	S	S	*	.	H	α-helix	trans	-42.5	-50	175.9	-178.3	-89.2	0	0	0	111.7	H14 S17 K22 I23	H14-F19 AromaticContact CE1-CD2 3.39Å; H14-F19 WeakPolarHBondContact CE1-CD2 3.36Å; H14-F19 AromaticContact CE1-CE2 3.28Å; H14-F19 WeakPolarHBondContact CE1-CE2 3.38Å; H14-F19 AromaticContact ND1-CD2 3.93Å; H14-F19 AromaticContact ND1-CE2 3.95Å; H14-F19 AromaticContact NE2-CD2 3.89Å; S17-F19 PolarHBondContact O-N 3.14Å; F19-K22 PolarHBondContact O-N 3.37Å; F19-I23 HydrophobicContact CD1-CD1 3.58Å; F19-I23 HydrophobicContact CD2-CD1 4.42Å; F19-I23 HydrophobicContact CE1-CD1 3.37Å; F19-I23 HydrophobicContact CE2-CD1 4.27Å; F19-I23 HydrophobicContact CG-CD1 4.11Å; F19-I23 HydrophobicContact CZ-CD1 3.76Å; F19-I23 VanDerWaalsContact O-CG1 3.29Å; F19-I23 WeakPolarHBondContact O-CG1 3.26Å; F19-I23 PolarHBondContact O-N 2.84Å
20	V	64.4	Low	66.8	Low	96 Å²	96	71.5 Å²	71.5	58%	0.582	37%	0.367	S	S	*	.	H	α-helix	trans	-57.8	-57	175.9	-175.2	0	0	0	0	111.7	T18 K22 I23 W24	T18-V20 PolarHBondContact O-N 2.95Å; V20-K22 VanDerWaalsContact C-N 3.32Å; V20-K22 PolarHBondContact O-N 3.28Å; V20-I23 PolarHBondContact O-N 3.47Å; V20-W24 VanDerWaalsContact O-CD1 3.27Å; V20-W24 PolarHBondContact O-N 3.21Å
21	G	67.3	Low	68.5	Low	10 Å²	10	70.4 Å²	70.4	10%	0.103	36%	0.357	C	S	.	.	H	α-helix	trans	-58	-41.1	-178	0	0	0	0	0	113.2	T18 L25	T18-G21 PolarHBondContact O-N 3.48Å; G21-L25 VanDerWaalsContact O-CB 3.29Å; G21-L25 WeakPolarHBondContact O-CB 3.43Å; G21-L25 VanDerWaalsContact O-CG 3.26Å; G21-L25 WeakPolarHBondContact O-CG 3.25Å; G21-L25 PolarHBondContact O-N 3.42Å
22	K	71.9	Confident	70.3	Confident	27 Å²	27	64.9 Å²	64.9	12%	0.117	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-45.4	177.9	-84.2	-179	169.3	161.8	0	113	I13 S17 T18 F19 V20 L25 T26 Y177	I13-K22 PolarHBondContact O-NZ 3.44Å; S17-K22 VanDerWaalsContact CB-CE 3.4Å; T18-K22 PolarHBondContact O-N 2.9Å; F19-K22 PolarHBondContact O-N 3.37Å; V20-K22 VanDerWaalsContact C-N 3.32Å; V20-K22 PolarHBondContact O-N 3.28Å; K22-L25 PolarHBondContact O-N 3.46Å; K22-T26 WeakPolarHBondContact O-CG2 3.18Å; K22-T26 PolarHBondContact O-N 3.42Å; K22-T26 PolarHBondContact O-OG1 3.14Å; K22-T26 VanDerWaalsContact O-OG1 3.13Å; K22-Y177 WeakPolarHBondContact CE-OH 3.48Å; K22-Y177 PolarHBondContact NZ-OH 3.41Å
23	I	78.4	Confident	72.4	Confident	59 Å²	59	64 Å²	64	30%	0.303	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-46.2	177.1	-67.2	168	0	0	0	110.6	H14 F19 V20 L25 T26 V27	H14-I23 VanDerWaalsContact NE2-CG1 3.32Å; H14-I23 WeakPolarHBondContact NE2-CG1 3.49Å; F19-I23 HydrophobicContact CD1-CD1 3.58Å; F19-I23 HydrophobicContact CD2-CD1 4.42Å; F19-I23 HydrophobicContact CE1-CD1 3.37Å; F19-I23 HydrophobicContact CE2-CD1 4.27Å; F19-I23 HydrophobicContact CG-CD1 4.11Å; F19-I23 HydrophobicContact CZ-CD1 3.76Å; F19-I23 VanDerWaalsContact O-CG1 3.29Å; F19-I23 WeakPolarHBondContact O-CG1 3.26Å; F19-I23 PolarHBondContact O-N 2.84Å; V20-I23 PolarHBondContact O-N 3.47Å; I23-L25 PolarHBondContact O-N 3.02Å; I23-T26 PolarHBondContact O-N 3.21Å; I23-T26 PolarHBondContact O-OG1 3.48Å; I23-T26 VanDerWaalsContact O-OG1 3.07Å; I23-V27 HydrophobicContact CG2-CG2 4.33Å; I23-V27 WeakPolarHBondContact O-CB 3.47Å; I23-V27 VanDerWaalsContact O-CG2 3.24Å; I23-V27 WeakPolarHBondContact O-CG2 3.23Å; I23-V27 PolarHBondContact O-N 3.39Å
24	W	78.6	Confident	74.2	Confident	145 Å²	145	65.9 Å²	65.9	55%	0.549	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-39.7	179.3	-81.8	91.5	0	0	0	112.4	V20 L28 L245	V20-W24 VanDerWaalsContact O-CD1 3.27Å; V20-W24 PolarHBondContact O-N 3.21Å; W24-L28 WeakPolarHBondContact O-CB 3.35Å; W24-L28 VanDerWaalsContact O-CG 3.27Å; W24-L28 WeakPolarHBondContact O-CG 3.4Å; W24-L28 PolarHBondContact O-N 3.33Å; W24-L245 HydrophobicContact CB-CD1 4.11Å
25	L	75.8	Confident	76.3	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-68.1	-36.4	176.5	-74.7	173.6	0	0	0	113.2	G21 K22 I23 I29 L245 N246	G21-L25 VanDerWaalsContact O-CB 3.29Å; G21-L25 WeakPolarHBondContact O-CB 3.43Å; G21-L25 VanDerWaalsContact O-CG 3.26Å; G21-L25 WeakPolarHBondContact O-CG 3.25Å; G21-L25 PolarHBondContact O-N 3.42Å; K22-L25 PolarHBondContact O-N 3.46Å; I23-L25 PolarHBondContact O-N 3.02Å; L25-I29 WeakPolarHBondContact O-CD1 3.24Å; L25-I29 WeakPolarHBondContact O-CG1 3.32Å; L25-I29 PolarHBondContact O-N 2.9Å; L25-I29 VanDerWaalsContact O-N 3.09Å; L25-L245 HydrophobicContact CD2-CB 3.75Å; L25-L245 HydrophobicContact CG-CB 4.21Å; L25-N246 WeakPolarHBondContact CD2-ND2 3.34Å
26	T	80.9	Confident	78.2	Confident	81 Å²	81	59.4 Å²	59.4	50%	0.497	31%	0.309	S	S	.	.	H	α-helix	trans	-72.5	-42.6	175.6	54.3	0	0	0	0	111.9	K22 I23 L28 I29 V30	K22-T26 WeakPolarHBondContact O-CG2 3.18Å; K22-T26 PolarHBondContact O-N 3.42Å; K22-T26 PolarHBondContact O-OG1 3.14Å; K22-T26 VanDerWaalsContact O-OG1 3.13Å; I23-T26 PolarHBondContact O-N 3.21Å; I23-T26 PolarHBondContact O-OG1 3.48Å; I23-T26 VanDerWaalsContact O-OG1 3.07Å; T26-L28 VanDerWaalsContact C-N 3.34Å; T26-L28 PolarHBondContact O-N 3.32Å; T26-I29 PolarHBondContact O-N 2.93Å; T26-V30 WeakPolarHBondContact O-CG2 3.49Å; T26-V30 PolarHBondContact O-N 2.74Å
27	V	84.2	Confident	80	Confident	80 Å²	80	57 Å²	57	49%	0.485	31%	0.307	S	S	.	.	H	α-helix	trans	-58.6	-44.7	174.5	168.5	0	0	0	0	111.1	I23 V30 F31	I23-V27 HydrophobicContact CG2-CG2 4.33Å; I23-V27 WeakPolarHBondContact O-CB 3.47Å; I23-V27 VanDerWaalsContact O-CG2 3.24Å; I23-V27 WeakPolarHBondContact O-CG2 3.23Å; I23-V27 PolarHBondContact O-N 3.39Å; V27-V30 PolarHBondContact O-N 3.32Å; V27-F31 VanDerWaalsContact O-CB 3.32Å; V27-F31 WeakPolarHBondContact O-CB 3.35Å; V27-F31 PolarHBondContact O-N 3.33Å
28	L	84.4	Confident	81.7	Confident	16 Å²	16	60.3 Å²	60.3	8%	0.084	33%	0.326	C	S	.	.	H	α-helix	trans	-69.8	-33.6	178.3	-71.8	171.8	0	0	0	113.5	W24 T26 F31 R32 L241 L245	W24-L28 WeakPolarHBondContact O-CB 3.35Å; W24-L28 VanDerWaalsContact O-CG 3.27Å; W24-L28 WeakPolarHBondContact O-CG 3.4Å; W24-L28 PolarHBondContact O-N 3.33Å; T26-L28 VanDerWaalsContact C-N 3.34Å; T26-L28 PolarHBondContact O-N 3.32Å; L28-F31 HydrophobicContact CD2-CD1 4.46Å; L28-R32 WeakPolarHBondContact O-CB 3.42Å; L28-R32 PolarHBondContact O-N 2.86Å; L28-L241 HydrophobicContact CD1-CB 4.41Å; L28-L245 HydrophobicContact CD1-CD1 3.4Å; L28-L245 VanDerWaalsContact CD1-CD1 3.4Å
29	I	83.5	Confident	82.9	Confident	57 Å²	57	58.8 Å²	58.8	29%	0.292	32%	0.318	S	S	.	.	H	α-helix	trans	-61.6	-48.7	170.6	-70.9	161.8	0	0	0	110.2	L25 T26 R32 I33	L25-I29 WeakPolarHBondContact O-CD1 3.24Å; L25-I29 WeakPolarHBondContact O-CG1 3.32Å; L25-I29 PolarHBondContact O-N 2.9Å; L25-I29 VanDerWaalsContact O-N 3.09Å; T26-I29 PolarHBondContact O-N 2.93Å; I29-R32 PolarHBondContact O-N 3.19Å; I29-I33 HydrophobicContact CG2-CD1 3.85Å; I29-I33 WeakPolarHBondContact O-CG1 3.41Å; I29-I33 PolarHBondContact O-N 2.91Å
30	V	87.8	Confident	84	Confident	88 Å²	88	53.2 Å²	53.2	53%	0.533	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-46.2	179.9	172.7	0	0	0	0	110.8	T26 V27 R32 I33 V34	T26-V30 WeakPolarHBondContact O-CG2 3.49Å; T26-V30 PolarHBondContact O-N 2.74Å; V27-V30 PolarHBondContact O-N 3.32Å; V30-R32 VanDerWaalsContact C-N 3.31Å; V30-R32 PolarHBondContact O-N 3.22Å; V30-I33 PolarHBondContact O-N 3.12Å; V30-V34 WeakPolarHBondContact O-CG2 3.45Å; V30-V34 PolarHBondContact O-N 3.01Å
31	F	89	Confident	85.2	Confident	94 Å²	94	56.1 Å²	56.1	41%	0.412	30%	0.303	S	S	.	.	H	α-helix	trans	-57.6	-43.4	175.3	179.3	-121.9	0	0	0	111.9	V27 L28 V34 L35 V238	V27-F31 VanDerWaalsContact O-CB 3.32Å; V27-F31 WeakPolarHBondContact O-CB 3.35Å; V27-F31 PolarHBondContact O-N 3.33Å; L28-F31 HydrophobicContact CD2-CD1 4.46Å; F31-V34 PolarHBondContact O-N 3.43Å; F31-L35 HydrophobicContact CD1-CD1 4.01Å; F31-L35 HydrophobicContact CD2-CG 4.4Å; F31-L35 HydrophobicContact CE1-CD1 3.56Å; F31-L35 HydrophobicContact CE1-CG 4.26Å; F31-L35 HydrophobicContact CE2-CD1 4.25Å; F31-L35 HydrophobicContact CE2-CD2 4.21Å; F31-L35 HydrophobicContact CE2-CG 4.07Å; F31-L35 HydrophobicContact CZ-CD1 3.7Å; F31-L35 HydrophobicContact CZ-CD2 4.14Å; F31-L35 HydrophobicContact CZ-CG 4Å; F31-L35 WeakPolarHBondContact O-CG 3.45Å; F31-L35 PolarHBondContact O-N 3.07Å; F31-V238 HydrophobicContact CD1-CG1 4.38Å; F31-V238 HydrophobicContact CD1-CG2 4.09Å; F31-V238 HydrophobicContact CE1-CG2 3.68Å
32	R	90.4	Very high	86.3	Confident	9 Å²	9	58.5 Å²	58.5	3%	0.034	32%	0.318	C	S	.	.	H	α-helix	trans	-66.9	-37	178	-174.7	169.1	147.3	-144.7	-24.6	112.8	L28 I29 V30 T36 Q80 I81 E188 V238	L28-R32 WeakPolarHBondContact O-CB 3.42Å; L28-R32 PolarHBondContact O-N 2.86Å; I29-R32 PolarHBondContact O-N 3.19Å; V30-R32 VanDerWaalsContact C-N 3.31Å; V30-R32 PolarHBondContact O-N 3.22Å; R32-T36 PolarHBondContact O-N 3.05Å; R32-T36 PolarHBondContact O-OG1 2.97Å; R32-Q80 VanDerWaalsContact CZ-CD 3.44Å; R32-Q80 VanDerWaalsContact CZ-NE2 3.35Å; R32-I81 HydrophobicContact CG-CD1 4.42Å; R32-E188 IonicContact CZ-OE2 3.78Å; R32-E188 VanDerWaalsContact NH1-CD 3.3Å; R32-E188 IonicContact NH1-OE1 2.95Å; R32-E188 PolarHBondContact NH1-OE1 3.46Å; R32-E188 IonicContact NH1-OE2 2.84Å; R32-E188 PolarHBondContact NH1-OE2 2.94Å; R32-E188 IonicContact NH2-OE2 3.99Å; R32-V238 HydrophobicContact CB-CG1 4.03Å; R32-V238 HydrophobicContact CG-CG1 4.32Å
33	I	90.3	Very high	87.3	Confident	80 Å²	80	57.9 Å²	57.9	41%	0.41	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-47.5	171.5	-68.7	163	0	0	0	110.6	I29 V30 L35 T36 A37 I81	I29-I33 HydrophobicContact CG2-CD1 3.85Å; I29-I33 WeakPolarHBondContact O-CG1 3.41Å; I29-I33 PolarHBondContact O-N 2.91Å; V30-I33 PolarHBondContact O-N 3.12Å; I33-L35 PolarHBondContact O-N 2.77Å; I33-T36 PolarHBondContact O-N 3.14Å; I33-A37 PolarHBondContact O-N 2.9Å; I33-I81 HydrophobicContact CD1-CG2 4.46Å; I33-I81 HydrophobicContact CG1-CD1 4.09Å; I33-I81 HydrophobicContact CG1-CG2 4.02Å
34	V	91.9	Very high	87.9	Confident	77 Å²	77	55.4 Å²	55.4	47%	0.467	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-44.5	178.5	171.9	0	0	0	0	111.2	V30 F31 A37 V38	V30-V34 WeakPolarHBondContact O-CG2 3.45Å; V30-V34 PolarHBondContact O-N 3.01Å; F31-V34 PolarHBondContact O-N 3.43Å; V34-A37 PolarHBondContact O-N 3.35Å; V34-V38 HydrophobicContact CG1-CG2 4.28Å; V34-V38 WeakPolarHBondContact O-CB 3.47Å; V34-V38 WeakPolarHBondContact O-CG2 3.5Å; V34-V38 PolarHBondContact O-N 2.86Å
35	L	92.7	Very high	88.4	Confident	31 Å²	31	57.9 Å²	57.9	16%	0.162	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-50.7	173.1	-75.3	178.8	0	0	0	111.4	F31 I33 A37 G39 F231 I234 M235 V238	F31-L35 HydrophobicContact CD1-CD1 4.01Å; F31-L35 HydrophobicContact CD2-CG 4.4Å; F31-L35 HydrophobicContact CE1-CD1 3.56Å; F31-L35 HydrophobicContact CE1-CG 4.26Å; F31-L35 HydrophobicContact CE2-CD1 4.25Å; F31-L35 HydrophobicContact CE2-CD2 4.21Å; F31-L35 HydrophobicContact CE2-CG 4.07Å; F31-L35 HydrophobicContact CZ-CD1 3.7Å; F31-L35 HydrophobicContact CZ-CD2 4.14Å; F31-L35 HydrophobicContact CZ-CG 4Å; F31-L35 WeakPolarHBondContact O-CG 3.45Å; F31-L35 PolarHBondContact O-N 3.07Å; I33-L35 PolarHBondContact O-N 2.77Å; L35-A37 VanDerWaalsContact C-N 3.31Å; L35-A37 PolarHBondContact O-N 3.49Å; L35-G39 WeakPolarHBondContact O-CA 3.39Å; L35-G39 PolarHBondContact O-N 3.36Å; L35-F231 HydrophobicContact CB-CZ 4.4Å; L35-F231 HydrophobicContact CD2-CE2 4.39Å; L35-F231 WeakPolarHBondContact O-CZ 3.4Å; L35-I234 HydrophobicContact CD1-CG2 4.05Å; L35-M235 HydrophobicContact CB-CE 3.85Å; L35-M235 HydrophobicContact CB-SD 4.1Å; L35-M235 HydrophobicContact CD1-SD 4.14Å; L35-V238 HydrophobicContact CD1-CG2 4.01Å
36	T	91.7	Very high	89.2	Confident	7 Å²	7	58.2 Å²	58.2	4%	0.043	32%	0.315	C	S	.	.	H	α-helix	trans	-60.4	-40.1	-177.9	-59.2	0	0	0	0	112.2	R32 I33 G40 V74 W77 V78 I81 M235	R32-T36 PolarHBondContact O-N 3.05Å; R32-T36 PolarHBondContact O-OG1 2.97Å; I33-T36 PolarHBondContact O-N 3.14Å; T36-G40 WeakPolarHBondContact O-CA 3.32Å; T36-G40 PolarHBondContact O-N 3.3Å; T36-G40 VanDerWaalsContact O-N 3.08Å; T36-V74 HydrophobicContact CG2-CG1 4.38Å; T36-W77 HydrophobicContact CG2-CB 3.89Å; T36-V78 HydrophobicContact CG2-CG2 3.89Å; T36-I81 HydrophobicContact CG2-CD1 4.33Å; T36-I81 WeakPolarHBondContact OG1-CD1 3.45Å; T36-M235 WeakPolarHBondContact OG1-CE 3.15Å
37	A	90.8	Very high	89.6	Confident	52 Å²	52	55.9 Å²	55.9	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-68.6	-61.4	177.1	0	0	0	0	0	111.8	I33 V34 L35 G39 G40 E41	I33-A37 PolarHBondContact O-N 2.9Å; V34-A37 PolarHBondContact O-N 3.35Å; L35-A37 VanDerWaalsContact C-N 3.31Å; L35-A37 PolarHBondContact O-N 3.49Å; A37-G39 PolarHBondContact O-N 3.48Å; A37-G40 PolarHBondContact O-N 3.4Å; A37-E41 PolarHBondContact O-N 3.32Å
38	V	92.6	Very high	89.8	Confident	91 Å²	91	57 Å²	57	55%	0.552	30%	0.299	S	S	*	.	H	α-helix	trans	-65.8	-42.2	-173.3	178.2	0	0	0	0	111.5	V34 S42	V34-V38 HydrophobicContact CG1-CG2 4.28Å; V34-V38 WeakPolarHBondContact O-CB 3.47Å; V34-V38 WeakPolarHBondContact O-CG2 3.5Å; V34-V38 PolarHBondContact O-N 2.86Å; V38-S42 WeakPolarHBondContact O-CB 3.5Å; V38-S42 PolarHBondContact O-N 3.23Å; V38-S42 PolarHBondContact O-OG 3.38Å
39	G	89.2	Confident	90.1	Very high	4 Å²	4	60.8 Å²	60.8	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-71.6	-31	176.9	0	0	0	0	0	113.4	L35 A37 I43	L35-G39 WeakPolarHBondContact O-CA 3.39Å; L35-G39 PolarHBondContact O-N 3.36Å; A37-G39 PolarHBondContact O-N 3.48Å; G39-I43 VanDerWaalsContact O-CB 3.3Å; G39-I43 WeakPolarHBondContact O-CB 3.42Å; G39-I43 PolarHBondContact O-N 3.03Å
40	G	89.1	Confident	90.6	Very high	8 Å²	8	63.1 Å²	63.1	8%	0.082	33%	0.334	C	S	.	.	I	π-helix	trans	-63.3	-51.3	172.9	0	0	0	0	0	111.8	T36 A37 S42 Y44 Y45	T36-G40 WeakPolarHBondContact O-CA 3.32Å; T36-G40 PolarHBondContact O-N 3.3Å; T36-G40 VanDerWaalsContact O-N 3.08Å; A37-G40 PolarHBondContact O-N 3.4Å; G40-S42 PolarHBondContact O-N 3.31Å; G40-Y44 WeakPolarHBondContact O-CB 3.47Å; G40-Y44 PolarHBondContact O-N 2.74Å; G40-Y44 VanDerWaalsContact O-N 3.13Å; G40-Y45 PolarHBondContact O-N 2.64Å
41	E	88.3	Confident	90.9	Very high	157 Å²	157	59.1 Å²	59.1	73%	0.734	31%	0.31	S	S	*	.	I	π-helix	trans	-69	-31.1	-179.8	-68.4	-178.3	176.5	0	0	113.5	A37 Y45	A37-E41 PolarHBondContact O-N 3.32Å; E41-Y45 WeakPolarHBondContact O-CB 3.31Å
42	S	90.9	Very high	91.1	Very high	61 Å²	61	58.6 Å²	58.6	43%	0.427	31%	0.314	S	S	.	.	I	π-helix	trans	-88.8	-35.9	-178.2	54	0	0	0	0	115.1	V38 G40	V38-S42 WeakPolarHBondContact O-CB 3.5Å; V38-S42 PolarHBondContact O-N 3.23Å; V38-S42 PolarHBondContact O-OG 3.38Å; G40-S42 PolarHBondContact O-N 3.31Å
43	I	92.4	Very high	91.4	Very high	14 Å²	14	58.6 Å²	58.6	7%	0.072	32%	0.315	C	S	.	.	I	π-helix	trans	-106.9	-26.5	-170.2	-51.6	174.4	0	0	0	112.4	G39 E227 K228 F231	G39-I43 VanDerWaalsContact O-CB 3.3Å; G39-I43 WeakPolarHBondContact O-CB 3.42Å; G39-I43 PolarHBondContact O-N 3.03Å; I43-E227 HydrophobicContact CD1-CG 4.29Å; I43-E227 HydrophobicContact CG1-CG 4.23Å; I43-E227 HydrophobicContact CG2-CB 4.4Å; I43-E227 HydrophobicContact CG2-CG 3.99Å; I43-K228 HydrophobicContact CG2-CG 3.6Å; I43-K228 VanDerWaalsContact O-CE 3.22Å; I43-K228 WeakPolarHBondContact O-CE 3.22Å; I43-F231 HydrophobicContact CD1-CB 3.67Å; I43-F231 HydrophobicContact CD1-CD1 4.42Å; I43-F231 HydrophobicContact CD1-CD2 3.57Å; I43-F231 HydrophobicContact CD1-CE2 4.33Å; I43-F231 HydrophobicContact CD1-CG 3.62Å
44	Y	91	Very high	91.6	Very high	6 Å²	6	60.3 Å²	60.3	2%	0.024	33%	0.325	C	S	.	.	I	π-helix	trans	-113.3	-10.5	-174.7	-66.6	-90.7	0	0	0	114.2	G40 D46 E47 H73 V74 W77 K228 F231	G40-Y44 WeakPolarHBondContact O-CB 3.47Å; G40-Y44 PolarHBondContact O-N 2.74Å; G40-Y44 VanDerWaalsContact O-N 3.13Å; Y44-D46 PolarHBondContact O-N 2.87Å; Y44-E47 WeakPolarHBondContact CD1-OE2 3.44Å; Y44-E47 WeakPolarHBondContact O-CB 3.41Å; Y44-E47 WeakPolarHBondContact O-CG 3.3Å; Y44-E47 PolarHBondContact O-N 3.43Å; Y44-H73 HydrophobicContact CD1-CB 4.39Å; Y44-H73 HydrophobicContact CE1-CB 3.8Å; Y44-H73 AromaticContact CE1-CG 3.73Å; Y44-H73 AromaticContact CE1-ND1 3.5Å; Y44-V74 HydrophobicContact CD1-CG2 4.45Å; Y44-V74 HydrophobicContact CD2-CG2 3.86Å; Y44-V74 HydrophobicContact CG-CG2 3.7Å; Y44-W77 HydrophobicContact CE2-CH2 4.13Å; Y44-W77 AromaticContact CE2-CZ3 3.87Å; Y44-W77 HydrophobicContact CE2-CZ3 3.87Å; Y44-K228 HydrophobicContact CD1-CD 4.36Å; Y44-K228 HydrophobicContact CE1-CB 4.5Å; Y44-K228 HydrophobicContact CE1-CD 3.86Å; Y44-K228 HydrophobicContact CE1-CG 3.88Å; Y44-K228 HydrophobicContact CE2-CG 4.4Å; Y44-F231 AromaticContact CE2-CD1 3.93Å; Y44-F231 HydrophobicContact CE2-CD1 3.93Å; Y44-F231 HydrophobicContact CE2-CE1 4.41Å
45	Y	89.9	Confident	91.7	Very high	197 Å²	197	58.8 Å²	58.8	77%	0.773	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-31.9	174.8	178	-91.2	0	0	0	113.6	G40 E41	G40-Y45 PolarHBondContact O-N 2.64Å; E41-Y45 WeakPolarHBondContact O-CB 3.31Å
46	D	91.5	Very high	91.6	Very high	13 Å²	13	66.6 Å²	66.6	7%	0.07	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	27.4	174.8	67.6	23.6	0	0	0	113.8	Y44 K50 S223 R224	Y44-D46 PolarHBondContact O-N 2.87Å; D46-K50 HydrophobicContact CB-CD 3.83Å; D46-K50 HydrophobicContact CB-CG 4.18Å; D46-K50 WeakPolarHBondContact OD2-CE 3.02Å; D46-K50 IonicContact OD2-NZ 2.71Å; D46-K50 PolarHBondContact OD2-NZ 2.92Å; D46-S223 PolarHBondContact O-OG 3.25Å; D46-R224 WeakPolarHBondContact OD1-CD 3.28Å; D46-R224 IonicContact OD1-CZ 3.95Å; D46-R224 IonicContact OD1-NE 2.96Å; D46-R224 PolarHBondContact OD1-NE 2.82Å; D46-R224 IonicContact OD2-CZ 3.35Å; D46-R224 IonicContact OD2-NE 2.94Å; D46-R224 PolarHBondContact OD2-NE 3Å; D46-R224 IonicContact OD2-NH2 2.84Å; D46-R224 PolarHBondContact OD2-NH2 3.13Å
47	E	89.2	Confident	91.7	Very high	31 Å²	31	70 Å²	70	15%	0.145	37%	0.367	C	S	.	.	S	Bend	trans	-70	-41.5	179.7	73.9	-179.4	160.3	0	0	113.8	Y44 Y65 S72	Y44-E47 WeakPolarHBondContact CD1-OE2 3.44Å; Y44-E47 WeakPolarHBondContact O-CB 3.41Å; Y44-E47 WeakPolarHBondContact O-CG 3.3Å; Y44-E47 PolarHBondContact O-N 3.43Å; E47-Y65 VanDerWaalsContact CD-OH 3.22Å; E47-Y65 HydrophobicContact CG-CE2 4.39Å; E47-Y65 VanDerWaalsContact CG-OH 3.28Å; E47-Y65 WeakPolarHBondContact CG-OH 3.48Å; E47-S72 WeakPolarHBondContact OE1-CB 3.33Å; E47-S72 PolarHBondContact OE1-OG 3.23Å; E47-S72 WeakPolarHBondContact OE2-CB 3.48Å
48	Q	89.3	Confident	91.9	Very high	105 Å²	105	72.3 Å²	72.3	49%	0.491	38%	0.378	S	S	.	.	S	Bend	trans	-86.6	-44.4	178.6	-171.7	179.7	-2.7	0	0	111.9	K50 F51 Y65	Q48-K50 PolarHBondContact O-N 3.23Å; Q48-K50 VanDerWaalsContact O-N 3.13Å; Q48-F51 PolarHBondContact O-N 3.27Å; Q48-Y65 HydrophobicContact CB-CE1 4.43Å; Q48-Y65 HydrophobicContact CB-CE2 4.24Å; Q48-Y65 HydrophobicContact CG-CD1 4.3Å; Q48-Y65 HydrophobicContact CG-CE1 4.38Å; Q48-Y65 HydrophobicContact CG-CG 4.42Å
49	S	91.1	Very high	91.9	Very high	94 Å²	94	69.8 Å²	69.8	66%	0.657	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-1.2	-173.2	56	0	0	0	0	115.4
50	K	92.8	Very high	92.1	Very high	107 Å²	107	69.6 Å²	69.6	47%	0.465	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	20.4	174.5	-63	-178.5	-174	169	0	112.5	D46 Q48 V52	D46-K50 HydrophobicContact CB-CD 3.83Å; D46-K50 HydrophobicContact CB-CG 4.18Å; D46-K50 WeakPolarHBondContact OD2-CE 3.02Å; D46-K50 IonicContact OD2-NZ 2.71Å; D46-K50 PolarHBondContact OD2-NZ 2.92Å; Q48-K50 PolarHBondContact O-N 3.23Å; Q48-K50 VanDerWaalsContact O-N 3.13Å; K50-V52 PolarHBondContact O-N 3.41Å
51	F	93.8	Very high	92.3	Very high	4 Å²	4	72.9 Å²	72.9	2%	0.018	38%	0.381	C	S	.	.			trans	-89.4	93.4	170.2	177.9	-96.4	0	0	0	108.4	Q48 C53 E61 C64 Y65 F68 Y207 C220 F221 I222	Q48-F51 PolarHBondContact O-N 3.27Å; F51-C53 VanDerWaalsContact CE1-SG 3.53Å; F51-E61 HydrophobicContact CD1-CG 4Å; F51-E61 WeakPolarHBondContact O-CG 3.48Å; F51-C64 HydrophobicContact CE1-CB 3.89Å; F51-C64 HydrophobicContact CZ-CB 4.18Å; F51-Y65 HydrophobicContact CB-CD2 4.01Å; F51-Y65 HydrophobicContact CD1-CD2 4.15Å; F51-Y65 HydrophobicContact CD1-CG 4.44Å; F51-Y65 HydrophobicContact CD2-CD2 4.23Å; F51-Y65 VanDerWaalsContact CE1-N 3.33Å; F51-Y65 AromaticContact CG-CD2 3.88Å; F51-Y65 HydrophobicContact CG-CD2 3.88Å; F51-F68 HydrophobicContact CD2-CD1 4.47Å; F51-F68 HydrophobicContact CE2-CB 4.41Å; F51-F68 AromaticContact CE2-CD1 3.97Å; F51-F68 HydrophobicContact CE2-CD1 3.97Å; F51-F68 HydrophobicContact CE2-CG 4.3Å; F51-F68 HydrophobicContact CZ-CB 4.44Å; F51-Y207 HydrophobicContact CZ-CD1 4.45Å; F51-C220 HydrophobicContact CE1-CB 3.85Å; F51-C220 HydrophobicContact CE2-CB 3.98Å; F51-C220 HydrophobicContact CZ-CB 3.47Å; F51-C220 VanDerWaalsContact CZ-CB 3.47Å; F51-F221 WeakPolarHBondContact CA-O 3.29Å; F51-I222 HydrophobicContact CD2-CG1 4.04Å; F51-I222 HydrophobicContact CE2-CG1 3.95Å
52	V	94.6	Very high	92.6	Very high	82 Å²	82	69.7 Å²	69.7	50%	0.497	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.2	-169.8	-178.8	0	0	0	0	110.3	K50 C220 F221	K50-V52 PolarHBondContact O-N 3.41Å; V52-C220 CarbonylContact O-C 3.59Å; V52-C220 WeakPolarHBondContact O-CA 3.3Å; V52-F221 PolarHBondContact N-O 2.96Å; V52-F221 WeakPolarHBondContact O-CD2 3.24Å; V52-F221 PolarHBondContact O-N 3.12Å
53	C	95.5	Very high	92.8	Very high	9 Å²	9	69 Å²	69	6%	0.061	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	142.2	173.4	-69.2	0	0	0	0	111.9	F51 T55 I218 C220	F51-C53 VanDerWaalsContact CE1-SG 3.53Å; C53-T55 HydrophobicContact CB-CG2 4.18Å; C53-T55 PolarHBondContact O-N 3.25Å; C53-I218 HydrophobicContact CB-CD1 3.79Å; C53-C220 HydrophobicContact CB-CB 4.06Å; C53-C220 WeakPolarHBondContact CB-SG 3.2Å; C53-C220 WeakPolarHBondContact SG-CB 3.37Å; C53-C220 CovalentContact SG-SG 2.04Å; C53-C220 PolarHBondContact SG-SG 3.47Å
54	N	94.8	Very high	92.9	Very high	117 Å²	117	68.4 Å²	68.4	63%	0.626	36%	0.359	S	S	*	.	S	Bend	trans	-77.2	70.9	176.7	-170.8	17	0	0	0	111.4	D219	N54-D219 PolarHBondContact N-O 2.89Å
55	T	93.7	Very high	93	Very high	44 Å²	44	69.5 Å²	69.5	27%	0.27	36%	0.364	S	S	.	.			trans	-160.3	149.9	179.5	-165.1	0	0	0	0	112.1	C53 Q57 C60 I218	C53-T55 HydrophobicContact CB-CG2 4.18Å; C53-T55 PolarHBondContact O-N 3.25Å; T55-Q57 HydrophobicContact CG2-CB 4.33Å; T55-Q57 WeakPolarHBondContact OG1-CB 3.44Å; T55-Q57 PolarHBondContact OG1-N 3.28Å; T55-C60 HydrophobicContact CG2-CB 3.94Å; T55-I218 HydrophobicContact CG2-CD1 3.64Å
56	E	92.5	Very high	93.2	Very high	196 Å²	196	65.2 Å²	65.2	92%	0.916	35%	0.354	S	S	*	.			trans	-92.5	-0.4	169	-59.8	-176.4	153.4	0	0	112.2	P58	E56-P58 VanDerWaalsContact O-CD 3.3Å; E56-P58 WeakPolarHBondContact O-CD 3.31Å
57	Q	92.6	Very high	93.3	Very high	79 Å²	79	65.8 Å²	65.8	37%	0.369	36%	0.36	S	S	.	.			trans	-72.4	115.1	-175.3	-179.6	62	42.8	0	0	111.8	T55 G59 C60	T55-Q57 HydrophobicContact CG2-CB 4.33Å; T55-Q57 WeakPolarHBondContact OG1-CB 3.44Å; T55-Q57 PolarHBondContact OG1-N 3.28Å; Q57-G59 PolarHBondContact O-N 3.24Å; Q57-C60 HydrophobicContact CB-CB 4.1Å; Q57-C60 HydrophobicContact CG-CB 4.12Å; Q57-C60 WeakPolarHBondContact O-CB 3.36Å; Q57-C60 PolarHBondContact O-N 3.18Å
58	P	94.1	Very high	93.4	Very high	100 Å²	100	67.2 Å²	67.2	65%	0.649	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	138.9	179.9	24.6	-34.7	0	0	0	111.9	E56 C60	E56-P58 VanDerWaalsContact O-CD 3.3Å; E56-P58 WeakPolarHBondContact O-CD 3.31Å; P58-C60 PolarHBondContact O-N 3.09Å
59	G	92.9	Very high	93.4	Very high	38 Å²	38	62.8 Å²	62.8	39%	0.392	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	-12.2	179.3	0	0	0	0	0	115.7	Q57 N62 V63	Q57-G59 PolarHBondContact O-N 3.24Å; G59-N62 PolarHBondContact O-N 3.21Å; G59-V63 PolarHBondContact O-N 3.2Å
60	C	94.7	Very high	93.4	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-42.4	177.2	172.4	0	0	0	0	112	T55 Q57 P58 N62 V63 C64 C214 I218	T55-C60 HydrophobicContact CG2-CB 3.94Å; Q57-C60 HydrophobicContact CB-CB 4.1Å; Q57-C60 HydrophobicContact CG-CB 4.12Å; Q57-C60 WeakPolarHBondContact O-CB 3.36Å; Q57-C60 PolarHBondContact O-N 3.18Å; P58-C60 PolarHBondContact O-N 3.09Å; C60-N62 PolarHBondContact O-N 3Å; C60-V63 WeakPolarHBondContact O-CG2 3.48Å; C60-V63 PolarHBondContact O-N 2.86Å; C60-C64 WeakPolarHBondContact O-CB 3.34Å; C60-C64 PolarHBondContact O-N 3.27Å; C60-C64 PolarHBondContact O-SG 3.41Å; C60-C214 VanDerWaalsContact CA-SG 3.58Å; C60-C214 HydrophobicContact CB-CB 4.08Å; C60-C214 WeakPolarHBondContact CB-SG 3.26Å; C60-C214 WeakPolarHBondContact SG-CB 3.44Å; C60-C214 CovalentContact SG-SG 2.03Å; C60-C214 PolarHBondContact SG-SG 2.9Å; C60-I218 WeakPolarHBondContact SG-CD1 3.32Å
61	E	93.6	Very high	93.3	Very high	76 Å²	76	60.6 Å²	60.6	36%	0.355	34%	0.339	S	S	.	.	H	α-helix	trans	-54.7	-47.5	176.3	-170.9	175.8	102.6	0	0	112.5	F51 V63 C64 Y65	F51-E61 HydrophobicContact CD1-CG 4Å; F51-E61 WeakPolarHBondContact O-CG 3.48Å; E61-V63 PolarHBondContact O-N 3.33Å; E61-C64 PolarHBondContact O-N 3.04Å; E61-Y65 WeakPolarHBondContact O-CB 3.5Å; E61-Y65 PolarHBondContact O-N 2.88Å
62	N	93.7	Very high	93.1	Very high	91 Å²	91	60.6 Å²	60.6	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-61.2	-44.3	-179.8	-72.3	-20	0	0	0	112.9	G59 C60 C64 Y65 D66	G59-N62 PolarHBondContact O-N 3.21Å; C60-N62 PolarHBondContact O-N 3Å; N62-C64 VanDerWaalsContact C-N 3.34Å; N62-Y65 PolarHBondContact O-N 2.98Å; N62-D66 WeakPolarHBondContact O-CB 3.38Å; N62-D66 PolarHBondContact O-N 3.22Å
63	V	94.7	Very high	93	Very high	47 Å²	47	57.2 Å²	57.2	29%	0.285	32%	0.318	S	S	.	.	H	α-helix	trans	-73.9	-26.6	179.5	-60.6	0	0	0	0	112.6	G59 C60 E61 A67 R211 L212	G59-V63 PolarHBondContact O-N 3.2Å; C60-V63 WeakPolarHBondContact O-CG2 3.48Å; C60-V63 PolarHBondContact O-N 2.86Å; E61-V63 PolarHBondContact O-N 3.33Å; V63-A67 WeakPolarHBondContact O-CB 3.29Å; V63-A67 PolarHBondContact O-N 2.97Å; V63-R211 HydrophobicContact CB-CB 4.29Å; V63-R211 HydrophobicContact CG2-CB 3.9Å; V63-L212 WeakPolarHBondContact CG2-O 3.43Å
64	C	95	Very high	92.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-75.8	-36.2	173.8	-66.7	0	0	0	0	111.7	F51 C60 E61 N62 F68 C209 C214	F51-C64 HydrophobicContact CE1-CB 3.89Å; F51-C64 HydrophobicContact CZ-CB 4.18Å; C60-C64 WeakPolarHBondContact O-CB 3.34Å; C60-C64 PolarHBondContact O-N 3.27Å; C60-C64 PolarHBondContact O-SG 3.41Å; E61-C64 PolarHBondContact O-N 3.04Å; N62-C64 VanDerWaalsContact C-N 3.34Å; C64-F68 VanDerWaalsContact O-CB 3.28Å; C64-F68 WeakPolarHBondContact O-CB 3.46Å; C64-F68 PolarHBondContact O-N 3.38Å; C64-C209 WeakPolarHBondContact CA-SG 3.4Å; C64-C209 HydrophobicContact CB-CB 3.71Å; C64-C209 WeakPolarHBondContact CB-SG 3.42Å; C64-C209 WeakPolarHBondContact SG-CB 3.4Å; C64-C209 CovalentContact SG-SG 2.03Å; C64-C209 PolarHBondContact SG-SG 3.05Å; C64-C214 PolarHBondContact SG-SG 3.11Å
65	Y	93.7	Very high	92.7	Very high	30 Å²	30	60 Å²	60	12%	0.118	32%	0.322	C	S	.	.	H	α-helix	trans	-63.9	-49.2	172.1	177.6	-93.6	0	0	0	111.2	E47 Q48 F51 E61 N62 A67 F68 A69	E47-Y65 VanDerWaalsContact CD-OH 3.22Å; E47-Y65 HydrophobicContact CG-CE2 4.39Å; E47-Y65 VanDerWaalsContact CG-OH 3.28Å; E47-Y65 WeakPolarHBondContact CG-OH 3.48Å; Q48-Y65 HydrophobicContact CB-CE1 4.43Å; Q48-Y65 HydrophobicContact CB-CE2 4.24Å; Q48-Y65 HydrophobicContact CG-CD1 4.3Å; Q48-Y65 HydrophobicContact CG-CE1 4.38Å; Q48-Y65 HydrophobicContact CG-CG 4.42Å; F51-Y65 HydrophobicContact CB-CD2 4.01Å; F51-Y65 HydrophobicContact CD1-CD2 4.15Å; F51-Y65 HydrophobicContact CD1-CG 4.44Å; F51-Y65 HydrophobicContact CD2-CD2 4.23Å; F51-Y65 VanDerWaalsContact CE1-N 3.33Å; F51-Y65 AromaticContact CG-CD2 3.88Å; F51-Y65 HydrophobicContact CG-CD2 3.88Å; E61-Y65 WeakPolarHBondContact O-CB 3.5Å; E61-Y65 PolarHBondContact O-N 2.88Å; N62-Y65 PolarHBondContact O-N 2.98Å; Y65-A67 VanDerWaalsContact C-N 3.34Å; Y65-A67 PolarHBondContact O-N 2.92Å; Y65-F68 PolarHBondContact O-N 2.98Å; Y65-F68 VanDerWaalsContact O-N 3.12Å; Y65-A69 PolarHBondContact O-N 3.1Å
66	D	93.9	Very high	92.7	Very high	107 Å²	107	58.4 Å²	58.4	57%	0.572	31%	0.311	S	S	*	.	H	α-helix	trans	-59.5	-41.3	176.4	-177.4	76.2	0	0	0	112.3	N62 F68 P70	N62-D66 WeakPolarHBondContact O-CB 3.38Å; N62-D66 PolarHBondContact O-N 3.22Å; D66-F68 VanDerWaalsContact C-N 3.32Å; D66-F68 PolarHBondContact O-N 3.31Å; D66-P70 WeakPolarHBondContact O-CA 3.43Å; D66-P70 WeakPolarHBondContact O-CD 3.44Å
67	A	92.5	Very high	92.8	Very high	24 Å²	24	49.1 Å²	49.1	20%	0.198	27%	0.268	C	S	.	.	H	α-helix	trans	-74	-17.3	176.4	0	0	0	0	0	114.7	V63 Y65 Y207 R211	V63-A67 WeakPolarHBondContact O-CB 3.29Å; V63-A67 PolarHBondContact O-N 2.97Å; Y65-A67 VanDerWaalsContact C-N 3.34Å; Y65-A67 PolarHBondContact O-N 2.92Å; A67-Y207 VanDerWaalsContact C-OH 3.27Å; A67-Y207 WeakPolarHBondContact CB-OH 3.48Å; A67-Y207 PolarHBondContact O-OH 3.21Å; A67-R211 HydrophobicContact CB-CG 3.85Å
68	F	91.5	Very high	92.8	Very high	62 Å²	62	48.2 Å²	48.2	27%	0.272	27%	0.268	S	S	.	.	H	α-helix	trans	-89	-45.8	174.3	166.6	-113.2	0	0	0	111.9	F51 C64 Y65 D66 P70 V203 Y207 I222	F51-F68 HydrophobicContact CD2-CD1 4.47Å; F51-F68 HydrophobicContact CE2-CB 4.41Å; F51-F68 AromaticContact CE2-CD1 3.97Å; F51-F68 HydrophobicContact CE2-CD1 3.97Å; F51-F68 HydrophobicContact CE2-CG 4.3Å; F51-F68 HydrophobicContact CZ-CB 4.44Å; C64-F68 VanDerWaalsContact O-CB 3.28Å; C64-F68 WeakPolarHBondContact O-CB 3.46Å; C64-F68 PolarHBondContact O-N 3.38Å; Y65-F68 PolarHBondContact O-N 2.98Å; Y65-F68 VanDerWaalsContact O-N 3.12Å; D66-F68 VanDerWaalsContact C-N 3.32Å; D66-F68 PolarHBondContact O-N 3.31Å; F68-P70 VanDerWaalsContact C-CD 3.48Å; F68-V203 HydrophobicContact CZ-CG1 4.38Å; F68-Y207 HydrophobicContact CB-CD1 4.05Å; F68-Y207 HydrophobicContact CB-CD2 4.02Å; F68-Y207 HydrophobicContact CB-CE1 4.02Å; F68-Y207 HydrophobicContact CB-CE2 3.97Å; F68-Y207 HydrophobicContact CB-CG 4.03Å; F68-Y207 AromaticContact CD2-CD2 3.53Å; F68-Y207 HydrophobicContact CD2-CD2 3.53Å; F68-Y207 HydrophobicContact CD2-CE2 4.04Å; F68-Y207 AromaticContact CD2-CG 3.91Å; F68-Y207 HydrophobicContact CD2-CG 3.91Å; F68-Y207 HydrophobicContact CE2-CD2 4.46Å; F68-Y207 HydrophobicContact CG-CD2 4.16Å; F68-Y207 HydrophobicContact CG-CG 4.22Å; F68-I222 HydrophobicContact CD1-CD1 4.48Å; F68-I222 HydrophobicContact CD1-CG1 4.42Å; F68-I222 HydrophobicContact CD2-CD1 4.19Å; F68-I222 HydrophobicContact CE1-CD1 3.87Å; F68-I222 HydrophobicContact CE1-CG1 3.87Å; F68-I222 HydrophobicContact CE1-CG2 4.31Å; F68-I222 HydrophobicContact CE2-CD1 3.53Å; F68-I222 HydrophobicContact CE2-CG1 4.41Å; F68-I222 HydrophobicContact CZ-CD1 3.35Å; F68-I222 HydrophobicContact CZ-CG1 3.87Å; F68-I222 HydrophobicContact CZ-CG2 4.32Å
69	A	90.6	Very high	92.8	Very high	11 Å²	11	48.8 Å²	48.8	9%	0.091	26%	0.26	C	S	.	.			trans	-129.4	62.8	-173.2	0	0	0	0	0	112.3	Y65 L71	Y65-A69 PolarHBondContact O-N 3.1Å; A69-L71 PolarHBondContact O-N 2.97Å
70	P	89.9	Confident	92.8	Very high	101 Å²	101	47 Å²	47	66%	0.656	24%	0.242	S	C	*	.	S	Bend	trans	-62.8	-15.7	-178.1	26.9	-36.3	0	0	0	113.5	D66 F68	D66-P70 WeakPolarHBondContact O-CA 3.43Å; D66-P70 WeakPolarHBondContact O-CD 3.44Å; F68-P70 VanDerWaalsContact C-CD 3.48Å
71	L	90.8	Very high	92.6	Very high	54 Å²	54	48.3 Å²	48.3	28%	0.283	25%	0.249	S	C	.	.	S	Bend	trans	-137.6	118.5	162.9	-179	67.5	0	0	0	108.1	A69 R75 F76 F79 Y199	A69-L71 PolarHBondContact O-N 2.97Å; L71-R75 HydrophobicContact CD1-CB 3.73Å; L71-R75 HydrophobicContact CG-CB 4.47Å; L71-F76 HydrophobicContact CD2-CB 3.92Å; L71-F76 HydrophobicContact CD2-CD2 4.03Å; L71-F76 HydrophobicContact CD2-CG 4.5Å; L71-F76 HydrophobicContact CG-CB 4.37Å; L71-F79 HydrophobicContact CD1-CE2 4.25Å; L71-Y199 WeakPolarHBondContact O-CE1 3.37Å; L71-Y199 PolarHBondContact O-OH 3.39Å
72	S	90.8	Very high	92.5	Very high	5 Å²	5	49 Å²	49	4%	0.035	25%	0.254	C	S	.	.			trans	-72.3	145.7	177.3	66.6	0	0	0	0	112.7	E47 V74 R75 F76	E47-S72 WeakPolarHBondContact OE1-CB 3.33Å; E47-S72 PolarHBondContact OE1-OG 3.23Å; E47-S72 WeakPolarHBondContact OE2-CB 3.48Å; S72-V74 VanDerWaalsContact C-N 3.25Å; S72-V74 PolarHBondContact O-N 3.06Å; S72-V74 VanDerWaalsContact O-N 3.15Å; S72-R75 WeakPolarHBondContact O-CB 3.44Å; S72-R75 PolarHBondContact O-N 3.17Å; S72-R75 PolarHBondContact OG-NH1 2.9Å; S72-R75 VanDerWaalsContact OG-NH1 3.16Å; S72-F76 PolarHBondContact O-N 3.44Å
73	H	90.9	Very high	92.5	Very high	10 Å²	10	48.1 Å²	48.1	5%	0.046	25%	0.249	C	C	.	.	H	α-helix	trans	-54	-39.4	-169.5	-60.7	77	0	0	0	113	Y44 R75 F76 W77 Y199	Y44-H73 HydrophobicContact CD1-CB 4.39Å; Y44-H73 HydrophobicContact CE1-CB 3.8Å; Y44-H73 AromaticContact CE1-CG 3.73Å; Y44-H73 AromaticContact CE1-ND1 3.5Å; H73-R75 PolarHBondContact O-N 2.98Å; H73-F76 WeakPolarHBondContact O-CB 3.31Å; H73-F76 PolarHBondContact O-N 3.17Å; H73-W77 HydrophobicContact CB-CE3 4.14Å; H73-W77 HydrophobicContact CB-CH2 3.55Å; H73-W77 HydrophobicContact CB-CZ2 4.07Å; H73-W77 HydrophobicContact CB-CZ3 3.58Å; H73-W77 VanDerWaalsContact O-CD2 3.27Å; H73-W77 VanDerWaalsContact O-CE3 3.27Å; H73-W77 PolarHBondContact O-N 3.47Å; H73-Y199 AromaticContact CD2-CD1 3.56Å; H73-Y199 AromaticContact CD2-CD2 3.95Å; H73-Y199 AromaticContact CD2-CE1 3.87Å; H73-Y199 AromaticContact CD2-CG 3.58Å; H73-Y199 AromaticContact CE1-CD1 3.62Å; H73-Y199 AromaticContact CE1-CE1 3.92Å; H73-Y199 AromaticContact CG-CE1 3.98Å; H73-Y199 AromaticContact NE2-CD1 3.23Å; H73-Y199 WeakPolarHBondContact NE2-CD1 3.2Å; H73-Y199 AromaticContact NE2-CE1 3.86Å; H73-Y199 AromaticContact NE2-CG 3.5Å
74	V	91.6	Very high	92.3	Very high	33 Å²	33	46.1 Å²	46.1	20%	0.2	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-43.6	177.4	-172.7	0	0	0	0	111.5	T36 Y44 S72 W77 V78	T36-V74 HydrophobicContact CG2-CG1 4.38Å; Y44-V74 HydrophobicContact CD1-CG2 4.45Å; Y44-V74 HydrophobicContact CD2-CG2 3.86Å; Y44-V74 HydrophobicContact CG-CG2 3.7Å; S72-V74 VanDerWaalsContact C-N 3.25Å; S72-V74 PolarHBondContact O-N 3.06Å; S72-V74 VanDerWaalsContact O-N 3.15Å; V74-W77 PolarHBondContact O-N 3.34Å; V74-V78 WeakPolarHBondContact O-CG2 3.36Å; V74-V78 PolarHBondContact O-N 3.24Å
75	R	92.9	Very high	91.9	Very high	152 Å²	152	47.9 Å²	47.9	57%	0.574	25%	0.251	S	S	*	.	H	α-helix	trans	-64.8	-41.5	177.3	-68.2	-176.7	169.9	95.7	-4.6	111.1	L71 S72 H73 V78 F79	L71-R75 HydrophobicContact CD1-CB 3.73Å; L71-R75 HydrophobicContact CG-CB 4.47Å; S72-R75 WeakPolarHBondContact O-CB 3.44Å; S72-R75 PolarHBondContact O-N 3.17Å; S72-R75 PolarHBondContact OG-NH1 2.9Å; S72-R75 VanDerWaalsContact OG-NH1 3.16Å; H73-R75 PolarHBondContact O-N 2.98Å; R75-V78 PolarHBondContact O-N 3.21Å; R75-F79 HydrophobicContact CB-CE2 4.39Å; R75-F79 WeakPolarHBondContact O-CD2 3.37Å; R75-F79 PolarHBondContact O-N 3.29Å
76	F	94.3	Very high	91.7	Very high	10 Å²	10	49.9 Å²	49.9	4%	0.044	27%	0.267	C	S	.	.	H	α-helix	trans	-58.4	-49	174.7	177.9	-88.6	0	0	0	112.2	L71 S72 H73 V78 F79 Q80 F191 Q195 L198 Y199	L71-F76 HydrophobicContact CD2-CB 3.92Å; L71-F76 HydrophobicContact CD2-CD2 4.03Å; L71-F76 HydrophobicContact CD2-CG 4.5Å; L71-F76 HydrophobicContact CG-CB 4.37Å; S72-F76 PolarHBondContact O-N 3.44Å; H73-F76 WeakPolarHBondContact O-CB 3.31Å; H73-F76 PolarHBondContact O-N 3.17Å; F76-V78 VanDerWaalsContact C-N 3.35Å; F76-V78 PolarHBondContact O-N 2.93Å; F76-F79 PolarHBondContact O-N 2.84Å; F76-Q80 PolarHBondContact O-N 3.14Å; F76-F191 HydrophobicContact CD2-CD1 4.47Å; F76-F191 HydrophobicContact CE1-CD1 4.11Å; F76-F191 AromaticContact CE2-CD1 3.82Å; F76-F191 HydrophobicContact CE2-CD1 3.82Å; F76-F191 HydrophobicContact CE2-CE1 4.32Å; F76-F191 HydrophobicContact CZ-CB 4.33Å; F76-F191 AromaticContact CZ-CD1 3.62Å; F76-F191 HydrophobicContact CZ-CD1 3.62Å; F76-F191 HydrophobicContact CZ-CE1 4.5Å; F76-F191 HydrophobicContact CZ-CG 4.47Å; F76-F191 WeakPolarHBondContact CZ-O 3.47Å; F76-Q195 HydrophobicContact CD1-CG 4.45Å; F76-Q195 HydrophobicContact CE1-CB 3.64Å; F76-Q195 HydrophobicContact CE1-CG 3.81Å; F76-Q195 HydrophobicContact CZ-CB 3.74Å; F76-Q195 HydrophobicContact CZ-CG 4.34Å; F76-L198 HydrophobicContact CD2-CD1 3.87Å; F76-L198 HydrophobicContact CE2-CD1 3.78Å; F76-Y199 HydrophobicContact CB-CE2 4Å; F76-Y199 WeakPolarHBondContact CB-OH 3.38Å; F76-Y199 HydrophobicContact CD1-CE2 4.02Å; F76-Y199 HydrophobicContact CD2-CE2 4.02Å; F76-Y199 AromaticContact CG-CE2 3.75Å; F76-Y199 HydrophobicContact CG-CE2 3.75Å
77	W	94.2	Very high	91.6	Very high	1 Å²	1	45 Å²	45	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-65.1	-35.3	177.7	-65.4	-44.1	0	0	0	113.2	T36 Y44 H73 V74 Q80 I81 F231 M235	T36-W77 HydrophobicContact CG2-CB 3.89Å; Y44-W77 HydrophobicContact CE2-CH2 4.13Å; Y44-W77 AromaticContact CE2-CZ3 3.87Å; Y44-W77 HydrophobicContact CE2-CZ3 3.87Å; H73-W77 HydrophobicContact CB-CE3 4.14Å; H73-W77 HydrophobicContact CB-CH2 3.55Å; H73-W77 HydrophobicContact CB-CZ2 4.07Å; H73-W77 HydrophobicContact CB-CZ3 3.58Å; H73-W77 VanDerWaalsContact O-CD2 3.27Å; H73-W77 VanDerWaalsContact O-CE3 3.27Å; H73-W77 PolarHBondContact O-N 3.47Å; V74-W77 PolarHBondContact O-N 3.34Å; W77-Q80 PolarHBondContact O-N 2.77Å; W77-I81 VanDerWaalsContact O-CG1 3.3Å; W77-I81 WeakPolarHBondContact O-CG1 3.41Å; W77-I81 PolarHBondContact O-N 2.9Å; W77-F231 HydrophobicContact CE3-CE1 4.08Å; W77-F231 AromaticContact CH2-CD1 3.69Å; W77-F231 HydrophobicContact CH2-CD1 3.69Å; W77-F231 AromaticContact CH2-CE1 3.82Å; W77-F231 HydrophobicContact CH2-CE1 3.82Å; W77-F231 AromaticContact CZ3-CD1 3.78Å; W77-F231 HydrophobicContact CZ3-CD1 3.78Å; W77-F231 AromaticContact CZ3-CE1 3.47Å; W77-F231 HydrophobicContact CZ3-CE1 3.47Å; W77-F231 VanDerWaalsContact CZ3-CE1 3.47Å; W77-M235 HydrophobicContact CD2-CE 4.11Å; W77-M235 HydrophobicContact CD2-CG 4.2Å; W77-M235 HydrophobicContact CE3-CE 4.17Å; W77-M235 HydrophobicContact CG-CE 4.31Å; W77-M235 HydrophobicContact CH2-CG 4.31Å; W77-M235 HydrophobicContact CZ2-CB 3.95Å; W77-M235 HydrophobicContact CZ2-CG 3.89Å
78	V	92.6	Very high	91.2	Very high	61 Å²	61	45.4 Å²	45.4	37%	0.37	24%	0.242	S	C	.	.	H	α-helix	trans	-62.9	-47.3	172.8	168.2	0	0	0	0	111.1	T36 V74 R75 F76 Q80 I81 I82	T36-V78 HydrophobicContact CG2-CG2 3.89Å; V74-V78 WeakPolarHBondContact O-CG2 3.36Å; V74-V78 PolarHBondContact O-N 3.24Å; R75-V78 PolarHBondContact O-N 3.21Å; F76-V78 VanDerWaalsContact C-N 3.35Å; F76-V78 PolarHBondContact O-N 2.93Å; V78-Q80 VanDerWaalsContact C-N 3.33Å; V78-Q80 PolarHBondContact O-N 2.9Å; V78-I81 PolarHBondContact O-N 3.34Å; V78-I82 HydrophobicContact CG1-CD1 3.79Å; V78-I82 VanDerWaalsContact O-CG1 3.32Å; V78-I82 WeakPolarHBondContact O-CG1 3.48Å; V78-I82 PolarHBondContact O-N 3.11Å
79	F	93.8	Very high	90.9	Very high	111 Å²	111	47 Å²	47	49%	0.487	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-40.1	174.9	-71.3	-56	0	0	0	112.4	L71 R75 F76 I82 L83 F191	L71-F79 HydrophobicContact CD1-CE2 4.25Å; R75-F79 HydrophobicContact CB-CE2 4.39Å; R75-F79 WeakPolarHBondContact O-CD2 3.37Å; R75-F79 PolarHBondContact O-N 3.29Å; F76-F79 PolarHBondContact O-N 2.84Å; F79-I82 PolarHBondContact O-N 2.74Å; F79-L83 PolarHBondContact O-N 3Å; F79-F191 HydrophobicContact CB-CE1 4.35Å; F79-F191 HydrophobicContact CB-CZ 4.39Å
80	Q	94.1	Very high	90.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-45.1	174.1	-171.2	-165.2	-2.1	0	0	111.5	R32 F76 W77 V78 V84 E188 F191 T239	R32-Q80 VanDerWaalsContact CZ-CD 3.44Å; R32-Q80 VanDerWaalsContact CZ-NE2 3.35Å; F76-Q80 PolarHBondContact O-N 3.14Å; W77-Q80 PolarHBondContact O-N 2.77Å; V78-Q80 VanDerWaalsContact C-N 3.33Å; V78-Q80 PolarHBondContact O-N 2.9Å; Q80-V84 HydrophobicContact CG-CG2 4.29Å; Q80-V84 WeakPolarHBondContact O-CB 3.12Å; Q80-V84 WeakPolarHBondContact O-CG2 3.24Å; Q80-V84 PolarHBondContact O-N 3.4Å; Q80-E188 PolarHBondContact NE2-OE2 3.33Å; Q80-F191 HydrophobicContact CB-CB 4.28Å; Q80-F191 HydrophobicContact CB-CD1 3.61Å; Q80-F191 HydrophobicContact CB-CD2 4.18Å; Q80-F191 HydrophobicContact CB-CE1 3.86Å; Q80-F191 HydrophobicContact CB-CE2 4.41Å; Q80-F191 HydrophobicContact CB-CG 3.8Å; Q80-F191 HydrophobicContact CB-CZ 4.26Å; Q80-F191 HydrophobicContact CG-CB 3.52Å; Q80-F191 HydrophobicContact CG-CD1 3.85Å; Q80-F191 HydrophobicContact CG-CD2 3.84Å; Q80-F191 HydrophobicContact CG-CE1 4.48Å; Q80-F191 HydrophobicContact CG-CE2 4.49Å; Q80-F191 HydrophobicContact CG-CG 3.49Å; Q80-F191 VanDerWaalsContact CG-CG 3.49Å; Q80-T239 VanDerWaalsContact NE2-CG2 3.28Å; Q80-T239 PolarHBondContact NE2-OG1 3.43Å
81	I	90.4	Very high	90.5	Very high	29 Å²	29	49.3 Å²	49.3	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-46.4	177.7	-71.8	167	0	0	0	110.4	R32 I33 T36 W77 V78 A85	R32-I81 HydrophobicContact CG-CD1 4.42Å; I33-I81 HydrophobicContact CD1-CG2 4.46Å; I33-I81 HydrophobicContact CG1-CD1 4.09Å; I33-I81 HydrophobicContact CG1-CG2 4.02Å; T36-I81 HydrophobicContact CG2-CD1 4.33Å; T36-I81 WeakPolarHBondContact OG1-CD1 3.45Å; W77-I81 VanDerWaalsContact O-CG1 3.3Å; W77-I81 WeakPolarHBondContact O-CG1 3.41Å; W77-I81 PolarHBondContact O-N 2.9Å; V78-I81 PolarHBondContact O-N 3.34Å; I81-A85 VanDerWaalsContact O-CB 3.29Å; I81-A85 WeakPolarHBondContact O-CB 3.4Å; I81-A85 PolarHBondContact O-N 3.33Å
82	I	91.3	Very high	90	Very high	89 Å²	89	50 Å²	50	46%	0.456	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-54.1	-177.9	-67.6	165.6	0	0	0	110.9	V78 F79 V84 A85 T86	V78-I82 HydrophobicContact CG1-CD1 3.79Å; V78-I82 VanDerWaalsContact O-CG1 3.32Å; V78-I82 WeakPolarHBondContact O-CG1 3.48Å; V78-I82 PolarHBondContact O-N 3.11Å; F79-I82 PolarHBondContact O-N 2.74Å; I82-V84 VanDerWaalsContact C-N 3.33Å; I82-V84 PolarHBondContact O-N 2.86Å; I82-A85 PolarHBondContact O-N 2.99Å; I82-T86 PolarHBondContact O-N 3.47Å; I82-T86 PolarHBondContact O-OG1 2.91Å
83	L	92.8	Very high	89.6	Confident	73 Å²	73	51.6 Å²	51.6	38%	0.382	28%	0.278	S	S	.	.	H	α-helix	trans	-68.6	-30.1	-177.1	-65.6	-166.5	0	0	0	113.1	F79 P87 F187 F191	F79-L83 PolarHBondContact O-N 3Å; L83-P87 WeakPolarHBondContact O-CD 3.42Å; L83-F187 WeakPolarHBondContact O-CD2 3.29Å; L83-F191 HydrophobicContact CB-CE2 3.93Å; L83-F191 HydrophobicContact CB-CZ 4.38Å; L83-F191 HydrophobicContact CD1-CE2 3.9Å; L83-F191 HydrophobicContact CD1-CZ 3.88Å; L83-F191 HydrophobicContact CG-CE2 4.34Å; L83-F191 HydrophobicContact CG-CZ 4.36Å
84	V	90.1	Very high	89.4	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-73.1	-31.6	174.7	170	0	0	0	0	111.7	Q80 I82 R184 F187 E188	Q80-V84 HydrophobicContact CG-CG2 4.29Å; Q80-V84 WeakPolarHBondContact O-CB 3.12Å; Q80-V84 WeakPolarHBondContact O-CG2 3.24Å; Q80-V84 PolarHBondContact O-N 3.4Å; I82-V84 VanDerWaalsContact C-N 3.33Å; I82-V84 PolarHBondContact O-N 2.86Å; V84-R184 HydrophobicContact CG1-CG 3.84Å; V84-F187 HydrophobicContact CG2-CB 3.99Å; V84-E188 HydrophobicContact CG1-CG 3.85Å; V84-E188 HydrophobicContact CG2-CG 3.77Å; V84-E188 WeakPolarHBondContact CG2-OE2 3.47Å
85	A	87.6	Confident	88.9	Confident	38 Å²	38	54 Å²	54	31%	0.314	29%	0.285	S	S	.	.	H	α-helix	trans	-76.7	-32	174.9	0	0	0	0	0	113.1	I81 I82 S88 V89	I81-A85 VanDerWaalsContact O-CB 3.29Å; I81-A85 WeakPolarHBondContact O-CB 3.4Å; I81-A85 PolarHBondContact O-N 3.33Å; I82-A85 PolarHBondContact O-N 2.99Å; A85-S88 PolarHBondContact O-N 3.19Å; A85-S88 VanDerWaalsContact O-N 3.15Å; A85-V89 WeakPolarHBondContact O-CG2 3.4Å; A85-V89 PolarHBondContact O-N 2.89Å
86	T	89.6	Confident	88.3	Confident	71 Å²	71	49.8 Å²	49.8	44%	0.436	27%	0.273	S	S	.	.	H	α-helix	trans	-54.3	-47.1	-174.3	-61.7	0	0	0	0	114.5	I82 S88 V89 M90	I82-T86 PolarHBondContact O-N 3.47Å; I82-T86 PolarHBondContact O-OG1 2.91Å; T86-S88 VanDerWaalsContact C-N 3.31Å; T86-S88 PolarHBondContact O-N 3.23Å; T86-V89 PolarHBondContact O-N 3.33Å; T86-M90 VanDerWaalsContact O-CB 3.31Å; T86-M90 WeakPolarHBondContact O-CB 3.45Å; T86-M90 PolarHBondContact O-N 3.46Å
87	P	90.5	Very high	87.7	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.039	30%	0.298	C	S	.	.	H	α-helix	trans	-56.9	-41.8	176.7	-27.2	34.5	0	0	0	113.5	L83 Y91 Q180 A183 R184 F187	L83-P87 WeakPolarHBondContact O-CD 3.42Å; P87-Y91 WeakPolarHBondContact O-CB 3.36Å; P87-Y91 PolarHBondContact O-N 3.06Å; P87-Q180 HydrophobicContact CB-CB 3.98Å; P87-A183 HydrophobicContact CB-CB 4.26Å; P87-A183 HydrophobicContact CG-CB 4.1Å; P87-R184 HydrophobicContact CG-CB 4.5Å; P87-F187 HydrophobicContact CG-CD2 3.91Å; P87-F187 HydrophobicContact CG-CE2 3.85Å
88	S	84.6	Confident	87.1	Confident	32 Å²	32	57.2 Å²	57.2	22%	0.224	31%	0.307	C	S	.	.	H	α-helix	trans	-72.2	-42	179.7	-58.9	0	0	0	0	111.5	A85 T86 M90 Y91 L92 Q180	A85-S88 PolarHBondContact O-N 3.19Å; A85-S88 VanDerWaalsContact O-N 3.15Å; T86-S88 VanDerWaalsContact C-N 3.31Å; T86-S88 PolarHBondContact O-N 3.23Å; S88-M90 VanDerWaalsContact C-N 3.32Å; S88-M90 PolarHBondContact O-N 3.44Å; S88-Y91 PolarHBondContact O-N 3.35Å; S88-L92 VanDerWaalsContact O-CG 3.27Å; S88-L92 WeakPolarHBondContact O-CG 3.42Å; S88-L92 PolarHBondContact O-N 3.2Å; S88-Q180 PolarHBondContact OG-OE1 3.23Å
89	V	84.8	Confident	86.4	Confident	94 Å²	94	57.4 Å²	57.4	57%	0.57	31%	0.305	S	S	*	.	H	α-helix	trans	-60.9	-41.1	173.1	175	0	0	0	0	111.5	A85 T86 L92 G93	A85-V89 WeakPolarHBondContact O-CG2 3.4Å; A85-V89 PolarHBondContact O-N 2.89Å; T86-V89 PolarHBondContact O-N 3.33Å; V89-L92 PolarHBondContact O-N 3.17Å; V89-G93 PolarHBondContact O-N 2.89Å
90	M	87.6	Confident	85.7	Confident	130 Å²	130	53.9 Å²	53.9	64%	0.64	30%	0.296	S	S	*	.	H	α-helix	trans	-64.4	-40.7	176.3	-174.7	178	62.3	0	0	112	T86 S88 G93 Y94	T86-M90 VanDerWaalsContact O-CB 3.31Å; T86-M90 WeakPolarHBondContact O-CB 3.45Å; T86-M90 PolarHBondContact O-N 3.46Å; S88-M90 VanDerWaalsContact C-N 3.32Å; S88-M90 PolarHBondContact O-N 3.44Å; M90-G93 PolarHBondContact O-N 2.93Å; M90-Y94 WeakPolarHBondContact O-CB 3.49Å; M90-Y94 PolarHBondContact O-N 2.72Å
91	Y	84.4	Confident	85	Confident	32 Å²	32	61.2 Å²	61.2	13%	0.125	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-43.1	173.4	172	-94	0	0	0	112.4	P87 S88 Y94 A95 I176 Y177 Q180	P87-Y91 WeakPolarHBondContact O-CB 3.36Å; P87-Y91 PolarHBondContact O-N 3.06Å; S88-Y91 PolarHBondContact O-N 3.35Å; Y91-Y94 PolarHBondContact O-N 2.91Å; Y91-A95 WeakPolarHBondContact O-CB 3.46Å; Y91-A95 PolarHBondContact O-N 3.31Å; Y91-I176 HydrophobicContact CD2-CG2 4.12Å; Y91-Y177 HydrophobicContact CD1-CD2 4.36Å; Y91-Y177 HydrophobicContact CD2-CD2 4.39Å; Y91-Y177 AromaticContact CE1-CD2 3.85Å; Y91-Y177 HydrophobicContact CE1-CD2 3.85Å; Y91-Y177 HydrophobicContact CE1-CE2 4.34Å; Y91-Y177 AromaticContact CE2-CD2 3.88Å; Y91-Y177 HydrophobicContact CE2-CD2 3.88Å; Y91-Y177 HydrophobicContact CE2-CG 4.38Å; Y91-Y177 AromaticContact CZ-CD2 3.6Å; Y91-Q180 HydrophobicContact CD2-CG 4.11Å; Y91-Q180 HydrophobicContact CG-CG 3.96Å
92	L	80.3	Confident	84.1	Confident	69 Å²	69	63.3 Å²	63.3	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-59	-49.1	174.8	-67.3	173.5	0	0	0	111	I13 S88 V89 Y94 A95 I96	I13-L92 HydrophobicContact CD1-CD2 3.28Å; I13-L92 HydrophobicContact CG1-CD2 4.48Å; S88-L92 VanDerWaalsContact O-CG 3.27Å; S88-L92 WeakPolarHBondContact O-CG 3.42Å; S88-L92 PolarHBondContact O-N 3.2Å; V89-L92 PolarHBondContact O-N 3.17Å; L92-Y94 PolarHBondContact O-N 3.48Å; L92-A95 PolarHBondContact O-N 3.23Å; L92-I96 WeakPolarHBondContact O-CB 3.45Å; L92-I96 WeakPolarHBondContact O-CD1 3.32Å; L92-I96 VanDerWaalsContact O-CG1 3.24Å; L92-I96 WeakPolarHBondContact O-CG1 3.19Å; L92-I96 PolarHBondContact O-N 3.46Å
93	G	84.2	Confident	83.2	Confident	37 Å²	37	65.6 Å²	65.6	38%	0.381	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-42.3	176.8	0	0	0	0	0	113.2	V89 M90 H97	V89-G93 PolarHBondContact O-N 2.89Å; M90-G93 PolarHBondContact O-N 2.93Å; G93-H97 WeakPolarHBondContact O-CB 3.43Å; G93-H97 PolarHBondContact O-N 2.94Å
94	Y	84.9	Confident	81.9	Confident	90 Å²	90	68.5 Å²	68.5	35%	0.353	36%	0.358	S	S	.	.	H	α-helix	trans	-62.6	-45.7	174.7	177.8	-88.9	0	0	0	112.1	M90 Y91 L92 H97 K98 I176	M90-Y94 WeakPolarHBondContact O-CB 3.49Å; M90-Y94 PolarHBondContact O-N 2.72Å; Y91-Y94 PolarHBondContact O-N 2.91Å; L92-Y94 PolarHBondContact O-N 3.48Å; Y94-H97 PolarHBondContact O-N 3Å; Y94-K98 HydrophobicContact CE1-CB 4.31Å; Y94-K98 HydrophobicContact CE1-CD 3.88Å; Y94-K98 VanDerWaalsContact O-CB 3.3Å; Y94-K98 WeakPolarHBondContact O-CB 3.5Å; Y94-K98 PolarHBondContact O-N 3.5Å; Y94-I176 HydrophobicContact CD1-CD1 3.96Å; Y94-I176 HydrophobicContact CE1-CD1 3.36Å; Y94-I176 HydrophobicContact CE2-CD1 4.02Å
95	A	81.6	Confident	80.6	Confident	5 Å²	5	69.4 Å²	69.4	4%	0.041	37%	0.369	C	S	.	.	H	α-helix	trans	-61.9	-46.8	178.7	0	0	0	0	0	111.3	Y91 L92 K98 I99	Y91-A95 WeakPolarHBondContact O-CB 3.46Å; Y91-A95 PolarHBondContact O-N 3.31Å; L92-A95 PolarHBondContact O-N 3.23Å; A95-K98 PolarHBondContact O-N 2.94Å; A95-I99 WeakPolarHBondContact O-CB 3.23Å; A95-I99 WeakPolarHBondContact O-CD1 3.28Å; A95-I99 VanDerWaalsContact O-CG1 3.24Å; A95-I99 WeakPolarHBondContact O-CG1 3.38Å; A95-I99 PolarHBondContact O-N 2.68Å
96	I	80.5	Confident	79.5	Confident	63 Å²	63	70.8 Å²	70.8	32%	0.323	37%	0.369	S	S	.	.	H	α-helix	trans	-54.8	-54.5	174.7	-71.5	162.4	0	0	0	111	F5 L9 L92 K98 I99 A100	F5-I96 HydrophobicContact CE1-CG2 4.25Å; L9-I96 HydrophobicContact CD1-CD1 4.16Å; L9-I96 HydrophobicContact CD1-CG1 3.59Å; L92-I96 WeakPolarHBondContact O-CB 3.45Å; L92-I96 WeakPolarHBondContact O-CD1 3.32Å; L92-I96 VanDerWaalsContact O-CG1 3.24Å; L92-I96 WeakPolarHBondContact O-CG1 3.19Å; L92-I96 PolarHBondContact O-N 3.46Å; I96-K98 VanDerWaalsContact C-N 3.33Å; I96-K98 PolarHBondContact O-N 3.37Å; I96-I99 PolarHBondContact O-N 2.92Å; I96-A100 WeakPolarHBondContact O-CB 3.37Å; I96-A100 PolarHBondContact O-N 3.34Å
97	H	82.6	Confident	78.2	Confident	125 Å²	125	69.9 Å²	69.9	58%	0.579	37%	0.368	S	S	*	.	H	α-helix	trans	-61.9	-39.9	-178.4	172.8	-108.4	0	0	0	112.2	G93 Y94 K101	G93-H97 WeakPolarHBondContact O-CB 3.43Å; G93-H97 PolarHBondContact O-N 2.94Å; Y94-H97 PolarHBondContact O-N 3Å; H97-K101 WeakPolarHBondContact O-CB 3.22Å; H97-K101 PolarHBondContact O-N 2.97Å; H97-K101 VanDerWaalsContact O-N 3.12Å
98	K	80.8	Confident	76.8	Confident	41 Å²	41	75 Å²	75	18%	0.178	40%	0.396	C	S	.	.	H	α-helix	trans	-68.6	-41.6	177.8	179.1	160.8	174.3	168.9	0	112.4	Y94 A95 I96 K101 M102 D171 L173	Y94-K98 HydrophobicContact CE1-CB 4.31Å; Y94-K98 HydrophobicContact CE1-CD 3.88Å; Y94-K98 VanDerWaalsContact O-CB 3.3Å; Y94-K98 WeakPolarHBondContact O-CB 3.5Å; Y94-K98 PolarHBondContact O-N 3.5Å; A95-K98 PolarHBondContact O-N 2.94Å; I96-K98 VanDerWaalsContact C-N 3.33Å; I96-K98 PolarHBondContact O-N 3.37Å; K98-K101 PolarHBondContact O-N 3.25Å; K98-M102 HydrophobicContact CD-CE 4.4Å; K98-M102 VanDerWaalsContact CE-CE 3.49Å; K98-M102 HydrophobicContact CG-CE 4.02Å; K98-M102 WeakPolarHBondContact O-CG 3.15Å; K98-M102 PolarHBondContact O-N 3.43Å; K98-M102 VanDerWaalsContact O-N 3.13Å; K98-D171 VanDerWaalsContact CE-OD1 3.24Å; K98-D171 WeakPolarHBondContact CE-OD1 3.31Å; K98-D171 PolarHBondContact NZ-O 2.82Å; K98-D171 IonicContact NZ-OD1 2.68Å; K98-D171 PolarHBondContact NZ-OD1 3.14Å; K98-L173 HydrophobicContact CD-CD1 3.77Å
99	I	78	Confident	75.8	Confident	66 Å²	66	80.8 Å²	80.8	34%	0.338	42%	0.416	S	S	.	.	H	α-helix	trans	-63.4	-49.8	176.9	-70	164.3	0	0	0	110.4	L9 A95 I96 K101 M102 E103	L9-I99 HydrophobicContact CD2-CD1 3.85Å; A95-I99 WeakPolarHBondContact O-CB 3.23Å; A95-I99 WeakPolarHBondContact O-CD1 3.28Å; A95-I99 VanDerWaalsContact O-CG1 3.24Å; A95-I99 WeakPolarHBondContact O-CG1 3.38Å; A95-I99 PolarHBondContact O-N 2.68Å; I96-I99 PolarHBondContact O-N 2.92Å; I99-K101 VanDerWaalsContact C-N 3.27Å; I99-K101 PolarHBondContact O-N 3.1Å; I99-M102 WeakPolarHBondContact O-CB 3.42Å; I99-M102 PolarHBondContact O-N 2.94Å; I99-E103 PolarHBondContact O-N 3.32Å; I99-E103 VanDerWaalsContact O-N 3.09Å
100	A	79.3	Confident	74.7	Confident	36 Å²	36	82.7 Å²	82.7	30%	0.298	42%	0.417	S	S	.	.	H	α-helix	trans	-57	-40.6	177.8	0	0	0	0	0	112.1	I96 M102 E103 H104	I96-A100 WeakPolarHBondContact O-CB 3.37Å; I96-A100 PolarHBondContact O-N 3.34Å; A100-M102 VanDerWaalsContact C-N 3.34Å; A100-M102 PolarHBondContact O-N 2.92Å; A100-E103 PolarHBondContact O-N 3.27Å; A100-H104 PolarHBondContact O-CD2 3.45Å; A100-H104 PolarHBondContact O-N 3.31Å
101	K	78.9	Confident	73.4	Confident	154 Å²	154	79.2 Å²	79.2	67%	0.67	41%	0.409	S	S	*	.	H	α-helix	trans	-65.9	-31.3	176.1	-171.1	169.9	-177.4	173.3	0	113.4	H97 K98 I99 G105	H97-K101 WeakPolarHBondContact O-CB 3.22Å; H97-K101 PolarHBondContact O-N 2.97Å; H97-K101 VanDerWaalsContact O-N 3.12Å; K98-K101 PolarHBondContact O-N 3.25Å; I99-K101 VanDerWaalsContact C-N 3.27Å; I99-K101 PolarHBondContact O-N 3.1Å; K101-G105 PolarHBondContact O-N 3.23Å
102	M	72.4	Confident	72.2	Confident	73 Å²	73	81 Å²	81	36%	0.36	43%	0.431	S	S	.	.	H	α-helix	trans	-68.6	-41.5	171.8	-67.6	-173.8	-168	0	0	111.9	K98 I99 A100 G105 E106 D171	K98-M102 HydrophobicContact CD-CE 4.4Å; K98-M102 VanDerWaalsContact CE-CE 3.49Å; K98-M102 HydrophobicContact CG-CE 4.02Å; K98-M102 WeakPolarHBondContact O-CG 3.15Å; K98-M102 PolarHBondContact O-N 3.43Å; K98-M102 VanDerWaalsContact O-N 3.13Å; I99-M102 WeakPolarHBondContact O-CB 3.42Å; I99-M102 PolarHBondContact O-N 2.94Å; A100-M102 VanDerWaalsContact C-N 3.34Å; A100-M102 PolarHBondContact O-N 2.92Å; M102-G105 CarbonylContact O-C 3.6Å; M102-G105 PolarHBondContact O-N 3.43Å; M102-E106 PolarHBondContact O-N 2.93Å; M102-D171 WeakPolarHBondContact CE-OD2 3.43Å
103	E	70.9	Confident	71.2	Confident	138 Å²	138	88.9 Å²	88.9	65%	0.645	46%	0.455	S	S	*	.	H	α-helix	trans	-63.3	-49	-176.8	-171	169.4	-173.4	0	0	111.8	I99 A100 G105 E106 A107	I99-E103 PolarHBondContact O-N 3.32Å; I99-E103 VanDerWaalsContact O-N 3.09Å; A100-E103 PolarHBondContact O-N 3.27Å; E103-G105 VanDerWaalsContact C-N 3.34Å; E103-G105 PolarHBondContact O-N 3.34Å; E103-E106 PolarHBondContact O-N 2.94Å; E103-A107 PolarHBondContact O-N 3.01Å
104	H	65.6	Low	69.6	Low	134 Å²	134	91.2 Å²	91.2	62%	0.62	47%	0.466	S	S	*	.	H	α-helix	trans	-57.2	-46.1	171	-71.2	-68.2	0	0	0	111.8	A100 E106 A107 D108	A100-H104 PolarHBondContact O-CD2 3.45Å; A100-H104 PolarHBondContact O-N 3.31Å; H104-E106 VanDerWaalsContact C-N 3.28Å; H104-E106 PolarHBondContact O-N 2.8Å; H104-A107 WeakPolarHBondContact O-CB 3.4Å; H104-A107 PolarHBondContact O-N 2.89Å; H104-A107 VanDerWaalsContact O-N 3.07Å; H104-D108 PolarHBondContact O-N 2.98Å
105	G	64.1	Low	67.7	Low	24 Å²	24	94.9 Å²	94.9	25%	0.247	48%	0.484	C	S	.	.	H	α-helix	trans	-67.2	-20.1	180	0	0	0	0	0	115.4	K101 M102 E103 K109	K101-G105 PolarHBondContact O-N 3.23Å; M102-G105 CarbonylContact O-C 3.6Å; M102-G105 PolarHBondContact O-N 3.43Å; E103-G105 VanDerWaalsContact C-N 3.34Å; E103-G105 PolarHBondContact O-N 3.34Å; G105-K109 WeakPolarHBondContact O-CD 3.44Å; G105-K109 WeakPolarHBondContact O-CE 3.06Å; G105-K109 VanDerWaalsContact O-CG 3.23Å; G105-K109 WeakPolarHBondContact O-CG 3.25Å
106	E	64.3	Low	66	Low	67 Å²	67	100.2 Å²	100.2	31%	0.313	52%	0.518	S	S	.	.	H	α-helix	trans	-89.1	-26	168.6	-74.3	-158.9	177.3	0	0	112.7	M102 E103 H104 K110 R167	M102-E106 PolarHBondContact O-N 2.93Å; E103-E106 PolarHBondContact O-N 2.94Å; H104-E106 VanDerWaalsContact C-N 3.28Å; H104-E106 PolarHBondContact O-N 2.8Å; E106-K110 WeakPolarHBondContact O-CD 3.35Å; E106-K110 VanDerWaalsContact O-CG 3.25Å; E106-K110 WeakPolarHBondContact O-CG 3.27Å; E106-K110 PolarHBondContact O-N 3.13Å; E106-K110 VanDerWaalsContact O-N 3.14Å; E106-K110 IonicContact OE2-NZ 3.35Å; E106-R167 IonicContact OE1-CZ 2.64Å; E106-R167 IonicContact OE1-NH1 2.87Å; E106-R167 PolarHBondContact OE1-NH1 3.49Å; E106-R167 IonicContact OE1-NH2 3.34Å; E106-R167 PolarHBondContact OE1-NH2 3.45Å
107	A	62.4	Low	64.3	Low	52 Å²	52	108.5 Å²	108.5	43%	0.43	55%	0.547	S	S	.	.	H	α-helix	trans	-65.6	-49.6	171.4	0	0	0	0	0	111.5	E103 H104 K109 K110 A111	E103-A107 PolarHBondContact O-N 3.01Å; H104-A107 WeakPolarHBondContact O-CB 3.4Å; H104-A107 PolarHBondContact O-N 2.89Å; H104-A107 VanDerWaalsContact O-N 3.07Å; A107-K109 VanDerWaalsContact C-N 3.28Å; A107-K109 PolarHBondContact O-N 3.2Å; A107-K110 WeakPolarHBondContact O-CB 3.49Å; A107-K110 PolarHBondContact O-N 2.79Å; A107-A111 PolarHBondContact O-N 3.31Å
108	D	61.3	Low	62.4	Low	114 Å²	114	107 Å²	107	61%	0.61	56%	0.557	S	S	*	*	H	α-helix	trans	-58.4	-39.7	177.2	-69.4	-29	0	0	0	112	H104 K110 A111 A112	H104-D108 PolarHBondContact O-N 2.98Å; D108-K110 VanDerWaalsContact C-N 3.34Å; D108-K110 PolarHBondContact O-N 3.29Å; D108-A111 PolarHBondContact O-N 3.43Å; D108-A112 VanDerWaalsContact O-CB 3.3Å; D108-A112 WeakPolarHBondContact O-CB 3.23Å; D108-A112 PolarHBondContact O-N 3.17Å
109	K	63.2	Low	60.6	Low	152 Å²	152	112 Å²	112	66%	0.661	58%	0.582	S	S	*	*	H	α-helix	trans	-68.7	-30.4	177.2	-71.8	172.3	-168.6	169.9	0	113	G105 A107 R113	G105-K109 WeakPolarHBondContact O-CD 3.44Å; G105-K109 WeakPolarHBondContact O-CE 3.06Å; G105-K109 VanDerWaalsContact O-CG 3.23Å; G105-K109 WeakPolarHBondContact O-CG 3.25Å; A107-K109 VanDerWaalsContact C-N 3.28Å; A107-K109 PolarHBondContact O-N 3.2Å; K109-R113 WeakPolarHBondContact O-CB 3.21Å; K109-R113 PolarHBondContact O-N 3.45Å
110	K	61.1	Low	58.5	Low	135 Å²	135	120 Å²	120	59%	0.587	61%	0.608	S	S	*	*	H	α-helix	trans	-71.2	-46.8	172.7	-72	160.9	-170.6	163.5	0	110.2	E106 A107 D108 A112 R113 S114	E106-K110 WeakPolarHBondContact O-CD 3.35Å; E106-K110 VanDerWaalsContact O-CG 3.25Å; E106-K110 WeakPolarHBondContact O-CG 3.27Å; E106-K110 PolarHBondContact O-N 3.13Å; E106-K110 VanDerWaalsContact O-N 3.14Å; E106-K110 IonicContact OE2-NZ 3.35Å; A107-K110 WeakPolarHBondContact O-CB 3.49Å; A107-K110 PolarHBondContact O-N 2.79Å; D108-K110 VanDerWaalsContact C-N 3.34Å; D108-K110 PolarHBondContact O-N 3.29Å; K110-A112 PolarHBondContact O-N 2.83Å; K110-R113 PolarHBondContact O-N 2.93Å; K110-R113 VanDerWaalsContact O-N 3.14Å; K110-S114 PolarHBondContact O-N 3.22Å; K110-S114 PolarHBondContact O-OG 3.13Å
111	A	60	Low	56.2	Low	56 Å²	56	128.3 Å²	128.3	46%	0.463	63%	0.632	S	S	.	*	H	α-helix	trans	-63	-38.6	176.9	0	0	0	0	0	113.3	A107 D108 R113 S114	A107-A111 PolarHBondContact O-N 3.31Å; D108-A111 PolarHBondContact O-N 3.43Å; A111-R113 VanDerWaalsContact C-N 3.29Å; A111-R113 PolarHBondContact O-N 2.95Å; A111-S114 PolarHBondContact O-N 3.2Å; A111-S114 PolarHBondContact O-OG 3.35Å
112	A	59.4	Low	54	Low	71 Å²	71	129.1 Å²	129.1	59%	0.587	64%	0.635	S	S	*	*	H	α-helix	trans	-65	-33.1	174.3	0	0	0	0	0	112.6	D108 K110	D108-A112 VanDerWaalsContact O-CB 3.3Å; D108-A112 WeakPolarHBondContact O-CB 3.23Å; D108-A112 PolarHBondContact O-N 3.17Å; K110-A112 PolarHBondContact O-N 2.83Å
113	R	59.7	Low	52.1	Low	233 Å²	233	134.4 Å²	134.4	88%	0.879	66%	0.659	S	S	*	*	H	α-helix	trans	-85.5	-14.4	-179.8	-163	174.2	-172.8	171.6	4.6	113.6	K109 K110 A111	K109-R113 WeakPolarHBondContact O-CB 3.21Å; K109-R113 PolarHBondContact O-N 3.45Å; K110-R113 PolarHBondContact O-N 2.93Å; K110-R113 VanDerWaalsContact O-N 3.14Å; A111-R113 VanDerWaalsContact C-N 3.29Å; A111-R113 PolarHBondContact O-N 2.95Å
114	S	50.7	Low	50.3	Low	87 Å²	87	135.5 Å²	135.5	61%	0.608	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	12.7	178.8	70.7	0	0	0	0	114.1	K110 A111 P116	K110-S114 PolarHBondContact O-N 3.22Å; K110-S114 PolarHBondContact O-OG 3.13Å; A111-S114 PolarHBondContact O-N 3.2Å; A111-S114 PolarHBondContact O-OG 3.35Å; S114-P116 VanDerWaalsContact O-CD 3.31Å; S114-P116 WeakPolarHBondContact O-CD 3.23Å
115	K	44.8	Very low	48.5	Very low	167 Å²	167	140.3 Å²	140.3	73%	0.726	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-74.4	116.8	170.3	-70.3	-173	175.9	-175.8	0	109.4
116	P	46.8	Very low	46.9	Very low	117 Å²	117	142.8 Å²	142.8	76%	0.76	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-64.5	159.5	165.9	29.9	-34.1	0	0	0	109.7	S114 A118	S114-P116 VanDerWaalsContact O-CD 3.31Å; S114-P116 WeakPolarHBondContact O-CD 3.23Å; P116-A118 PolarHBondContact O-N 2.82Å
117	Y	44.2	Very low	45.4	Very low	236 Å²	236	146.6 Å²	146.6	93%	0.925	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-56	130	178	-85.1	-105.6	0	0	0	110.6	M119	Y117-M119 PolarHBondContact O-N 2.89Å
118	A	42.1	Very low	43.9	Very low	95 Å²	95	151.5 Å²	151.5	79%	0.785	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-67.6	119	179.1	0	0	0	0	0	110.1	P116 R120	P116-A118 PolarHBondContact O-N 2.82Å; A118-R120 PolarHBondContact O-N 3.14Å; A118-R120 VanDerWaalsContact O-N 3.08Å
119	M	42.5	Very low	42.3	Very low	146 Å²	146	154.1 Å²	154.1	72%	0.719	74%	0.739	S	S	*	*			trans	-59.8	115.1	176.1	-87.7	-139.4	-107.9	0	0	110.9	Y117 W121	Y117-M119 PolarHBondContact O-N 2.89Å; M119-W121 VanDerWaalsContact C-N 3.3Å; M119-W121 HydrophobicContact CE-CZ2 3.99Å; M119-W121 PolarHBondContact O-N 2.87Å; M119-W121 VanDerWaalsContact O-N 3.07Å; M119-W121 HydrophobicContact SD-CZ2 4.01Å
120	R	36	Very low	40.7	Very low	234 Å²	234	152.4 Å²	152.4	88%	0.883	74%	0.742	S	S	*	*			trans	-83.9	72.1	179.7	-179.2	59.3	167.1	177.4	-2.3	109.7	A118 K122	A118-R120 PolarHBondContact O-N 3.14Å; A118-R120 VanDerWaalsContact O-N 3.08Å; R120-K122 PolarHBondContact O-N 3.42Å
121	W	29.5	Very low	39.2	Very low	210 Å²	210	155 Å²	155	80%	0.795	76%	0.756	S	S	*	*			trans	-55.2	122.6	172.7	-65.7	99.2	0	0	0	110.3	M119	M119-W121 VanDerWaalsContact C-N 3.3Å; M119-W121 HydrophobicContact CE-CZ2 3.99Å; M119-W121 PolarHBondContact O-N 2.87Å; M119-W121 VanDerWaalsContact O-N 3.07Å; M119-W121 HydrophobicContact SD-CZ2 4.01Å
122	K	33.7	Very low	37.7	Very low	170 Å²	170	161.1 Å²	161.1	74%	0.739	78%	0.775	S	S	*	*			trans	-118.1	92.6	-178.7	-169.6	-169.9	-180	-162.7	0	108.4	R120 H124	R120-K122 PolarHBondContact O-N 3.42Å; K122-H124 PolarHBondContact O-N 2.89Å
123	Q	32.3	Very low	36.1	Very low	185 Å²	185	165.2 Å²	165.2	86%	0.864	79%	0.787	S	S	*	*			trans	-73.7	124.8	-173.3	-167.5	169.3	12.2	0	0	111.2
124	H	33.6	Very low	34.7	Very low	161 Å²	161	161.5 Å²	161.5	75%	0.745	79%	0.785	S	S	*	*			trans	-85.6	143.4	173.8	-99.4	-116.7	0	0	0	111.8	K122	K122-H124 PolarHBondContact O-N 2.89Å
125	R	27.5	Very low	34	Very low	234 Å²	234	165.7 Å²	165.7	88%	0.883	79%	0.794	S	S	*	*			trans	-155.5	146.3	165.3	-91.5	-171.5	164.1	172.9	-5.5	106.5
126	A	30	Very low	33.3	Very low	76 Å²	76	166.9 Å²	166.9	63%	0.628	80%	0.803	S	S	*	*			cis	-168.5	169.7	-16.4	0	0	0	0	0	107.7
127	L	33.2	Very low	32.6	Very low	147 Å²	147	168.5 Å²	168.5	77%	0.77	81%	0.805	S	S	*	*			trans	69.5	147	166.8	-51.4	175.1	0	0	0	114
128	E	30.2	Very low	32.2	Very low	155 Å²	155	163 Å²	163	72%	0.724	80%	0.798	S	S	*	*			cis	-159.7	163.1	0.1	-109.4	145.5	-170.8	0	0	105.2
129	E	27.2	Very low	31.8	Very low	170 Å²	170	165 Å²	165	79%	0.794	79%	0.793	S	S	*	*			cis	-156.3	-145.6	11.3	-152.3	171	-149.4	0	0	110
130	T	30.8	Very low	31	Very low	116 Å²	116	166.8 Å²	166.8	71%	0.712	80%	0.802	S	S	*	*			trans	58.4	83.2	164.4	69.3	0	0	0	0	121.6
131	E	29.3	Very low	30.8	Very low	188 Å²	188	163.4 Å²	163.4	88%	0.879	79%	0.79	S	S	*	*				53.1	145.8	115.2	-63.4	-176.1	139.4	0	0	125.2
132	E	27.7	Very low	31.1	Very low	185 Å²	185	159.3 Å²	159.3	86%	0.864	79%	0.791	S	S	*	*			trans	76.1	120	163.1	-69.6	-173.5	158.7	0	0	122.7
133	D	26.6	Very low	31	Very low	158 Å²	158	159.4 Å²	159.4	85%	0.845	79%	0.794	S	S	*	*			trans	69.5	113.5	151.8	-74.6	9.4	0	0	0	125.3
134	N	30.7	Very low	31.3	Very low	155 Å²	155	158.5 Å²	158.5	83%	0.829	79%	0.792	S	S	*	*			trans	98.9	151.5	143.1	-142.5	16.7	0	0	0	119.4
135	E	34.4	Very low	31.2	Very low	174 Å²	174	159.6 Å²	159.6	81%	0.813	80%	0.797	S	S	*	*			trans	-87.8	143.1	-161.5	-54.3	177.4	121.3	0	0	113.8
136	E	30.5	Very low	31.7	Very low	192 Å²	192	156.1 Å²	156.1	90%	0.897	80%	0.795	S	S	*	*				168.5	157.6	129.1	-93.4	-178.9	-155.1	0	0	112.4	P138	E136-P138 WeakPolarHBondContact O-CD 3.31Å
137	D	33	Very low	31.8	Very low	151 Å²	151	161.4 Å²	161.4	81%	0.807	81%	0.807	S	S	*	*			trans	-82.3	120.9	-174.5	-127.2	-18	0	0	0	111.9	M139	D137-M139 PolarHBondContact O-N 2.93Å
138	P	36	Very low	31.5	Very low	121 Å²	121	158.7 Å²	158.7	79%	0.786	80%	0.8	S	S	*	*			trans	-71.6	87.6	-179.2	-21.5	35.1	0	0	0	114.1	E136 M140	E136-P138 WeakPolarHBondContact O-CD 3.31Å; P138-M140 PolarHBondContact O-N 2.76Å
139	M	32.2	Very low	31.7	Very low	138 Å²	138	159.2 Å²	159.2	68%	0.68	81%	0.808	S	S	*	*			trans	-64.9	101.3	170.2	-80.1	-163.9	-74.8	0	0	111.9	D137 Y141	D137-M139 PolarHBondContact O-N 2.93Å; M139-Y141 HydrophobicContact CB-CE2 4.22Å; M139-Y141 VanDerWaalsContact CE-OH 3.31Å; M139-Y141 WeakPolarHBondContact CE-OH 3.36Å; M139-Y141 PolarHBondContact O-N 3.47Å; M139-Y141 HydrophobicContact SD-CE1 4.41Å
140	M	27.4	Very low	31.9	Very low	183 Å²	183	160.8 Å²	160.8	90%	0.901	81%	0.812	S	S	*	*			trans	-87.9	103.1	168.3	-174.6	178.6	-73.1	0	0	110.9	P138	P138-M140 PolarHBondContact O-N 2.76Å
141	Y	31.8	Very low	31.8	Very low	162 Å²	162	163.4 Å²	163.4	64%	0.635	82%	0.816	S	S	*	*			trans	-73.8	143.8	170.7	-50.3	-85	0	0	0	111.1	M139 E143	M139-Y141 HydrophobicContact CB-CE2 4.22Å; M139-Y141 VanDerWaalsContact CE-OH 3.31Å; M139-Y141 WeakPolarHBondContact CE-OH 3.36Å; M139-Y141 PolarHBondContact O-N 3.47Å; M139-Y141 HydrophobicContact SD-CE1 4.41Å; Y141-E143 PolarHBondContact O-N 3.27Å; Y141-E143 VanDerWaalsContact O-N 3.15Å
142	P	35.2	Very low	31.7	Very low	124 Å²	124	160.3 Å²	160.3	81%	0.805	81%	0.806	S	S	*	*			trans	-68.1	106.4	161.5	-16.6	31.5	0	0	0	109.4
143	E	31.6	Very low	31.6	Very low	172 Å²	172	160.8 Å²	160.8	80%	0.804	81%	0.805	S	S	*	*			trans	-67.7	131.8	-179.6	-168.7	158.2	-143.9	0	0	111.2	Y141 E145	Y141-E143 PolarHBondContact O-N 3.27Å; Y141-E143 VanDerWaalsContact O-N 3.15Å; E143-E145 HydrophobicContact CG-CG 4.49Å
144	M	38.7	Very low	31.6	Very low	167 Å²	167	161.4 Å²	161.4	82%	0.823	80%	0.803	S	S	*	*			trans	-104.4	76.4	-176.2	-63.1	-167.7	-56.1	0	0	110.8	L146	M144-L146 PolarHBondContact O-N 2.9Å
145	E	32.1	Very low	31.4	Very low	183 Å²	183	160.6 Å²	160.6	86%	0.855	79%	0.794	S	S	*	*			trans	-68.6	115.9	172.1	-67.3	-164.5	126.7	0	0	110.9	E143	E143-E145 HydrophobicContact CG-CG 4.49Å
146	L	38.2	Very low	31	Very low	162 Å²	162	158 Å²	158	85%	0.848	80%	0.795	S	S	*	*			trans	-122.5	96.4	175.1	-88.6	173.9	0	0	0	110.2	M144	M144-L146 PolarHBondContact O-N 2.9Å
147	E	30.4	Very low	30.6	Very low	187 Å²	187	155.5 Å²	155.5	87%	0.874	78%	0.783	S	S	*	*			trans	-159	153.4	157.6	-97.2	-157.9	-162.7	0	0	109.2
148	S	28.3	Very low	30.5	Very low	90 Å²	90	153.5 Å²	153.5	63%	0.629	78%	0.779	S	S	*	*			cis	-152.7	152.6	-9.8	41.6	0	0	0	0	110.2
149	D	34.3	Very low	30.2	Very low	166 Å²	166	156.8 Å²	156.8	89%	0.888	78%	0.781	S	S	*	*			trans	-73.6	126.5	174.1	-88.6	-53.4	0	0	0	111.9
150	K	30.5	Very low	30.2	Very low	202 Å²	202	155.5 Å²	155.5	88%	0.878	78%	0.783	S	S	*	*			trans	-137.8	127.8	154.5	-74.2	-169.1	177.7	169.8	0	110.5
151	E	29.3	Very low	30.5	Very low	171 Å²	171	156.7 Å²	156.7	80%	0.799	78%	0.783	S	S	*	*			trans	-83.2	163.6	-167.4	-55.8	-178.8	89.9	0	0	115.4
152	N	26.1	Very low	30.6	Very low	124 Å²	124	155.7 Å²	155.7	66%	0.663	78%	0.784	S	S	*	*			trans	88.5	126	138.1	-92	-58.3	0	0	0	120.6
153	K	27.4	Very low	30.6	Very low	194 Å²	194	154 Å²	154	84%	0.843	77%	0.768	S	S	*	*			trans	67.9	129.7	169.7	-56	171.3	-175.5	172.3	0	114
154	E	25.1	Very low	31.3	Very low	172 Å²	172	148.1 Å²	148.1	80%	0.804	75%	0.753	S	S	*	*	S	Bend	cis	-134.7	165.9	29.6	-76.2	-171.2	90.3	0	0	115.7
155	Q	27.1	Very low	31.6	Very low	137 Å²	137	149.9 Å²	149.9	64%	0.64	75%	0.751	S	S	*	*			trans	32.9	92.4	161.1	-65.9	-172.7	7.6	0	0	117.7	Q157	Q155-Q157 PolarHBondContact O-N 3.2Å
156	S	26.4	Very low	31.9	Very low	120 Å²	120	149.1 Å²	149.1	84%	0.839	74%	0.74	S	S	*	*			trans	-57	77.6	138.6	43.4	0	0	0	0	110.5	P158	S156-P158 WeakPolarHBondContact O-CD 3.44Å
157	Q	22.5	Very low	32.1	Very low	139 Å²	139	148.2 Å²	148.2	65%	0.65	73%	0.725	S	S	*	*			trans	-47.1	114.5	168.7	-85.7	-75.6	-19.5	0	0	108.5	Q155 K159	Q155-Q157 PolarHBondContact O-N 3.2Å; Q157-K159 PolarHBondContact O-N 2.98Å
158	P	29.2	Very low	33	Very low	109 Å²	109	142.8 Å²	142.8	71%	0.708	70%	0.701	S	S	*	*			trans	-66.5	108.9	179.9	26.4	-31.8	0	0	0	106.8	S156 P160	S156-P158 WeakPolarHBondContact O-CD 3.44Å; P158-P160 WeakPolarHBondContact O-CD 3.47Å
159	K	29.9	Very low	33.7	Very low	190 Å²	190	146.3 Å²	146.3	83%	0.826	70%	0.701	S	S	*	*			trans	-43.4	115.7	169.3	-73.2	176.3	-178.6	168.4	0	106.2	Q157 K161	Q157-K159 PolarHBondContact O-N 2.98Å; K159-K161 PolarHBondContact O-N 2.93Å
160	P	31.8	Very low	34.3	Very low	111 Å²	111	145.6 Å²	145.6	72%	0.721	69%	0.692	S	S	*	*			trans	-56.5	113.4	-171.2	19.8	-31.7	0	0	0	106.8	P158 H162	P158-P160 WeakPolarHBondContact O-CD 3.47Å; P160-H162 VanDerWaalsContact C-N 3.3Å; P160-H162 VanDerWaalsContact O-CA 3.31Å; P160-H162 WeakPolarHBondContact O-CA 3.33Å; P160-H162 PolarHBondContact O-N 3.32Å
161	K	35.6	Very low	35.3	Very low	208 Å²	208	138.8 Å²	138.8	90%	0.904	67%	0.665	S	S	*	*			trans	-62.4	96.5	-167.5	-171.1	177.5	-175.9	179.6	0	106.4	K159 D163	K159-K161 PolarHBondContact O-N 2.93Å; K161-D163 VanDerWaalsContact C-N 3.31Å; K161-D163 PolarHBondContact O-N 3.34Å
162	H	33	Very low	36.7	Very low	141 Å²	141	132.2 Å²	132.2	65%	0.653	64%	0.644	S	S	*	*			trans	-76.2	90.8	-153	-157.3	-59.9	0	0	0	108.6	P160 G164	P160-H162 VanDerWaalsContact C-N 3.3Å; P160-H162 VanDerWaalsContact O-CA 3.31Å; P160-H162 WeakPolarHBondContact O-CA 3.33Å; P160-H162 PolarHBondContact O-N 3.32Å; H162-G164 PolarHBondContact O-N 2.86Å; H162-G164 VanDerWaalsContact O-N 3.11Å
163	D	34.5	Very low	38.9	Very low	90 Å²	90	128.2 Å²	128.2	48%	0.481	62%	0.623	S	S	.	*			trans	-52	119.1	-169.4	-173.6	2.5	0	0	0	109.5	K161 R165 R166	K161-D163 VanDerWaalsContact C-N 3.31Å; K161-D163 PolarHBondContact O-N 3.34Å; D163-R165 VanDerWaalsContact CG-CB 3.41Å; D163-R165 PolarHBondContact O-N 2.99Å; D163-R165 VanDerWaalsContact O-N 3.14Å; D163-R165 WeakPolarHBondContact OD1-CB 3.46Å; D163-R165 PolarHBondContact OD1-N 3.15Å; D163-R165 WeakPolarHBondContact OD2-CB 3.22Å; D163-R166 WeakPolarHBondContact O-CB 3.39Å; D163-R166 PolarHBondContact O-N 2.97Å
164	G	46.4	Very low	41.1	Very low	48 Å²	48	123.8 Å²	123.8	50%	0.495	61%	0.606	S	S	.	*	H	α-helix	trans	-57.3	-31	-178.2	0	0	0	0	0	111.2	H162 R166 R167	H162-G164 PolarHBondContact O-N 2.86Å; H162-G164 VanDerWaalsContact O-N 3.11Å; G164-R166 PolarHBondContact O-N 2.9Å; G164-R166 VanDerWaalsContact O-N 3.1Å; G164-R167 PolarHBondContact O-N 2.87Å
165	R	45.4	Very low	43.6	Very low	204 Å²	204	123.9 Å²	123.9	77%	0.77	60%	0.604	S	S	*	*	H	α-helix	trans	-52.1	-27.1	170.7	-159.9	179.9	-168.1	173.1	5.2	114	D163	D163-R165 VanDerWaalsContact CG-CB 3.41Å; D163-R165 PolarHBondContact O-N 2.99Å; D163-R165 VanDerWaalsContact O-N 3.14Å; D163-R165 WeakPolarHBondContact OD1-CB 3.46Å; D163-R165 PolarHBondContact OD1-N 3.15Å; D163-R165 WeakPolarHBondContact OD2-CB 3.22Å
166	R	38.3	Very low	46.3	Very low	167 Å²	167	119.8 Å²	119.8	63%	0.63	59%	0.586	S	S	*	*	H	α-helix	trans	-85.1	-37.5	-177.7	-160.3	171.9	-177.8	169.4	1.2	113.4	D163 G164 I168 R169	D163-R166 WeakPolarHBondContact O-CB 3.39Å; D163-R166 PolarHBondContact O-N 2.97Å; G164-R166 PolarHBondContact O-N 2.9Å; G164-R166 VanDerWaalsContact O-N 3.1Å; R166-I168 VanDerWaalsContact C-N 3.26Å; R166-I168 PolarHBondContact O-N 3.16Å; R166-R169 PolarHBondContact O-N 2.97Å
167	R	41.9	Very low	48.8	Very low	143 Å²	143	115.3 Å²	115.3	54%	0.54	55%	0.551	S	S	.	*	H	α-helix	trans	-57	-42.4	174	-95.6	-170.9	175.6	-175.9	-0.7	110.9	E106 G164 R169 E170	E106-R167 IonicContact OE1-CZ 2.64Å; E106-R167 IonicContact OE1-NH1 2.87Å; E106-R167 PolarHBondContact OE1-NH1 3.49Å; E106-R167 IonicContact OE1-NH2 3.34Å; E106-R167 PolarHBondContact OE1-NH2 3.45Å; G164-R167 PolarHBondContact O-N 2.87Å; R167-R169 PolarHBondContact O-N 3.34Å; R167-E170 PolarHBondContact O-N 3.4Å
168	I	49.6	Very low	51.7	Low	72 Å²	72	111.7 Å²	111.7	37%	0.369	54%	0.538	S	S	.	.	H	α-helix	trans	-64.3	-25.1	-176.2	-61.8	168	0	0	0	112.8	R166	R166-I168 VanDerWaalsContact C-N 3.26Å; R166-I168 PolarHBondContact O-N 3.16Å
169	R	42.9	Very low	54.5	Low	164 Å²	164	111.9 Å²	111.9	62%	0.619	53%	0.532	S	S	*	.	H	α-helix	trans	-75.6	-22.6	-177.1	-155.4	179.2	-168.2	-151.7	6.4	113.8	R166 R167 D260	R166-R169 PolarHBondContact O-N 2.97Å; R167-R169 PolarHBondContact O-N 3.34Å; R169-D260 IonicContact CZ-OD2 2.68Å; R169-D260 IonicContact NE-OD2 3.99Å; R169-D260 VanDerWaalsContact NH2-CG 3.3Å; R169-D260 IonicContact NH2-OD1 3.67Å; R169-D260 IonicContact NH2-OD2 3.85Å; R169-D260 PolarHBondContact NH2-OD2 2.93Å
170	E	46.8	Very low	57.3	Low	151 Å²	151	103.4 Å²	103.4	71%	0.706	50%	0.495	S	S	*	.	H	α-helix	trans	-102.6	-14.4	-173.5	-70.2	164.7	-161.5	0	0	112.6	R167 G172	R167-E170 PolarHBondContact O-N 3.4Å; E170-G172 PolarHBondContact O-N 3.32Å
171	D	51.4	Low	59.9	Low	59 Å²	59	98.3 Å²	98.3	32%	0.316	46%	0.462	S	S	.	.	S	Bend	trans	-92.7	14.4	-160.7	-138.3	-22.9	0	0	0	115.8	K98 M102 L173	K98-D171 VanDerWaalsContact CE-OD1 3.24Å; K98-D171 WeakPolarHBondContact CE-OD1 3.31Å; K98-D171 PolarHBondContact NZ-O 2.82Å; K98-D171 IonicContact NZ-OD1 2.68Å; K98-D171 PolarHBondContact NZ-OD1 3.14Å; M102-D171 WeakPolarHBondContact CE-OD2 3.43Å; D171-L173 HydrophobicContact CB-CD1 4.27Å; D171-L173 VanDerWaalsContact O-CD1 3.31Å; D171-L173 WeakPolarHBondContact O-CD1 3.1Å; D171-L173 PolarHBondContact O-N 3.47Å
172	G	59.9	Low	62.5	Low	34 Å²	34	92.5 Å²	92.5	35%	0.351	44%	0.441	S	S	.	.	S	Bend	trans	70.4	-12.6	173	0	0	0	0	0	117.3	E170 M174 K175 I176	E170-G172 PolarHBondContact O-N 3.32Å; G172-M174 PolarHBondContact O-N 2.97Å; G172-M174 VanDerWaalsContact O-N 3.17Å; G172-K175 WeakPolarHBondContact O-CB 3.32Å; G172-K175 PolarHBondContact O-N 2.9Å; G172-I176 PolarHBondContact O-N 3.48Å
173	L	70.9	Confident	65.3	Low	40 Å²	40	87.1 Å²	87.1	21%	0.209	42%	0.42	C	S	.	.	H	α-helix	trans	-52.4	-39.7	178.8	-87.7	72	0	0	0	112.2	K98 D171 K175 I176 Y177	K98-L173 HydrophobicContact CD-CD1 3.77Å; D171-L173 HydrophobicContact CB-CD1 4.27Å; D171-L173 VanDerWaalsContact O-CD1 3.31Å; D171-L173 WeakPolarHBondContact O-CD1 3.1Å; D171-L173 PolarHBondContact O-N 3.47Å; L173-K175 VanDerWaalsContact C-N 3.29Å; L173-K175 PolarHBondContact O-N 3.47Å; L173-I176 PolarHBondContact O-N 3.1Å; L173-I176 VanDerWaalsContact O-N 3.14Å; L173-Y177 WeakPolarHBondContact O-CB 3.36Å; L173-Y177 PolarHBondContact O-N 3.25Å
174	M	74.4	Confident	68	Low	101 Å²	101	83.4 Å²	83.4	50%	0.498	40%	0.4	S	S	.	.	H	α-helix	trans	-57.7	-38.7	177.9	-168.1	-161.2	-63.7	0	0	112.5	G172 Y177 V178	G172-M174 PolarHBondContact O-N 2.97Å; G172-M174 VanDerWaalsContact O-N 3.17Å; M174-Y177 PolarHBondContact O-N 3.07Å; M174-V178 WeakPolarHBondContact O-CG2 3.42Å; M174-V178 PolarHBondContact O-N 3.22Å
175	K	78.4	Confident	70.2	Confident	174 Å²	174	81.9 Å²	81.9	76%	0.757	38%	0.381	S	S	*	.	H	α-helix	trans	-66.1	-40.3	177.9	-67.8	-177.1	175.3	-179.9	0	111.3	G172 L173 V178 L179	G172-K175 WeakPolarHBondContact O-CB 3.32Å; G172-K175 PolarHBondContact O-N 2.9Å; L173-K175 VanDerWaalsContact C-N 3.29Å; L173-K175 PolarHBondContact O-N 3.47Å; K175-V178 PolarHBondContact O-N 2.87Å; K175-L179 WeakPolarHBondContact O-CB 3.34Å; K175-L179 PolarHBondContact O-N 3.32Å
176	I	82.4	Confident	72.6	Confident	51 Å²	51	76.3 Å²	76.3	26%	0.262	37%	0.369	S	S	.	.	H	α-helix	trans	-73.5	-33.5	179	-54	173.6	0	0	0	110.3	Y91 Y94 G172 L173 L179 Q180	Y91-I176 HydrophobicContact CD2-CG2 4.12Å; Y94-I176 HydrophobicContact CD1-CD1 3.96Å; Y94-I176 HydrophobicContact CE1-CD1 3.36Å; Y94-I176 HydrophobicContact CE2-CD1 4.02Å; G172-I176 PolarHBondContact O-N 3.48Å; L173-I176 PolarHBondContact O-N 3.1Å; L173-I176 VanDerWaalsContact O-N 3.14Å; I176-L179 PolarHBondContact O-N 3Å; I176-Q180 PolarHBondContact O-N 3.06Å
177	Y	80.6	Confident	75.3	Confident	26 Å²	26	72 Å²	72	10%	0.102	36%	0.355	C	S	.	.	H	α-helix	trans	-65.7	-41.1	173.1	-171.3	-106.3	0	0	0	112.7	K22 Y91 L173 M174 Q180 L181 E249 L253	K22-Y177 WeakPolarHBondContact CE-OH 3.48Å; K22-Y177 PolarHBondContact NZ-OH 3.41Å; Y91-Y177 HydrophobicContact CD1-CD2 4.36Å; Y91-Y177 HydrophobicContact CD2-CD2 4.39Å; Y91-Y177 AromaticContact CE1-CD2 3.85Å; Y91-Y177 HydrophobicContact CE1-CD2 3.85Å; Y91-Y177 HydrophobicContact CE1-CE2 4.34Å; Y91-Y177 AromaticContact CE2-CD2 3.88Å; Y91-Y177 HydrophobicContact CE2-CD2 3.88Å; Y91-Y177 HydrophobicContact CE2-CG 4.38Å; Y91-Y177 AromaticContact CZ-CD2 3.6Å; L173-Y177 WeakPolarHBondContact O-CB 3.36Å; L173-Y177 PolarHBondContact O-N 3.25Å; M174-Y177 PolarHBondContact O-N 3.07Å; Y177-Q180 WeakPolarHBondContact O-CG 3.37Å; Y177-Q180 PolarHBondContact O-NE2 3.47Å; Y177-L181 WeakPolarHBondContact O-CB 3.27Å; Y177-L181 PolarHBondContact O-N 2.8Å; Y177-E249 PolarHBondContact OH-OE1 3.4Å; Y177-L253 HydrophobicContact CD1-CD1 4.25Å; Y177-L253 HydrophobicContact CE1-CD1 3.76Å
178	V	83.3	Confident	77.8	Confident	63 Å²	63	65.3 Å²	65.3	38%	0.382	33%	0.33	S	S	.	.	H	α-helix	trans	-66.8	-41.7	171.9	171.6	0	0	0	0	110.7	M174 K175 L181 L182	M174-V178 WeakPolarHBondContact O-CG2 3.42Å; M174-V178 PolarHBondContact O-N 3.22Å; K175-V178 PolarHBondContact O-N 2.87Å; V178-L181 PolarHBondContact O-N 3.12Å; V178-L182 WeakPolarHBondContact O-CB 3.07Å; V178-L182 PolarHBondContact O-N 3.44Å
179	L	87.1	Confident	80.1	Confident	112 Å²	112	64.5 Å²	64.5	59%	0.586	33%	0.329	S	S	*	.	H	α-helix	trans	-62.7	-43.2	178.9	-175.5	63.3	0	0	0	112.8	K175 I176 L181 A183	K175-L179 WeakPolarHBondContact O-CB 3.34Å; K175-L179 PolarHBondContact O-N 3.32Å; I176-L179 PolarHBondContact O-N 3Å; L179-L181 VanDerWaalsContact C-N 3.34Å; L179-A183 WeakPolarHBondContact O-CB 3.43Å; L179-A183 PolarHBondContact O-N 2.87Å
180	Q	89.1	Confident	82.6	Confident	12 Å²	12	58.7 Å²	58.7	6%	0.056	32%	0.319	C	S	.	.	H	α-helix	trans	-68.3	-33.7	176.1	69.3	80.9	50	0	0	112.4	P87 S88 Y91 I176 Y177 R184	P87-Q180 HydrophobicContact CB-CB 3.98Å; S88-Q180 PolarHBondContact OG-OE1 3.23Å; Y91-Q180 HydrophobicContact CD2-CG 4.11Å; Y91-Q180 HydrophobicContact CG-CG 3.96Å; I176-Q180 PolarHBondContact O-N 3.06Å; Y177-Q180 WeakPolarHBondContact O-CG 3.37Å; Y177-Q180 PolarHBondContact O-NE2 3.47Å; Q180-R184 VanDerWaalsContact O-CB 3.25Å; Q180-R184 WeakPolarHBondContact O-CB 3.07Å; Q180-R184 PolarHBondContact O-N 2.98Å
181	L	86.2	Confident	84.9	Confident	4 Å²	4	53 Å²	53	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-70.1	-41.9	177.9	-158.2	72.3	0	0	0	110.8	Y177 V178 L179 R184 T185 E249 M250 L253	Y177-L181 WeakPolarHBondContact O-CB 3.27Å; Y177-L181 PolarHBondContact O-N 2.8Å; V178-L181 PolarHBondContact O-N 3.12Å; L179-L181 VanDerWaalsContact C-N 3.34Å; L181-R184 PolarHBondContact O-N 3.46Å; L181-T185 WeakPolarHBondContact O-CB 3.05Å; L181-T185 PolarHBondContact O-N 3.42Å; L181-T185 PolarHBondContact O-OG1 3.45Å; L181-E249 HydrophobicContact CD2-CB 4.35Å; L181-E249 HydrophobicContact CD2-CG 4.02Å; L181-M250 HydrophobicContact CD2-CB 4.05Å; L181-L253 HydrophobicContact CD2-CD1 3.91Å
182	L	90.4	Very high	87	Confident	86 Å²	86	52.5 Å²	52.5	45%	0.45	29%	0.289	S	S	.	.	H	α-helix	trans	-62	-49	172.4	-175.7	153.4	0	0	0	111.4	V178 R184 T185 V186 M250	V178-L182 WeakPolarHBondContact O-CB 3.07Å; V178-L182 PolarHBondContact O-N 3.44Å; L182-R184 VanDerWaalsContact C-N 3.33Å; L182-R184 PolarHBondContact O-N 2.88Å; L182-T185 PolarHBondContact O-N 2.87Å; L182-T185 VanDerWaalsContact O-N 3.14Å; L182-V186 HydrophobicContact CD2-CG2 4.06Å; L182-V186 WeakPolarHBondContact O-CG2 3.17Å; L182-V186 PolarHBondContact O-N 3.18Å; L182-M250 HydrophobicContact CB-CE 4.41Å
183	A	91.8	Very high	88.7	Confident	28 Å²	28	55 Å²	55	23%	0.231	29%	0.294	C	S	.	.	H	α-helix	trans	-59.4	-43.5	177.2	0	0	0	0	0	111.9	P87 L179 T185 V186 F187	P87-A183 HydrophobicContact CB-CB 4.26Å; P87-A183 HydrophobicContact CG-CB 4.1Å; L179-A183 WeakPolarHBondContact O-CB 3.43Å; L179-A183 PolarHBondContact O-N 2.87Å; A183-T185 VanDerWaalsContact C-N 3.33Å; A183-T185 PolarHBondContact O-N 3.23Å; A183-V186 PolarHBondContact O-N 2.91Å; A183-F187 WeakPolarHBondContact O-CD2 3.24Å; A183-F187 PolarHBondContact O-N 3.45Å
184	R	91.7	Very high	89.8	Confident	13 Å²	13	54.1 Å²	54.1	5%	0.049	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-40.9	174.6	-174.4	178.7	172.8	-157.6	-7	112.3	V84 P87 Q180 L181 L182 F187 E188 N246	V84-R184 HydrophobicContact CG1-CG 3.84Å; P87-R184 HydrophobicContact CG-CB 4.5Å; Q180-R184 VanDerWaalsContact O-CB 3.25Å; Q180-R184 WeakPolarHBondContact O-CB 3.07Å; Q180-R184 PolarHBondContact O-N 2.98Å; L181-R184 PolarHBondContact O-N 3.46Å; L182-R184 VanDerWaalsContact C-N 3.33Å; L182-R184 PolarHBondContact O-N 2.88Å; R184-F187 PolarHBondContact O-N 3.38Å; R184-E188 PolarHBondContact O-N 3.37Å; R184-N246 PolarHBondContact NH1-OD1 3.49Å
185	T	92.5	Very high	90.8	Very high	15 Å²	15	49.4 Å²	49.4	9%	0.092	27%	0.271	C	S	.	.	H	α-helix	trans	-67	-42.8	177.7	-55.6	0	0	0	0	111	L181 L182 A183 F187 E188 V189 I247 M250	L181-T185 WeakPolarHBondContact O-CB 3.05Å; L181-T185 PolarHBondContact O-N 3.42Å; L181-T185 PolarHBondContact O-OG1 3.45Å; L182-T185 PolarHBondContact O-N 2.87Å; L182-T185 VanDerWaalsContact O-N 3.14Å; A183-T185 VanDerWaalsContact C-N 3.33Å; A183-T185 PolarHBondContact O-N 3.23Å; T185-F187 VanDerWaalsContact C-N 3.33Å; T185-F187 PolarHBondContact O-N 2.96Å; T185-E188 PolarHBondContact O-N 3.35Å; T185-V189 HydrophobicContact CG2-CG2 4.39Å; T185-V189 WeakPolarHBondContact O-CB 3.37Å; T185-V189 VanDerWaalsContact O-CG2 3.22Å; T185-V189 WeakPolarHBondContact O-CG2 3.43Å; T185-V189 PolarHBondContact O-N 3.5Å; T185-I247 HydrophobicContact CG2-CG1 4.19Å; T185-M250 HydrophobicContact CG2-CE 4.18Å; T185-M250 VanDerWaalsContact OG1-CE 3.28Å; T185-M250 WeakPolarHBondContact OG1-CE 3.36Å
186	V	95.1	Very high	91.5	Very high	87 Å²	87	46.6 Å²	46.6	53%	0.527	26%	0.257	S	S	.	.	H	α-helix	trans	-60.9	-40	174.5	169.6	0	0	0	0	111.4	L182 A183 G190	L182-V186 HydrophobicContact CD2-CG2 4.06Å; L182-V186 WeakPolarHBondContact O-CG2 3.17Å; L182-V186 PolarHBondContact O-N 3.18Å; A183-V186 PolarHBondContact O-N 2.91Å; V186-G190 PolarHBondContact O-N 2.93Å
187	F	95.3	Very high	92.1	Very high	78 Å²	78	51.8 Å²	51.8	34%	0.342	28%	0.278	S	S	.	.	H	α-helix	trans	-67.1	-49.2	174	-69.4	-50.9	0	0	0	112.5	L83 V84 P87 A183 R184 T185 V189 G190 F191	L83-F187 WeakPolarHBondContact O-CD2 3.29Å; V84-F187 HydrophobicContact CG2-CB 3.99Å; P87-F187 HydrophobicContact CG-CD2 3.91Å; P87-F187 HydrophobicContact CG-CE2 3.85Å; A183-F187 WeakPolarHBondContact O-CD2 3.24Å; A183-F187 PolarHBondContact O-N 3.45Å; R184-F187 PolarHBondContact O-N 3.38Å; T185-F187 VanDerWaalsContact C-N 3.33Å; T185-F187 PolarHBondContact O-N 2.96Å; F187-V189 VanDerWaalsContact C-N 3.3Å; F187-V189 PolarHBondContact O-N 3.34Å; F187-G190 PolarHBondContact O-N 2.97Å; F187-F191 WeakPolarHBondContact O-CD2 3.32Å; F187-F191 PolarHBondContact O-N 2.59Å
188	E	94.8	Very high	92.6	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-39.3	177.9	-68	-80.9	-136	0	0	111.8	R32 Q80 V84 R184 T185 L192	R32-E188 IonicContact CZ-OE2 3.78Å; R32-E188 VanDerWaalsContact NH1-CD 3.3Å; R32-E188 IonicContact NH1-OE1 2.95Å; R32-E188 PolarHBondContact NH1-OE1 3.46Å; R32-E188 IonicContact NH1-OE2 2.84Å; R32-E188 PolarHBondContact NH1-OE2 2.94Å; R32-E188 IonicContact NH2-OE2 3.99Å; Q80-E188 PolarHBondContact NE2-OE2 3.33Å; V84-E188 HydrophobicContact CG1-CG 3.85Å; V84-E188 HydrophobicContact CG2-CG 3.77Å; V84-E188 WeakPolarHBondContact CG2-OE2 3.47Å; R184-E188 PolarHBondContact O-N 3.37Å; T185-E188 PolarHBondContact O-N 3.35Å; E188-L192 WeakPolarHBondContact O-CB 3.45Å; E188-L192 PolarHBondContact O-N 3.34Å
189	V	96.3	Very high	93	Very high	56 Å²	56	54 Å²	54	34%	0.339	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-49.4	172.8	170	0	0	0	0	111.2	T185 F187 F191 L192 I193 L243	T185-V189 HydrophobicContact CG2-CG2 4.39Å; T185-V189 WeakPolarHBondContact O-CB 3.37Å; T185-V189 VanDerWaalsContact O-CG2 3.22Å; T185-V189 WeakPolarHBondContact O-CG2 3.43Å; T185-V189 PolarHBondContact O-N 3.5Å; F187-V189 VanDerWaalsContact C-N 3.3Å; F187-V189 PolarHBondContact O-N 3.34Å; V189-F191 PolarHBondContact O-N 2.57Å; V189-L192 PolarHBondContact O-N 2.93Å; V189-I193 HydrophobicContact CG1-CD1 3.74Å; V189-I193 WeakPolarHBondContact O-CG1 3.49Å; V189-I193 PolarHBondContact O-N 3.33Å; V189-L243 HydrophobicContact CB-CD1 4.45Å; V189-L243 HydrophobicContact CG2-CD1 3.61Å; V189-L243 HydrophobicContact CG2-CG 4.45Å
190	G	96.3	Very high	93.3	Very high	41 Å²	41	49.6 Å²	49.6	42%	0.423	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-40.2	-177.9	0	0	0	0	0	112.8	V186 F187 G194	V186-G190 PolarHBondContact O-N 2.93Å; F187-G190 PolarHBondContact O-N 2.97Å; G190-G194 PolarHBondContact O-N 3.28Å
191	F	95.3	Very high	93.4	Very high	31 Å²	31	54.6 Å²	54.6	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-74.2	-35.3	173.6	-82.1	-82.9	0	0	0	112.9	F76 F79 Q80 L83 F187 V189 I193 G194 Q195	F76-F191 HydrophobicContact CD2-CD1 4.47Å; F76-F191 HydrophobicContact CE1-CD1 4.11Å; F76-F191 AromaticContact CE2-CD1 3.82Å; F76-F191 HydrophobicContact CE2-CD1 3.82Å; F76-F191 HydrophobicContact CE2-CE1 4.32Å; F76-F191 HydrophobicContact CZ-CB 4.33Å; F76-F191 AromaticContact CZ-CD1 3.62Å; F76-F191 HydrophobicContact CZ-CD1 3.62Å; F76-F191 HydrophobicContact CZ-CE1 4.5Å; F76-F191 HydrophobicContact CZ-CG 4.47Å; F76-F191 WeakPolarHBondContact CZ-O 3.47Å; F79-F191 HydrophobicContact CB-CE1 4.35Å; F79-F191 HydrophobicContact CB-CZ 4.39Å; Q80-F191 HydrophobicContact CB-CB 4.28Å; Q80-F191 HydrophobicContact CB-CD1 3.61Å; Q80-F191 HydrophobicContact CB-CD2 4.18Å; Q80-F191 HydrophobicContact CB-CE1 3.86Å; Q80-F191 HydrophobicContact CB-CE2 4.41Å; Q80-F191 HydrophobicContact CB-CG 3.8Å; Q80-F191 HydrophobicContact CB-CZ 4.26Å; Q80-F191 HydrophobicContact CG-CB 3.52Å; Q80-F191 HydrophobicContact CG-CD1 3.85Å; Q80-F191 HydrophobicContact CG-CD2 3.84Å; Q80-F191 HydrophobicContact CG-CE1 4.48Å; Q80-F191 HydrophobicContact CG-CE2 4.49Å; Q80-F191 HydrophobicContact CG-CG 3.49Å; Q80-F191 VanDerWaalsContact CG-CG 3.49Å; L83-F191 HydrophobicContact CB-CE2 3.93Å; L83-F191 HydrophobicContact CB-CZ 4.38Å; L83-F191 HydrophobicContact CD1-CE2 3.9Å; L83-F191 HydrophobicContact CD1-CZ 3.88Å; L83-F191 HydrophobicContact CG-CE2 4.34Å; L83-F191 HydrophobicContact CG-CZ 4.36Å; F187-F191 WeakPolarHBondContact O-CD2 3.32Å; F187-F191 PolarHBondContact O-N 2.59Å; V189-F191 PolarHBondContact O-N 2.57Å; F191-I193 VanDerWaalsContact C-N 3.29Å; F191-I193 PolarHBondContact O-N 3.21Å; F191-G194 PolarHBondContact O-N 3.01Å; F191-Q195 WeakPolarHBondContact O-CB 3.33Å; F191-Q195 PolarHBondContact O-N 3.44Å
192	L	95.3	Very high	93.7	Very high	50 Å²	50	60.3 Å²	60.3	26%	0.262	32%	0.316	S	S	.	.	H	α-helix	trans	-59.8	-42.9	173.6	-177.5	66.7	0	0	0	111.3	E188 V189 Y196 Y236 T239 L243	E188-L192 WeakPolarHBondContact O-CB 3.45Å; E188-L192 PolarHBondContact O-N 3.34Å; V189-L192 PolarHBondContact O-N 2.93Å; L192-Y196 PolarHBondContact O-N 2.99Å; L192-Y236 HydrophobicContact CD1-CD1 3.6Å; L192-Y236 HydrophobicContact CD1-CE1 3.96Å; L192-T239 HydrophobicContact CB-CG2 4.37Å; L192-T239 HydrophobicContact CD1-CG2 4.12Å; L192-L243 HydrophobicContact CD2-CD1 3.93Å
193	I	95.6	Very high	93.8	Very high	87 Å²	87	56.7 Å²	56.7	45%	0.446	30%	0.298	S	S	.	.	H	α-helix	trans	-68	-43.4	174.5	-67.3	169.2	0	0	0	111	V189 F191 Q195 Y196 F197	V189-I193 HydrophobicContact CG1-CD1 3.74Å; V189-I193 WeakPolarHBondContact O-CG1 3.49Å; V189-I193 PolarHBondContact O-N 3.33Å; F191-I193 VanDerWaalsContact C-N 3.29Å; F191-I193 PolarHBondContact O-N 3.21Å; I193-Q195 PolarHBondContact O-N 3.4Å; I193-Y196 WeakPolarHBondContact O-CB 3.36Å; I193-Y196 PolarHBondContact O-N 3.36Å; I193-F197 HydrophobicContact CG2-CD2 3.68Å; I193-F197 HydrophobicContact CG2-CE2 3.62Å; I193-F197 WeakPolarHBondContact O-CD2 3.38Å; I193-F197 PolarHBondContact O-N 2.91Å
194	G	94.3	Very high	93.7	Very high	21 Å²	21	60.9 Å²	60.9	22%	0.216	31%	0.313	C	S	.	.	H	α-helix	trans	-61.9	-39.4	177.2	0	0	0	0	0	113.3	G190 F191 Y196 F197 L198	G190-G194 PolarHBondContact O-N 3.28Å; F191-G194 PolarHBondContact O-N 3.01Å; G194-Y196 VanDerWaalsContact C-N 3.29Å; G194-Y196 PolarHBondContact O-N 3.05Å; G194-F197 PolarHBondContact O-N 3.23Å; G194-L198 WeakPolarHBondContact O-CB 3.31Å; G194-L198 VanDerWaalsContact O-CG 3.31Å; G194-L198 WeakPolarHBondContact O-CG 3.34Å; G194-L198 PolarHBondContact O-N 2.98Å
195	Q	94.6	Very high	93.8	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-62.9	-40	176.4	-160.5	177.6	-66.4	0	0	110.5	F76 F191 I193 Y199 G200 Y236	F76-Q195 HydrophobicContact CD1-CG 4.45Å; F76-Q195 HydrophobicContact CE1-CB 3.64Å; F76-Q195 HydrophobicContact CE1-CG 3.81Å; F76-Q195 HydrophobicContact CZ-CB 3.74Å; F76-Q195 HydrophobicContact CZ-CG 4.34Å; F191-Q195 WeakPolarHBondContact O-CB 3.33Å; F191-Q195 PolarHBondContact O-N 3.44Å; I193-Q195 PolarHBondContact O-N 3.4Å; Q195-Y199 HydrophobicContact CG-CD2 3.86Å; Q195-Y199 PolarHBondContact O-N 2.71Å; Q195-G200 PolarHBondContact O-N 2.94Å; Q195-Y236 HydrophobicContact CB-CE1 3.96Å; Q195-Y236 HydrophobicContact CG-CE1 4.05Å; Q195-Y236 HydrophobicContact CG-CE2 4.34Å; Q195-Y236 VanDerWaalsContact NE2-CD2 3.27Å; Q195-Y236 VanDerWaalsContact NE2-CZ 3.26Å; Q195-Y236 PolarHBondContact O-OH 3.33Å
196	Y	94.4	Very high	93.8	Very high	116 Å²	116	68 Å²	68	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-66.1	-44	177.8	175.7	-107.6	0	0	0	112.5	L192 I193 G194 G200 F201 Y236	L192-Y196 PolarHBondContact O-N 2.99Å; I193-Y196 WeakPolarHBondContact O-CB 3.36Å; I193-Y196 PolarHBondContact O-N 3.36Å; G194-Y196 VanDerWaalsContact C-N 3.29Å; G194-Y196 PolarHBondContact O-N 3.05Å; Y196-G200 VanDerWaalsContact O-CA 3.25Å; Y196-G200 WeakPolarHBondContact O-CA 3.41Å; Y196-G200 PolarHBondContact O-N 3.38Å; Y196-F201 HydrophobicContact CD2-CD2 4.03Å; Y196-F201 HydrophobicContact CD2-CE1 4.21Å; Y196-F201 AromaticContact CD2-CE2 3.55Å; Y196-F201 HydrophobicContact CD2-CE2 3.55Å; Y196-F201 AromaticContact CD2-CZ 3.65Å; Y196-F201 HydrophobicContact CD2-CZ 3.65Å; Y196-F201 AromaticContact CE2-CD2 3.78Å; Y196-F201 HydrophobicContact CE2-CD2 3.78Å; Y196-F201 AromaticContact CE2-CE2 3.35Å; Y196-F201 HydrophobicContact CE2-CE2 3.35Å; Y196-F201 AromaticContact CE2-CZ 3.93Å; Y196-F201 HydrophobicContact CE2-CZ 3.93Å; Y196-Y236 WeakPolarHBondContact CA-OH 3.33Å; Y196-Y236 PolarHBondContact N-OH 2.99Å
197	F	93.9	Very high	93.7	Very high	160 Å²	160	66.8 Å²	66.8	70%	0.702	34%	0.336	S	S	*	.	H	α-helix	trans	-74.3	-26.8	178	-77	-64.3	0	0	0	114.5	I193 G194	I193-F197 HydrophobicContact CG2-CD2 3.68Å; I193-F197 HydrophobicContact CG2-CE2 3.62Å; I193-F197 WeakPolarHBondContact O-CD2 3.38Å; I193-F197 PolarHBondContact O-N 2.91Å; G194-F197 PolarHBondContact O-N 3.23Å
198	L	92.3	Very high	93.7	Very high	102 Å²	102	65.6 Å²	65.6	53%	0.534	34%	0.335	S	S	.	.	H	α-helix	trans	-87.7	-37.6	179.2	-70	173.2	0	0	0	113.7	F76 G194	F76-L198 HydrophobicContact CD2-CD1 3.87Å; F76-L198 HydrophobicContact CE2-CD1 3.78Å; G194-L198 WeakPolarHBondContact O-CB 3.31Å; G194-L198 VanDerWaalsContact O-CG 3.31Å; G194-L198 WeakPolarHBondContact O-CG 3.34Å; G194-L198 PolarHBondContact O-N 2.98Å
199	Y	91.3	Very high	93.7	Very high	32 Å²	32	65.6 Å²	65.6	13%	0.125	34%	0.335	C	S	.	.	H	α-helix	trans	-128.4	-9.8	-169.1	-48.5	-65.6	0	0	0	114.2	L71 H73 F76 Q195	L71-Y199 WeakPolarHBondContact O-CE1 3.37Å; L71-Y199 PolarHBondContact O-OH 3.39Å; H73-Y199 AromaticContact CD2-CD1 3.56Å; H73-Y199 AromaticContact CD2-CD2 3.95Å; H73-Y199 AromaticContact CD2-CE1 3.87Å; H73-Y199 AromaticContact CD2-CG 3.58Å; H73-Y199 AromaticContact CE1-CD1 3.62Å; H73-Y199 AromaticContact CE1-CE1 3.92Å; H73-Y199 AromaticContact CG-CE1 3.98Å; H73-Y199 AromaticContact NE2-CD1 3.23Å; H73-Y199 WeakPolarHBondContact NE2-CD1 3.2Å; H73-Y199 AromaticContact NE2-CE1 3.86Å; H73-Y199 AromaticContact NE2-CG 3.5Å; F76-Y199 HydrophobicContact CB-CE2 4Å; F76-Y199 WeakPolarHBondContact CB-OH 3.38Å; F76-Y199 HydrophobicContact CD1-CE2 4.02Å; F76-Y199 HydrophobicContact CD2-CE2 4.02Å; F76-Y199 AromaticContact CG-CE2 3.75Å; F76-Y199 HydrophobicContact CG-CE2 3.75Å; Q195-Y199 HydrophobicContact CG-CD2 3.86Å; Q195-Y199 PolarHBondContact O-N 2.71Å
200	G	92.2	Very high	93.7	Very high	21 Å²	21	67.3 Å²	67.3	22%	0.216	35%	0.349	C	S	.	.			trans	61.4	-149.6	-175.7	0	0	0	0	0	113	Q195 Y196 Y236	Q195-G200 PolarHBondContact O-N 2.94Å; Y196-G200 VanDerWaalsContact O-CA 3.25Å; Y196-G200 WeakPolarHBondContact O-CA 3.41Å; Y196-G200 PolarHBondContact O-N 3.38Å; G200-Y236 VanDerWaalsContact O-CE2 3.22Å; G200-Y236 WeakPolarHBondContact O-CE2 3.21Å; G200-Y236 PolarHBondContact O-OH 3.39Å
201	F	92.1	Very high	93.6	Very high	117 Å²	117	72.5 Å²	72.5	51%	0.513	36%	0.356	S	S	.	.	S	Bend	trans	-108.3	-7.6	176.3	-66.8	-58.2	0	0	0	114	Y196 L232 Y236	Y196-F201 HydrophobicContact CD2-CD2 4.03Å; Y196-F201 HydrophobicContact CD2-CE1 4.21Å; Y196-F201 AromaticContact CD2-CE2 3.55Å; Y196-F201 HydrophobicContact CD2-CE2 3.55Å; Y196-F201 AromaticContact CD2-CZ 3.65Å; Y196-F201 HydrophobicContact CD2-CZ 3.65Å; Y196-F201 AromaticContact CE2-CD2 3.78Å; Y196-F201 HydrophobicContact CE2-CD2 3.78Å; Y196-F201 AromaticContact CE2-CE2 3.35Å; Y196-F201 HydrophobicContact CE2-CE2 3.35Å; Y196-F201 AromaticContact CE2-CZ 3.93Å; Y196-F201 HydrophobicContact CE2-CZ 3.93Å; F201-L232 WeakPolarHBondContact O-CD2 3.19Å; F201-Y236 HydrophobicContact CD1-CD2 4.08Å; F201-Y236 AromaticContact CD1-CE2 3.72Å; F201-Y236 HydrophobicContact CD1-CE2 3.72Å; F201-Y236 AromaticContact CD1-CZ 3.97Å; F201-Y236 HydrophobicContact CE1-CD1 4.42Å; F201-Y236 HydrophobicContact CE1-CD2 4.42Å; F201-Y236 HydrophobicContact CE1-CE1 4.14Å; F201-Y236 HydrophobicContact CE1-CE2 4.13Å; F201-Y236 AromaticContact CE1-CZ 3.98Å
202	Q	92.9	Very high	93.4	Very high	123 Å²	123	78.6 Å²	78.6	58%	0.575	39%	0.389	S	S	*	.			trans	-148.6	132.2	-175.5	178	173.3	2.7	0	0	110.6	T229	Q202-T229 HydrophobicContact CB-CG2 4.25Å; Q202-T229 HydrophobicContact CG-CG2 4.17Å
203	V	92.1	Very high	93.4	Very high	11 Å²	11	78.9 Å²	78.9	7%	0.067	39%	0.394	C	S	.	.			trans	-84.1	115.6	171.8	-176.9	0	0	0	0	108.4	F68 I222 P225 K228 T229 L232	F68-V203 HydrophobicContact CZ-CG1 4.38Å; V203-I222 HydrophobicContact CG1-CG2 3.99Å; V203-P225 HydrophobicContact CG1-CB 4.42Å; V203-K228 HydrophobicContact CG2-CB 4.18Å; V203-T229 PolarHBondContact N-OG1 2.9Å; V203-L232 HydrophobicContact CG2-CD1 4.44Å
204	H	90.8	Very high	93.3	Very high	116 Å²	116	75.3 Å²	75.3	54%	0.537	38%	0.376	S	S	.	.			trans	-66.9	148	174.5	-76.6	-75.8	0	0	0	111.2	F206 I222	H204-F206 VanDerWaalsContact C-N 3.35Å; H204-I222 WeakPolarHBondContact O-CD1 3.31Å
205	P	92	Very high	93.2	Very high	61 Å²	61	78.4 Å²	78.4	40%	0.396	39%	0.392	S	S	.	.	S	Bend	trans	-76.3	-20.5	-177.9	29.5	-34.3	0	0	0	113.9	I222 P225	P205-I222 PolarHBondContact O-N 2.8Å; P205-P225 HydrophobicContact CB-CB 4.29Å; P205-P225 HydrophobicContact CB-CG 3.85Å
206	F	92.8	Very high	93	Very high	115 Å²	115	84.1 Å²	84.1	50%	0.504	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.2	177.6	61	-96.5	0	0	0	110.9	H204 V208 C220	H204-F206 VanDerWaalsContact C-N 3.35Å; F206-V208 HydrophobicContact CD2-CG2 4.04Å; F206-V208 HydrophobicContact CE2-CG2 4.36Å; F206-C220 CarbonylContact C-O 3.57Å; F206-C220 WeakPolarHBondContact CA-O 3.41Å
207	Y	93.7	Very high	93	Very high	63 Å²	63	85.5 Å²	85.5	25%	0.247	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.1	171.6	173.3	-95.7	0	0	0	109	F51 A67 F68 C209 C220	F51-Y207 HydrophobicContact CZ-CD1 4.45Å; A67-Y207 VanDerWaalsContact C-OH 3.27Å; A67-Y207 WeakPolarHBondContact CB-OH 3.48Å; A67-Y207 PolarHBondContact O-OH 3.21Å; F68-Y207 HydrophobicContact CB-CD1 4.05Å; F68-Y207 HydrophobicContact CB-CD2 4.02Å; F68-Y207 HydrophobicContact CB-CE1 4.02Å; F68-Y207 HydrophobicContact CB-CE2 3.97Å; F68-Y207 HydrophobicContact CB-CG 4.03Å; F68-Y207 AromaticContact CD2-CD2 3.53Å; F68-Y207 HydrophobicContact CD2-CD2 3.53Å; F68-Y207 HydrophobicContact CD2-CE2 4.04Å; F68-Y207 AromaticContact CD2-CG 3.91Å; F68-Y207 HydrophobicContact CD2-CG 3.91Å; F68-Y207 HydrophobicContact CE2-CD2 4.46Å; F68-Y207 HydrophobicContact CG-CD2 4.16Å; F68-Y207 HydrophobicContact CG-CG 4.22Å; Y207-C209 HydrophobicContact CD1-CB 4.11Å; Y207-C209 HydrophobicContact CE1-CB 3.87Å; Y207-C220 PolarHBondContact N-O 3.2Å; Y207-C220 PolarHBondContact O-N 2.84Å
208	V	95.1	Very high	93.1	Very high	53 Å²	53	78.1 Å²	78.1	32%	0.321	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	106.2	-173	-163.2	0	0	0	0	109.8	F206 K217 I218 D219	F206-V208 HydrophobicContact CD2-CG2 4.04Å; F206-V208 HydrophobicContact CE2-CG2 4.36Å; V208-K217 HydrophobicContact CG1-CD 3.78Å; V208-K217 VanDerWaalsContact CG1-CE 3.4Å; V208-K217 HydrophobicContact CG1-CG 3.74Å; V208-I218 CarbonylContact C-O 3.54Å; V208-I218 WeakPolarHBondContact CA-O 3.44Å; V208-D219 WeakPolarHBondContact CG2-OD1 3.39Å
209	C	95.5	Very high	93.2	Very high	1 Å²	1	76.7 Å²	76.7	1%	0.007	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	150.5	-169.4	-172.3	0	0	0	0	113.2	C64 Y207 K217 I218	C64-C209 WeakPolarHBondContact CA-SG 3.4Å; C64-C209 HydrophobicContact CB-CB 3.71Å; C64-C209 WeakPolarHBondContact CB-SG 3.42Å; C64-C209 WeakPolarHBondContact SG-CB 3.4Å; C64-C209 CovalentContact SG-SG 2.03Å; C64-C209 PolarHBondContact SG-SG 3.05Å; Y207-C209 HydrophobicContact CD1-CB 4.11Å; Y207-C209 HydrophobicContact CE1-CB 3.87Å; C209-K217 CarbonylContact O-C 3.55Å; C209-K217 WeakPolarHBondContact O-CA 3.45Å; C209-I218 HydrophobicContact CB-CG1 4.27Å; C209-I218 PolarHBondContact N-O 3.23Å; C209-I218 PolarHBondContact O-N 3.06Å
210	S	94.8	Very high	93.4	Very high	91 Å²	91	75.1 Å²	75.1	64%	0.636	38%	0.382	S	S	*	.			trans	-151.9	37.5	174.1	62.1	0	0	0	0	112.7
211	R	94.3	Very high	93.6	Very high	151 Å²	151	79.4 Å²	79.4	57%	0.57	40%	0.395	S	S	*	.			trans	-86.3	148.5	175.9	-69.6	-65.3	-167.3	165.9	5.1	110.6	V63 A67 C214	V63-R211 HydrophobicContact CB-CB 4.29Å; V63-R211 HydrophobicContact CG2-CB 3.9Å; A67-R211 HydrophobicContact CB-CG 3.85Å; R211-C214 WeakPolarHBondContact O-CB 3.49Å; R211-C214 PolarHBondContact O-N 2.88Å; R211-C214 PolarHBondContact O-SG 3.09Å
212	L	92.6	Very high	93.6	Very high	158 Å²	158	74.6 Å²	74.6	83%	0.827	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	135.4	165.3	-70.8	163.2	0	0	0	109.2	V63	V63-L212 WeakPolarHBondContact CG2-O 3.43Å
213	P	94.2	Very high	93.6	Very high	56 Å²	56	69.2 Å²	69.2	36%	0.364	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	cis	-96.3	16	16.5	38.5	-37.9	0	0	0	115.7
214	C	93.7	Very high	93.6	Very high	13 Å²	13	72.8 Å²	72.8	9%	0.088	36%	0.363	C	S	.	.			trans	-63.3	133.3	-177.1	-49.8	0	0	0	0	111.9	C60 C64 R211 H216	C60-C214 VanDerWaalsContact CA-SG 3.58Å; C60-C214 HydrophobicContact CB-CB 4.08Å; C60-C214 WeakPolarHBondContact CB-SG 3.26Å; C60-C214 WeakPolarHBondContact SG-CB 3.44Å; C60-C214 CovalentContact SG-SG 2.03Å; C60-C214 PolarHBondContact SG-SG 2.9Å; C64-C214 PolarHBondContact SG-SG 3.11Å; R211-C214 WeakPolarHBondContact O-CB 3.49Å; R211-C214 PolarHBondContact O-N 2.88Å; R211-C214 PolarHBondContact O-SG 3.09Å; C214-H216 PolarHBondContact O-N 3.38Å
215	P	91.2	Very high	93.8	Very high	85 Å²	85	68.7 Å²	68.7	55%	0.552	35%	0.346	S	S	*	.	S	Bend	trans	-78.6	-20.8	-169.3	28.9	-35	0	0	0	114.4
216	H	91.4	Very high	93.9	Very high	121 Å²	121	70.7 Å²	70.7	56%	0.56	36%	0.357	S	S	*	.	S	Bend	trans	-152	-176.8	175.8	58.9	-84.3	0	0	0	109.6	C214 I218	C214-H216 PolarHBondContact O-N 3.38Å; H216-I218 PolarHBondContact O-N 3.38Å
217	K	95	Very high	93.9	Very high	145 Å²	145	68.5 Å²	68.5	63%	0.63	35%	0.349	S	S	*	.			trans	-74.3	115.2	174.5	-163.6	-170.8	-163.2	-156.3	0	109.3	V208 C209	V208-K217 HydrophobicContact CG1-CD 3.78Å; V208-K217 VanDerWaalsContact CG1-CE 3.4Å; V208-K217 HydrophobicContact CG1-CG 3.74Å; C209-K217 CarbonylContact O-C 3.55Å; C209-K217 WeakPolarHBondContact O-CA 3.45Å
218	I	95.1	Very high	93.9	Very high	5 Å²	5	65.9 Å²	65.9	3%	0.026	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	156.8	-175.3	66.3	170.5	0	0	0	112.2	C53 T55 C60 V208 C209 H216	C53-I218 HydrophobicContact CB-CD1 3.79Å; T55-I218 HydrophobicContact CG2-CD1 3.64Å; C60-I218 WeakPolarHBondContact SG-CD1 3.32Å; V208-I218 CarbonylContact C-O 3.54Å; V208-I218 WeakPolarHBondContact CA-O 3.44Å; C209-I218 HydrophobicContact CB-CG1 4.27Å; C209-I218 PolarHBondContact N-O 3.23Å; C209-I218 PolarHBondContact O-N 3.06Å; H216-I218 PolarHBondContact O-N 3.38Å
219	D	95.3	Very high	93.9	Very high	72 Å²	72	64.2 Å²	64.2	39%	0.385	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	135	171.7	-59.7	-50.6	0	0	0	110.9	N54 V208 F221	N54-D219 PolarHBondContact N-O 2.89Å; V208-D219 WeakPolarHBondContact CG2-OD1 3.39Å; D219-F221 HydrophobicContact CB-CZ 4.48Å
220	C	95.4	Very high	93.9	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137	172.7	-55.4	0	0	0	0	110.4	F51 V52 C53 F206 Y207	F51-C220 HydrophobicContact CE1-CB 3.85Å; F51-C220 HydrophobicContact CE2-CB 3.98Å; F51-C220 HydrophobicContact CZ-CB 3.47Å; F51-C220 VanDerWaalsContact CZ-CB 3.47Å; V52-C220 CarbonylContact O-C 3.59Å; V52-C220 WeakPolarHBondContact O-CA 3.3Å; C53-C220 HydrophobicContact CB-CB 4.06Å; C53-C220 WeakPolarHBondContact CB-SG 3.2Å; C53-C220 WeakPolarHBondContact SG-CB 3.37Å; C53-C220 CovalentContact SG-SG 2.04Å; C53-C220 PolarHBondContact SG-SG 3.47Å; F206-C220 CarbonylContact C-O 3.57Å; F206-C220 WeakPolarHBondContact CA-O 3.41Å; Y207-C220 PolarHBondContact N-O 3.2Å; Y207-C220 PolarHBondContact O-N 2.84Å
221	F	94.8	Very high	93.8	Very high	111 Å²	111	65.5 Å²	65.5	49%	0.487	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.4	-173.9	-59.6	-78.8	0	0	0	110.8	F51 V52 D219	F51-F221 WeakPolarHBondContact CA-O 3.29Å; V52-F221 PolarHBondContact N-O 2.96Å; V52-F221 WeakPolarHBondContact O-CD2 3.24Å; V52-F221 PolarHBondContact O-N 3.12Å; D219-F221 HydrophobicContact CB-CZ 4.48Å
222	I	93.6	Very high	93.8	Very high	15 Å²	15	58.3 Å²	58.3	8%	0.077	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-95.6	131.6	-173.5	-67.9	151.6	0	0	0	109.8	F51 F68 V203 H204 P205 R224 P225	F51-I222 HydrophobicContact CD2-CG1 4.04Å; F51-I222 HydrophobicContact CE2-CG1 3.95Å; F68-I222 HydrophobicContact CD1-CD1 4.48Å; F68-I222 HydrophobicContact CD1-CG1 4.42Å; F68-I222 HydrophobicContact CD2-CD1 4.19Å; F68-I222 HydrophobicContact CE1-CD1 3.87Å; F68-I222 HydrophobicContact CE1-CG1 3.87Å; F68-I222 HydrophobicContact CE1-CG2 4.31Å; F68-I222 HydrophobicContact CE2-CD1 3.53Å; F68-I222 HydrophobicContact CE2-CG1 4.41Å; F68-I222 HydrophobicContact CZ-CD1 3.35Å; F68-I222 HydrophobicContact CZ-CG1 3.87Å; F68-I222 HydrophobicContact CZ-CG2 4.32Å; V203-I222 HydrophobicContact CG1-CG2 3.99Å; H204-I222 WeakPolarHBondContact O-CD1 3.31Å; P205-I222 PolarHBondContact O-N 2.8Å; I222-R224 PolarHBondContact O-N 3.44Å; I222-P225 WeakPolarHBondContact O-CD 3.46Å
223	S	92.3	Very high	93.9	Very high	11 Å²	11	54.7 Å²	54.7	8%	0.077	28%	0.281	C	S	.	.	S	Bend	trans	-65.5	134.1	178.2	62.8	0	0	0	0	112	D46 K228	D46-S223 PolarHBondContact O-OG 3.25Å; S223-K228 WeakPolarHBondContact O-CD 3.29Å; S223-K228 WeakPolarHBondContact O-CE 3.39Å; S223-K228 PolarHBondContact O-NZ 3.3Å; S223-K228 PolarHBondContact OG-NZ 3.42Å
224	R	92.4	Very high	93.9	Very high	86 Å²	86	55.6 Å²	55.6	33%	0.325	28%	0.282	S	S	.	.	S	Bend	trans	51.8	50.6	170.3	-51.2	161	176.6	-102	16.4	115.6	D46 I222 T226 E227 K228	D46-R224 WeakPolarHBondContact OD1-CD 3.28Å; D46-R224 IonicContact OD1-CZ 3.95Å; D46-R224 IonicContact OD1-NE 2.96Å; D46-R224 PolarHBondContact OD1-NE 2.82Å; D46-R224 IonicContact OD2-CZ 3.35Å; D46-R224 IonicContact OD2-NE 2.94Å; D46-R224 PolarHBondContact OD2-NE 3Å; D46-R224 IonicContact OD2-NH2 2.84Å; D46-R224 PolarHBondContact OD2-NH2 3.13Å; I222-R224 PolarHBondContact O-N 3.44Å; R224-T226 VanDerWaalsContact C-N 3.32Å; R224-T226 PolarHBondContact O-N 3.42Å; R224-E227 HydrophobicContact CB-CB 3.95Å; R224-E227 WeakPolarHBondContact CB-OE2 3.36Å; R224-E227 WeakPolarHBondContact CD-OE2 3.45Å; R224-E227 WeakPolarHBondContact CG-OE2 3.27Å; R224-E227 IonicContact CZ-OE2 3.69Å; R224-E227 IonicContact NE-OE2 3.86Å; R224-E227 VanDerWaalsContact NH1-CD 3.34Å; R224-E227 IonicContact NH1-OE1 3.12Å; R224-E227 PolarHBondContact NH1-OE1 3.45Å; R224-E227 VanDerWaalsContact NH1-OE1 3.12Å; R224-E227 IonicContact NH1-OE2 2.77Å; R224-E227 PolarHBondContact NH1-OE2 2.86Å; R224-E227 PolarHBondContact O-N 3.33Å; R224-K228 WeakPolarHBondContact O-CB 3.5Å; R224-K228 WeakPolarHBondContact O-CG 3.32Å; R224-K228 PolarHBondContact O-N 2.93Å
225	P	93.8	Very high	93.8	Very high	29 Å²	29	55 Å²	55	19%	0.188	28%	0.278	C	S	.	.	H	α-helix	trans	-65.8	-32.3	-170.1	27.3	-33.8	0	0	0	113.1	V203 P205 I222 T229	V203-P225 HydrophobicContact CG1-CB 4.42Å; P205-P225 HydrophobicContact CB-CB 4.29Å; P205-P225 HydrophobicContact CB-CG 3.85Å; I222-P225 WeakPolarHBondContact O-CD 3.46Å; P225-T229 VanDerWaalsContact O-CB 3.26Å; P225-T229 WeakPolarHBondContact O-CB 3.5Å; P225-T229 PolarHBondContact O-N 2.91Å; P225-T229 PolarHBondContact O-OG1 2.94Å
226	T	94.1	Very high	94	Very high	103 Å²	103	52 Å²	52	63%	0.632	26%	0.255	S	S	*	.	H	α-helix	trans	-69.1	-47.5	174.8	45.6	0	0	0	0	112.3	R224 T229 I230	R224-T226 VanDerWaalsContact C-N 3.32Å; R224-T226 PolarHBondContact O-N 3.42Å; T226-T229 PolarHBondContact O-N 3.5Å; T226-I230 VanDerWaalsContact O-CG1 3.32Å; T226-I230 WeakPolarHBondContact O-CG1 3.25Å; T226-I230 PolarHBondContact O-N 3.35Å
227	E	94.2	Very high	94.2	Very high	69 Å²	69	48.2 Å²	48.2	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-46.8	177.4	-163.3	178.4	174.3	0	0	111.1	I43 R224 T229 I230 F231	I43-E227 HydrophobicContact CD1-CG 4.29Å; I43-E227 HydrophobicContact CG1-CG 4.23Å; I43-E227 HydrophobicContact CG2-CB 4.4Å; I43-E227 HydrophobicContact CG2-CG 3.99Å; R224-E227 HydrophobicContact CB-CB 3.95Å; R224-E227 WeakPolarHBondContact CB-OE2 3.36Å; R224-E227 WeakPolarHBondContact CD-OE2 3.45Å; R224-E227 WeakPolarHBondContact CG-OE2 3.27Å; R224-E227 IonicContact CZ-OE2 3.69Å; R224-E227 IonicContact NE-OE2 3.86Å; R224-E227 VanDerWaalsContact NH1-CD 3.34Å; R224-E227 IonicContact NH1-OE1 3.12Å; R224-E227 PolarHBondContact NH1-OE1 3.45Å; R224-E227 VanDerWaalsContact NH1-OE1 3.12Å; R224-E227 IonicContact NH1-OE2 2.77Å; R224-E227 PolarHBondContact NH1-OE2 2.86Å; R224-E227 PolarHBondContact O-N 3.33Å; E227-T229 PolarHBondContact O-N 3.28Å; E227-I230 PolarHBondContact O-N 2.84Å; E227-F231 WeakPolarHBondContact O-CB 3.14Å; E227-F231 PolarHBondContact O-N 3.42Å
228	K	93.6	Very high	94	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.035	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-43	174.6	-72.4	177.2	-176.1	164.5	0	112	I43 Y44 V203 S223 R224 F231 L232	I43-K228 HydrophobicContact CG2-CG 3.6Å; I43-K228 VanDerWaalsContact O-CE 3.22Å; I43-K228 WeakPolarHBondContact O-CE 3.22Å; Y44-K228 HydrophobicContact CD1-CD 4.36Å; Y44-K228 HydrophobicContact CE1-CB 4.5Å; Y44-K228 HydrophobicContact CE1-CD 3.86Å; Y44-K228 HydrophobicContact CE1-CG 3.88Å; Y44-K228 HydrophobicContact CE2-CG 4.4Å; V203-K228 HydrophobicContact CG2-CB 4.18Å; S223-K228 WeakPolarHBondContact O-CD 3.29Å; S223-K228 WeakPolarHBondContact O-CE 3.39Å; S223-K228 PolarHBondContact O-NZ 3.3Å; S223-K228 PolarHBondContact OG-NZ 3.42Å; R224-K228 WeakPolarHBondContact O-CB 3.5Å; R224-K228 WeakPolarHBondContact O-CG 3.32Å; R224-K228 PolarHBondContact O-N 2.93Å; K228-F231 PolarHBondContact O-N 2.95Å; K228-L232 WeakPolarHBondContact O-CB 3.48Å; K228-L232 PolarHBondContact O-N 3.34Å
229	T	94.4	Very high	93.9	Very high	18 Å²	18	41.6 Å²	41.6	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-47.4	175.8	-63.6	0	0	0	0	112.1	Q202 V203 P225 T226 E227 F231 L232 L233	Q202-T229 HydrophobicContact CB-CG2 4.25Å; Q202-T229 HydrophobicContact CG-CG2 4.17Å; V203-T229 PolarHBondContact N-OG1 2.9Å; P225-T229 VanDerWaalsContact O-CB 3.26Å; P225-T229 WeakPolarHBondContact O-CB 3.5Å; P225-T229 PolarHBondContact O-N 2.91Å; P225-T229 PolarHBondContact O-OG1 2.94Å; T226-T229 PolarHBondContact O-N 3.5Å; E227-T229 PolarHBondContact O-N 3.28Å; T229-F231 VanDerWaalsContact C-N 3.33Å; T229-F231 PolarHBondContact O-N 3.02Å; T229-L232 PolarHBondContact O-N 3.44Å; T229-L233 HydrophobicContact CG2-CD1 4.05Å; T229-L233 HydrophobicContact CG2-CG 4.47Å; T229-L233 WeakPolarHBondContact O-CG 3.11Å; T229-L233 PolarHBondContact O-N 3.02Å
230	I	94.8	Very high	93.8	Very high	105 Å²	105	39.1 Å²	39.1	54%	0.538	21%	0.213	S	C	.	.	H	α-helix	trans	-59.9	-45.4	178.2	-69.5	163.4	0	0	0	110.3	T226 E227 L233 I234	T226-I230 VanDerWaalsContact O-CG1 3.32Å; T226-I230 WeakPolarHBondContact O-CG1 3.25Å; T226-I230 PolarHBondContact O-N 3.35Å; E227-I230 PolarHBondContact O-N 2.84Å; I230-L233 PolarHBondContact O-N 2.67Å; I230-I234 HydrophobicContact CG2-CD1 4.04Å; I230-I234 WeakPolarHBondContact O-CG1 3.08Å; I230-I234 PolarHBondContact O-N 2.95Å
231	F	94	Very high	93.7	Very high	15 Å²	15	43.5 Å²	43.5	7%	0.066	24%	0.235	C	C	.	.	H	α-helix	trans	-65.9	-41.3	178.7	-171.1	-98.3	0	0	0	113	L35 I43 Y44 W77 E227 K228 T229 L233 I234 M235	L35-F231 HydrophobicContact CB-CZ 4.4Å; L35-F231 HydrophobicContact CD2-CE2 4.39Å; L35-F231 WeakPolarHBondContact O-CZ 3.4Å; I43-F231 HydrophobicContact CD1-CB 3.67Å; I43-F231 HydrophobicContact CD1-CD1 4.42Å; I43-F231 HydrophobicContact CD1-CD2 3.57Å; I43-F231 HydrophobicContact CD1-CE2 4.33Å; I43-F231 HydrophobicContact CD1-CG 3.62Å; Y44-F231 AromaticContact CE2-CD1 3.93Å; Y44-F231 HydrophobicContact CE2-CD1 3.93Å; Y44-F231 HydrophobicContact CE2-CE1 4.41Å; W77-F231 HydrophobicContact CE3-CE1 4.08Å; W77-F231 AromaticContact CH2-CD1 3.69Å; W77-F231 HydrophobicContact CH2-CD1 3.69Å; W77-F231 AromaticContact CH2-CE1 3.82Å; W77-F231 HydrophobicContact CH2-CE1 3.82Å; W77-F231 AromaticContact CZ3-CD1 3.78Å; W77-F231 HydrophobicContact CZ3-CD1 3.78Å; W77-F231 AromaticContact CZ3-CE1 3.47Å; W77-F231 HydrophobicContact CZ3-CE1 3.47Å; W77-F231 VanDerWaalsContact CZ3-CE1 3.47Å; E227-F231 WeakPolarHBondContact O-CB 3.14Å; E227-F231 PolarHBondContact O-N 3.42Å; K228-F231 PolarHBondContact O-N 2.95Å; T229-F231 VanDerWaalsContact C-N 3.33Å; T229-F231 PolarHBondContact O-N 3.02Å; F231-L233 VanDerWaalsContact C-N 3.33Å; F231-L233 PolarHBondContact O-N 3.37Å; F231-I234 PolarHBondContact O-N 2.75Å; F231-M235 HydrophobicContact CD1-CG 4.21Å; F231-M235 HydrophobicContact CE1-CE 3.83Å; F231-M235 HydrophobicContact CE1-CG 3.82Å; F231-M235 HydrophobicContact CZ-CE 3.71Å; F231-M235 HydrophobicContact CZ-CG 4.22Å; F231-M235 HydrophobicContact CZ-SD 4.42Å; F231-M235 WeakPolarHBondContact O-CG 3.42Å; F231-M235 PolarHBondContact O-N 3Å
232	L	93.6	Very high	93.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.7	-40.8	173.5	164.3	150.8	0	0	0	111.7	F201 V203 K228 T229 M235 Y236	F201-L232 WeakPolarHBondContact O-CD2 3.19Å; V203-L232 HydrophobicContact CG2-CD1 4.44Å; K228-L232 WeakPolarHBondContact O-CB 3.48Å; K228-L232 PolarHBondContact O-N 3.34Å; T229-L232 PolarHBondContact O-N 3.44Å; L232-M235 PolarHBondContact O-N 2.95Å; L232-Y236 HydrophobicContact CD2-CD2 3.81Å; L232-Y236 HydrophobicContact CD2-CE2 3.61Å; L232-Y236 HydrophobicContact CG-CD2 4.11Å; L232-Y236 HydrophobicContact CG-CE2 3.88Å; L232-Y236 WeakPolarHBondContact O-CD2 3.47Å; L232-Y236 PolarHBondContact O-N 3.18Å
233	L	94.4	Very high	93.3	Very high	82 Å²	82	38.5 Å²	38.5	43%	0.429	21%	0.214	S	C	.	.	H	α-helix	trans	-68.1	-37.2	174.9	-70.2	172.3	0	0	0	112.6	T229 I230 F231 Y236 G237	T229-L233 HydrophobicContact CG2-CD1 4.05Å; T229-L233 HydrophobicContact CG2-CG 4.47Å; T229-L233 WeakPolarHBondContact O-CG 3.11Å; T229-L233 PolarHBondContact O-N 3.02Å; I230-L233 PolarHBondContact O-N 2.67Å; F231-L233 VanDerWaalsContact C-N 3.33Å; F231-L233 PolarHBondContact O-N 3.37Å; L233-Y236 WeakPolarHBondContact O-CB 3.04Å; L233-Y236 PolarHBondContact O-N 2.89Å; L233-G237 PolarHBondContact O-N 2.84Å
234	I	94	Very high	93.3	Very high	75 Å²	75	43.3 Å²	43.3	39%	0.385	24%	0.238	S	C	.	.	H	α-helix	trans	-62.5	-44.1	172	-68.5	165	0	0	0	110.3	L35 I230 F231 Y236 G237 V238	L35-I234 HydrophobicContact CD1-CG2 4.05Å; I230-I234 HydrophobicContact CG2-CD1 4.04Å; I230-I234 WeakPolarHBondContact O-CG1 3.08Å; I230-I234 PolarHBondContact O-N 2.95Å; F231-I234 PolarHBondContact O-N 2.75Å; I234-Y236 PolarHBondContact O-N 3.27Å; I234-G237 PolarHBondContact O-N 2.97Å; I234-G237 VanDerWaalsContact O-N 3.16Å; I234-V238 HydrophobicContact CG2-CG2 4.47Å; I234-V238 WeakPolarHBondContact O-CG2 3.28Å; I234-V238 PolarHBondContact O-N 3.25Å
235	M	93.1	Very high	93.1	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-36.3	177	-72.5	-57.9	-141.9	0	0	113.2	L35 T36 W77 F231 L232 T239	L35-M235 HydrophobicContact CB-CE 3.85Å; L35-M235 HydrophobicContact CB-SD 4.1Å; L35-M235 HydrophobicContact CD1-SD 4.14Å; T36-M235 WeakPolarHBondContact OG1-CE 3.15Å; W77-M235 HydrophobicContact CD2-CE 4.11Å; W77-M235 HydrophobicContact CD2-CG 4.2Å; W77-M235 HydrophobicContact CE3-CE 4.17Å; W77-M235 HydrophobicContact CG-CE 4.31Å; W77-M235 HydrophobicContact CH2-CG 4.31Å; W77-M235 HydrophobicContact CZ2-CB 3.95Å; W77-M235 HydrophobicContact CZ2-CG 3.89Å; F231-M235 HydrophobicContact CD1-CG 4.21Å; F231-M235 HydrophobicContact CE1-CE 3.83Å; F231-M235 HydrophobicContact CE1-CG 3.82Å; F231-M235 HydrophobicContact CZ-CE 3.71Å; F231-M235 HydrophobicContact CZ-CG 4.22Å; F231-M235 HydrophobicContact CZ-SD 4.42Å; F231-M235 WeakPolarHBondContact O-CG 3.42Å; F231-M235 PolarHBondContact O-N 3Å; L232-M235 PolarHBondContact O-N 2.95Å; M235-T239 VanDerWaalsContact O-CB 3.3Å; M235-T239 WeakPolarHBondContact O-CB 3.04Å; M235-T239 PolarHBondContact O-N 3.45Å; M235-T239 PolarHBondContact O-OG1 3.15Å
236	Y	94.8	Very high	92.7	Very high	21 Å²	21	39.8 Å²	39.8	8%	0.082	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-49	168	-86.2	-63.9	0	0	0	111.8	L192 Q195 Y196 G200 F201 L232 L233 I234 V238 T239 G240	L192-Y236 HydrophobicContact CD1-CD1 3.6Å; L192-Y236 HydrophobicContact CD1-CE1 3.96Å; Q195-Y236 HydrophobicContact CB-CE1 3.96Å; Q195-Y236 HydrophobicContact CG-CE1 4.05Å; Q195-Y236 HydrophobicContact CG-CE2 4.34Å; Q195-Y236 VanDerWaalsContact NE2-CD2 3.27Å; Q195-Y236 VanDerWaalsContact NE2-CZ 3.26Å; Q195-Y236 PolarHBondContact O-OH 3.33Å; Y196-Y236 WeakPolarHBondContact CA-OH 3.33Å; Y196-Y236 PolarHBondContact N-OH 2.99Å; G200-Y236 VanDerWaalsContact O-CE2 3.22Å; G200-Y236 WeakPolarHBondContact O-CE2 3.21Å; G200-Y236 PolarHBondContact O-OH 3.39Å; F201-Y236 HydrophobicContact CD1-CD2 4.08Å; F201-Y236 AromaticContact CD1-CE2 3.72Å; F201-Y236 HydrophobicContact CD1-CE2 3.72Å; F201-Y236 AromaticContact CD1-CZ 3.97Å; F201-Y236 HydrophobicContact CE1-CD1 4.42Å; F201-Y236 HydrophobicContact CE1-CD2 4.42Å; F201-Y236 HydrophobicContact CE1-CE1 4.14Å; F201-Y236 HydrophobicContact CE1-CE2 4.13Å; F201-Y236 AromaticContact CE1-CZ 3.98Å; L232-Y236 HydrophobicContact CD2-CD2 3.81Å; L232-Y236 HydrophobicContact CD2-CE2 3.61Å; L232-Y236 HydrophobicContact CG-CD2 4.11Å; L232-Y236 HydrophobicContact CG-CE2 3.88Å; L232-Y236 WeakPolarHBondContact O-CD2 3.47Å; L232-Y236 PolarHBondContact O-N 3.18Å; L233-Y236 WeakPolarHBondContact O-CB 3.04Å; L233-Y236 PolarHBondContact O-N 2.89Å; I234-Y236 PolarHBondContact O-N 3.27Å; Y236-V238 PolarHBondContact O-N 2.97Å; Y236-T239 PolarHBondContact O-N 3.44Å; Y236-G240 PolarHBondContact O-N 3.41Å
237	G	94.5	Very high	92.5	Very high	42 Å²	42	37.8 Å²	37.8	43%	0.433	21%	0.209	S	C	.	.	H	α-helix	trans	-58.9	-46.2	-179.8	0	0	0	0	0	112.6	L233 I234 G240 L241	L233-G237 PolarHBondContact O-N 2.84Å; I234-G237 PolarHBondContact O-N 2.97Å; I234-G237 VanDerWaalsContact O-N 3.16Å; G237-G240 PolarHBondContact O-N 3.44Å; G237-L241 WeakPolarHBondContact O-CB 3.43Å; G237-L241 PolarHBondContact O-N 2.92Å
238	V	92.7	Very high	92.2	Very high	11 Å²	11	43.6 Å²	43.6	7%	0.067	23%	0.228	C	C	.	.	H	α-helix	trans	-65.7	-42.6	176.8	175.3	0	0	0	0	111.6	F31 R32 L35 I234 Y236 L241 C242	F31-V238 HydrophobicContact CD1-CG1 4.38Å; F31-V238 HydrophobicContact CD1-CG2 4.09Å; F31-V238 HydrophobicContact CE1-CG2 3.68Å; R32-V238 HydrophobicContact CB-CG1 4.03Å; R32-V238 HydrophobicContact CG-CG1 4.32Å; L35-V238 HydrophobicContact CD1-CG2 4.01Å; I234-V238 HydrophobicContact CG2-CG2 4.47Å; I234-V238 WeakPolarHBondContact O-CG2 3.28Å; I234-V238 PolarHBondContact O-N 3.25Å; Y236-V238 PolarHBondContact O-N 2.97Å; V238-L241 PolarHBondContact O-N 3.5Å; V238-C242 WeakPolarHBondContact O-CB 3.47Å; V238-C242 PolarHBondContact O-N 2.89Å; V238-C242 PolarHBondContact O-SG 3.09Å
239	T	92.6	Very high	91.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63	-42.2	176	-61.1	0	0	0	0	111.5	Q80 L192 M235 Y236 C242 L243	Q80-T239 VanDerWaalsContact NE2-CG2 3.28Å; Q80-T239 PolarHBondContact NE2-OG1 3.43Å; L192-T239 HydrophobicContact CB-CG2 4.37Å; L192-T239 HydrophobicContact CD1-CG2 4.12Å; M235-T239 VanDerWaalsContact O-CB 3.3Å; M235-T239 WeakPolarHBondContact O-CB 3.04Å; M235-T239 PolarHBondContact O-N 3.45Å; M235-T239 PolarHBondContact O-OG1 3.15Å; Y236-T239 PolarHBondContact O-N 3.44Å; T239-C242 WeakPolarHBondContact O-CB 3.23Å; T239-C242 PolarHBondContact O-N 2.99Å; T239-L243 VanDerWaalsContact O-CB 3.31Å; T239-L243 WeakPolarHBondContact O-CB 3.42Å; T239-L243 PolarHBondContact O-N 3.13Å
240	G	93.6	Very high	91.3	Very high	20 Å²	20	45.5 Å²	45.5	21%	0.206	24%	0.236	C	C	.	.	H	α-helix	trans	-61.7	-44.2	174.2	0	0	0	0	0	112.6	Y236 G237 L243 L244	Y236-G240 PolarHBondContact O-N 3.41Å; G237-G240 PolarHBondContact O-N 3.44Å; G240-L243 PolarHBondContact O-N 3.07Å; G240-L244 WeakPolarHBondContact O-CB 3.28Å; G240-L244 VanDerWaalsContact O-CG 3.27Å; G240-L244 WeakPolarHBondContact O-CG 3.44Å; G240-L244 PolarHBondContact O-N 3.19Å
241	L	92	Very high	90.8	Very high	91 Å²	91	45.1 Å²	45.1	48%	0.476	24%	0.235	S	C	.	.	H	α-helix	trans	-62.4	-44.7	175.5	-111.5	165.4	0	0	0	112.3	L28 G237 V238 L243 L244 L245	L28-L241 HydrophobicContact CD1-CB 4.41Å; G237-L241 WeakPolarHBondContact O-CB 3.43Å; G237-L241 PolarHBondContact O-N 2.92Å; V238-L241 PolarHBondContact O-N 3.5Å; L241-L243 PolarHBondContact O-N 3.29Å; L241-L244 PolarHBondContact O-N 2.71Å; L241-L245 HydrophobicContact CD2-CD1 4.27Å; L241-L245 WeakPolarHBondContact O-CB 3.3Å; L241-L245 WeakPolarHBondContact O-CG 3.29Å; L241-L245 PolarHBondContact O-N 3.36Å
242	C	89.4	Confident	90.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.9	-48.5	172	-77.2	0	0	0	0	111.6	V238 T239 L245 N246	V238-C242 WeakPolarHBondContact O-CB 3.47Å; V238-C242 PolarHBondContact O-N 2.89Å; V238-C242 PolarHBondContact O-SG 3.09Å; T239-C242 WeakPolarHBondContact O-CB 3.23Å; T239-C242 PolarHBondContact O-N 2.99Å; C242-L245 PolarHBondContact O-N 3.01Å; C242-N246 PolarHBondContact O-N 3.25Å; C242-N246 PolarHBondContact O-ND2 2.99Å
243	L	91.8	Very high	89.5	Confident	21 Å²	21	51.4 Å²	51.4	11%	0.11	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-45.9	-179.9	178.7	153.2	0	0	0	111.7	V189 L192 T239 G240 L241 L245 N246 I247	V189-L243 HydrophobicContact CB-CD1 4.45Å; V189-L243 HydrophobicContact CG2-CD1 3.61Å; V189-L243 HydrophobicContact CG2-CG 4.45Å; L192-L243 HydrophobicContact CD2-CD1 3.93Å; T239-L243 VanDerWaalsContact O-CB 3.31Å; T239-L243 WeakPolarHBondContact O-CB 3.42Å; T239-L243 PolarHBondContact O-N 3.13Å; G240-L243 PolarHBondContact O-N 3.07Å; L241-L243 PolarHBondContact O-N 3.29Å; L243-L245 VanDerWaalsContact C-N 3.33Å; L243-L245 PolarHBondContact O-N 3.49Å; L243-N246 PolarHBondContact O-N 2.96Å; L243-I247 HydrophobicContact CD2-CD1 3.58Å; L243-I247 HydrophobicContact CD2-CG1 4.47Å; L243-I247 HydrophobicContact CG-CD1 4.3Å; L243-I247 WeakPolarHBondContact O-CG1 3.14Å; L243-I247 PolarHBondContact O-N 3.32Å
244	L	91.2	Very high	88.7	Confident	113 Å²	113	48.6 Å²	48.6	59%	0.592	26%	0.257	S	S	*	.	H	α-helix	trans	-60.6	-40.4	176.8	-73.3	169.6	0	0	0	112	G240 L241 I247 W248	G240-L244 WeakPolarHBondContact O-CB 3.28Å; G240-L244 VanDerWaalsContact O-CG 3.27Å; G240-L244 WeakPolarHBondContact O-CG 3.44Å; G240-L244 PolarHBondContact O-N 3.19Å; L241-L244 PolarHBondContact O-N 2.71Å; L244-I247 PolarHBondContact O-N 2.95Å; L244-W248 WeakPolarHBondContact O-CB 3.43Å; L244-W248 PolarHBondContact O-N 2.69Å
245	L	87.9	Confident	87.8	Confident	39 Å²	39	52 Å²	52	20%	0.204	27%	0.269	C	S	.	.	H	α-helix	trans	-71.8	-36.6	177.3	-73.4	165.6	0	0	0	113.1	W24 L25 L28 L241 C242 L243 I247 W248 E249	W24-L245 HydrophobicContact CB-CD1 4.11Å; L25-L245 HydrophobicContact CD2-CB 3.75Å; L25-L245 HydrophobicContact CG-CB 4.21Å; L28-L245 HydrophobicContact CD1-CD1 3.4Å; L28-L245 VanDerWaalsContact CD1-CD1 3.4Å; L241-L245 HydrophobicContact CD2-CD1 4.27Å; L241-L245 WeakPolarHBondContact O-CB 3.3Å; L241-L245 WeakPolarHBondContact O-CG 3.29Å; L241-L245 PolarHBondContact O-N 3.36Å; C242-L245 PolarHBondContact O-N 3.01Å; L243-L245 VanDerWaalsContact C-N 3.33Å; L243-L245 PolarHBondContact O-N 3.49Å; L245-I247 VanDerWaalsContact C-N 3.35Å; L245-W248 PolarHBondContact O-N 3.05Å; L245-E249 PolarHBondContact O-N 3.19Å
246	N	87	Confident	86.8	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-40.3	171.4	-76.7	-82	0	0	0	111.1	L25 R184 C242 L243 E249 M250	L25-N246 WeakPolarHBondContact CD2-ND2 3.34Å; R184-N246 PolarHBondContact NH1-OD1 3.49Å; C242-N246 PolarHBondContact O-N 3.25Å; C242-N246 PolarHBondContact O-ND2 2.99Å; L243-N246 PolarHBondContact O-N 2.96Å; N246-E249 PolarHBondContact O-N 2.97Å; N246-M250 WeakPolarHBondContact O-CB 3.35Å; N246-M250 PolarHBondContact O-N 3.41Å
247	I	88.8	Confident	85.7	Confident	62 Å²	62	55.9 Å²	55.9	32%	0.318	30%	0.301	S	S	.	.	H	α-helix	trans	-65.8	-41.5	174.2	-69.7	176.3	0	0	0	110.9	T185 L243 L244 L245 M250 L251	T185-I247 HydrophobicContact CG2-CG1 4.19Å; L243-I247 HydrophobicContact CD2-CD1 3.58Å; L243-I247 HydrophobicContact CD2-CG1 4.47Å; L243-I247 HydrophobicContact CG-CD1 4.3Å; L243-I247 WeakPolarHBondContact O-CG1 3.14Å; L243-I247 PolarHBondContact O-N 3.32Å; L244-I247 PolarHBondContact O-N 2.95Å; L245-I247 VanDerWaalsContact C-N 3.35Å; I247-M250 PolarHBondContact O-N 3.46Å; I247-L251 HydrophobicContact CG2-CD1 3.89Å; I247-L251 HydrophobicContact CG2-CG 4.21Å; I247-L251 WeakPolarHBondContact O-CB 2.98Å; I247-L251 VanDerWaalsContact O-CG 3.31Å; I247-L251 WeakPolarHBondContact O-CG 3.43Å; I247-L251 PolarHBondContact O-N 2.91Å
248	W	87.3	Confident	84.7	Confident	190 Å²	190	58.6 Å²	58.6	72%	0.72	31%	0.305	S	S	*	.	H	α-helix	trans	-62.5	-43.5	176.7	-168.2	-67.1	0	0	0	111.9	L244 L245 L251 H252	L244-W248 WeakPolarHBondContact O-CB 3.43Å; L244-W248 PolarHBondContact O-N 2.69Å; L245-W248 PolarHBondContact O-N 3.05Å; W248-L251 PolarHBondContact O-N 3.46Å; W248-H252 WeakPolarHBondContact O-CB 3.39Å; W248-H252 PolarHBondContact O-N 3.33Å
249	E	84.8	Confident	83.8	Confident	4 Å²	4	66.1 Å²	66.1	2%	0.019	33%	0.332	C	S	.	.	H	α-helix	trans	-61.5	-45	173.1	-176.7	173.5	-174.5	0	0	110.9	S17 Y177 L181 L245 N246 L251 H252 L253	S17-E249 VanDerWaalsContact CB-OE1 3.27Å; S17-E249 WeakPolarHBondContact CB-OE1 3.27Å; S17-E249 PolarHBondContact OG-OE1 2.82Å; Y177-E249 PolarHBondContact OH-OE1 3.4Å; L181-E249 HydrophobicContact CD2-CB 4.35Å; L181-E249 HydrophobicContact CD2-CG 4.02Å; L245-E249 PolarHBondContact O-N 3.19Å; N246-E249 PolarHBondContact O-N 2.97Å; E249-L251 PolarHBondContact O-N 3.29Å; E249-H252 PolarHBondContact O-N 2.87Å; E249-L253 HydrophobicContact CG-CD1 3.72Å; E249-L253 HydrophobicContact CG-CG 4.31Å; E249-L253 WeakPolarHBondContact O-CB 3.42Å; E249-L253 WeakPolarHBondContact O-CD1 3.19Å; E249-L253 VanDerWaalsContact O-CG 3.22Å; E249-L253 WeakPolarHBondContact O-CG 3.37Å; E249-L253 PolarHBondContact O-N 3.14Å
250	M	84.2	Confident	82.7	Confident	63 Å²	63	69.1 Å²	69.1	31%	0.31	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-40.7	177.6	-167.9	-175.9	-58.7	0	0	112.7	L181 L182 T185 N246 I247 G254	L181-M250 HydrophobicContact CD2-CB 4.05Å; L182-M250 HydrophobicContact CB-CE 4.41Å; T185-M250 HydrophobicContact CG2-CE 4.18Å; T185-M250 VanDerWaalsContact OG1-CE 3.28Å; T185-M250 WeakPolarHBondContact OG1-CE 3.36Å; N246-M250 WeakPolarHBondContact O-CB 3.35Å; N246-M250 PolarHBondContact O-N 3.41Å; I247-M250 PolarHBondContact O-N 3.46Å; M250-G254 WeakPolarHBondContact O-CA 3.49Å; M250-G254 PolarHBondContact O-N 2.03Å
251	L	84.3	Confident	81.8	Confident	97 Å²	97	71.2 Å²	71.2	51%	0.508	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-47.1	175.1	-74.2	171.6	0	0	0	111.3	I247 W248 E249 L253 G254 F255	I247-L251 HydrophobicContact CG2-CD1 3.89Å; I247-L251 HydrophobicContact CG2-CG 4.21Å; I247-L251 WeakPolarHBondContact O-CB 2.98Å; I247-L251 VanDerWaalsContact O-CG 3.31Å; I247-L251 WeakPolarHBondContact O-CG 3.43Å; I247-L251 PolarHBondContact O-N 2.91Å; W248-L251 PolarHBondContact O-N 3.46Å; E249-L251 PolarHBondContact O-N 3.29Å; L251-L253 PolarHBondContact O-N 2.92Å; L251-G254 CarbonylContact O-C 3.54Å; L251-G254 WeakPolarHBondContact O-CA 3.37Å; L251-G254 PolarHBondContact O-N 3.44Å; L251-F255 HydrophobicContact CB-CE2 4.43Å; L251-F255 WeakPolarHBondContact O-CD2 3.24Å; L251-F255 PolarHBondContact O-N 3.2Å
252	H	82.1	Confident	81	Confident	103 Å²	103	72 Å²	72	48%	0.477	36%	0.364	S	S	.	.	H	α-helix	trans	-60.4	-44.9	178.6	177.7	-87.2	0	0	0	112	T18 W248 E249 G256	T18-H252 VanDerWaalsContact CG2-CE1 3.42Å; T18-H252 WeakPolarHBondContact CG2-CE1 3.4Å; T18-H252 VanDerWaalsContact CG2-ND1 3.34Å; T18-H252 WeakPolarHBondContact CG2-ND1 3.46Å; W248-H252 WeakPolarHBondContact O-CB 3.39Å; W248-H252 PolarHBondContact O-N 3.33Å; E249-H252 PolarHBondContact O-N 2.87Å; H252-G256 PolarHBondContact O-N 3.02Å
253	L	78.4	Confident	80.2	Confident	43 Å²	43	75.8 Å²	75.8	23%	0.225	38%	0.384	C	S	.	.	H	α-helix	trans	-64.3	-42.7	173.7	-66.8	166.7	0	0	0	111.3	Y177 L181 E249 L251 G256 T257	Y177-L253 HydrophobicContact CD1-CD1 4.25Å; Y177-L253 HydrophobicContact CE1-CD1 3.76Å; L181-L253 HydrophobicContact CD2-CD1 3.91Å; E249-L253 HydrophobicContact CG-CD1 3.72Å; E249-L253 HydrophobicContact CG-CG 4.31Å; E249-L253 WeakPolarHBondContact O-CB 3.42Å; E249-L253 WeakPolarHBondContact O-CD1 3.19Å; E249-L253 VanDerWaalsContact O-CG 3.22Å; E249-L253 WeakPolarHBondContact O-CG 3.37Å; E249-L253 PolarHBondContact O-N 3.14Å; L251-L253 PolarHBondContact O-N 2.92Å; L253-G256 WeakPolarHBondContact O-CA 3.48Å; L253-G256 PolarHBondContact O-N 3.26Å; L253-G256 VanDerWaalsContact O-N 3.13Å; L253-T257 PolarHBondContact O-N 3.07Å; L253-T257 PolarHBondContact O-OG1 3.36Å
254	G	78	Confident	79.1	Confident	24 Å²	24	78.1 Å²	78.1	25%	0.247	40%	0.402	C	S	.	.	H	α-helix	trans	-56.9	-48.8	175.9	0	0	0	0	0	112.7	M250 L251 G256 T257 I258	M250-G254 WeakPolarHBondContact O-CA 3.49Å; M250-G254 PolarHBondContact O-N 2.03Å; L251-G254 CarbonylContact O-C 3.54Å; L251-G254 WeakPolarHBondContact O-CA 3.37Å; L251-G254 PolarHBondContact O-N 3.44Å; G254-G256 VanDerWaalsContact C-N 3.28Å; G254-G256 PolarHBondContact O-N 2.03Å; G254-T257 PolarHBondContact O-N 3.46Å; G254-I258 WeakPolarHBondContact O-CB 3.42Å; G254-I258 WeakPolarHBondContact O-CD1 3.48Å; G254-I258 WeakPolarHBondContact O-CG1 3.39Å; G254-I258 PolarHBondContact O-N 2.86Å
255	F	75.6	Confident	78	Confident	145 Å²	145	79 Å²	79	64%	0.636	40%	0.401	S	S	*	.	H	α-helix	trans	-58.8	-38.9	174.4	-76.8	-62.7	0	0	0	112.3	L251 R259	L251-F255 HydrophobicContact CB-CE2 4.43Å; L251-F255 WeakPolarHBondContact O-CD2 3.24Å; L251-F255 PolarHBondContact O-N 3.2Å; F255-R259 VanDerWaalsContact O-CB 3.23Å; F255-R259 WeakPolarHBondContact O-CB 3.3Å; F255-R259 PolarHBondContact O-N 2.85Å
256	G	71.3	Confident	76.7	Confident	31 Å²	31	84.8 Å²	84.8	32%	0.32	42%	0.42	S	S	.	.	H	α-helix	trans	-58.7	-53.5	172.4	0	0	0	0	0	112.3	H252 L253 G254 R259 D260	H252-G256 PolarHBondContact O-N 3.02Å; L253-G256 WeakPolarHBondContact O-CA 3.48Å; L253-G256 PolarHBondContact O-N 3.26Å; L253-G256 VanDerWaalsContact O-N 3.13Å; G254-G256 VanDerWaalsContact C-N 3.28Å; G254-G256 PolarHBondContact O-N 2.03Å; G256-R259 PolarHBondContact O-N 2.83Å; G256-D260 WeakPolarHBondContact O-CB 3.47Å; G256-D260 PolarHBondContact O-N 3.42Å
257	T	71.6	Confident	75.4	Confident	74 Å²	74	94.2 Å²	94.2	45%	0.454	46%	0.456	S	S	.	.	H	α-helix	trans	-65.4	-39.2	180	-52.9	0	0	0	0	112.8	L253 G254 D260 S261	L253-T257 PolarHBondContact O-N 3.07Å; L253-T257 PolarHBondContact O-OG1 3.36Å; G254-T257 PolarHBondContact O-N 3.46Å; T257-D260 PolarHBondContact O-N 3.31Å; T257-S261 WeakPolarHBondContact O-CB 3.48Å; T257-S261 PolarHBondContact O-N 3.27Å
258	I	73.5	Confident	74	Confident	99 Å²	99	98.6 Å²	98.6	51%	0.508	48%	0.475	S	S	.	.	H	α-helix	trans	-66.1	-46	177.5	-70	163.6	0	0	0	110.2	G254 D260 S261 L262	G254-I258 WeakPolarHBondContact O-CB 3.42Å; G254-I258 WeakPolarHBondContact O-CD1 3.48Å; G254-I258 WeakPolarHBondContact O-CG1 3.39Å; G254-I258 PolarHBondContact O-N 2.86Å; I258-D260 VanDerWaalsContact C-N 3.34Å; I258-D260 PolarHBondContact O-N 3.12Å; I258-S261 WeakPolarHBondContact O-CB 3.33Å; I258-S261 PolarHBondContact O-N 3.01Å; I258-L262 HydrophobicContact CG2-CD1 3.86Å; I258-L262 HydrophobicContact CG2-CG 4.4Å; I258-L262 WeakPolarHBondContact O-CG 3.4Å; I258-L262 PolarHBondContact O-N 3.42Å
259	R	74.1	Confident	72.7	Confident	168 Å²	168	96.5 Å²	96.5	63%	0.634	48%	0.477	S	S	*	.	H	α-helix	trans	-63.8	-39.7	177.3	-169.5	-179.2	69.3	169.2	0.2	111.8	F255 G256 N263	F255-R259 VanDerWaalsContact O-CB 3.23Å; F255-R259 WeakPolarHBondContact O-CB 3.3Å; F255-R259 PolarHBondContact O-N 2.85Å; G256-R259 PolarHBondContact O-N 2.83Å; R259-N263 VanDerWaalsContact O-CB 3.29Å; R259-N263 WeakPolarHBondContact O-CB 3.2Å; R259-N263 VanDerWaalsContact O-CG 3.25Å; R259-N263 PolarHBondContact O-N 3.21Å; R259-N263 PolarHBondContact O-ND2 2.99Å
260	D	70.8	Confident	71.4	Confident	64 Å²	64	102.2 Å²	102.2	34%	0.342	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-40.3	173.5	-88.7	9.6	0	0	0	112	R169 G256 T257 I258 S264	R169-D260 IonicContact CZ-OD2 2.68Å; R169-D260 IonicContact NE-OD2 3.99Å; R169-D260 VanDerWaalsContact NH2-CG 3.3Å; R169-D260 IonicContact NH2-OD1 3.67Å; R169-D260 IonicContact NH2-OD2 3.85Å; R169-D260 PolarHBondContact NH2-OD2 2.93Å; G256-D260 WeakPolarHBondContact O-CB 3.47Å; G256-D260 PolarHBondContact O-N 3.42Å; T257-D260 PolarHBondContact O-N 3.31Å; I258-D260 VanDerWaalsContact C-N 3.34Å; I258-D260 PolarHBondContact O-N 3.12Å; D260-S264 WeakPolarHBondContact O-CB 3.49Å; D260-S264 PolarHBondContact O-N 3.26Å
261	S	73.4	Confident	69.8	Low	64 Å²	64	103.7 Å²	103.7	45%	0.448	51%	0.513	S	S	.	.	H	α-helix	trans	-65	-45.4	176.2	-173.9	0	0	0	0	112.4	T257 I258 S264 K265	T257-S261 WeakPolarHBondContact O-CB 3.48Å; T257-S261 PolarHBondContact O-N 3.27Å; I258-S261 WeakPolarHBondContact O-CB 3.33Å; I258-S261 PolarHBondContact O-N 3.01Å; S261-S264 WeakPolarHBondContact O-CB 3.45Å; S261-S264 PolarHBondContact O-N 3.3Å; S261-K265 PolarHBondContact O-N 3.46Å
262	L	75.9	Confident	68	Low	107 Å²	107	104 Å²	104	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-63.2	-43.4	176.1	-69.9	168.8	0	0	0	111.6	I258 S264 K265 R266	I258-L262 HydrophobicContact CG2-CD1 3.86Å; I258-L262 HydrophobicContact CG2-CG 4.4Å; I258-L262 WeakPolarHBondContact O-CG 3.4Å; I258-L262 PolarHBondContact O-N 3.42Å; L262-S264 VanDerWaalsContact C-N 3.31Å; L262-S264 PolarHBondContact O-N 3.37Å; L262-K265 PolarHBondContact O-N 3.02Å; L262-R266 WeakPolarHBondContact O-CB 2.96Å; L262-R266 PolarHBondContact O-N 3.16Å
263	N	72	Confident	66.6	Low	80 Å²	80	101.9 Å²	101.9	43%	0.428	53%	0.527	S	S	.	.	H	α-helix	trans	-66.3	-31	175	-75.6	-23.4	0	0	0	112.7	R259 R267	R259-N263 VanDerWaalsContact O-CB 3.29Å; R259-N263 WeakPolarHBondContact O-CB 3.2Å; R259-N263 VanDerWaalsContact O-CG 3.25Å; R259-N263 PolarHBondContact O-N 3.21Å; R259-N263 PolarHBondContact O-ND2 2.99Å; N263-R267 WeakPolarHBondContact O-CG 3.25Å; N263-R267 PolarHBondContact O-N 3.27Å; N263-R267 VanDerWaalsContact O-N 3.17Å
264	S	69.4	Low	65	Low	69 Å²	69	102.7 Å²	102.7	48%	0.483	54%	0.539	S	S	.	.	H	α-helix	trans	-66.8	-51.4	172.7	-160.8	0	0	0	0	110.9	D260 S261 L262 R266 R267 E268	D260-S264 WeakPolarHBondContact O-CB 3.49Å; D260-S264 PolarHBondContact O-N 3.26Å; S261-S264 WeakPolarHBondContact O-CB 3.45Å; S261-S264 PolarHBondContact O-N 3.3Å; L262-S264 VanDerWaalsContact C-N 3.31Å; L262-S264 PolarHBondContact O-N 3.37Å; S264-R266 VanDerWaalsContact C-N 3.27Å; S264-R266 PolarHBondContact O-N 2.98Å; S264-R267 WeakPolarHBondContact O-CB 3.49Å; S264-R267 PolarHBondContact O-N 3.41Å; S264-E268 PolarHBondContact O-N 3.47Å
265	K	67.7	Low	63.3	Low	133 Å²	133	110.5 Å²	110.5	58%	0.578	56%	0.563	S	S	*	*	H	α-helix	trans	-59.1	-37.6	176.8	-73.2	-170.9	173.4	-169.4	0	112.7	S261 L262 E268 L269	S261-K265 PolarHBondContact O-N 3.46Å; L262-K265 PolarHBondContact O-N 3.02Å; K265-E268 WeakPolarHBondContact O-CB 3.47Å; K265-E268 PolarHBondContact O-N 2.95Å; K265-L269 PolarHBondContact O-N 2.91Å
266	R	61.2	Low	61.6	Low	160 Å²	160	111 Å²	111	60%	0.604	57%	0.572	S	S	*	*	H	α-helix	trans	-62.8	-40.8	174.8	-176.3	174.1	173	156.2	7	112.2	L262 S264 L269 E270	L262-R266 WeakPolarHBondContact O-CB 2.96Å; L262-R266 PolarHBondContact O-N 3.16Å; S264-R266 VanDerWaalsContact C-N 3.27Å; S264-R266 PolarHBondContact O-N 2.98Å; R266-L269 PolarHBondContact O-N 3.28Å; R266-E270 IonicContact CZ-OE2 3.06Å; R266-E270 IonicContact NE-OE2 2.82Å; R266-E270 PolarHBondContact NE-OE2 3.39Å; R266-E270 IonicContact NH2-OE2 3.81Å; R266-E270 PolarHBondContact NH2-OE2 2.96Å; R266-E270 WeakPolarHBondContact O-CB 3.45Å; R266-E270 PolarHBondContact O-N 2.95Å
267	R	58.9	Low	59.9	Low	199 Å²	199	119.2 Å²	119.2	75%	0.751	60%	0.595	S	S	*	*	H	α-helix	trans	-68.3	-35.6	175.2	-74	175	174.1	-153.7	-4	112.9	N263 S264 L269 E270 D271	N263-R267 WeakPolarHBondContact O-CG 3.25Å; N263-R267 PolarHBondContact O-N 3.27Å; N263-R267 VanDerWaalsContact O-N 3.17Å; S264-R267 WeakPolarHBondContact O-CB 3.49Å; S264-R267 PolarHBondContact O-N 3.41Å; R267-L269 VanDerWaalsContact C-N 3.28Å; R267-L269 PolarHBondContact O-N 3.44Å; R267-E270 PolarHBondContact O-N 2.97Å; R267-D271 PolarHBondContact O-N 3.07Å
268	E	59.1	Low	58.5	Low	153 Å²	153	120.9 Å²	120.9	72%	0.715	61%	0.607	S	S	*	*	H	α-helix	trans	-65.8	-31.3	175.2	-153.1	172.4	126.6	0	0	111.9	S264 K265	S264-E268 PolarHBondContact O-N 3.47Å; K265-E268 WeakPolarHBondContact O-CB 3.47Å; K265-E268 PolarHBondContact O-N 2.95Å
269	L	61	Low	56.7	Low	147 Å²	147	124.8 Å²	124.8	77%	0.77	62%	0.621	S	S	*	*	H	α-helix	trans	-85.2	-19.5	173	-76.6	161.2	0	0	0	114.4	K265 R266 R267	K265-L269 PolarHBondContact O-N 2.91Å; R266-L269 PolarHBondContact O-N 3.28Å; R267-L269 VanDerWaalsContact C-N 3.28Å; R267-L269 PolarHBondContact O-N 3.44Å
270	E	56.1	Low	54.7	Low	124 Å²	124	122 Å²	122	58%	0.579	62%	0.622	S	S	*	*	S	Bend	trans	-89.2	1.9	176.7	-82	-177	39.3	0	0	113.8	R266 R267	R266-E270 IonicContact CZ-OE2 3.06Å; R266-E270 IonicContact NE-OE2 2.82Å; R266-E270 PolarHBondContact NE-OE2 3.39Å; R266-E270 IonicContact NH2-OE2 3.81Å; R266-E270 PolarHBondContact NH2-OE2 2.96Å; R266-E270 WeakPolarHBondContact O-CB 3.45Å; R266-E270 PolarHBondContact O-N 2.95Å; R267-E270 PolarHBondContact O-N 2.97Å
271	D	50.4	Low	53.4	Low	94 Å²	94	129.4 Å²	129.4	50%	0.503	65%	0.646	S	S	.	*			trans	-120.9	81.2	172	-169.1	-3.9	0	0	0	114.2	R267 G273 A274	R267-D271 PolarHBondContact O-N 3.07Å; D271-G273 PolarHBondContact O-N 3.01Å; D271-G273 WeakPolarHBondContact OD1-CA 3.42Å; D271-G273 PolarHBondContact OD1-N 3.34Å; D271-A274 PolarHBondContact OD1-N 3.42Å; D271-A274 VanDerWaalsContact OD1-N 3.12Å; D271-A274 WeakPolarHBondContact OD2-CB 3.44Å
272	P	47.2	Very low	51.8	Low	102 Å²	102	133 Å²	133	66%	0.662	66%	0.66	S	S	*	*	S	Bend	trans	-76.6	8.5	166.8	-14.5	31.2	0	0	0	114.4	Y275	P272-Y275 WeakPolarHBondContact O-CE2 3.33Å
273	G	52.6	Low	50.1	Low	60 Å²	60	134 Å²	134	62%	0.619	67%	0.671	S	S	*	*			trans	-112.6	-22.6	-160.8	0	0	0	0	0	116.6	D271 Y275	D271-G273 PolarHBondContact O-N 3.01Å; D271-G273 WeakPolarHBondContact OD1-CA 3.42Å; D271-G273 PolarHBondContact OD1-N 3.34Å; G273-Y275 PolarHBondContact O-N 2.93Å
274	A	45.2	Very low	48.7	Very low	59 Å²	59	136.1 Å²	136.1	49%	0.488	69%	0.689	S	S	.	*			trans	-98.1	57.7	-169.6	0	0	0	0	0	115.3	D271 N276	D271-A274 PolarHBondContact OD1-N 3.42Å; D271-A274 VanDerWaalsContact OD1-N 3.12Å; D271-A274 WeakPolarHBondContact OD2-CB 3.44Å; A274-N276 PolarHBondContact O-N 3.08Å
275	Y	43.2	Very low	47.6	Very low	188 Å²	188	138.6 Å²	138.6	74%	0.737	71%	0.706	S	S	*	*			trans	-67.6	91.5	170.2	-61.7	-82.6	0	0	0	111.3	P272 G273 Y277	P272-Y275 WeakPolarHBondContact O-CE2 3.33Å; G273-Y275 PolarHBondContact O-N 2.93Å; Y275-Y277 VanDerWaalsContact C-N 3.31Å; Y275-Y277 PolarHBondContact O-N 3Å
276	N	38.6	Very low	46.5	Very low	156 Å²	156	136 Å²	136	83%	0.834	71%	0.709	S	S	*	*			trans	-67.5	83.4	173.9	-84.6	-50.4	0	0	0	111.6	A274	A274-N276 PolarHBondContact O-N 3.08Å
277	Y	36	Very low	45.8	Very low	203 Å²	203	132.8 Å²	132.8	80%	0.796	71%	0.709	S	S	*	*			trans	-67.1	125.8	158.5	-83.6	-86.7	0	0	0	109.2	Y275 F279	Y275-Y277 VanDerWaalsContact C-N 3.31Å; Y275-Y277 PolarHBondContact O-N 3Å; Y277-F279 PolarHBondContact O-N 3.36Å
278	P	41.8	Very low	45.2	Very low	110 Å²	110	129.7 Å²	129.7	71%	0.714	72%	0.715	S	S	*	*			trans	-69.7	106.1	176.6	28	-33.1	0	0	0	109.5	T280	P278-T280 PolarHBondContact O-N 3.47Å
279	F	35.6	Very low	44.6	Very low	181 Å²	181	126.2 Å²	126.2	79%	0.794	72%	0.72	S	S	*	*			trans	-73.3	88.3	-178.2	-159.4	-85.7	0	0	0	110.6	Y277 W281	Y277-F279 PolarHBondContact O-N 3.36Å; F279-W281 PolarHBondContact O-N 2.93Å
280	T	33.3	Very low	43.7	Very low	108 Å²	108	126.6 Å²	126.6	66%	0.663	71%	0.712	S	S	*	*			trans	-70.5	113.2	177.9	53.4	0	0	0	0	110.3	P278 N282	P278-T280 PolarHBondContact O-N 3.47Å; T280-N282 VanDerWaalsContact C-N 3.29Å; T280-N282 PolarHBondContact O-N 3.27Å
281	W	43.1	Very low	43.4	Very low	221 Å²	221	128.5 Å²	128.5	84%	0.837	73%	0.726	S	S	*	*			trans	-67.3	85.3	170.8	-85.3	86.7	0	0	0	111	F279	F279-W281 PolarHBondContact O-N 2.93Å
282	N	38.9	Very low	43	Very low	140 Å²	140	130 Å²	130	75%	0.749	73%	0.733	S	S	*	*			trans	-149.7	87.2	169.7	-86.6	-42.6	0	0	0	108.3	T280 P284	T280-N282 VanDerWaalsContact C-N 3.29Å; T280-N282 PolarHBondContact O-N 3.27Å; N282-P284 WeakPolarHBondContact O-CD 3.38Å
283	T	40.3	Very low	42.9	Very low	127 Å²	127	130 Å²	130	78%	0.779	74%	0.742	S	S	*	*			trans	-85.1	112.2	167.4	44.8	0	0	0	0	109.2	S285	T283-S285 PolarHBondContact O-N 3.5Å
284	P	42.9	Very low	42.4	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	75%	0.745	S	S	*	*			trans	-73.6	123.2	171.4	-8.7	26.8	0	0	0	108.6	N282 A286	N282-P284 WeakPolarHBondContact O-CD 3.38Å; P284-A286 PolarHBondContact O-N 2.97Å; P284-A286 VanDerWaalsContact O-N 3.14Å
285	S	47.4	Very low	42.1	Very low	121 Å²	121	137.7 Å²	137.7	85%	0.846	76%	0.756	S	S	*	*			trans	-64.2	112.7	172.7	-58.1	0	0	0	0	109.8	T283	T283-S285 PolarHBondContact O-N 3.5Å
286	A	44.8	Very low	41.9	Very low	77 Å²	77	134 Å²	134	64%	0.636	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-67.6	135.6	173.7	0	0	0	0	0	110.2	P284	P284-A286 PolarHBondContact O-N 2.97Å; P284-A286 VanDerWaalsContact O-N 3.14Å
287	P	45.1	Very low	41.9	Very low	93 Å²	93	132.1 Å²	132.1	60%	0.604	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-71.6	151.8	177.5	30.5	-34.9	0	0	0	111.2
288	P	46.8	Very low	42.1	Very low	135 Å²	135	131 Å²	131	88%	0.877	75%	0.748	S	S	*	*	S	Bend	trans	-70.5	138.4	179	29.9	-34.8	0	0	0	111.3
289	G	46.7	Very low	42.2	Very low	80 Å²	80	133.2 Å²	133.2	83%	0.825	75%	0.752	S	S	*	*			trans	137.4	8.4	160.6	0	0	0	0	0	119.5
290	Y	42.4	Very low	42.2	Very low	154 Å²	154	131 Å²	131	60%	0.604	74%	0.744	S	S	*	*			trans	-136.9	130.1	175.1	65.3	-75.2	0	0	0	113.9	I292	Y290-I292 HydrophobicContact CD2-CD1 4.42Å; Y290-I292 HydrophobicContact CD2-CG1 3.89Å; Y290-I292 HydrophobicContact CE2-CD1 3.86Å; Y290-I292 HydrophobicContact CE2-CG1 3.84Å
291	N	50	Low	42.9	Very low	164 Å²	164	136 Å²	136	88%	0.877	75%	0.752	S	S	*	*			trans	-87.9	111.7	175.3	-71.2	-71.2	0	0	0	109.6	A293	N291-A293 PolarHBondContact O-N 3.23Å; N291-A293 VanDerWaalsContact O-N 3.13Å
292	I	41.3	Very low	43.1	Very low	126 Å²	126	128.5 Å²	128.5	65%	0.646	73%	0.731	S	S	*	*			trans	-79.1	94.9	169.9	-58.8	177.8	0	0	0	108.2	Y290 V294	Y290-I292 HydrophobicContact CD2-CD1 4.42Å; Y290-I292 HydrophobicContact CD2-CG1 3.89Å; Y290-I292 HydrophobicContact CE2-CD1 3.86Å; Y290-I292 HydrophobicContact CE2-CG1 3.84Å; I292-V294 HydrophobicContact CG2-CB 4.19Å; I292-V294 HydrophobicContact CG2-CG2 3.83Å; I292-V294 PolarHBondContact O-N 3.3Å
293	A	45.6	Very low	43.5	Very low	103 Å²	103	128 Å²	128	85%	0.851	72%	0.724	S	S	*	*			trans	-76.8	66.7	174.1	0	0	0	0	0	111.4	N291	N291-A293 PolarHBondContact O-N 3.23Å; N291-A293 VanDerWaalsContact O-N 3.13Å
294	V	40.8	Very low	43.9	Very low	112 Å²	112	128.5 Å²	128.5	68%	0.679	72%	0.721	S	S	*	*			trans	-116.3	107.9	166.8	178.8	0	0	0	0	107.8	I292 P296	I292-V294 HydrophobicContact CG2-CB 4.19Å; I292-V294 HydrophobicContact CG2-CG2 3.83Å; I292-V294 PolarHBondContact O-N 3.3Å; V294-P296 VanDerWaalsContact O-CD 3.24Å; V294-P296 WeakPolarHBondContact O-CD 3.1Å
295	K	40.4	Very low	44.5	Very low	167 Å²	167	125.1 Å²	125.1	73%	0.726	70%	0.7	S	S	*	*			trans	-77.7	112.3	171.3	-179.7	-161.3	179	-136.6	0	108.1	D297	K295-D297 WeakPolarHBondContact CE-OD1 3.07Å; K295-D297 IonicContact NZ-OD1 2.72Å; K295-D297 PolarHBondContact NZ-OD1 3.35Å; K295-D297 PolarHBondContact O-N 2.94Å
296	P	38.5	Very low	44.9	Very low	110 Å²	110	123.3 Å²	123.3	71%	0.714	68%	0.681	S	S	*	*			trans	-73.5	123.8	166.4	31	-31	0	0	0	108	V294	V294-P296 VanDerWaalsContact O-CD 3.24Å; V294-P296 WeakPolarHBondContact O-CD 3.1Å
297	D	39.3	Very low	45.8	Very low	118 Å²	118	122.6 Å²	122.6	63%	0.631	68%	0.675	S	S	*	*			trans	-67.3	143.4	167.1	-81.5	-39.1	0	0	0	110	K295 I299	K295-D297 WeakPolarHBondContact CE-OD1 3.07Å; K295-D297 IonicContact NZ-OD1 2.72Å; K295-D297 PolarHBondContact NZ-OD1 3.35Å; K295-D297 PolarHBondContact O-N 2.94Å; D297-I299 PolarHBondContact O-N 2.86Å
298	Q	40.1	Very low	46.7	Very low	179 Å²	179	125.3 Å²	125.3	84%	0.836	68%	0.677	S	S	*	*			trans	-80.5	86.2	-154.7	-169.9	176.2	17.9	0	0	111.9	Q300	Q298-Q300 PolarHBondContact O-N 3Å; Q298-Q300 VanDerWaalsContact O-N 3.09Å
299	I	42.9	Very low	47.8	Very low	157 Å²	157	123.6 Å²	123.6	81%	0.805	66%	0.66	S	S	*	*			trans	-55.5	118.4	171.3	-59.4	179.8	0	0	0	108.5	D297 Y301	D297-I299 PolarHBondContact O-N 2.86Å; I299-Y301 PolarHBondContact O-N 3.04Å
300	Q	36.8	Very low	48.8	Very low	135 Å²	135	122.2 Å²	122.2	63%	0.631	64%	0.641	S	S	*	*			trans	-81.8	116.7	-160.8	-140.5	176.3	3.7	0	0	111	Q298 T302 E303	Q298-Q300 PolarHBondContact O-N 3Å; Q298-Q300 VanDerWaalsContact O-N 3.09Å; Q300-T302 VanDerWaalsContact CG-OG1 3.32Å; Q300-T302 WeakPolarHBondContact CG-OG1 3.17Å; Q300-T302 PolarHBondContact O-N 3.4Å; Q300-E303 PolarHBondContact O-N 2.87Å; Q300-E303 VanDerWaalsContact O-N 3.14Å
301	Y	46.3	Very low	50.1	Low	213 Å²	213	122.6 Å²	122.6	84%	0.835	64%	0.642	S	S	*	*	H	α-helix	trans	-56.6	-17.4	-179.6	-81.8	-98.4	0	0	0	114.2	I299 S305	I299-Y301 PolarHBondContact O-N 3.04Å; Y301-S305 PolarHBondContact O-OG 2.92Å
302	T	48.9	Very low	51.1	Low	63 Å²	63	122 Å²	122	39%	0.387	63%	0.632	S	S	.	*	H	α-helix	trans	-62.9	-35.6	176.2	43.5	0	0	0	0	113.6	Q300 L304 S305 N306	Q300-T302 VanDerWaalsContact CG-OG1 3.32Å; Q300-T302 WeakPolarHBondContact CG-OG1 3.17Å; Q300-T302 PolarHBondContact O-N 3.4Å; T302-L304 PolarHBondContact O-N 3.49Å; T302-S305 WeakPolarHBondContact CA-OG 3.48Å; T302-S305 PolarHBondContact O-N 3.03Å; T302-S305 PolarHBondContact O-OG 3.46Å; T302-N306 WeakPolarHBondContact O-CB 3.2Å; T302-N306 PolarHBondContact O-N 2.96Å; T302-N306 PolarHBondContact O-ND2 2.95Å; T302-N306 PolarHBondContact O-OD1 3.44Å
303	E	46.8	Very low	52.4	Low	128 Å²	128	121.7 Å²	121.7	60%	0.598	63%	0.627	S	S	*	*	H	α-helix	trans	-64.5	-42.6	-178.2	-81.1	-62.7	99.4	0	0	112.2	Q300 S305 N306 A307	Q300-E303 PolarHBondContact O-N 2.87Å; Q300-E303 VanDerWaalsContact O-N 3.14Å; E303-S305 VanDerWaalsContact C-N 3.33Å; E303-S305 PolarHBondContact O-N 3.33Å; E303-N306 PolarHBondContact O-N 3.16Å; E303-A307 WeakPolarHBondContact O-CB 3.13Å; E303-A307 PolarHBondContact O-N 3.3Å
304	L	48.8	Very low	53.6	Low	139 Å²	139	121.9 Å²	121.9	73%	0.728	61%	0.614	S	S	*	*	H	α-helix	trans	-67.3	-34.2	179.5	-162.7	74.8	0	0	0	111.9	T302 K308	T302-L304 PolarHBondContact O-N 3.49Å; L304-K308 VanDerWaalsContact O-CB 3.26Å; L304-K308 WeakPolarHBondContact O-CB 3.34Å; L304-K308 PolarHBondContact O-N 3.26Å
305	S	54.9	Low	55	Low	53 Å²	53	123.1 Å²	123.1	37%	0.371	61%	0.611	S	S	.	*	H	α-helix	trans	-68.2	-43.4	171	42.5	0	0	0	0	112.2	Y301 T302 E303 K308 I309	Y301-S305 PolarHBondContact O-OG 2.92Å; T302-S305 WeakPolarHBondContact CA-OG 3.48Å; T302-S305 PolarHBondContact O-N 3.03Å; T302-S305 PolarHBondContact O-OG 3.46Å; E303-S305 VanDerWaalsContact C-N 3.33Å; E303-S305 PolarHBondContact O-N 3.33Å; S305-K308 PolarHBondContact O-N 2.89Å; S305-I309 WeakPolarHBondContact O-CD1 3.3Å; S305-I309 VanDerWaalsContact O-CG1 3.26Å; S305-I309 WeakPolarHBondContact O-CG1 3.42Å; S305-I309 PolarHBondContact O-N 3.09Å
306	N	55.6	Low	56.3	Low	84 Å²	84	117.9 Å²	117.9	45%	0.449	60%	0.598	S	S	.	*	H	α-helix	trans	-62.7	-47.3	-179.4	-67.6	-13.2	0	0	0	111	T302 E303 K308 I309 A310	T302-N306 WeakPolarHBondContact O-CB 3.2Å; T302-N306 PolarHBondContact O-N 2.96Å; T302-N306 PolarHBondContact O-ND2 2.95Å; T302-N306 PolarHBondContact O-OD1 3.44Å; E303-N306 PolarHBondContact O-N 3.16Å; N306-K308 VanDerWaalsContact C-N 3.32Å; N306-K308 PolarHBondContact O-N 3.48Å; N306-I309 PolarHBondContact O-N 2.86Å; N306-A310 WeakPolarHBondContact O-CB 3.41Å; N306-A310 PolarHBondContact O-N 2.88Å
307	A	63.9	Low	57.6	Low	61 Å²	61	116.3 Å²	116.3	50%	0.504	58%	0.584	S	S	.	*	H	α-helix	trans	-59.4	-40.4	174.7	0	0	0	0	0	112.5	E303 A310 Y311	E303-A307 WeakPolarHBondContact O-CB 3.13Å; E303-A307 PolarHBondContact O-N 3.3Å; A307-A310 PolarHBondContact O-N 2.88Å; A307-Y311 WeakPolarHBondContact O-CB 3.21Å; A307-Y311 PolarHBondContact O-N 3.32Å
308	K	64	Low	58.9	Low	150 Å²	150	114 Å²	114	65%	0.652	57%	0.574	S	S	*	*	H	α-helix	trans	-70.9	-30.2	178.7	-168.7	171.7	-174.2	173.1	0	113.1	L304 S305 N306 K312	L304-K308 VanDerWaalsContact O-CB 3.26Å; L304-K308 WeakPolarHBondContact O-CB 3.34Å; L304-K308 PolarHBondContact O-N 3.26Å; S305-K308 PolarHBondContact O-N 2.89Å; N306-K308 VanDerWaalsContact C-N 3.32Å; N306-K308 PolarHBondContact O-N 3.48Å; K308-K312 PolarHBondContact O-N 3.13Å
309	I	69.6	Low	60	Low	100 Å²	100	107.8 Å²	107.8	51%	0.513	55%	0.553	S	S	.	*	H	α-helix	trans	-73.2	-50.3	172.4	-68.2	162.8	0	0	0	109.7	S305 N306 Y311 K312 Q313	S305-I309 WeakPolarHBondContact O-CD1 3.3Å; S305-I309 VanDerWaalsContact O-CG1 3.26Å; S305-I309 WeakPolarHBondContact O-CG1 3.42Å; S305-I309 PolarHBondContact O-N 3.09Å; N306-I309 PolarHBondContact O-N 2.86Å; I309-Y311 VanDerWaalsContact C-N 3.32Å; I309-Y311 PolarHBondContact O-N 3.42Å; I309-K312 WeakPolarHBondContact O-CB 3.32Å; I309-K312 PolarHBondContact O-N 3.41Å; I309-K312 VanDerWaalsContact O-N 3.1Å; I309-Q313 WeakPolarHBondContact O-CB 3.4Å; I309-Q313 PolarHBondContact O-N 3.37Å
310	A	69	Low	60.8	Low	50 Å²	50	106.7 Å²	106.7	41%	0.413	55%	0.545	S	S	.	.	H	α-helix	trans	-57.7	-41.9	177.5	0	0	0	0	0	112.4	N306 A307 Q313 N314	N306-A310 WeakPolarHBondContact O-CB 3.41Å; N306-A310 PolarHBondContact O-N 2.88Å; A307-A310 PolarHBondContact O-N 2.88Å; A310-Q313 PolarHBondContact O-N 3.16Å; A310-N314 PolarHBondContact O-N 3.39Å
311	Y	69	Low	61.7	Low	162 Å²	162	106.3 Å²	106.3	64%	0.635	54%	0.543	S	S	*	.	H	α-helix	trans	-63.6	-41.3	175	-179.5	-106.5	0	0	0	112.7	A307 I309 Q313 K315	A307-Y311 WeakPolarHBondContact O-CB 3.21Å; A307-Y311 PolarHBondContact O-N 3.32Å; I309-Y311 VanDerWaalsContact C-N 3.32Å; I309-Y311 PolarHBondContact O-N 3.42Å; Y311-Q313 VanDerWaalsContact C-N 3.33Å; Y311-K315 VanDerWaalsContact O-CB 3.32Å; Y311-K315 WeakPolarHBondContact O-CB 3.43Å; Y311-K315 PolarHBondContact O-N 3.37Å
312	K	71.6	Confident	61.9	Low	153 Å²	153	103.3 Å²	103.3	67%	0.665	54%	0.537	S	S	*	.	H	α-helix	trans	-63	-39.5	172.4	-85.7	-172.6	170.3	-170	0	112.1	K308 I309 K315 A316	K308-K312 PolarHBondContact O-N 3.13Å; I309-K312 WeakPolarHBondContact O-CB 3.32Å; I309-K312 PolarHBondContact O-N 3.41Å; I309-K312 VanDerWaalsContact O-N 3.1Å; K312-K315 PolarHBondContact O-N 2.92Å; K312-A316 PolarHBondContact O-N 2.7Å
313	Q	67.9	Low	62	Low	118 Å²	118	108.1 Å²	108.1	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-73.2	-42.7	-176.9	-168.4	165.8	-7.8	0	0	112	I309 A310 Y311 K315 A316 N317	I309-Q313 WeakPolarHBondContact O-CB 3.4Å; I309-Q313 PolarHBondContact O-N 3.37Å; A310-Q313 PolarHBondContact O-N 3.16Å; Y311-Q313 VanDerWaalsContact C-N 3.33Å; Q313-K315 VanDerWaalsContact C-N 3.32Å; Q313-K315 PolarHBondContact O-N 2.99Å; Q313-A316 WeakPolarHBondContact O-CB 3.27Å; Q313-A316 PolarHBondContact O-N 2.81Å; Q313-N317 PolarHBondContact O-N 2.85Å; Q313-N317 PolarHBondContact O-OD1 3.07Å
314	N	70.6	Confident	61.7	Low	108 Å²	108	112 Å²	112	58%	0.578	57%	0.565	S	S	*	*	H	α-helix	trans	-59.5	-42.7	169	-86.8	-7.3	0	0	0	111.4	A310 A316 N317 T318	A310-N314 PolarHBondContact O-N 3.39Å; N314-A316 VanDerWaalsContact C-N 3.26Å; N314-A316 PolarHBondContact O-N 2.93Å; N314-N317 PolarHBondContact O-N 3.16Å; N314-T318 PolarHBondContact O-N 3.13Å; N314-T318 PolarHBondContact O-OG1 3.24Å
315	K	70.5	Confident	61.2	Low	138 Å²	138	108.8 Å²	108.8	60%	0.6	57%	0.566	S	S	*	*	H	α-helix	trans	-63.7	-30.5	176.7	-171.8	166.2	-174.5	165.6	0	113.2	Y311 K312 Q313 A319	Y311-K315 VanDerWaalsContact O-CB 3.32Å; Y311-K315 WeakPolarHBondContact O-CB 3.43Å; Y311-K315 PolarHBondContact O-N 3.37Å; K312-K315 PolarHBondContact O-N 2.92Å; Q313-K315 VanDerWaalsContact C-N 3.32Å; Q313-K315 PolarHBondContact O-N 2.99Å; K315-A319 WeakPolarHBondContact O-CB 3.47Å; K315-A319 PolarHBondContact O-N 3.41Å
316	A	67.9	Low	60.3	Low	56 Å²	56	110.5 Å²	110.5	46%	0.463	58%	0.578	S	S	.	*	H	α-helix	trans	-71.8	-47.3	171.8	0	0	0	0	0	111.5	K312 Q313 N314 T318 A319 Q320	K312-A316 PolarHBondContact O-N 2.7Å; Q313-A316 WeakPolarHBondContact O-CB 3.27Å; Q313-A316 PolarHBondContact O-N 2.81Å; N314-A316 VanDerWaalsContact C-N 3.26Å; N314-A316 PolarHBondContact O-N 2.93Å; A316-T318 PolarHBondContact O-N 3.5Å; A316-A319 PolarHBondContact O-N 2.04Å; A316-Q320 PolarHBondContact O-N 2.94Å
317	N	65.8	Low	59.3	Low	78 Å²	78	113.9 Å²	113.9	42%	0.417	59%	0.591	S	S	.	*	H	α-helix	trans	-58.6	-48.2	177.4	-74	10	0	0	0	111.8	Q313 N314 A319 Q320 E321	Q313-N317 PolarHBondContact O-N 2.85Å; Q313-N317 PolarHBondContact O-OD1 3.07Å; N314-N317 PolarHBondContact O-N 3.16Å; N317-A319 VanDerWaalsContact C-N 3.28Å; N317-A319 PolarHBondContact O-N 2.94Å; N317-Q320 CarbonylContact O-C 3.54Å; N317-Q320 WeakPolarHBondContact O-CA 3.4Å; N317-Q320 WeakPolarHBondContact O-CB 3.38Å; N317-Q320 PolarHBondContact O-N 2.9Å; N317-E321 WeakPolarHBondContact O-CG 3.39Å; N317-E321 PolarHBondContact O-N 3.48Å
318	T	65.6	Low	57.6	Low	69 Å²	69	120 Å²	120	42%	0.423	61%	0.609	S	S	.	*	H	α-helix	trans	-64.8	-29.8	178.7	-56.4	0	0	0	0	113.1	N314 A316 E321 Q322	N314-T318 PolarHBondContact O-N 3.13Å; N314-T318 PolarHBondContact O-OG1 3.24Å; A316-T318 PolarHBondContact O-N 3.5Å; T318-E321 WeakPolarHBondContact CA-OE2 3.43Å; T318-Q322 WeakPolarHBondContact O-CG 3.11Å; T318-Q322 PolarHBondContact O-N 2.91Å; T318-Q322 VanDerWaalsContact O-N 3.13Å
319	A	63.4	Low	56.3	Low	49 Å²	49	120 Å²	120	41%	0.405	61%	0.611	S	S	.	*	H	α-helix	trans	-70.1	-36.5	171.3	0	0	0	0	0	111.8	K315 A316 N317 Q322 Q323	K315-A319 WeakPolarHBondContact O-CB 3.47Å; K315-A319 PolarHBondContact O-N 3.41Å; A316-A319 PolarHBondContact O-N 2.04Å; N317-A319 VanDerWaalsContact C-N 3.28Å; N317-A319 PolarHBondContact O-N 2.94Å; A319-Q322 PolarHBondContact O-N 3.32Å; A319-Q323 PolarHBondContact O-N 2.88Å
320	Q	59.3	Low	55	Low	134 Å²	134	121 Å²	121	63%	0.626	62%	0.618	S	S	*	*	H	α-helix	trans	-71.7	-37.7	176	-171.4	172.3	-19.3	0	0	112.2	A316 N317 Q322 Q323 Y324	A316-Q320 PolarHBondContact O-N 2.94Å; N317-Q320 CarbonylContact O-C 3.54Å; N317-Q320 WeakPolarHBondContact O-CA 3.4Å; N317-Q320 WeakPolarHBondContact O-CB 3.38Å; N317-Q320 PolarHBondContact O-N 2.9Å; Q320-Q322 VanDerWaalsContact C-N 3.32Å; Q320-Q322 PolarHBondContact O-N 3.23Å; Q320-Q323 PolarHBondContact O-N 2.99Å; Q320-Y324 PolarHBondContact O-N 3.46Å
321	E	55.7	Low	53.9	Low	126 Å²	126	125.4 Å²	125.4	59%	0.589	63%	0.634	S	S	*	*	H	α-helix	trans	-61.4	-39	171.1	-70.9	173.2	133.5	0	0	111.4	N317 T318 Q323 Y324 G325	N317-E321 WeakPolarHBondContact O-CG 3.39Å; N317-E321 PolarHBondContact O-N 3.48Å; T318-E321 WeakPolarHBondContact CA-OE2 3.43Å; E321-Q323 PolarHBondContact O-N 3.34Å; E321-Y324 PolarHBondContact O-N 2.93Å; E321-Y324 VanDerWaalsContact O-N 3.12Å; E321-G325 PolarHBondContact O-N 3.31Å
322	Q	52	Low	52.8	Low	151 Å²	151	122.7 Å²	122.7	71%	0.706	64%	0.636	S	S	*	*	H	α-helix	trans	-66.8	-19.5	172.9	-75.2	179.3	8.7	0	0	114	T318 A319 Q320	T318-Q322 WeakPolarHBondContact O-CG 3.11Å; T318-Q322 PolarHBondContact O-N 2.91Å; T318-Q322 VanDerWaalsContact O-N 3.13Å; A319-Q322 PolarHBondContact O-N 3.32Å; Q320-Q322 VanDerWaalsContact C-N 3.32Å; Q320-Q322 PolarHBondContact O-N 3.23Å
323	Q	50	Low	51.9	Low	163 Å²	163	119.1 Å²	119.1	76%	0.762	64%	0.635	S	S	*	*	H	α-helix	trans	-89.9	-20	170.3	-67.1	-171.2	-93	0	0	113.4	A319 Q320 E321	A319-Q323 PolarHBondContact O-N 2.88Å; Q320-Q323 PolarHBondContact O-N 2.99Å; E321-Q323 PolarHBondContact O-N 3.34Å
324	Y	40.5	Very low	51.4	Low	209 Å²	209	118.9 Å²	118.9	82%	0.82	64%	0.638	S	S	*	*	H	α-helix	trans	-95	-24	-179.8	-151	-102.1	0	0	0	113	Q320 E321 S326	Q320-Y324 PolarHBondContact O-N 3.46Å; E321-Y324 PolarHBondContact O-N 2.93Å; E321-Y324 VanDerWaalsContact O-N 3.12Å; Y324-S326 PolarHBondContact O-N 2.92Å; Y324-S326 VanDerWaalsContact O-N 3.09Å
325	G	39	Very low	50.6	Low	72 Å²	72	119.4 Å²	119.4	74%	0.742	64%	0.639	S	S	*	*	S	Bend	trans	-74.7	16.1	179.6	0	0	0	0	0	116.3	E321	E321-G325 PolarHBondContact O-N 3.31Å
326	S	35.5	Very low	50	Low	89 Å²	89	118.3 Å²	118.3	62%	0.622	64%	0.636	S	S	*	*			trans	-142	72.1	-178.1	66.9	0	0	0	0	113.1	Y324	Y324-S326 PolarHBondContact O-N 2.92Å; Y324-S326 VanDerWaalsContact O-N 3.09Å
327	H	33.9	Very low	49.9	Very low	155 Å²	155	117.3 Å²	117.3	72%	0.718	63%	0.629	S	S	*	*			trans	-150.3	68.2	167.5	-156.1	-73.9	0	0	0	116.4
328	E	29.5	Very low	50.2	Low	189 Å²	189	118 Å²	118	88%	0.883	63%	0.631	S	S	*	*			trans	-144.3	123.4	148.9	-83.2	-172.4	117.2	0	0	106.7
329	E	35.1	Very low	50.2	Low	150 Å²	150	119.9 Å²	119.9	70%	0.701	64%	0.636	S	S	*	*	S	Bend	cis	-143.1	169.2	-13.3	-65.9	-168	95.4	0	0	110.4
330	N	43.4	Very low	50.5	Low	122 Å²	122	123.8 Å²	123.8	65%	0.652	64%	0.64	S	S	*	*			trans	54.4	82.4	155	-69	-57.3	0	0	0	119.5
331	L	46.8	Very low	51.2	Low	143 Å²	143	123.5 Å²	123.5	75%	0.749	64%	0.638	S	S	*	*			trans	-163	27.3	146.9	-111.8	157.7	0	0	0	118.2	A333	L331-A333 PolarHBondContact O-N 2.92Å
332	P	45.7	Very low	52.1	Low	104 Å²	104	122 Å²	122	68%	0.675	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-8.8	-166.4	35.3	-39.4	0	0	0	117.3
333	A	51.7	Low	53	Low	79 Å²	79	122.4 Å²	122.4	65%	0.653	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-34.8	-170.8	0	0	0	0	0	114.6	L331	L331-A333 PolarHBondContact O-N 2.92Å
334	D	56.6	Low	54.4	Low	113 Å²	113	119.5 Å²	119.5	60%	0.604	62%	0.616	S	S	*	*	H	α-helix	trans	-81.7	-34.2	-166	-159	35.9	0	0	0	112.5	E336 A337 L338	D334-E336 PolarHBondContact O-N 2.94Å; D334-A337 WeakPolarHBondContact O-CB 3.47Å; D334-A337 PolarHBondContact O-N 2.99Å; D334-A337 VanDerWaalsContact O-N 3.13Å; D334-L338 PolarHBondContact O-N 3.07Å
335	L	55.2	Low	56.1	Low	118 Å²	118	112.6 Å²	112.6	62%	0.618	60%	0.602	S	S	*	*	H	α-helix	trans	-64.4	-38.2	179.3	-172.9	63.3	0	0	0	112.3	Q339	L335-Q339 WeakPolarHBondContact O-CB 3.26Å; L335-Q339 PolarHBondContact O-N 3Å
336	E	57.9	Low	57.9	Low	115 Å²	115	114.8 Å²	114.8	54%	0.537	59%	0.593	S	S	.	*	H	α-helix	trans	-68.3	-36.3	172.9	-75	-155.5	173.5	0	0	112.5	D334 Q339 R340	D334-E336 PolarHBondContact O-N 2.94Å; E336-Q339 PolarHBondContact O-N 3.2Å; E336-R340 WeakPolarHBondContact O-CB 3.34Å; E336-R340 VanDerWaalsContact O-CG 3.25Å; E336-R340 WeakPolarHBondContact O-CG 3.33Å; E336-R340 PolarHBondContact O-N 3.29Å; E336-R340 PolarHBondContact O-NE 3.49Å; E336-R340 IonicContact OE2-CZ 3.66Å; E336-R340 IonicContact OE2-NE 3.83Å; E336-R340 IonicContact OE2-NH2 2.7Å; E336-R340 PolarHBondContact OE2-NH2 3.38Å
337	A	65.2	Low	60	Low	36 Å²	36	116.6 Å²	116.6	30%	0.298	59%	0.592	S	S	.	*	H	α-helix	trans	-62.6	-51.3	176.9	0	0	0	0	0	110.1	D334 Q339 R340 E341	D334-A337 WeakPolarHBondContact O-CB 3.47Å; D334-A337 PolarHBondContact O-N 2.99Å; D334-A337 VanDerWaalsContact O-N 3.13Å; A337-Q339 VanDerWaalsContact C-N 3.33Å; A337-Q339 PolarHBondContact O-N 3.25Å; A337-R340 WeakPolarHBondContact O-CB 3.17Å; A337-R340 PolarHBondContact O-N 2.86Å; A337-R340 VanDerWaalsContact O-N 3.07Å; A337-E341 PolarHBondContact O-N 3.23Å
338	L	71.4	Confident	61.9	Low	91 Å²	91	118.3 Å²	118.3	48%	0.476	59%	0.592	S	S	.	*	H	α-helix	trans	-56.8	-43.6	174.6	-167.2	75.2	0	0	0	112.1	D334 R340 E341 I342	D334-L338 PolarHBondContact O-N 3.07Å; L338-R340 VanDerWaalsContact C-N 3.28Å; L338-R340 PolarHBondContact O-N 3.13Å; L338-E341 PolarHBondContact O-N 3.06Å; L338-I342 HydrophobicContact CG-CD1 4.07Å; L338-I342 VanDerWaalsContact O-CG1 3.29Å; L338-I342 WeakPolarHBondContact O-CG1 3.39Å; L338-I342 PolarHBondContact O-N 2.99Å
339	Q	66.3	Low	64.1	Low	110 Å²	110	114.2 Å²	114.2	51%	0.514	58%	0.576	S	S	.	*	H	α-helix	trans	-74.5	-14.3	179.5	-162.1	178.1	4.9	0	0	113.6	L335 E336 A337	L335-Q339 WeakPolarHBondContact O-CB 3.26Å; L335-Q339 PolarHBondContact O-N 3Å; E336-Q339 PolarHBondContact O-N 3.2Å; A337-Q339 VanDerWaalsContact C-N 3.33Å; A337-Q339 PolarHBondContact O-N 3.25Å
340	R	70.7	Confident	66	Low	131 Å²	131	111 Å²	111	49%	0.494	56%	0.564	S	S	.	*	H	α-helix	trans	-84.3	-42.6	166.2	-73.9	178.2	-123.7	131.1	-6.7	111.2	E336 A337 L338 R343 M344	E336-R340 WeakPolarHBondContact O-CB 3.34Å; E336-R340 VanDerWaalsContact O-CG 3.25Å; E336-R340 WeakPolarHBondContact O-CG 3.33Å; E336-R340 PolarHBondContact O-N 3.29Å; E336-R340 PolarHBondContact O-NE 3.49Å; E336-R340 IonicContact OE2-CZ 3.66Å; E336-R340 IonicContact OE2-NE 3.83Å; E336-R340 IonicContact OE2-NH2 2.7Å; E336-R340 PolarHBondContact OE2-NH2 3.38Å; A337-R340 WeakPolarHBondContact O-CB 3.17Å; A337-R340 PolarHBondContact O-N 2.86Å; A337-R340 VanDerWaalsContact O-N 3.07Å; L338-R340 VanDerWaalsContact C-N 3.28Å; L338-R340 PolarHBondContact O-N 3.13Å; R340-R343 WeakPolarHBondContact O-CB 3.49Å; R340-R343 PolarHBondContact O-N 3.07Å; R340-M344 PolarHBondContact O-N 3.13Å
341	E	72.8	Confident	67.8	Low	127 Å²	127	110.4 Å²	110.4	59%	0.593	56%	0.559	S	S	*	*	H	α-helix	trans	-60.8	-47.7	175.8	-71.5	-162.3	149.2	0	0	112.5	A337 L338 R343 M344 A345	A337-E341 PolarHBondContact O-N 3.23Å; L338-E341 PolarHBondContact O-N 3.06Å; E341-R343 PolarHBondContact O-N 2.84Å; E341-M344 PolarHBondContact O-N 3.24Å; E341-A345 WeakPolarHBondContact O-CB 3.44Å; E341-A345 PolarHBondContact O-N 2.85Å
342	I	75	Confident	69.3	Low	95 Å²	95	106.2 Å²	106.2	49%	0.487	55%	0.545	S	S	.	.	H	α-helix	trans	-56.7	-39.6	175.6	-69.2	165.4	0	0	0	110.8	L338 A345 Q346	L338-I342 HydrophobicContact CG-CD1 4.07Å; L338-I342 VanDerWaalsContact O-CG1 3.29Å; L338-I342 WeakPolarHBondContact O-CG1 3.39Å; L338-I342 PolarHBondContact O-N 2.99Å; I342-A345 PolarHBondContact O-N 2.64Å; I342-Q346 WeakPolarHBondContact O-CB 3.45Å; I342-Q346 PolarHBondContact O-N 3.13Å
343	R	71.6	Confident	70.8	Confident	159 Å²	159	105.7 Å²	105.7	60%	0.6	54%	0.536	S	S	*	.	H	α-helix	trans	-67.6	-45.2	179.8	-146.5	178	-56.4	-171.1	2.9	111.7	R340 E341 Q346 E347	R340-R343 WeakPolarHBondContact O-CB 3.49Å; R340-R343 PolarHBondContact O-N 3.07Å; E341-R343 PolarHBondContact O-N 2.84Å; R343-Q346 PolarHBondContact O-N 2.84Å; R343-E347 WeakPolarHBondContact O-CB 3.47Å; R343-E347 PolarHBondContact O-N 3.44Å
344	M	79.2	Confident	71.9	Confident	103 Å²	103	107.9 Å²	107.9	51%	0.507	53%	0.533	S	S	.	.	H	α-helix	trans	-66.7	-34.1	175.1	-69.9	-169.9	-67	0	0	112.8	R340 E341 R348	R340-M344 PolarHBondContact O-N 3.13Å; E341-M344 PolarHBondContact O-N 3.24Å; M344-R348 WeakPolarHBondContact O-CB 3.46Å; M344-R348 VanDerWaalsContact O-CG 3.27Å; M344-R348 WeakPolarHBondContact O-CG 3.47Å; M344-R348 PolarHBondContact O-N 2.97Å; M344-R348 VanDerWaalsContact O-N 3.07Å
345	A	76.3	Confident	72.8	Confident	63 Å²	63	105.3 Å²	105.3	52%	0.521	53%	0.527	S	S	.	.	H	α-helix	trans	-65.9	-40.9	174.8	0	0	0	0	0	111.5	E341 I342 L349	E341-A345 WeakPolarHBondContact O-CB 3.44Å; E341-A345 PolarHBondContact O-N 2.85Å; I342-A345 PolarHBondContact O-N 2.64Å; A345-L349 PolarHBondContact O-N 3.04Å; A345-L349 VanDerWaalsContact O-N 3.13Å
346	Q	75.7	Confident	73.3	Confident	118 Å²	118	107.3 Å²	107.3	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-72.2	-41.1	178.4	-167.5	160.6	-17.9	0	0	112.2	I342 R343 R348 L349 D350	I342-Q346 WeakPolarHBondContact O-CB 3.45Å; I342-Q346 PolarHBondContact O-N 3.13Å; R343-Q346 PolarHBondContact O-N 2.84Å; Q346-R348 VanDerWaalsContact C-N 3.32Å; Q346-R348 PolarHBondContact O-N 2.96Å; Q346-L349 WeakPolarHBondContact O-CA 3.37Å; Q346-L349 WeakPolarHBondContact O-CB 3.2Å; Q346-L349 PolarHBondContact O-N 2.72Å; Q346-D350 PolarHBondContact O-N 2.87Å
347	E	79.1	Confident	73.7	Confident	127 Å²	127	105.1 Å²	105.1	59%	0.593	53%	0.525	S	S	*	.	H	α-helix	trans	-61.5	-38.1	174	-173.8	171.9	-141.7	0	0	112.4	R343 L349 D350 L351	R343-E347 WeakPolarHBondContact O-CB 3.47Å; R343-E347 PolarHBondContact O-N 3.44Å; E347-L349 VanDerWaalsContact C-N 3.34Å; E347-D350 PolarHBondContact O-N 2.93Å; E347-L351 WeakPolarHBondContact O-CG 3.32Å; E347-L351 PolarHBondContact O-N 2.8Å
348	R	75	Confident	73.7	Confident	191 Å²	191	110.5 Å²	110.5	72%	0.721	54%	0.544	S	S	*	.	H	α-helix	trans	-65	-35.1	171	-76.5	176.3	179.1	-164.6	1.7	113.1	M344 Q346 A352	M344-R348 WeakPolarHBondContact O-CB 3.46Å; M344-R348 VanDerWaalsContact O-CG 3.27Å; M344-R348 WeakPolarHBondContact O-CG 3.47Å; M344-R348 PolarHBondContact O-N 2.97Å; M344-R348 VanDerWaalsContact O-N 3.07Å; Q346-R348 VanDerWaalsContact C-N 3.32Å; Q346-R348 PolarHBondContact O-N 2.96Å; R348-A352 WeakPolarHBondContact O-CB 3.21Å; R348-A352 PolarHBondContact O-N 3.28Å; R348-A352 VanDerWaalsContact O-N 3.09Å
349	L	76.5	Confident	73.2	Confident	104 Å²	104	113.5 Å²	113.5	55%	0.545	56%	0.555	S	S	.	*	H	α-helix	trans	-69.4	-43.8	176.5	-175.1	64.6	0	0	0	111	A345 Q346 E347 L351 A352 I353	A345-L349 PolarHBondContact O-N 3.04Å; A345-L349 VanDerWaalsContact O-N 3.13Å; Q346-L349 WeakPolarHBondContact O-CA 3.37Å; Q346-L349 WeakPolarHBondContact O-CB 3.2Å; Q346-L349 PolarHBondContact O-N 2.72Å; E347-L349 VanDerWaalsContact C-N 3.34Å; L349-L351 PolarHBondContact O-N 3.17Å; L349-A352 WeakPolarHBondContact O-CB 3.35Å; L349-A352 PolarHBondContact O-N 3.49Å; L349-A352 VanDerWaalsContact O-N 3.16Å; L349-I353 HydrophobicContact CG-CD1 4Å; L349-I353 VanDerWaalsContact O-CG1 3.3Å; L349-I353 WeakPolarHBondContact O-CG1 3.38Å; L349-I353 PolarHBondContact O-N 2.98Å
350	D	74.2	Confident	72.5	Confident	83 Å²	83	113.4 Å²	113.4	44%	0.444	56%	0.558	S	S	.	*	H	α-helix	trans	-64.8	-38.6	177.4	-72.4	-33.6	0	0	0	112.1	Q346 E347 I353 Q354	Q346-D350 PolarHBondContact O-N 2.87Å; E347-D350 PolarHBondContact O-N 2.93Å; D350-I353 PolarHBondContact O-N 3.35Å; D350-Q354 WeakPolarHBondContact O-CG 3.3Å; D350-Q354 PolarHBondContact O-N 2.95Å
351	L	81.5	Confident	71.3	Confident	108 Å²	108	112.3 Å²	112.3	57%	0.565	56%	0.562	S	S	*	*	H	α-helix	trans	-63.3	-38.8	171.3	-74.3	170.2	0	0	0	112.6	E347 L349 Q354 A355	E347-L351 WeakPolarHBondContact O-CG 3.32Å; E347-L351 PolarHBondContact O-N 2.8Å; L349-L351 PolarHBondContact O-N 3.17Å; L351-Q354 PolarHBondContact O-N 3Å; L351-A355 WeakPolarHBondContact O-CB 3.22Å; L351-A355 PolarHBondContact O-N 3.27Å
352	A	77.2	Confident	69.9	Low	55 Å²	55	111 Å²	111	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-67.4	-39.4	174.8	0	0	0	0	0	112.1	R348 L349 A355 Y356	R348-A352 WeakPolarHBondContact O-CB 3.21Å; R348-A352 PolarHBondContact O-N 3.28Å; R348-A352 VanDerWaalsContact O-N 3.09Å; L349-A352 WeakPolarHBondContact O-CB 3.35Å; L349-A352 PolarHBondContact O-N 3.49Å; L349-A352 VanDerWaalsContact O-N 3.16Å; A352-A355 PolarHBondContact O-N 3.43Å; A352-Y356 WeakPolarHBondContact O-CB 3.43Å; A352-Y356 PolarHBondContact O-N 3.45Å
353	I	76.9	Confident	68.4	Low	94 Å²	94	115.3 Å²	115.3	48%	0.482	58%	0.582	S	S	.	*	H	α-helix	trans	-64.1	-44.6	174.5	-70.2	164.8	0	0	0	110.6	L349 D350 Y356 S357	L349-I353 HydrophobicContact CG-CD1 4Å; L349-I353 VanDerWaalsContact O-CG1 3.3Å; L349-I353 WeakPolarHBondContact O-CG1 3.38Å; L349-I353 PolarHBondContact O-N 2.98Å; D350-I353 PolarHBondContact O-N 3.35Å; I353-Y356 PolarHBondContact O-N 3.47Å; I353-S357 PolarHBondContact O-N 2.9Å
354	Q	76.3	Confident	66.9	Low	125 Å²	125	110.9 Å²	110.9	58%	0.584	59%	0.586	S	S	*	*	H	α-helix	trans	-60.5	-48.3	175	-77.1	-172.2	2.7	0	0	111.3	D350 L351 Y356 S357 H358	D350-Q354 WeakPolarHBondContact O-CG 3.3Å; D350-Q354 PolarHBondContact O-N 2.95Å; L351-Q354 PolarHBondContact O-N 3Å; Q354-Y356 VanDerWaalsContact C-N 3.27Å; Q354-Y356 PolarHBondContact O-N 3.26Å; Q354-S357 PolarHBondContact O-N 3.47Å; Q354-S357 VanDerWaalsContact O-N 3.13Å; Q354-S357 PolarHBondContact O-OG 2.71Å; Q354-H358 WeakPolarHBondContact O-CB 3.44Å; Q354-H358 PolarHBondContact O-N 3.28Å
355	A	74.4	Confident	65.2	Low	59 Å²	59	112 Å²	112	49%	0.488	60%	0.601	S	S	.	*	H	α-helix	trans	-57.1	-40.3	176	0	0	0	0	0	112.4	L351 A352 H358 Q359	L351-A355 WeakPolarHBondContact O-CB 3.22Å; L351-A355 PolarHBondContact O-N 3.27Å; A352-A355 PolarHBondContact O-N 3.43Å; A355-H358 PolarHBondContact O-N 2.84Å; A355-Q359 PolarHBondContact O-N 2.94Å; A355-Q359 VanDerWaalsContact O-N 3.16Å
356	Y	67.1	Low	63.2	Low	160 Å²	160	119.2 Å²	119.2	63%	0.627	62%	0.615	S	S	*	*	H	α-helix	trans	-69.8	-35.6	177.1	-158.5	-97.9	0	0	0	113	A352 I353 Q354 N360	A352-Y356 WeakPolarHBondContact O-CB 3.43Å; A352-Y356 PolarHBondContact O-N 3.45Å; I353-Y356 PolarHBondContact O-N 3.47Å; Q354-Y356 VanDerWaalsContact C-N 3.27Å; Q354-Y356 PolarHBondContact O-N 3.26Å; Y356-N360 WeakPolarHBondContact CE1-ND2 3.34Å; Y356-N360 PolarHBondContact O-ND2 2.96Å
357	S	65.5	Low	61.3	Low	68 Å²	68	119.2 Å²	119.2	48%	0.476	62%	0.615	S	S	.	*	H	α-helix	trans	-67.3	-37	170.9	69	0	0	0	0	112.3	I353 Q354 Q359 N360 N361	I353-S357 PolarHBondContact O-N 2.9Å; Q354-S357 PolarHBondContact O-N 3.47Å; Q354-S357 VanDerWaalsContact O-N 3.13Å; Q354-S357 PolarHBondContact O-OG 2.71Å; S357-Q359 VanDerWaalsContact C-N 3.27Å; S357-Q359 PolarHBondContact O-N 2.84Å; S357-N360 PolarHBondContact O-N 2.8Å; S357-N361 PolarHBondContact O-N 2.93Å
358	H	64.3	Low	59.1	Low	150 Å²	150	122.1 Å²	122.1	69%	0.694	63%	0.625	S	S	*	*	H	α-helix	trans	-70.9	-23.8	-178.3	-134.7	-52.4	0	0	0	112.8	Q354 A355	Q354-H358 WeakPolarHBondContact O-CB 3.44Å; Q354-H358 PolarHBondContact O-N 3.28Å; A355-H358 PolarHBondContact O-N 2.84Å
359	Q	60.9	Low	57.1	Low	154 Å²	154	122.9 Å²	122.9	72%	0.72	63%	0.634	S	S	*	*	H	α-helix	trans	-74.1	-26.4	168.6	-75.9	-173.7	-20.3	0	0	113.4	A355 S357	A355-Q359 PolarHBondContact O-N 2.94Å; A355-Q359 VanDerWaalsContact O-N 3.16Å; S357-Q359 VanDerWaalsContact C-N 3.27Å; S357-Q359 PolarHBondContact O-N 2.84Å
360	N	53.3	Low	54.9	Low	108 Å²	108	122.8 Å²	122.8	58%	0.578	65%	0.648	S	S	*	*	H	α-helix	trans	-103.7	-10.7	-167.9	-78.5	-60.3	0	0	0	115.4	Y356 S357	Y356-N360 WeakPolarHBondContact CE1-ND2 3.34Å; Y356-N360 PolarHBondContact O-ND2 2.96Å; S357-N360 PolarHBondContact O-N 2.8Å
361	N	43.4	Very low	52.9	Low	108 Å²	108	127.9 Å²	127.9	58%	0.578	67%	0.667	S	S	*	*			trans	-154.8	100.4	176.4	-163.3	-11.1	0	0	0	116	S357 H363	S357-N361 PolarHBondContact O-N 2.93Å; N361-H363 PolarHBondContact OD1-CD2 2.77Å
362	P	44.2	Very low	50.5	Low	99 Å²	99	129 Å²	129	64%	0.643	68%	0.678	S	S	*	*			trans	-130.7	84.4	172.2	37	-19.6	0	0	0	113.4	G364	P362-G364 PolarHBondContact O-N 3.12Å
363	H	43.7	Very low	48.3	Very low	185 Å²	185	129.4 Å²	129.4	86%	0.856	69%	0.687	S	S	*	*			trans	-82.7	63.7	-174.7	-85	-60	0	0	0	116.3	N361	N361-H363 PolarHBondContact OD1-CD2 2.77Å
364	G	39.4	Very low	46.2	Very low	66 Å²	66	130.2 Å²	130.2	68%	0.68	70%	0.701	S	S	*	*			trans	78.4	173.5	156.6	0	0	0	0	0	118.2	P362	P362-G364 PolarHBondContact O-N 3.12Å
365	P	44.2	Very low	44.1	Very low	127 Å²	127	133.7 Å²	133.7	83%	0.825	71%	0.714	S	S	*	*			cis	-123.3	153.5	0.2	40.7	-27.3	0	0	0	116.3
366	R	34.9	Very low	42	Very low	215 Å²	215	135.8 Å²	135.8	81%	0.811	73%	0.731	S	S	*	*			trans	61.3	115.8	143.6	-138.1	-179.5	162.8	149.6	-0.7	123.1
367	E	35.6	Very low	40.3	Very low	117 Å²	117	132.1 Å²	132.1	55%	0.547	74%	0.742	S	S	.	*			trans	92.3	133.8	135.8	-101.1	-179.6	-120.6	0	0	124.9
368	K	32.7	Very low	38.6	Very low	188 Å²	188	134.4 Å²	134.4	82%	0.817	76%	0.758	S	S	*	*			trans	89.6	143.9	155.6	-70.4	165.8	174.7	125.6	0	119.5
369	K	32	Very low	37.1	Very low	208 Å²	208	134.6 Å²	134.6	90%	0.904	77%	0.765	S	S	*	*			trans	-115.8	148	-159.2	-55.2	169.4	176.6	173.4	0	112.2
370	A	31.9	Very low	35.6	Very low	102 Å²	102	136.1 Å²	136.1	84%	0.843	77%	0.769	S	S	*	*			trans	174.1	162.4	134	0	0	0	0	0	111.5
371	K	31.5	Very low	34.6	Very low	190 Å²	190	135 Å²	135	83%	0.826	77%	0.769	S	S	*	*			cis	-174	150.9	-38.9	-163.1	-172.5	-179.5	-175.8	0	107.4
372	V	31.1	Very low	33.9	Very low	132 Å²	132	135.7 Å²	135.7	80%	0.8	78%	0.778	S	S	*	*			trans	73.4	140.9	170.6	-165.3	0	0	0	0	115.3
373	G	31.3	Very low	33.3	Very low	62 Å²	62	135.8 Å²	135.8	64%	0.639	79%	0.786	S	S	*	*			cis	143.1	154.1	-16.4	0	0	0	0	0	115.9
374	S	32.7	Very low	32.6	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	78%	0.779	S	S	*	*			trans	69.6	155.5	171.1	-62	0	0	0	0	116.9
375	K	32.5	Very low	32.3	Very low	198 Å²	198	133.7 Å²	133.7	86%	0.861	78%	0.782	S	S	*	*			cis	-160.9	153.5	-13.1	-116.1	173.7	-176.9	179.6	0	108.8
376	A	29.8	Very low	31.7	Very low	103 Å²	103	137.1 Å²	137.1	85%	0.851	78%	0.784	S	S	*	*			trans	-136.3	142.1	156.2	0	0	0	0	0	108.8
377	G	30.7	Very low	31.5	Very low	84 Å²	84	132 Å²	132	87%	0.866	78%	0.781	S	S	*	*			trans	-107.2	157.5	-173.2	0	0	0	0	0	113.3
378	S	31.1	Very low	31.4	Very low	115 Å²	115	129.4 Å²	129.4	80%	0.804	79%	0.786	S	S	*	*			trans	-126.1	145.9	172.6	-179.4	0	0	0	0	110.8
379	N	31.5	Very low	31.4	Very low	155 Å²	155	128 Å²	128	83%	0.829	79%	0.788	S	S	*	*			trans	-165.6	149.8	160.2	-95.8	-47	0	0	0	106.6
380	K	30	Very low	31.6	Very low	186 Å²	186	121.9 Å²	121.9	81%	0.809	78%	0.783	S	S	*	*			cis	-149.4	155.5	26.7	-144.6	-172.7	178.3	-178.8	0	112.3
381	S	31.6	Very low	31.8	Very low	84 Å²	84	126 Å²	126	59%	0.587	78%	0.782	S	S	*	*			trans	-13.9	152	157.8	63.5	0	0	0	0	118.7
382	T	29.9	Very low	32.1	Very low	123 Å²	123	123.3 Å²	123.3	76%	0.755	78%	0.782	S	S	*	*				-159.6	136.9	59.1	42.2	0	0	0	0	117.4
383	A	31	Very low	32.3	Very low	100 Å²	100	121.7 Å²	121.7	83%	0.826	78%	0.776	S	S	*	*				58.9	151.1	129	0	0	0	0	0	121
384	S	29.3	Very low	32.6	Very low	99 Å²	99	123.8 Å²	123.8	69%	0.692	78%	0.777	S	S	*	*			cis	-159.6	143.3	6.6	-171	0	0	0	0	113
385	S	32.3	Very low	32.5	Very low	108 Å²	108	129.2 Å²	129.2	76%	0.755	78%	0.78	S	S	*	*			trans	58	156.5	149.3	62.7	0	0	0	0	119.4
386	K	32.7	Very low	32.8	Very low	200 Å²	200	130.6 Å²	130.6	87%	0.87	80%	0.795	S	S	*	*			cis	-164.6	163.9	-5.3	-126.8	-174.4	173.1	-177.1	0	103.6
387	S	31.2	Very low	33	Very low	106 Å²	106	132 Å²	132	74%	0.741	79%	0.792	S	S	*	*			cis	177.2	164.9	14	-167.9	0	0	0	0	107
388	G	33	Very low	33.1	Very low	63 Å²	63	134.5 Å²	134.5	65%	0.649	79%	0.788	S	S	*	*			trans	88.4	101.4	166.1	0	0	0	0	0	114.6
389	D	33.2	Very low	33.2	Very low	160 Å²	160	135.6 Å²	135.6	86%	0.856	79%	0.787	S	S	*	*				71.9	118.9	61.8	-76.3	-62.6	0	0	0	115.4
390	G	34.9	Very low	33.3	Very low	79 Å²	79	134.5 Å²	134.5	81%	0.814	79%	0.785	S	S	*	*			trans	174	68	-176.7	0	0	0	0	0	115
391	K	36.3	Very low	33.5	Very low	189 Å²	189	131.3 Å²	131.3	82%	0.822	78%	0.783	S	S	*	*			trans	-74.9	160.1	164.4	-62.6	160.7	-179.1	164.7	0	108.8
392	T	38.3	Very low	33.7	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	80%	0.796	S	S	*	*			cis	-152.5	-171.6	2.4	-6.6	0	0	0	0	106.3
393	S	36.1	Very low	33.9	Very low	99 Å²	99	135.2 Å²	135.2	69%	0.692	80%	0.799	S	S	*	*			cis	-144.1	178.8	12.8	29.6	0	0	0	0	108.4
394	V	36.2	Very low	34.1	Very low	106 Å²	106	137.9 Å²	137.9	64%	0.642	80%	0.797	S	S	*	*			cis	73	137.1	37.3	-165.2	0	0	0	0	114.9
395	W	30.7	Very low	34.6	Very low	225 Å²	225	141.2 Å²	141.2	85%	0.852	81%	0.806	S	S	*	*			trans	80.9	128.5	-178.1	-50.1	110.6	0	0	0	115.1
396	I	39.8	Very low	34.8	Very low	227 Å²	227	144.2 Å²	144.2	100%	1.164	81%	0.81	S	S	*	*			cis	-129.4	0	-5.7	-95.8	156.9	0	0	0	108.7

Retrieved 396 of 396 residues in 191.7 ms (Link to these results)

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