A0A087YS64_POEFO Loading...

Gap junction protein beta 7

AlphaFold DB , UniProt , Accession A0A087YS64, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 255 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	44.3	Very low	53	Low	209 Å²	209	118.2 Å²	118.2	100%	1.03	59%	0.588	S	S	*	*				0	124.3	0	-82.5	144.5	80.2	0	0	108.6	W3	M1-W3 PolarHBondContact O-N 3.47Å; M1-W3 VanDerWaalsContact O-N 3.09Å
2	N	49.5	Very low	53	Low	159 Å²	159	110.9 Å²	110.9	85%	0.85	57%	0.565	S	S	*	*			trans	-75.6	93	-177.4	-101.3	-21.7	0	0	0	110.7	G4 F5	N2-G4 PolarHBondContact O-N 3.16Å; N2-F5 PolarHBondContact O-N 3.11Å
3	W	51.9	Low	53.2	Low	187 Å²	187	106.1 Å²	106.1	71%	0.708	54%	0.544	S	S	*	.	H	α-helix	trans	-62.9	-22.7	177.4	-68.5	97.4	0	0	0	113.7	M1 F5 L6 E7	M1-W3 PolarHBondContact O-N 3.47Å; M1-W3 VanDerWaalsContact O-N 3.09Å; W3-F5 VanDerWaalsContact C-N 3.27Å; W3-F5 PolarHBondContact O-N 2.87Å; W3-L6 PolarHBondContact O-N 2.03Å; W3-L6 VanDerWaalsContact O-N 3.15Å; W3-E7 PolarHBondContact O-N 3.42Å
4	G	46.8	Very low	53.1	Low	38 Å²	38	104.1 Å²	104.1	39%	0.392	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-21	-179.9	0	0	0	0	0	115.2	N2 K8	N2-G4 PolarHBondContact O-N 3.16Å; G4-K8 WeakPolarHBondContact O-CB 3.5Å; G4-K8 WeakPolarHBondContact O-CG 3.1Å; G4-K8 PolarHBondContact O-N 2.92Å; G4-K8 VanDerWaalsContact O-N 3.13Å
5	F	54	Low	52.9	Low	142 Å²	142	105.5 Å²	105.5	62%	0.623	54%	0.536	S	S	*	.	H	α-helix	trans	-73.4	-43.9	171.9	179.3	-102.9	0	0	0	111.1	N2 W3 E7 K8 I9	N2-F5 PolarHBondContact O-N 3.11Å; W3-F5 VanDerWaalsContact C-N 3.27Å; W3-F5 PolarHBondContact O-N 2.87Å; F5-E7 VanDerWaalsContact C-N 3.31Å; F5-E7 PolarHBondContact O-N 2.92Å; F5-K8 PolarHBondContact O-N 3.15Å; F5-I9 HydrophobicContact CD1-CG1 4.29Å; F5-I9 HydrophobicContact CE1-CD1 4.34Å; F5-I9 HydrophobicContact CE1-CG1 3.94Å; F5-I9 HydrophobicContact CE2-CD1 4.34Å; F5-I9 HydrophobicContact CE2-CG1 4.33Å; F5-I9 HydrophobicContact CZ-CD1 3.94Å; F5-I9 HydrophobicContact CZ-CG1 3.97Å; F5-I9 VanDerWaalsContact O-CG1 3.25Å; F5-I9 WeakPolarHBondContact O-CG1 3.11Å; F5-I9 PolarHBondContact O-N 2.85Å
6	L	54.7	Low	52.8	Low	94 Å²	94	104.3 Å²	104.3	49%	0.492	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-41.4	177	-132.4	101.5	0	0	0	110.8	W3 I9 L10	W3-L6 PolarHBondContact O-N 2.03Å; W3-L6 VanDerWaalsContact O-N 3.15Å; L6-I9 PolarHBondContact O-N 2.84Å; L6-L10 HydrophobicContact CD2-CD1 4.07Å; L6-L10 WeakPolarHBondContact O-CB 3.18Å; L6-L10 WeakPolarHBondContact O-CD1 3.28Å; L6-L10 VanDerWaalsContact O-CG 3.28Å; L6-L10 WeakPolarHBondContact O-CG 3.28Å; L6-L10 PolarHBondContact O-N 2.9Å
7	E	55.9	Low	52.4	Low	134 Å²	134	99.9 Å²	99.9	63%	0.626	51%	0.505	S	S	*	.	H	α-helix	trans	-64.6	-39.7	177.2	-167.8	-179.2	175.2	0	0	112.5	W3 F5 L10 S11	W3-E7 PolarHBondContact O-N 3.42Å; F5-E7 VanDerWaalsContact C-N 3.31Å; F5-E7 PolarHBondContact O-N 2.92Å; E7-L10 PolarHBondContact O-N 3.01Å; E7-S11 VanDerWaalsContact O-CB 3.28Å; E7-S11 WeakPolarHBondContact O-CB 3.06Å; E7-S11 PolarHBondContact O-N 2.95Å; E7-S11 PolarHBondContact O-OG 2.95Å
8	K	56.4	Low	52.7	Low	162 Å²	162	97.2 Å²	97.2	70%	0.704	49%	0.494	S	S	*	.	H	α-helix	trans	-66.2	-39.2	173.1	-86.7	-176.8	176.1	178.7	0	112.9	G4 F5 S11 G12	G4-K8 WeakPolarHBondContact O-CB 3.5Å; G4-K8 WeakPolarHBondContact O-CG 3.1Å; G4-K8 PolarHBondContact O-N 2.92Å; G4-K8 VanDerWaalsContact O-N 3.13Å; F5-K8 PolarHBondContact O-N 3.15Å; K8-S11 WeakPolarHBondContact CA-OG 3.39Å; K8-S11 PolarHBondContact O-OG 3.16Å; K8-G12 PolarHBondContact O-N 2.02Å; K8-G12 VanDerWaalsContact O-N 3.1Å
9	I	56.8	Low	53	Low	41 Å²	41	96.4 Å²	96.4	21%	0.21	50%	0.499	C	S	.	.	H	α-helix	trans	-65.5	-46.3	175.1	-66.8	-76.1	0	0	0	110	F5 L6 V13 L89 A92	F5-I9 HydrophobicContact CD1-CG1 4.29Å; F5-I9 HydrophobicContact CE1-CD1 4.34Å; F5-I9 HydrophobicContact CE1-CG1 3.94Å; F5-I9 HydrophobicContact CE2-CD1 4.34Å; F5-I9 HydrophobicContact CE2-CG1 4.33Å; F5-I9 HydrophobicContact CZ-CD1 3.94Å; F5-I9 HydrophobicContact CZ-CG1 3.97Å; F5-I9 VanDerWaalsContact O-CG1 3.25Å; F5-I9 WeakPolarHBondContact O-CG1 3.11Å; F5-I9 PolarHBondContact O-N 2.85Å; L6-I9 PolarHBondContact O-N 2.84Å; I9-V13 VanDerWaalsContact O-CG2 3.31Å; I9-V13 WeakPolarHBondContact O-CG2 3.47Å; I9-V13 PolarHBondContact O-N 3.2Å; I9-L89 HydrophobicContact CD1-CD2 3.9Å; I9-L89 HydrophobicContact CG1-CD2 4.39Å; I9-L89 HydrophobicContact CG2-CD2 3.58Å; I9-A92 HydrophobicContact CD1-CB 4.47Å
10	L	57.1	Low	53.7	Low	62 Å²	62	98 Å²	98	33%	0.325	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-40.8	-179.4	-77.3	163.5	0	0	0	112.7	L6 E7 L30	L6-L10 HydrophobicContact CD2-CD1 4.07Å; L6-L10 WeakPolarHBondContact O-CB 3.18Å; L6-L10 WeakPolarHBondContact O-CD1 3.28Å; L6-L10 VanDerWaalsContact O-CG 3.28Å; L6-L10 WeakPolarHBondContact O-CG 3.28Å; L6-L10 PolarHBondContact O-N 2.9Å; E7-L10 PolarHBondContact O-N 3.01Å; L10-L30 HydrophobicContact CD2-CD1 4.07Å; L10-L30 HydrophobicContact CD2-CD2 4.13Å; L10-L30 HydrophobicContact CD2-CG 4.35Å
11	S	55.9	Low	54.4	Low	72 Å²	72	93.9 Å²	93.9	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-72.4	-35.1	179	56.2	0	0	0	0	113.3	E7 K8 V13 N14	E7-S11 VanDerWaalsContact O-CB 3.28Å; E7-S11 WeakPolarHBondContact O-CB 3.06Å; E7-S11 PolarHBondContact O-N 2.95Å; E7-S11 PolarHBondContact O-OG 2.95Å; K8-S11 WeakPolarHBondContact CA-OG 3.39Å; K8-S11 PolarHBondContact O-OG 3.16Å; S11-V13 VanDerWaalsContact C-N 3.33Å; S11-V13 PolarHBondContact O-N 3.29Å; S11-N14 PolarHBondContact O-N 3.21Å
12	G	52.9	Low	55.6	Low	31 Å²	31	84.8 Å²	84.8	32%	0.32	44%	0.442	S	S	.	.	H	α-helix	trans	-64.8	-33.2	177.7	0	0	0	0	0	113.7	K8 N14	K8-G12 PolarHBondContact O-N 2.02Å; K8-G12 VanDerWaalsContact O-N 3.1Å; G12-N14 PolarHBondContact O-N 2.85Å
13	V	55.6	Low	57	Low	48 Å²	48	80.7 Å²	80.7	29%	0.291	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-22	179.1	174	0	0	0	0	112.3	I9 S11 R22 A92	I9-V13 VanDerWaalsContact O-CG2 3.31Å; I9-V13 WeakPolarHBondContact O-CG2 3.47Å; I9-V13 PolarHBondContact O-N 3.2Å; S11-V13 VanDerWaalsContact C-N 3.33Å; S11-V13 PolarHBondContact O-N 3.29Å; V13-R22 PolarHBondContact O-NE 3.35Å; V13-R22 VanDerWaalsContact O-NE 3.08Å; V13-A92 HydrophobicContact CG2-CB 4.34Å
14	N	51.4	Low	58.3	Low	79 Å²	79	79 Å²	79	42%	0.422	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-15	-169.5	-148	11.2	0	0	0	115	S11 G12 R22 I23	S11-N14 PolarHBondContact O-N 3.21Å; G12-N14 PolarHBondContact O-N 2.85Å; N14-R22 PolarHBondContact O-NH2 3.02Å; N14-R22 VanDerWaalsContact O-NH2 3.14Å; N14-I23 VanDerWaalsContact OD1-CG1 3.32Å; N14-I23 WeakPolarHBondContact OD1-CG1 2.93Å
15	K	50.9	Low	60	Low	124 Å²	124	78.1 Å²	78.1	54%	0.539	40%	0.399	S	S	.	.	S	Bend	trans	-90.3	-6.5	-155.5	-166.4	174.1	171.4	-164.9	0	118.2	E99	K15-E99 IonicContact NZ-OE1 3.66Å
16	Y	50.5	Low	61.3	Low	87 Å²	87	73 Å²	73	34%	0.341	38%	0.381	S	S	.	.	S	Bend	trans	-143.1	42.5	-163.7	-65.9	-77.4	0	0	0	120.1	R22 V95	Y16-R22 PolarHBondContact O-NH1 3Å; Y16-V95 HydrophobicContact CE2-CG1 4.44Å
17	S	45.7	Very low	62.9	Low	30 Å²	30	72.4 Å²	72.4	21%	0.21	38%	0.381	C	S	.	.	S	Bend	trans	169.3	160.6	178.8	-159.6	0	0	0	0	109.4	S19 R22	S17-S19 PolarHBondContact O-N 2.76Å; S17-R22 VanDerWaalsContact N-NH1 3.1Å; S17-R22 PolarHBondContact O-NH2 3.34Å
18	T	58	Low	64.4	Low	51 Å²	51	66.9 Å²	66.9	31%	0.313	36%	0.356	S	S	.	.			trans	-25.3	104.3	-174.9	32.2	0	0	0	0	114.4	I20 G21 Y200	T18-I20 PolarHBondContact O-N 2.05Å; T18-G21 PolarHBondContact O-N 3.35Å; T18-Y200 HydrophobicContact CG2-CD1 4.17Å; T18-Y200 HydrophobicContact CG2-CE1 3.54Å
19	S	58.8	Low	65.8	Low	82 Å²	82	61.1 Å²	61.1	57%	0.573	33%	0.331	S	S	*	.	H	α-helix	trans	-54.6	-31.6	-169	-49.6	0	0	0	0	113	S17 I23	S17-S19 PolarHBondContact O-N 2.76Å; S19-I23 WeakPolarHBondContact O-CB 3.39Å; S19-I23 WeakPolarHBondContact O-CD1 3.44Å; S19-I23 WeakPolarHBondContact O-CG1 3.21Å; S19-I23 PolarHBondContact O-N 3.11Å
20	I	66.1	Low	67.4	Low	128 Å²	128	62.5 Å²	62.5	66%	0.656	34%	0.339	S	S	*	.	H	α-helix	trans	-67.8	-52.8	-175.1	-145.5	103.8	0	0	0	111.9	T18 R22 I23 W24	T18-I20 PolarHBondContact O-N 2.05Å; I20-R22 PolarHBondContact O-N 3.45Å; I20-I23 PolarHBondContact O-N 3.45Å; I20-W24 PolarHBondContact O-N 2.99Å; I20-W24 VanDerWaalsContact O-N 3.11Å
21	G	68.4	Low	69	Low	11 Å²	11	64.2 Å²	64.2	11%	0.113	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-40	-172.6	0	0	0	0	0	113.1	T18 L25	T18-G21 PolarHBondContact O-N 3.35Å; G21-L25 WeakPolarHBondContact O-CB 3.47Å; G21-L25 WeakPolarHBondContact O-CG 3.41Å; G21-L25 PolarHBondContact O-N 3.38Å
22	R	70.3	Confident	70.7	Confident	19 Å²	19	60.8 Å²	60.8	7%	0.072	32%	0.32	C	S	.	.	H	α-helix	trans	-76.6	-34.1	-179.9	-71.9	-158.1	-54.5	-120.2	-11.1	114.6	V13 N14 Y16 S17 I20 S26 Y124	V13-R22 PolarHBondContact O-NE 3.35Å; V13-R22 VanDerWaalsContact O-NE 3.08Å; N14-R22 PolarHBondContact O-NH2 3.02Å; N14-R22 VanDerWaalsContact O-NH2 3.14Å; Y16-R22 PolarHBondContact O-NH1 3Å; S17-R22 VanDerWaalsContact N-NH1 3.1Å; S17-R22 PolarHBondContact O-NH2 3.34Å; I20-R22 PolarHBondContact O-N 3.45Å; R22-S26 WeakPolarHBondContact O-CB 3.44Å; R22-S26 PolarHBondContact O-N 3.03Å; R22-Y124 WeakPolarHBondContact CD-OH 3.4Å
23	I	78.4	Confident	72.5	Confident	73 Å²	73	62.4 Å²	62.4	37%	0.374	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-48.9	172.7	-69	167.3	0	0	0	108.8	N14 S19 I20 L25 S26 V27	N14-I23 VanDerWaalsContact OD1-CG1 3.32Å; N14-I23 WeakPolarHBondContact OD1-CG1 2.93Å; S19-I23 WeakPolarHBondContact O-CB 3.39Å; S19-I23 WeakPolarHBondContact O-CD1 3.44Å; S19-I23 WeakPolarHBondContact O-CG1 3.21Å; S19-I23 PolarHBondContact O-N 3.11Å; I20-I23 PolarHBondContact O-N 3.45Å; I23-L25 PolarHBondContact O-N 3.43Å; I23-S26 PolarHBondContact O-N 3.08Å; I23-V27 HydrophobicContact CG2-CG2 4.29Å; I23-V27 WeakPolarHBondContact O-CB 3.09Å; I23-V27 VanDerWaalsContact O-CG2 3.25Å; I23-V27 WeakPolarHBondContact O-CG2 3Å; I23-V27 PolarHBondContact O-N 3.02Å
24	W	80.6	Confident	74.2	Confident	152 Å²	152	65.6 Å²	65.6	58%	0.576	34%	0.335	S	S	*	.	H	α-helix	trans	-63	-43.1	178.2	-80.5	97.8	0	0	0	112.6	I20 S26 V27 V28 L193	I20-W24 PolarHBondContact O-N 2.99Å; I20-W24 VanDerWaalsContact O-N 3.11Å; W24-S26 VanDerWaalsContact C-N 3.34Å; W24-S26 PolarHBondContact O-N 3.37Å; W24-V27 PolarHBondContact O-N 3.33Å; W24-V28 WeakPolarHBondContact O-CB 3.11Å; W24-V28 VanDerWaalsContact O-CG2 3.27Å; W24-V28 WeakPolarHBondContact O-CG2 3.28Å; W24-V28 PolarHBondContact O-N 2.93Å; W24-L193 HydrophobicContact CB-CD1 4.08Å
25	L	80.8	Confident	76.2	Confident	19 Å²	19	62.6 Å²	62.6	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-59.2	-44.1	174	-78.7	169.8	0	0	0	112	G21 I23 F29 L193	G21-L25 WeakPolarHBondContact O-CB 3.47Å; G21-L25 WeakPolarHBondContact O-CG 3.41Å; G21-L25 PolarHBondContact O-N 3.38Å; I23-L25 PolarHBondContact O-N 3.43Å; L25-F29 WeakPolarHBondContact O-CB 3.46Å; L25-F29 PolarHBondContact O-N 2.93Å; L25-L193 HydrophobicContact CD1-CB 4.5Å; L25-L193 HydrophobicContact CD2-CB 3.5Å; L25-L193 VanDerWaalsContact CD2-CB 3.5Å; L25-L193 HydrophobicContact CD2-CD1 4.06Å; L25-L193 HydrophobicContact CD2-CG 4.45Å; L25-L193 HydrophobicContact CG-CB 3.86Å; L25-L193 HydrophobicContact CG-CD1 4.25Å
26	S	82.4	Confident	78.1	Confident	34 Å²	34	59.2 Å²	59.2	24%	0.238	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-41.3	177.5	-170	0	0	0	0	111.9	R22 I23 W24 F29 L30	R22-S26 WeakPolarHBondContact O-CB 3.44Å; R22-S26 PolarHBondContact O-N 3.03Å; I23-S26 PolarHBondContact O-N 3.08Å; W24-S26 VanDerWaalsContact C-N 3.34Å; W24-S26 PolarHBondContact O-N 3.37Å; S26-F29 PolarHBondContact O-N 3.11Å; S26-L30 WeakPolarHBondContact O-CB 3.09Å; S26-L30 VanDerWaalsContact O-CG 3.26Å; S26-L30 WeakPolarHBondContact O-CG 3.49Å; S26-L30 PolarHBondContact O-N 3.17Å
27	V	87.2	Confident	80.1	Confident	82 Å²	82	59.5 Å²	59.5	50%	0.497	31%	0.314	S	S	.	.	H	α-helix	trans	-65.3	-47.7	178.7	169.1	0	0	0	0	110.8	I23 W24 F29 L30 F31	I23-V27 HydrophobicContact CG2-CG2 4.29Å; I23-V27 WeakPolarHBondContact O-CB 3.09Å; I23-V27 VanDerWaalsContact O-CG2 3.25Å; I23-V27 WeakPolarHBondContact O-CG2 3Å; I23-V27 PolarHBondContact O-N 3.02Å; W24-V27 PolarHBondContact O-N 3.33Å; V27-F29 VanDerWaalsContact C-N 3.31Å; V27-F29 PolarHBondContact O-N 3.01Å; V27-L30 PolarHBondContact O-N 3.06Å; V27-F31 WeakPolarHBondContact O-CB 3.23Å; V27-F31 PolarHBondContact O-N 3.45Å
28	V	87.8	Confident	82.2	Confident	17 Å²	17	60.5 Å²	60.5	10%	0.103	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-39.8	177.9	175.1	0	0	0	0	110.8	W24 F31 R32 T186 C190	W24-V28 WeakPolarHBondContact O-CB 3.11Å; W24-V28 VanDerWaalsContact O-CG2 3.27Å; W24-V28 WeakPolarHBondContact O-CG2 3.28Å; W24-V28 PolarHBondContact O-N 2.93Å; V28-F31 PolarHBondContact O-N 2.86Å; V28-R32 WeakPolarHBondContact O-CG 3.09Å; V28-R32 PolarHBondContact O-N 2.72Å; V28-T186 HydrophobicContact CG1-CG2 4.4Å; V28-C190 VanDerWaalsContact CG1-SG 3.53Å
29	F	87.1	Confident	83.7	Confident	41 Å²	41	59.6 Å²	59.6	18%	0.18	32%	0.319	C	S	.	.	H	α-helix	trans	-65.8	-43.7	177.5	-176.1	-101.8	0	0	0	112.5	L25 S26 V27 R32 I33 L81 V84 S85	L25-F29 WeakPolarHBondContact O-CB 3.46Å; L25-F29 PolarHBondContact O-N 2.93Å; S26-F29 PolarHBondContact O-N 3.11Å; V27-F29 VanDerWaalsContact C-N 3.31Å; V27-F29 PolarHBondContact O-N 3.01Å; F29-R32 WeakPolarHBondContact O-CB 3.47Å; F29-R32 PolarHBondContact O-N 2.95Å; F29-I33 HydrophobicContact CD1-CD1 4.05Å; F29-I33 HydrophobicContact CE1-CD1 3.33Å; F29-I33 HydrophobicContact CE1-CG1 4.14Å; F29-I33 HydrophobicContact CZ-CD1 3.67Å; F29-I33 HydrophobicContact CZ-CG1 4.12Å; F29-I33 PolarHBondContact O-N 2.93Å; F29-L81 HydrophobicContact CE2-CD2 3.93Å; F29-V84 HydrophobicContact CE2-CG1 4.44Å; F29-S85 WeakPolarHBondContact CZ-OG 3.46Å
30	L	88.8	Confident	85	Confident	71 Å²	71	56.6 Å²	56.6	37%	0.372	30%	0.299	S	S	.	.	H	α-helix	trans	-63.9	-42.1	174.7	-74.7	175.2	0	0	0	112	L10 S26 V27 R32 I33 L34	L10-L30 HydrophobicContact CD2-CD1 4.07Å; L10-L30 HydrophobicContact CD2-CD2 4.13Å; L10-L30 HydrophobicContact CD2-CG 4.35Å; S26-L30 WeakPolarHBondContact O-CB 3.09Å; S26-L30 VanDerWaalsContact O-CG 3.26Å; S26-L30 WeakPolarHBondContact O-CG 3.49Å; S26-L30 PolarHBondContact O-N 3.17Å; V27-L30 PolarHBondContact O-N 3.06Å; L30-R32 VanDerWaalsContact C-N 3.29Å; L30-R32 PolarHBondContact O-N 2.84Å; L30-I33 PolarHBondContact O-N 3.15Å; L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 PolarHBondContact O-N 3.19Å
31	F	91.6	Very high	85.7	Confident	97 Å²	97	57.9 Å²	57.9	43%	0.425	30%	0.303	S	S	.	.	H	α-helix	trans	-58.1	-42.7	173.7	174.2	-104.9	0	0	0	111.4	V27 V28 I33 L34 V35 I182 T186	V27-F31 WeakPolarHBondContact O-CB 3.23Å; V27-F31 PolarHBondContact O-N 3.45Å; V28-F31 PolarHBondContact O-N 2.86Å; F31-I33 PolarHBondContact O-N 3.45Å; F31-L34 PolarHBondContact O-N 3.42Å; F31-V35 HydrophobicContact CD1-CG2 4.31Å; F31-V35 HydrophobicContact CD2-CG2 4.12Å; F31-V35 HydrophobicContact CE1-CG2 3.87Å; F31-V35 HydrophobicContact CE2-CG2 3.65Å; F31-V35 HydrophobicContact CG-CG2 4.43Å; F31-V35 HydrophobicContact CZ-CG2 3.52Å; F31-V35 WeakPolarHBondContact O-CG2 3.46Å; F31-V35 PolarHBondContact O-N 2.89Å; F31-I182 HydrophobicContact CE1-CG2 3.85Å; F31-I182 HydrophobicContact CZ-CG2 4.16Å; F31-T186 HydrophobicContact CD1-CG2 3.83Å; F31-T186 HydrophobicContact CE1-CG2 3.78Å
32	R	91.8	Very high	86.5	Confident	1 Å²	1	64.6 Å²	64.6	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-60.4	-44.1	174.7	-80.2	-179.4	70.2	177.2	5.1	112.8	V28 F29 L30 L34 V35 Y36 Q80 L81 E135 M183 T186 S187	V28-R32 WeakPolarHBondContact O-CG 3.09Å; V28-R32 PolarHBondContact O-N 2.72Å; F29-R32 WeakPolarHBondContact O-CB 3.47Å; F29-R32 PolarHBondContact O-N 2.95Å; L30-R32 VanDerWaalsContact C-N 3.29Å; L30-R32 PolarHBondContact O-N 2.84Å; R32-L34 VanDerWaalsContact C-N 3.33Å; R32-V35 PolarHBondContact O-N 2.99Å; R32-Y36 VanDerWaalsContact O-CB 3.24Å; R32-Y36 WeakPolarHBondContact O-CB 3.42Å; R32-Y36 PolarHBondContact O-N 3.21Å; R32-Q80 VanDerWaalsContact NH2-CD 3.28Å; R32-L81 HydrophobicContact CB-CD2 4.05Å; R32-E135 IonicContact CZ-OE1 3.66Å; R32-E135 IonicContact CZ-OE2 3.8Å; R32-E135 VanDerWaalsContact NH1-CD 3.27Å; R32-E135 IonicContact NH1-OE1 4Å; R32-E135 PolarHBondContact NH1-OE1 2.94Å; R32-E135 IonicContact NH1-OE2 3.83Å; R32-E135 PolarHBondContact NH1-OE2 3.17Å; R32-E135 IonicContact NH2-OE2 2.78Å; R32-M183 HydrophobicContact CG-SD 4.41Å; R32-T186 WeakPolarHBondContact CD-OG1 3.36Å; R32-T186 HydrophobicContact CG-CG2 4.3Å; R32-T186 VanDerWaalsContact CG-OG1 3.29Å; R32-T186 WeakPolarHBondContact CG-OG1 3.35Å; R32-S187 VanDerWaalsContact CZ-OG 3.27Å; R32-S187 PolarHBondContact NH1-OG 2.97Å; R32-S187 PolarHBondContact NH2-OG 3.31Å
33	I	90.9	Very high	87.4	Confident	65 Å²	65	64 Å²	64	33%	0.333	33%	0.33	S	S	.	.	H	α-helix	trans	-61.5	-45.1	175.9	-68.9	175.7	0	0	0	110.3	F29 L30 F31 Y36 V37	F29-I33 HydrophobicContact CD1-CD1 4.05Å; F29-I33 HydrophobicContact CE1-CD1 3.33Å; F29-I33 HydrophobicContact CE1-CG1 4.14Å; F29-I33 HydrophobicContact CZ-CD1 3.67Å; F29-I33 HydrophobicContact CZ-CG1 4.12Å; F29-I33 PolarHBondContact O-N 2.93Å; L30-I33 PolarHBondContact O-N 3.15Å; F31-I33 PolarHBondContact O-N 3.45Å; I33-Y36 PolarHBondContact O-N 2.86Å; I33-V37 HydrophobicContact CG2-CG2 4.25Å; I33-V37 WeakPolarHBondContact O-CG2 3.3Å; I33-V37 PolarHBondContact O-N 3.44Å
34	L	91.6	Very high	87.8	Confident	114 Å²	114	61.4 Å²	61.4	60%	0.597	32%	0.315	S	S	*	.	H	α-helix	trans	-61.1	-48.4	-179.8	-176.9	149.3	0	0	0	111.5	L30 F31 R32 Y36 V37 A38	L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 PolarHBondContact O-N 3.19Å; F31-L34 PolarHBondContact O-N 3.42Å; R32-L34 VanDerWaalsContact C-N 3.33Å; L34-Y36 VanDerWaalsContact C-N 3.35Å; L34-Y36 PolarHBondContact O-N 3.46Å; L34-V37 PolarHBondContact O-N 3.49Å; L34-A38 VanDerWaalsContact O-CB 3.31Å; L34-A38 WeakPolarHBondContact O-CB 3.45Å; L34-A38 PolarHBondContact O-N 3.42Å
35	V	91.8	Very high	88	Confident	16 Å²	16	62 Å²	62	10%	0.097	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-43.8	176.9	170.8	0	0	0	0	110.9	F31 R32 V39 F179 I182 M183	F31-V35 HydrophobicContact CD1-CG2 4.31Å; F31-V35 HydrophobicContact CD2-CG2 4.12Å; F31-V35 HydrophobicContact CE1-CG2 3.87Å; F31-V35 HydrophobicContact CE2-CG2 3.65Å; F31-V35 HydrophobicContact CG-CG2 4.43Å; F31-V35 HydrophobicContact CZ-CG2 3.52Å; F31-V35 WeakPolarHBondContact O-CG2 3.46Å; F31-V35 PolarHBondContact O-N 2.89Å; R32-V35 PolarHBondContact O-N 2.99Å; V35-V39 WeakPolarHBondContact O-CB 3.31Å; V35-V39 WeakPolarHBondContact O-CG2 3.49Å; V35-V39 PolarHBondContact O-N 2.61Å; V35-F179 HydrophobicContact CG1-CD2 3.79Å; V35-F179 HydrophobicContact CG1-CE2 3.77Å; V35-I182 HydrophobicContact CG1-CG2 4.06Å; V35-I182 HydrophobicContact CG2-CG2 4.33Å; V35-M183 HydrophobicContact CG1-SD 4.4Å
36	Y	92.8	Very high	88.2	Confident	53 Å²	53	64.1 Å²	64.1	21%	0.208	33%	0.333	C	S	.	.	H	α-helix	trans	-57.5	-52.8	175.7	175.2	-90.2	0	0	0	111.5	R32 I33 L34 A38 V39 A40 I74 W77 A78 L81 F179	R32-Y36 VanDerWaalsContact O-CB 3.24Å; R32-Y36 WeakPolarHBondContact O-CB 3.42Å; R32-Y36 PolarHBondContact O-N 3.21Å; I33-Y36 PolarHBondContact O-N 2.86Å; L34-Y36 VanDerWaalsContact C-N 3.35Å; L34-Y36 PolarHBondContact O-N 3.46Å; Y36-A38 PolarHBondContact O-N 3.29Å; Y36-V39 PolarHBondContact O-N 2.84Å; Y36-A40 HydrophobicContact CE1-CB 4.24Å; Y36-A40 WeakPolarHBondContact O-CB 3.43Å; Y36-A40 PolarHBondContact O-N 3.17Å; Y36-I74 HydrophobicContact CD2-CD1 3.65Å; Y36-I74 HydrophobicContact CD2-CG1 4.42Å; Y36-I74 HydrophobicContact CE2-CD1 3.36Å; Y36-I74 HydrophobicContact CE2-CG1 3.64Å; Y36-I74 WeakPolarHBondContact CE2-O 3.44Å; Y36-W77 HydrophobicContact CD2-CB 4.37Å; Y36-W77 HydrophobicContact CE2-CB 4.43Å; Y36-A78 HydrophobicContact CE2-CB 3.94Å; Y36-A78 VanDerWaalsContact OH-CB 3.27Å; Y36-A78 WeakPolarHBondContact OH-CB 3.47Å; Y36-L81 HydrophobicContact CD1-CD1 4.3Å; Y36-L81 HydrophobicContact CD2-CD1 4.02Å; Y36-L81 HydrophobicContact CG-CD1 3.78Å; Y36-F179 HydrophobicContact CD2-CZ 4.35Å
37	V	91	Very high	88.5	Confident	93 Å²	93	63.3 Å²	63.3	56%	0.564	33%	0.326	S	S	*	.	H	α-helix	trans	-64.8	-40.7	-177.5	171.9	0	0	0	0	111.8	I33 L34 V39	I33-V37 HydrophobicContact CG2-CG2 4.25Å; I33-V37 WeakPolarHBondContact O-CG2 3.3Å; I33-V37 PolarHBondContact O-N 3.44Å; L34-V37 PolarHBondContact O-N 3.49Å; V37-V39 VanDerWaalsContact C-N 3.28Å; V37-V39 PolarHBondContact O-N 3.21Å
38	A	90.3	Very high	88.6	Confident	51 Å²	51	64.2 Å²	64.2	42%	0.421	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-34.9	-179.2	0	0	0	0	0	112.8	L34 Y36	L34-A38 VanDerWaalsContact O-CB 3.31Å; L34-A38 WeakPolarHBondContact O-CB 3.45Å; L34-A38 PolarHBondContact O-N 3.42Å; Y36-A38 PolarHBondContact O-N 3.29Å
39	V	89.2	Confident	88.7	Confident	32 Å²	32	70.4 Å²	70.4	19%	0.194	35%	0.35	C	S	.	.	H	α-helix	trans	-102.6	-29.7	-170.5	-174.3	0	0	0	0	112.5	V35 Y36 V37 E41 Q42 V43 W44 F179	V35-V39 WeakPolarHBondContact O-CB 3.31Å; V35-V39 WeakPolarHBondContact O-CG2 3.49Å; V35-V39 PolarHBondContact O-N 2.61Å; Y36-V39 PolarHBondContact O-N 2.84Å; V37-V39 VanDerWaalsContact C-N 3.28Å; V37-V39 PolarHBondContact O-N 3.21Å; V39-E41 VanDerWaalsContact C-N 3.32Å; V39-E41 PolarHBondContact O-N 3.08Å; V39-Q42 PolarHBondContact O-N 3.46Å; V39-V43 HydrophobicContact CG1-CB 3.81Å; V39-V43 HydrophobicContact CG1-CG2 3.42Å; V39-V43 VanDerWaalsContact CG1-CG2 3.42Å; V39-V43 PolarHBondContact O-N 2.7Å; V39-W44 HydrophobicContact CG1-CE3 4.13Å; V39-W44 HydrophobicContact CG1-CZ3 3.66Å; V39-F179 HydrophobicContact CB-CD2 3.67Å; V39-F179 HydrophobicContact CB-CE2 3.93Å; V39-F179 HydrophobicContact CB-CG 4.49Å; V39-F179 HydrophobicContact CG1-CB 4.16Å; V39-F179 HydrophobicContact CG1-CD2 3.69Å; V39-F179 HydrophobicContact CG1-CE2 4.3Å; V39-F179 HydrophobicContact CG1-CG 4.03Å; V39-F179 HydrophobicContact CG2-CD2 3.89Å; V39-F179 HydrophobicContact CG2-CE2 4.39Å
40	A	86	Confident	88.9	Confident	19 Å²	19	70.8 Å²	70.8	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-53.4	-46.3	-175.2	0	0	0	0	0	112.7	Y36 W44 I74	Y36-A40 HydrophobicContact CE1-CB 4.24Å; Y36-A40 WeakPolarHBondContact O-CB 3.43Å; Y36-A40 PolarHBondContact O-N 3.17Å; A40-W44 WeakPolarHBondContact O-CB 2.92Å; A40-I74 HydrophobicContact CB-CD1 3.84Å; A40-I74 HydrophobicContact CB-CG1 3.88Å
41	E	81.6	Confident	89.1	Confident	156 Å²	156	67.6 Å²	67.6	73%	0.729	34%	0.337	S	S	*	.	H	α-helix	trans	-81.2	-27.8	-177.9	-63.3	-170.5	169.9	0	0	113.2	V39 K45	V39-E41 VanDerWaalsContact C-N 3.32Å; V39-E41 PolarHBondContact O-N 3.08Å; E41-K45 WeakPolarHBondContact O-CB 3.01Å
42	Q	85.3	Confident	89.3	Confident	152 Å²	152	67 Å²	67	71%	0.71	34%	0.341	S	S	*	.	H	α-helix	trans	-84	-41.4	-174.4	-63.9	-174	3.9	0	0	112.4	V39	V39-Q42 PolarHBondContact O-N 3.46Å
43	V	87.9	Confident	89.5	Confident	7 Å²	7	67.6 Å²	67.6	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-94.9	-34	-171.1	176.1	0	0	0	0	111.9	V39 R172 E175 K176	V39-V43 HydrophobicContact CG1-CB 3.81Å; V39-V43 HydrophobicContact CG1-CG2 3.42Å; V39-V43 VanDerWaalsContact CG1-CG2 3.42Å; V39-V43 PolarHBondContact O-N 2.7Å; V43-R172 HydrophobicContact CG1-CB 4.47Å; V43-R172 PolarHBondContact O-NE 3.04Å; V43-R172 PolarHBondContact O-NH2 3.11Å; V43-E175 HydrophobicContact CG1-CB 4.42Å; V43-E175 HydrophobicContact CG2-CB 4.25Å; V43-K176 HydrophobicContact CG1-CD 4.46Å; V43-K176 HydrophobicContact CG1-CG 3.44Å; V43-K176 VanDerWaalsContact CG1-CG 3.44Å
44	W	88.4	Confident	89.8	Confident	17 Å²	17	70.4 Å²	70.4	6%	0.064	36%	0.361	C	S	.	.	S	Bend	trans	-103.2	-7.4	-169.5	-87.6	-94.2	0	0	0	115.8	V39 A40 D46 E47 Q73 I74 K176 F179	V39-W44 HydrophobicContact CG1-CE3 4.13Å; V39-W44 HydrophobicContact CG1-CZ3 3.66Å; A40-W44 WeakPolarHBondContact O-CB 2.92Å; W44-D46 PolarHBondContact O-N 3.29Å; W44-E47 HydrophobicContact CB-CG 4.45Å; W44-E47 VanDerWaalsContact CD1-OE1 3.31Å; W44-E47 HydrophobicContact CG-CG 4.26Å; W44-E47 VanDerWaalsContact NE1-CD 3.32Å; W44-E47 PolarHBondContact NE1-OE1 2.92Å; W44-E47 PolarHBondContact NE1-OE2 3.41Å; W44-Q73 HydrophobicContact CZ2-CB 4.37Å; W44-I74 HydrophobicContact CB-CB 4.28Å; W44-I74 HydrophobicContact CB-CG2 4.01Å; W44-I74 HydrophobicContact CD2-CB 4.02Å; W44-I74 HydrophobicContact CD2-CD1 4.44Å; W44-I74 HydrophobicContact CD2-CG1 4.48Å; W44-I74 HydrophobicContact CE3-CD1 4.17Å; W44-I74 HydrophobicContact CG-CB 3.79Å; W44-I74 HydrophobicContact CG-CG1 4.38Å; W44-I74 HydrophobicContact CG-CG2 3.84Å; W44-K176 HydrophobicContact CH2-CB 3.88Å; W44-K176 HydrophobicContact CH2-CG 3.82Å; W44-K176 HydrophobicContact CZ2-CB 3.84Å; W44-K176 HydrophobicContact CZ2-CD 4.11Å; W44-K176 HydrophobicContact CZ2-CG 3.63Å; W44-K176 HydrophobicContact CZ3-CG 4.48Å; W44-F179 HydrophobicContact CH2-CB 4Å; W44-F179 AromaticContact CH2-CD1 3.32Å; W44-F179 HydrophobicContact CH2-CD1 3.32Å; W44-F179 AromaticContact CH2-CE1 3.99Å; W44-F179 HydrophobicContact CH2-CE1 3.99Å; W44-F179 AromaticContact CH2-CG 3.84Å; W44-F179 HydrophobicContact CH2-CG 3.84Å; W44-F179 HydrophobicContact CZ2-CD1 4.31Å; W44-F179 HydrophobicContact CZ3-CB 4.1Å; W44-F179 AromaticContact CZ3-CD1 3.56Å; W44-F179 HydrophobicContact CZ3-CD1 3.56Å; W44-F179 HydrophobicContact CZ3-CD2 4.45Å; W44-F179 HydrophobicContact CZ3-CE1 4.04Å; W44-F179 AromaticContact CZ3-CG 3.78Å; W44-F179 HydrophobicContact CZ3-CG 3.78Å
45	K	83.6	Confident	90	Very high	166 Å²	166	66.8 Å²	66.8	72%	0.722	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-40.3	-175.3	178	178.6	-179.7	-179.6	0	114.2	E41	E41-K45 WeakPolarHBondContact O-CB 3.01Å
46	D	85.6	Confident	90.1	Very high	63 Å²	63	74.7 Å²	74.7	34%	0.337	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	29	-174	-69.2	-63.7	0	0	0	112.8	W44 Q48 K49 D50	W44-D46 PolarHBondContact O-N 3.29Å; D46-Q48 PolarHBondContact O-N 3.37Å; D46-K49 HydrophobicContact CB-CB 4.27Å; D46-K49 PolarHBondContact O-N 2.89Å; D46-K49 VanDerWaalsContact O-N 3.15Å; D46-D50 WeakPolarHBondContact O-CB 3.37Å; D46-D50 PolarHBondContact O-N 3.15Å
47	E	87.8	Confident	90.2	Very high	17 Å²	17	76.3 Å²	76.3	8%	0.079	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-47.2	-175.7	-84.5	-158.5	122.4	0	0	114.2	W44 F51 F65 K176	W44-E47 HydrophobicContact CB-CG 4.45Å; W44-E47 VanDerWaalsContact CD1-OE1 3.31Å; W44-E47 HydrophobicContact CG-CG 4.26Å; W44-E47 VanDerWaalsContact NE1-CD 3.32Å; W44-E47 PolarHBondContact NE1-OE1 2.92Å; W44-E47 PolarHBondContact NE1-OE2 3.41Å; E47-F51 WeakPolarHBondContact O-CB 3.16Å; E47-F51 PolarHBondContact O-N 3.29Å; E47-F65 HydrophobicContact CB-CE2 4.26Å; E47-F65 HydrophobicContact CB-CZ 4.23Å; E47-K176 WeakPolarHBondContact OE1-CE 3.42Å; E47-K176 IonicContact OE1-NZ 3.31Å; E47-K176 PolarHBondContact OE1-NZ 3.13Å
48	Q	89.3	Confident	90.4	Very high	100 Å²	100	76.7 Å²	76.7	47%	0.467	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-34	-178.6	-171.8	177.1	2.6	0	0	111.8	D46 K61 F65	D46-Q48 PolarHBondContact O-N 3.37Å; Q48-K61 WeakPolarHBondContact O-CE 3.11Å; Q48-K61 PolarHBondContact O-NZ 3.43Å; Q48-F65 HydrophobicContact CB-CD1 4.33Å; Q48-F65 HydrophobicContact CB-CD2 4.44Å; Q48-F65 HydrophobicContact CB-CE1 3.91Å; Q48-F65 HydrophobicContact CB-CE2 4.04Å; Q48-F65 HydrophobicContact CB-CZ 3.75Å; Q48-F65 HydrophobicContact CG-CD1 3.94Å; Q48-F65 HydrophobicContact CG-CD2 4.41Å; Q48-F65 HydrophobicContact CG-CE1 4.01Å; Q48-F65 HydrophobicContact CG-CE2 4.47Å; Q48-F65 HydrophobicContact CG-CG 4.15Å; Q48-F65 HydrophobicContact CG-CZ 4.27Å
49	K	90	Very high	90.6	Very high	148 Å²	148	76.1 Å²	76.1	64%	0.643	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-46.2	179.4	-175	-177.6	174.9	-173.1	0	110.6	D46 F51 K61	D46-K49 HydrophobicContact CB-CB 4.27Å; D46-K49 PolarHBondContact O-N 2.89Å; D46-K49 VanDerWaalsContact O-N 3.15Å; K49-F51 VanDerWaalsContact C-N 3.28Å; K49-F51 PolarHBondContact O-N 3.48Å; K49-K61 PolarHBondContact O-NZ 3.28Å
50	D	91.6	Very high	91	Very high	49 Å²	49	74.6 Å²	74.6	26%	0.262	39%	0.388	S	S	.	.	S	Bend	trans	-83.2	-2.6	-176	-60.1	-21.5	0	0	0	113.4	D46 A171 R172	D46-D50 WeakPolarHBondContact O-CB 3.37Å; D46-D50 PolarHBondContact O-N 3.15Å; D50-A171 HydrophobicContact CB-CB 3.44Å; D50-A171 VanDerWaalsContact CB-CB 3.44Å; D50-R172 IonicContact OD2-CZ 3.05Å; D50-R172 VanDerWaalsContact OD2-CZ 3.31Å; D50-R172 IonicContact OD2-NH1 2.94Å; D50-R172 PolarHBondContact OD2-NH1 2.87Å; D50-R172 IonicContact OD2-NH2 3.89Å; D50-R172 PolarHBondContact OD2-NH2 3.44Å
51	F	94.1	Very high	91.4	Very high	3 Å²	3	76.8 Å²	76.8	1%	0.013	39%	0.394	C	S	.	.			trans	-74.6	120.8	169.5	-174	-112.1	0	0	0	110.1	E47 K49 C53 K61 C64 F65 F68 F69 M155 C168 Y169 I170	E47-F51 WeakPolarHBondContact O-CB 3.16Å; E47-F51 PolarHBondContact O-N 3.29Å; K49-F51 VanDerWaalsContact C-N 3.28Å; K49-F51 PolarHBondContact O-N 3.48Å; F51-C53 WeakPolarHBondContact CE1-SG 3.32Å; F51-K61 HydrophobicContact CD1-CG 4.05Å; F51-K61 WeakPolarHBondContact O-CD 3.31Å; F51-K61 WeakPolarHBondContact O-CE 3.3Å; F51-K61 PolarHBondContact O-NZ 3.01Å; F51-C64 HydrophobicContact CE1-CB 4.05Å; F51-C64 HydrophobicContact CZ-CB 4.33Å; F51-F65 HydrophobicContact CB-CD2 3.89Å; F51-F65 HydrophobicContact CB-CE2 4.37Å; F51-F65 HydrophobicContact CD1-CB 3.84Å; F51-F65 AromaticContact CD1-CD2 3.88Å; F51-F65 HydrophobicContact CD1-CD2 3.88Å; F51-F65 HydrophobicContact CD1-CG 4.35Å; F51-F65 HydrophobicContact CD2-CD2 4.36Å; F51-F65 HydrophobicContact CE1-CB 3.93Å; F51-F65 HydrophobicContact CE1-CD2 4.46Å; F51-F65 AromaticContact CG-CD2 3.8Å; F51-F65 HydrophobicContact CG-CD2 3.8Å; F51-F68 HydrophobicContact CZ-CD2 4.48Å; F51-F69 HydrophobicContact CE2-CE2 4.33Å; F51-M155 HydrophobicContact CE2-CE 4.18Å; F51-C168 HydrophobicContact CE1-CB 4.05Å; F51-C168 HydrophobicContact CE2-CB 3.78Å; F51-C168 HydrophobicContact CZ-CB 3.37Å; F51-Y169 WeakPolarHBondContact CD2-O 3.23Å; F51-I170 HydrophobicContact CD2-CG1 4.23Å; F51-I170 HydrophobicContact CE2-CG1 4.17Å
52	V	95.3	Very high	92	Very high	84 Å²	84	73.7 Å²	73.7	51%	0.509	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.6	-174.2	179.6	0	0	0	0	109.7	C168 Y169	V52-C168 CarbonylContact O-C 3.52Å; V52-C168 VanDerWaalsContact O-CA 3.28Å; V52-C168 WeakPolarHBondContact O-CA 3.47Å; V52-Y169 PolarHBondContact N-O 3.13Å; V52-Y169 PolarHBondContact O-N 2.76Å
53	C	96.4	Very high	92.5	Very high	15 Å²	15	67.7 Å²	67.7	10%	0.101	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.8	173.1	-62.5	0	0	0	0	110.2	F51 T55 D167 C168	F51-C53 WeakPolarHBondContact CE1-SG 3.32Å; C53-T55 HydrophobicContact CB-CG2 3.93Å; C53-T55 PolarHBondContact O-N 3.28Å; C53-D167 CarbonylContact C-O 3.57Å; C53-D167 WeakPolarHBondContact CA-O 3.3Å; C53-C168 HydrophobicContact CB-CB 4.13Å; C53-C168 WeakPolarHBondContact CB-SG 3.49Å; C53-C168 WeakPolarHBondContact SG-CB 3.5Å; C53-C168 CovalentContact SG-SG 2.05Å; C53-C168 PolarHBondContact SG-SG 3.34Å
54	N	95.9	Very high	92.9	Very high	123 Å²	123	67.3 Å²	67.3	66%	0.658	36%	0.357	S	S	*	.	S	Bend	trans	-77.5	70.1	178.6	-170.4	12.1	0	0	0	111.1	D167	N54-D167 PolarHBondContact N-O 3.24Å
55	T	95.1	Very high	93.2	Very high	39 Å²	39	67.9 Å²	67.9	24%	0.239	36%	0.36	C	S	.	.			trans	-159.2	147.1	-178.5	-176	0	0	0	0	110.9	C53 Q57 C60 V166	C53-T55 HydrophobicContact CB-CG2 3.93Å; C53-T55 PolarHBondContact O-N 3.28Å; T55-Q57 WeakPolarHBondContact OG1-CB 3.46Å; T55-Q57 PolarHBondContact OG1-N 3.05Å; T55-Q57 VanDerWaalsContact OG1-N 3.15Å; T55-C60 HydrophobicContact CG2-CB 4.06Å; T55-V166 HydrophobicContact CG2-CG1 4.35Å
56	L	94.3	Very high	93.7	Very high	181 Å²	181	65.4 Å²	65.4	95%	0.948	35%	0.354	S	S	*	.			trans	-94.7	-2.2	172.1	-63.1	174.4	0	0	0	112.2
57	Q	95.1	Very high	94.1	Very high	87 Å²	87	67.1 Å²	67.1	41%	0.407	36%	0.36	S	S	.	.			trans	-69.4	122.5	-176.4	-174.3	65.8	10.9	0	0	110.8	T55 C60 P161	T55-Q57 WeakPolarHBondContact OG1-CB 3.46Å; T55-Q57 PolarHBondContact OG1-N 3.05Å; T55-Q57 VanDerWaalsContact OG1-N 3.15Å; Q57-C60 HydrophobicContact CB-CB 4.12Å; Q57-C60 HydrophobicContact CG-CB 4.28Å; Q57-P161 VanDerWaalsContact CG-O 3.28Å; Q57-P161 WeakPolarHBondContact CG-O 3.45Å
58	P	95.8	Very high	94.2	Very high	101 Å²	101	68.6 Å²	68.6	66%	0.656	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	142.5	177.7	27	-34.1	0	0	0	110.8	C60 P161	P58-C60 PolarHBondContact O-N 3.21Å; P58-C60 VanDerWaalsContact O-N 3.16Å; P58-P161 WeakPolarHBondContact O-CG 3.46Å
59	G	95	Very high	94.3	Very high	39 Å²	39	64.6 Å²	64.6	40%	0.402	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	-26	178.9	0	0	0	0	0	115.4	K61 N62 A63	G59-K61 PolarHBondContact O-N 3.22Å; G59-N62 PolarHBondContact O-N 2.84Å; G59-A63 PolarHBondContact O-N 3.3Å
60	C	96	Very high	94.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-57.5	-44.1	-178.9	173.8	0	0	0	0	112.5	T55 Q57 P58 N62 A63 C64 C162	T55-C60 HydrophobicContact CG2-CB 4.06Å; Q57-C60 HydrophobicContact CB-CB 4.12Å; Q57-C60 HydrophobicContact CG-CB 4.28Å; P58-C60 PolarHBondContact O-N 3.21Å; P58-C60 VanDerWaalsContact O-N 3.16Å; C60-N62 VanDerWaalsContact C-N 3.29Å; C60-N62 PolarHBondContact O-N 3.06Å; C60-A63 PolarHBondContact O-N 2.9Å; C60-C64 WeakPolarHBondContact O-CB 3.38Å; C60-C64 PolarHBondContact O-N 3.29Å; C60-C64 PolarHBondContact O-SG 2.93Å; C60-C162 VanDerWaalsContact CA-SG 3.59Å; C60-C162 HydrophobicContact CB-CB 4.11Å; C60-C162 WeakPolarHBondContact CB-SG 3.02Å; C60-C162 WeakPolarHBondContact SG-CB 3.34Å; C60-C162 CovalentContact SG-SG 2.03Å; C60-C162 PolarHBondContact SG-SG 2.98Å
61	K	95	Very high	94.3	Very high	65 Å²	65	62.1 Å²	62.1	28%	0.283	35%	0.345	S	S	.	.	H	α-helix	trans	-55.2	-42.9	174.3	173.4	178.1	161.8	161.1	0	112.6	Q48 K49 F51 G59 F65	Q48-K61 WeakPolarHBondContact O-CE 3.11Å; Q48-K61 PolarHBondContact O-NZ 3.43Å; K49-K61 PolarHBondContact O-NZ 3.28Å; F51-K61 HydrophobicContact CD1-CG 4.05Å; F51-K61 WeakPolarHBondContact O-CD 3.31Å; F51-K61 WeakPolarHBondContact O-CE 3.3Å; F51-K61 PolarHBondContact O-NZ 3.01Å; G59-K61 PolarHBondContact O-N 3.22Å; K61-F65 VanDerWaalsContact O-CB 3.3Å; K61-F65 WeakPolarHBondContact O-CB 3.48Å; K61-F65 PolarHBondContact O-N 3.4Å
62	N	95.3	Very high	94.1	Very high	91 Å²	91	62.7 Å²	62.7	49%	0.487	35%	0.349	S	S	.	.	H	α-helix	trans	-72.8	-42.8	-176.9	-71.5	-8	0	0	0	111.3	G59 C60 F65 D66	G59-N62 PolarHBondContact O-N 2.84Å; C60-N62 VanDerWaalsContact C-N 3.29Å; C60-N62 PolarHBondContact O-N 3.06Å; N62-F65 PolarHBondContact O-N 3.42Å; N62-D66 PolarHBondContact O-N 3.4Å
63	A	95.4	Very high	93.9	Very high	26 Å²	26	59 Å²	59	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-47.5	176	0	0	0	0	0	111.6	G59 C60 F65 D66 H67 E160	G59-A63 PolarHBondContact O-N 3.3Å; C60-A63 PolarHBondContact O-N 2.9Å; A63-F65 PolarHBondContact O-N 3.48Å; A63-D66 PolarHBondContact O-N 2.98Å; A63-H67 WeakPolarHBondContact O-CB 3.4Å; A63-H67 PolarHBondContact O-N 3.33Å; A63-E160 WeakPolarHBondContact CB-O 3.47Å
64	C	95.8	Very high	93.6	Very high	0 Å²	0	59 Å²	59	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-40.6	176.9	-64.6	0	0	0	0	112.5	F51 C60 H67 F68 C157 C162	F51-C64 HydrophobicContact CE1-CB 4.05Å; F51-C64 HydrophobicContact CZ-CB 4.33Å; C60-C64 WeakPolarHBondContact O-CB 3.38Å; C60-C64 PolarHBondContact O-N 3.29Å; C60-C64 PolarHBondContact O-SG 2.93Å; C64-H67 PolarHBondContact O-N 2.99Å; C64-F68 WeakPolarHBondContact O-CD2 3.49Å; C64-F68 PolarHBondContact O-N 3.04Å; C64-F68 VanDerWaalsContact O-N 3.11Å; C64-C157 WeakPolarHBondContact CA-SG 3.31Å; C64-C157 HydrophobicContact CB-CB 3.78Å; C64-C157 WeakPolarHBondContact CB-SG 3.26Å; C64-C157 WeakPolarHBondContact SG-CB 3.35Å; C64-C157 CovalentContact SG-SG 2.02Å; C64-C157 PolarHBondContact SG-SG 3.38Å; C64-C162 PolarHBondContact SG-SG 2.58Å
65	F	94.7	Very high	93.5	Very high	29 Å²	29	61.2 Å²	61.2	13%	0.127	32%	0.324	C	S	.	.	H	α-helix	trans	-61.5	-45.7	177.6	-177	-94.3	0	0	0	111.6	E47 Q48 F51 K61 N62 A63 F69	E47-F65 HydrophobicContact CB-CE2 4.26Å; E47-F65 HydrophobicContact CB-CZ 4.23Å; Q48-F65 HydrophobicContact CB-CD1 4.33Å; Q48-F65 HydrophobicContact CB-CD2 4.44Å; Q48-F65 HydrophobicContact CB-CE1 3.91Å; Q48-F65 HydrophobicContact CB-CE2 4.04Å; Q48-F65 HydrophobicContact CB-CZ 3.75Å; Q48-F65 HydrophobicContact CG-CD1 3.94Å; Q48-F65 HydrophobicContact CG-CD2 4.41Å; Q48-F65 HydrophobicContact CG-CE1 4.01Å; Q48-F65 HydrophobicContact CG-CE2 4.47Å; Q48-F65 HydrophobicContact CG-CG 4.15Å; Q48-F65 HydrophobicContact CG-CZ 4.27Å; F51-F65 HydrophobicContact CB-CD2 3.89Å; F51-F65 HydrophobicContact CB-CE2 4.37Å; F51-F65 HydrophobicContact CD1-CB 3.84Å; F51-F65 AromaticContact CD1-CD2 3.88Å; F51-F65 HydrophobicContact CD1-CD2 3.88Å; F51-F65 HydrophobicContact CD1-CG 4.35Å; F51-F65 HydrophobicContact CD2-CD2 4.36Å; F51-F65 HydrophobicContact CE1-CB 3.93Å; F51-F65 HydrophobicContact CE1-CD2 4.46Å; F51-F65 AromaticContact CG-CD2 3.8Å; F51-F65 HydrophobicContact CG-CD2 3.8Å; K61-F65 VanDerWaalsContact O-CB 3.3Å; K61-F65 WeakPolarHBondContact O-CB 3.48Å; K61-F65 PolarHBondContact O-N 3.4Å; N62-F65 PolarHBondContact O-N 3.42Å; A63-F65 PolarHBondContact O-N 3.48Å; F65-F69 AromaticContact CD2-CD2 3.99Å; F65-F69 HydrophobicContact CD2-CD2 3.99Å; F65-F69 AromaticContact CE2-CD2 3.97Å; F65-F69 HydrophobicContact CE2-CD2 3.97Å; F65-F69 HydrophobicContact CE2-CG 4.46Å; F65-F69 HydrophobicContact CZ-CB 4.39Å; F65-F69 WeakPolarHBondContact O-CB 3.34Å; F65-F69 PolarHBondContact O-N 3.38Å
66	D	94.4	Very high	93.4	Very high	113 Å²	113	60.2 Å²	60.2	60%	0.604	32%	0.317	S	S	*	.	H	α-helix	trans	-64.9	-40.3	179.2	-165.4	65.6	0	0	0	112.2	N62 A63 F69 P70	N62-D66 PolarHBondContact O-N 3.4Å; A63-D66 PolarHBondContact O-N 2.98Å; D66-F69 CarbonylContact O-C 3.58Å; D66-P70 WeakPolarHBondContact O-CA 3.41Å
67	H	93.1	Very high	93.4	Very high	99 Å²	99	51.6 Å²	51.6	46%	0.458	27%	0.272	S	S	.	.	H	α-helix	trans	-62.3	-46.3	177.2	-180	89.4	0	0	0	113.1	A63 C64 E159	A63-H67 WeakPolarHBondContact O-CB 3.4Å; A63-H67 PolarHBondContact O-N 3.33Å; C64-H67 PolarHBondContact O-N 2.99Å; H67-E159 HydrophobicContact CB-CG 3.83Å; H67-E159 IonicContact CE1-OE1 3.82Å; H67-E159 PolarHBondContact CE1-OE1 3.36Å; H67-E159 IonicContact CG-OE1 2.76Å; H67-E159 IonicContact ND1-OE1 2.7Å; H67-E159 PolarHBondContact ND1-OE1 2.65Å; H67-E159 IonicContact NE2-OE1 2.95Å
68	F	91.3	Very high	93.4	Very high	48 Å²	48	48.4 Å²	48.4	21%	0.211	26%	0.261	C	S	.	.	H	α-helix	trans	-83.1	-25.3	-178.1	-68.9	-65.2	0	0	0	114.2	F51 C64 P70 M155 R156 C157	F51-F68 HydrophobicContact CZ-CD2 4.48Å; C64-F68 WeakPolarHBondContact O-CD2 3.49Å; C64-F68 PolarHBondContact O-N 3.04Å; C64-F68 VanDerWaalsContact O-N 3.11Å; F68-P70 WeakPolarHBondContact O-CD 3.4Å; F68-M155 HydrophobicContact CB-CE 3.32Å; F68-M155 HydrophobicContact CB-SD 4.16Å; F68-M155 HydrophobicContact CD1-CB 4.5Å; F68-M155 HydrophobicContact CD1-CE 3.78Å; F68-M155 HydrophobicContact CD1-SD 3.68Å; F68-M155 HydrophobicContact CD2-CB 4.33Å; F68-M155 HydrophobicContact CD2-CE 3.5Å; F68-M155 HydrophobicContact CD2-SD 4.38Å; F68-M155 HydrophobicContact CE1-CB 4.12Å; F68-M155 HydrophobicContact CE1-CE 4.46Å; F68-M155 HydrophobicContact CE1-SD 4.13Å; F68-M155 HydrophobicContact CE2-CB 3.94Å; F68-M155 HydrophobicContact CE2-CE 4.22Å; F68-M155 HydrophobicContact CG-CE 3.25Å; F68-M155 HydrophobicContact CG-SD 3.84Å; F68-M155 HydrophobicContact CZ-CB 3.84Å; F68-R156 WeakPolarHBondContact CZ-O 3.34Å; F68-C157 HydrophobicContact CE2-CB 3.8Å; F68-C157 HydrophobicContact CZ-CB 4.31Å
69	F	91.6	Very high	93.3	Very high	16 Å²	16	47.8 Å²	47.8	7%	0.07	25%	0.252	C	S	.	.			trans	-125.7	60.8	-178.1	-60.5	-80.9	0	0	0	111.6	F51 F65 D66 I71 M155 I170	F51-F69 HydrophobicContact CE2-CE2 4.33Å; F65-F69 AromaticContact CD2-CD2 3.99Å; F65-F69 HydrophobicContact CD2-CD2 3.99Å; F65-F69 AromaticContact CE2-CD2 3.97Å; F65-F69 HydrophobicContact CE2-CD2 3.97Å; F65-F69 HydrophobicContact CE2-CG 4.46Å; F65-F69 HydrophobicContact CZ-CB 4.39Å; F65-F69 WeakPolarHBondContact O-CB 3.34Å; F65-F69 PolarHBondContact O-N 3.38Å; D66-F69 CarbonylContact O-C 3.58Å; F69-I71 PolarHBondContact O-N 2.82Å; F69-I71 VanDerWaalsContact O-N 3.17Å; F69-M155 HydrophobicContact CE2-CE 3.69Å; F69-M155 HydrophobicContact CZ-CE 4.05Å; F69-I170 HydrophobicContact CE2-CD1 4.25Å; F69-I170 HydrophobicContact CE2-CG1 4.2Å; F69-I170 HydrophobicContact CZ-CD1 3.7Å; F69-I170 HydrophobicContact CZ-CG1 3.96Å
70	P	90	Very high	93.3	Very high	78 Å²	78	46.1 Å²	46.1	51%	0.506	23%	0.233	S	C	.	.	S	Bend	trans	-59.4	-34	-179.3	25	-34.9	0	0	0	111.6	D66 F68	D66-P70 WeakPolarHBondContact O-CA 3.41Å; F68-P70 WeakPolarHBondContact O-CD 3.4Å
71	I	91.2	Very high	93.2	Very high	67 Å²	67	46.7 Å²	46.7	34%	0.344	24%	0.236	S	C	.	.	S	Bend	trans	-130.4	137.1	165.9	-55.1	175.4	0	0	0	106.7	F69 R75 L76 L145 Y146	F69-I71 PolarHBondContact O-N 2.82Å; F69-I71 VanDerWaalsContact O-N 3.17Å; I71-R75 HydrophobicContact CG2-CB 4.09Å; I71-L76 HydrophobicContact CB-CD1 4.5Å; I71-L76 HydrophobicContact CB-CG 4.36Å; I71-L76 HydrophobicContact CD1-CD2 4.27Å; I71-L76 HydrophobicContact CG2-CD1 4.4Å; I71-L76 HydrophobicContact CG2-CD2 4.1Å; I71-L76 HydrophobicContact CG2-CG 3.78Å; I71-L145 HydrophobicContact CD1-CD2 4.43Å; I71-Y146 PolarHBondContact O-OH 3.32Å
72	S	90	Very high	93	Very high	15 Å²	15	48.4 Å²	48.4	11%	0.105	25%	0.248	C	C	.	.			trans	-70.6	141.5	174.7	66	0	0	0	0	110.9	I74 R75 L76	S72-I74 PolarHBondContact O-N 3.47Å; S72-R75 WeakPolarHBondContact O-CB 3.46Å; S72-R75 PolarHBondContact O-N 2.89Å; S72-R75 WeakPolarHBondContact OG-CD 3.5Å; S72-R75 WeakPolarHBondContact OG-CG 3.46Å; S72-R75 PolarHBondContact OG-NE 3.3Å; S72-L76 PolarHBondContact O-N 3.32Å
73	Q	90.4	Very high	93	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.028	24%	0.241	C	C	.	.	H	α-helix	trans	-54.6	-42.1	-176.7	-68.1	173.2	-3.6	0	0	111.4	W44 R75 L76 W77 F142 Y146	W44-Q73 HydrophobicContact CZ2-CB 4.37Å; Q73-R75 VanDerWaalsContact C-N 3.29Å; Q73-R75 PolarHBondContact O-N 2.83Å; Q73-L76 PolarHBondContact O-N 3.23Å; Q73-W77 PolarHBondContact O-N 3.47Å; Q73-F142 HydrophobicContact CB-CE2 4.08Å; Q73-F142 HydrophobicContact CG-CE2 3.91Å; Q73-F142 HydrophobicContact CG-CZ 3.99Å; Q73-Y146 WeakPolarHBondContact CA-OH 3.08Å; Q73-Y146 HydrophobicContact CG-CD1 4.3Å; Q73-Y146 HydrophobicContact CG-CD2 4.39Å; Q73-Y146 HydrophobicContact CG-CE1 3.69Å; Q73-Y146 HydrophobicContact CG-CE2 3.78Å; Q73-Y146 WeakPolarHBondContact CG-OH 3.15Å; Q73-Y146 PolarHBondContact N-OH 3.03Å
74	I	90.7	Very high	92.8	Very high	17 Å²	17	46.6 Å²	46.6	9%	0.087	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-35.7	179.6	-161.5	65.3	0	0	0	112.6	Y36 A40 W44 S72 W77 A78 F179	Y36-I74 HydrophobicContact CD2-CD1 3.65Å; Y36-I74 HydrophobicContact CD2-CG1 4.42Å; Y36-I74 HydrophobicContact CE2-CD1 3.36Å; Y36-I74 HydrophobicContact CE2-CG1 3.64Å; Y36-I74 WeakPolarHBondContact CE2-O 3.44Å; A40-I74 HydrophobicContact CB-CD1 3.84Å; A40-I74 HydrophobicContact CB-CG1 3.88Å; W44-I74 HydrophobicContact CB-CB 4.28Å; W44-I74 HydrophobicContact CB-CG2 4.01Å; W44-I74 HydrophobicContact CD2-CB 4.02Å; W44-I74 HydrophobicContact CD2-CD1 4.44Å; W44-I74 HydrophobicContact CD2-CG1 4.48Å; W44-I74 HydrophobicContact CE3-CD1 4.17Å; W44-I74 HydrophobicContact CG-CB 3.79Å; W44-I74 HydrophobicContact CG-CG1 4.38Å; W44-I74 HydrophobicContact CG-CG2 3.84Å; S72-I74 PolarHBondContact O-N 3.47Å; I74-W77 PolarHBondContact O-N 2.98Å; I74-A78 WeakPolarHBondContact O-CB 3.39Å; I74-A78 PolarHBondContact O-N 3.42Å; I74-F179 HydrophobicContact CD1-CE1 3.97Å; I74-F179 HydrophobicContact CD1-CZ 3.76Å
75	R	93.1	Very high	92.5	Very high	169 Å²	169	47.7 Å²	47.7	64%	0.638	24%	0.241	S	C	*	.	H	α-helix	trans	-68.7	-39.8	177.8	-72.5	173.3	-171	174.8	4.1	111.5	I71 S72 Q73 A78 L79	I71-R75 HydrophobicContact CG2-CB 4.09Å; S72-R75 WeakPolarHBondContact O-CB 3.46Å; S72-R75 PolarHBondContact O-N 2.89Å; S72-R75 WeakPolarHBondContact OG-CD 3.5Å; S72-R75 WeakPolarHBondContact OG-CG 3.46Å; S72-R75 PolarHBondContact OG-NE 3.3Å; Q73-R75 VanDerWaalsContact C-N 3.29Å; Q73-R75 PolarHBondContact O-N 2.83Å; R75-A78 WeakPolarHBondContact O-CB 3.26Å; R75-A78 PolarHBondContact O-N 2.87Å; R75-L79 WeakPolarHBondContact O-CG 3.24Å; R75-L79 PolarHBondContact O-N 2.94Å
76	L	93.2	Very high	92.3	Very high	17 Å²	17	49.9 Å²	49.9	9%	0.089	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-43.3	174.4	-73	172.1	0	0	0	111.6	I71 S72 Q73 A78 L79 Q80 L145 Y146	I71-L76 HydrophobicContact CB-CD1 4.5Å; I71-L76 HydrophobicContact CB-CG 4.36Å; I71-L76 HydrophobicContact CD1-CD2 4.27Å; I71-L76 HydrophobicContact CG2-CD1 4.4Å; I71-L76 HydrophobicContact CG2-CD2 4.1Å; I71-L76 HydrophobicContact CG2-CG 3.78Å; S72-L76 PolarHBondContact O-N 3.32Å; Q73-L76 PolarHBondContact O-N 3.23Å; L76-A78 VanDerWaalsContact C-N 3.31Å; L76-A78 PolarHBondContact O-N 3.31Å; L76-L79 PolarHBondContact O-N 3.42Å; L76-Q80 WeakPolarHBondContact O-CB 3.29Å; L76-Q80 PolarHBondContact O-N 2.91Å; L76-L145 HydrophobicContact CD1-CD2 4.2Å; L76-Y146 HydrophobicContact CD1-CE2 3.62Å; L76-Y146 WeakPolarHBondContact CD1-OH 3.34Å
77	W	94.5	Very high	92.1	Very high	1 Å²	1	44.8 Å²	44.8	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-37.2	174.9	-73.3	114.9	0	0	0	112.5	Y36 Q73 I74 Q80 L81 L139 F142 F179 L180 M183 V184 S187	Y36-W77 HydrophobicContact CD2-CB 4.37Å; Y36-W77 HydrophobicContact CE2-CB 4.43Å; Q73-W77 PolarHBondContact O-N 3.47Å; I74-W77 PolarHBondContact O-N 2.98Å; W77-Q80 PolarHBondContact O-N 3.3Å; W77-L81 WeakPolarHBondContact O-CG 3.4Å; W77-L81 PolarHBondContact O-N 3.34Å; W77-L139 HydrophobicContact CH2-CD2 4.01Å; W77-F142 HydrophobicContact CZ2-CD2 4.24Å; W77-F142 HydrophobicContact CZ2-CE2 4.41Å; W77-F142 AromaticContact NE1-CD2 4Å; W77-F142 AromaticContact NE1-CE2 3.56Å; W77-F179 AromaticContact CD1-CE1 3.99Å; W77-F179 HydrophobicContact CG-CE1 4.48Å; W77-L180 HydrophobicContact CZ2-CD1 3.71Å; W77-M183 HydrophobicContact CB-CE 4.07Å; W77-M183 HydrophobicContact CD2-CB 3.92Å; W77-M183 HydrophobicContact CD2-CE 3.92Å; W77-M183 HydrophobicContact CD2-CG 4.35Å; W77-M183 HydrophobicContact CE3-CB 3.92Å; W77-M183 HydrophobicContact CE3-CE 3.62Å; W77-M183 HydrophobicContact CG-CE 4.12Å; W77-M183 HydrophobicContact CH2-CB 3.73Å; W77-M183 HydrophobicContact CZ2-CB 3.74Å; W77-M183 HydrophobicContact CZ3-CB 3.8Å; W77-M183 HydrophobicContact CZ3-CE 4.37Å; W77-V184 HydrophobicContact CH2-CG2 3.9Å; W77-V184 HydrophobicContact CZ2-CG2 3.82Å; W77-S187 WeakPolarHBondContact CZ3-OG 3.48Å
78	A	94.2	Very high	91.7	Very high	20 Å²	20	41.4 Å²	41.4	17%	0.165	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-48.8	174.3	0	0	0	0	0	111.7	Y36 I74 R75 L76 Q80 L81 I82	Y36-A78 HydrophobicContact CE2-CB 3.94Å; Y36-A78 VanDerWaalsContact OH-CB 3.27Å; Y36-A78 WeakPolarHBondContact OH-CB 3.47Å; I74-A78 WeakPolarHBondContact O-CB 3.39Å; I74-A78 PolarHBondContact O-N 3.42Å; R75-A78 WeakPolarHBondContact O-CB 3.26Å; R75-A78 PolarHBondContact O-N 2.87Å; L76-A78 VanDerWaalsContact C-N 3.31Å; L76-A78 PolarHBondContact O-N 3.31Å; A78-Q80 VanDerWaalsContact C-N 3.31Å; A78-Q80 PolarHBondContact O-N 3.06Å; A78-L81 PolarHBondContact O-N 2.91Å; A78-I82 VanDerWaalsContact O-CG1 3.3Å; A78-I82 WeakPolarHBondContact O-CG1 3.29Å; A78-I82 PolarHBondContact O-N 3.19Å
79	L	95	Very high	91.4	Very high	88 Å²	88	42.7 Å²	42.7	46%	0.461	23%	0.226	S	C	.	.	H	α-helix	trans	-60.8	-41.3	177.6	-70.7	172.8	0	0	0	111.3	R75 L76 I82 M83 F138	R75-L79 WeakPolarHBondContact O-CG 3.24Å; R75-L79 PolarHBondContact O-N 2.94Å; L76-L79 PolarHBondContact O-N 3.42Å; L79-I82 PolarHBondContact O-N 2.94Å; L79-M83 WeakPolarHBondContact O-CB 3.48Å; L79-M83 VanDerWaalsContact O-CG 3.22Å; L79-M83 WeakPolarHBondContact O-CG 3.25Å; L79-M83 PolarHBondContact O-N 2.7Å; L79-F138 HydrophobicContact CB-CE1 3.81Å; L79-F138 HydrophobicContact CB-CZ 3.91Å
80	Q	95.4	Very high	91.2	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.019	24%	0.244	C	C	.	.	H	α-helix	trans	-60	-48.9	174.8	-176.8	179.4	-7.5	0	0	111.8	R32 L76 W77 A78 I82 M83 V84 E135 F138 S187	R32-Q80 VanDerWaalsContact NH2-CD 3.28Å; L76-Q80 WeakPolarHBondContact O-CB 3.29Å; L76-Q80 PolarHBondContact O-N 2.91Å; W77-Q80 PolarHBondContact O-N 3.3Å; A78-Q80 VanDerWaalsContact C-N 3.31Å; A78-Q80 PolarHBondContact O-N 3.06Å; Q80-I82 VanDerWaalsContact C-N 3.32Å; Q80-I82 PolarHBondContact O-N 3.4Å; Q80-M83 PolarHBondContact O-N 3.42Å; Q80-V84 HydrophobicContact CG-CG2 4.3Å; Q80-V84 WeakPolarHBondContact O-CB 3.48Å; Q80-V84 VanDerWaalsContact O-CG2 3.23Å; Q80-V84 WeakPolarHBondContact O-CG2 3.2Å; Q80-V84 PolarHBondContact O-N 2.92Å; Q80-E135 PolarHBondContact NE2-OE2 3.41Å; Q80-F138 HydrophobicContact CB-CB 3.96Å; Q80-F138 HydrophobicContact CB-CD1 3.88Å; Q80-F138 HydrophobicContact CB-CD2 3.87Å; Q80-F138 HydrophobicContact CB-CE1 4.33Å; Q80-F138 HydrophobicContact CB-CE2 4.35Å; Q80-F138 HydrophobicContact CB-CG 3.63Å; Q80-F138 HydrophobicContact CG-CB 3.7Å; Q80-F138 HydrophobicContact CG-CD2 3.92Å; Q80-F138 HydrophobicContact CG-CG 3.82Å; Q80-S187 PolarHBondContact NE2-OG 3.43Å
81	L	92.6	Very high	90.9	Very high	12 Å²	12	43.6 Å²	43.6	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-41.9	178.7	-72.1	174.6	0	0	0	111.8	F29 R32 Y36 W77 A78 S85 M183	F29-L81 HydrophobicContact CE2-CD2 3.93Å; R32-L81 HydrophobicContact CB-CD2 4.05Å; Y36-L81 HydrophobicContact CD1-CD1 4.3Å; Y36-L81 HydrophobicContact CD2-CD1 4.02Å; Y36-L81 HydrophobicContact CG-CD1 3.78Å; W77-L81 WeakPolarHBondContact O-CG 3.4Å; W77-L81 PolarHBondContact O-N 3.34Å; A78-L81 PolarHBondContact O-N 2.91Å; L81-S85 WeakPolarHBondContact O-CB 3.17Å; L81-S85 PolarHBondContact O-N 2.83Å; L81-S85 PolarHBondContact O-OG 3.48Å; L81-M183 HydrophobicContact CD1-CE 4.4Å
82	I	92.2	Very high	90.5	Very high	101 Å²	101	41.1 Å²	41.1	52%	0.518	22%	0.215	S	C	.	.	H	α-helix	trans	-63.5	-51.4	177	-67.6	165.1	0	0	0	110.5	A78 L79 Q80 V84 S85 T86	A78-I82 VanDerWaalsContact O-CG1 3.3Å; A78-I82 WeakPolarHBondContact O-CG1 3.29Å; A78-I82 PolarHBondContact O-N 3.19Å; L79-I82 PolarHBondContact O-N 2.94Å; Q80-I82 VanDerWaalsContact C-N 3.32Å; Q80-I82 PolarHBondContact O-N 3.4Å; I82-V84 VanDerWaalsContact C-N 3.35Å; I82-V84 PolarHBondContact O-N 3.45Å; I82-S85 WeakPolarHBondContact O-CB 3.29Å; I82-S85 PolarHBondContact O-N 3.36Å; I82-S85 VanDerWaalsContact O-N 3.17Å; I82-T86 PolarHBondContact O-N 3.29Å; I82-T86 VanDerWaalsContact O-N 3.1Å; I82-T86 PolarHBondContact O-OG1 2.85Å
83	M	94.3	Very high	90.2	Very high	72 Å²	72	46.3 Å²	46.3	36%	0.355	24%	0.242	S	C	.	.	H	α-helix	trans	-64.8	-37.4	-177	-69.6	-63.3	-72.8	0	0	112.4	L79 Q80 P87 F134 F138	L79-M83 WeakPolarHBondContact O-CB 3.48Å; L79-M83 VanDerWaalsContact O-CG 3.22Å; L79-M83 WeakPolarHBondContact O-CG 3.25Å; L79-M83 PolarHBondContact O-N 2.7Å; Q80-M83 PolarHBondContact O-N 3.42Å; M83-P87 WeakPolarHBondContact O-CD 3.33Å; M83-F134 HydrophobicContact CB-CB 4.48Å; M83-F134 HydrophobicContact CB-CD2 4.19Å; M83-F134 HydrophobicContact CB-CG 4.18Å; M83-F134 HydrophobicContact CE-CD1 4.11Å; M83-F134 HydrophobicContact CE-CE1 3.53Å; M83-F134 HydrophobicContact CE-CE2 4.06Å; M83-F134 HydrophobicContact CE-CZ 3.51Å; M83-F134 WeakPolarHBondContact O-CD2 3.23Å; M83-F138 HydrophobicContact CB-CE2 3.87Å; M83-F138 HydrophobicContact CB-CZ 4.47Å; M83-F138 HydrophobicContact CG-CE2 3.94Å; M83-F138 HydrophobicContact CG-CZ 4.09Å
84	V	92.1	Very high	89.9	Confident	6 Å²	6	49 Å²	49	4%	0.036	25%	0.254	C	S	.	.	H	α-helix	trans	-72.4	-29.3	175.8	172.4	0	0	0	0	112.2	F29 Q80 I82 K131 F134 E135	F29-V84 HydrophobicContact CE2-CG1 4.44Å; Q80-V84 HydrophobicContact CG-CG2 4.3Å; Q80-V84 WeakPolarHBondContact O-CB 3.48Å; Q80-V84 VanDerWaalsContact O-CG2 3.23Å; Q80-V84 WeakPolarHBondContact O-CG2 3.2Å; Q80-V84 PolarHBondContact O-N 2.92Å; I82-V84 VanDerWaalsContact C-N 3.35Å; I82-V84 PolarHBondContact O-N 3.45Å; V84-K131 HydrophobicContact CG1-CG 4.38Å; V84-F134 HydrophobicContact CG2-CB 4.06Å; V84-E135 HydrophobicContact CG1-CG 4.37Å; V84-E135 HydrophobicContact CG2-CG 3.73Å
85	S	89	Confident	89.6	Confident	24 Å²	24	49.2 Å²	49.2	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-69.3	-38.2	174.6	-61.8	0	0	0	0	112.6	F29 L81 I82 S88 L89	F29-S85 WeakPolarHBondContact CZ-OG 3.46Å; L81-S85 WeakPolarHBondContact O-CB 3.17Å; L81-S85 PolarHBondContact O-N 2.83Å; L81-S85 PolarHBondContact O-OG 3.48Å; I82-S85 WeakPolarHBondContact O-CB 3.29Å; I82-S85 PolarHBondContact O-N 3.36Å; I82-S85 VanDerWaalsContact O-N 3.17Å; S85-S88 WeakPolarHBondContact O-CA 3.29Å; S85-S88 VanDerWaalsContact O-CB 3.24Å; S85-S88 WeakPolarHBondContact O-CB 3.42Å; S85-S88 PolarHBondContact O-N 3.23Å; S85-L89 PolarHBondContact O-N 2.89Å
86	T	90.2	Very high	89.1	Confident	74 Å²	74	42.7 Å²	42.7	45%	0.454	24%	0.242	S	C	.	.	H	α-helix	trans	-55.2	-48.3	-171.7	-62.7	0	0	0	0	113.5	I82 S88 L89 M90	I82-T86 PolarHBondContact O-N 3.29Å; I82-T86 VanDerWaalsContact O-N 3.1Å; I82-T86 PolarHBondContact O-OG1 2.85Å; T86-S88 VanDerWaalsContact C-N 3.3Å; T86-S88 PolarHBondContact O-N 2.9Å; T86-L89 PolarHBondContact O-N 3.36Å; T86-M90 WeakPolarHBondContact O-CB 3.48Å; T86-M90 PolarHBondContact O-N 2.88Å
87	P	90	Very high	88.7	Confident	7 Å²	7	47.9 Å²	47.9	5%	0.045	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-34.2	174.5	-23.3	32.1	0	0	0	113.8	M83 M90 V91 F130 K131 F134	M83-P87 WeakPolarHBondContact O-CD 3.33Å; P87-M90 PolarHBondContact O-N 3.38Å; P87-V91 WeakPolarHBondContact O-CG2 3.45Å; P87-V91 PolarHBondContact O-N 3.24Å; P87-V91 VanDerWaalsContact O-N 3.09Å; P87-F130 HydrophobicContact CG-CB 4Å; P87-K131 HydrophobicContact CB-CG 4.1Å; P87-K131 HydrophobicContact CG-CG 4.19Å; P87-F134 HydrophobicContact CG-CD2 4.39Å; P87-F134 HydrophobicContact CG-CE2 4.21Å
88	S	84.8	Confident	88.1	Confident	28 Å²	28	49.5 Å²	49.5	20%	0.196	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-47.1	175.6	-48	0	0	0	0	111.3	S85 T86 M90 V91 A92 K131	S85-S88 WeakPolarHBondContact O-CA 3.29Å; S85-S88 VanDerWaalsContact O-CB 3.24Å; S85-S88 WeakPolarHBondContact O-CB 3.42Å; S85-S88 PolarHBondContact O-N 3.23Å; T86-S88 VanDerWaalsContact C-N 3.3Å; T86-S88 PolarHBondContact O-N 2.9Å; S88-M90 VanDerWaalsContact C-N 3.34Å; S88-V91 PolarHBondContact O-N 3.3Å; S88-A92 WeakPolarHBondContact O-CB 3.46Å; S88-A92 PolarHBondContact O-N 3.49Å; S88-K131 WeakPolarHBondContact OG-CE 3.25Å; S88-K131 PolarHBondContact OG-NZ 3.25Å
89	L	84.7	Confident	87.6	Confident	75 Å²	75	52.7 Å²	52.7	39%	0.393	28%	0.278	S	S	.	.	H	α-helix	trans	-64.8	-40.5	179.4	-66.8	175.9	0	0	0	111	I9 S85 T86 V91 A92 L93	I9-L89 HydrophobicContact CD1-CD2 3.9Å; I9-L89 HydrophobicContact CG1-CD2 4.39Å; I9-L89 HydrophobicContact CG2-CD2 3.58Å; S85-L89 PolarHBondContact O-N 2.89Å; T86-L89 PolarHBondContact O-N 3.36Å; L89-V91 PolarHBondContact O-N 3.45Å; L89-A92 PolarHBondContact O-N 3.48Å; L89-L93 WeakPolarHBondContact O-CB 3.37Å; L89-L93 PolarHBondContact O-N 2.67Å
90	M	87.4	Confident	87.1	Confident	91 Å²	91	54.6 Å²	54.6	45%	0.448	29%	0.285	S	S	.	.	H	α-helix	trans	-58.2	-46.7	174.9	-178.6	-172.5	69.5	0	0	111.5	T86 P87 S88 L93 H94	T86-M90 WeakPolarHBondContact O-CB 3.48Å; T86-M90 PolarHBondContact O-N 2.88Å; P87-M90 PolarHBondContact O-N 3.38Å; S88-M90 VanDerWaalsContact C-N 3.34Å; M90-L93 PolarHBondContact O-N 3.21Å; M90-H94 VanDerWaalsContact O-CB 3.3Å; M90-H94 WeakPolarHBondContact O-CB 3.24Å; M90-H94 PolarHBondContact O-N 3.23Å
91	V	84.8	Confident	86.6	Confident	21 Å²	21	60 Å²	60	13%	0.127	31%	0.305	C	S	.	.	H	α-helix	trans	-66.4	-44.6	177.9	171.8	0	0	0	0	111.5	P87 S88 L89 L93 H94 V95 Y124 S127	P87-V91 WeakPolarHBondContact O-CG2 3.45Å; P87-V91 PolarHBondContact O-N 3.24Å; P87-V91 VanDerWaalsContact O-N 3.09Å; S88-V91 PolarHBondContact O-N 3.3Å; L89-V91 PolarHBondContact O-N 3.45Å; V91-L93 VanDerWaalsContact C-N 3.32Å; V91-L93 PolarHBondContact O-N 3.31Å; V91-H94 PolarHBondContact O-N 3.44Å; V91-V95 WeakPolarHBondContact O-CG2 3.28Å; V91-V95 PolarHBondContact O-N 2.96Å; V91-Y124 HydrophobicContact CG1-CD2 4.37Å; V91-S127 VanDerWaalsContact CG2-CB 3.47Å; V91-S127 WeakPolarHBondContact CG2-OG 3.22Å
92	A	81.6	Confident	86.3	Confident	15 Å²	15	61.8 Å²	61.8	12%	0.124	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-42.8	177.5	0	0	0	0	0	111.6	I9 V13 S88 L89 V95 G96	I9-A92 HydrophobicContact CD1-CB 4.47Å; V13-A92 HydrophobicContact CG2-CB 4.34Å; S88-A92 WeakPolarHBondContact O-CB 3.46Å; S88-A92 PolarHBondContact O-N 3.49Å; L89-A92 PolarHBondContact O-N 3.48Å; A92-V95 PolarHBondContact O-N 2.99Å; A92-G96 PolarHBondContact O-N 3Å
93	L	84.6	Confident	86	Confident	125 Å²	125	60.5 Å²	60.5	65%	0.654	32%	0.317	S	S	*	.	H	α-helix	trans	-65.1	-41.9	175.4	-178	64	0	0	0	111.5	L89 M90 V91 V95 G96 Y97	L89-L93 WeakPolarHBondContact O-CB 3.37Å; L89-L93 PolarHBondContact O-N 2.67Å; M90-L93 PolarHBondContact O-N 3.21Å; V91-L93 VanDerWaalsContact C-N 3.32Å; V91-L93 PolarHBondContact O-N 3.31Å; L93-V95 VanDerWaalsContact C-N 3.34Å; L93-V95 PolarHBondContact O-N 2.76Å; L93-G96 PolarHBondContact O-N 3.01Å; L93-Y97 WeakPolarHBondContact O-CB 3.49Å; L93-Y97 PolarHBondContact O-N 2.96Å
94	H	84.6	Confident	85.7	Confident	62 Å²	62	64.6 Å²	64.6	29%	0.287	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-42.5	176.6	179.5	-102.4	0	0	0	111.7	M90 V91 R98	M90-H94 VanDerWaalsContact O-CB 3.3Å; M90-H94 WeakPolarHBondContact O-CB 3.24Å; M90-H94 PolarHBondContact O-N 3.23Å; V91-H94 PolarHBondContact O-N 3.44Å; H94-R98 WeakPolarHBondContact O-CB 3.42Å; H94-R98 PolarHBondContact O-N 3.28Å; H94-R98 VanDerWaalsContact O-N 3.11Å
95	V	83.1	Confident	85.4	Confident	21 Å²	21	68.3 Å²	68.3	13%	0.127	35%	0.35	C	S	.	.	H	α-helix	trans	-64.3	-49.2	174.1	173.2	0	0	0	0	110.9	Y16 V91 A92 L93 Y97 R98 E99 L120	Y16-V95 HydrophobicContact CE2-CG1 4.44Å; V91-V95 WeakPolarHBondContact O-CG2 3.28Å; V91-V95 PolarHBondContact O-N 2.96Å; A92-V95 PolarHBondContact O-N 2.99Å; L93-V95 VanDerWaalsContact C-N 3.34Å; L93-V95 PolarHBondContact O-N 2.76Å; V95-Y97 PolarHBondContact O-N 2.96Å; V95-R98 PolarHBondContact O-N 3.02Å; V95-E99 PolarHBondContact O-N 3.46Å; V95-L120 HydrophobicContact CG2-CD1 3.77Å
96	G	83.8	Confident	85	Confident	33 Å²	33	76.7 Å²	76.7	34%	0.34	38%	0.383	S	S	.	.	H	α-helix	trans	-62.8	-39.2	179.5	0	0	0	0	0	113.3	A92 L93 R98 E99 H100	A92-G96 PolarHBondContact O-N 3Å; L93-G96 PolarHBondContact O-N 3.01Å; G96-R98 VanDerWaalsContact C-N 3.32Å; G96-R98 PolarHBondContact O-N 3.46Å; G96-E99 PolarHBondContact O-N 2.98Å; G96-H100 WeakPolarHBondContact O-CB 3.36Å; G96-H100 PolarHBondContact O-N 3.32Å
97	Y	84.9	Confident	84.5	Confident	126 Å²	126	82 Å²	82	49%	0.494	40%	0.395	S	S	.	.	H	α-helix	trans	-61.2	-42.6	174.3	178.7	-97.7	0	0	0	111.5	L93 V95 H100 R101	L93-Y97 WeakPolarHBondContact O-CB 3.49Å; L93-Y97 PolarHBondContact O-N 2.96Å; V95-Y97 PolarHBondContact O-N 2.96Å; Y97-H100 PolarHBondContact O-N 3.41Å; Y97-R101 HydrophobicContact CD1-CG 4.33Å; Y97-R101 HydrophobicContact CE1-CG 3.85Å; Y97-R101 WeakPolarHBondContact O-CB 3.37Å; Y97-R101 PolarHBondContact O-N 2.9Å; Y97-R101 PolarHBondContact OH-NE 2.91Å; Y97-R101 PolarHBondContact OH-NH2 2.9Å
98	R	81.9	Confident	83.6	Confident	35 Å²	35	90.5 Å²	90.5	13%	0.132	43%	0.431	C	S	.	.	H	α-helix	trans	-68.4	-44.2	179.6	-173.9	170.4	152.8	177.3	-15.8	111.8	H94 V95 G96 H100 R101 E102 Y110 D117	H94-R98 WeakPolarHBondContact O-CB 3.42Å; H94-R98 PolarHBondContact O-N 3.28Å; H94-R98 VanDerWaalsContact O-N 3.11Å; V95-R98 PolarHBondContact O-N 3.02Å; G96-R98 VanDerWaalsContact C-N 3.32Å; G96-R98 PolarHBondContact O-N 3.46Å; R98-H100 VanDerWaalsContact C-N 3.33Å; R98-H100 PolarHBondContact O-N 2.92Å; R98-R101 PolarHBondContact O-N 3.43Å; R98-E102 IonicContact NE-OE1 3.01Å; R98-E102 WeakPolarHBondContact O-CG 3.45Å; R98-E102 PolarHBondContact O-N 3.37Å; R98-Y110 HydrophobicContact CG-CD2 4.29Å; R98-Y110 HydrophobicContact CG-CE2 4.14Å; R98-Y110 VanDerWaalsContact CZ-CE1 3.49Å; R98-Y110 VanDerWaalsContact CZ-CE2 3.42Å; R98-Y110 VanDerWaalsContact NH1-CZ 3.31Å; R98-D117 IonicContact CZ-OD2 2.69Å; R98-D117 IonicContact NH1-OD2 3.85Å; R98-D117 IonicContact NH2-OD2 3.78Å; R98-D117 PolarHBondContact NH2-OD2 2.78Å
99	E	82.5	Confident	82.7	Confident	86 Å²	86	94.9 Å²	94.9	40%	0.402	45%	0.447	S	S	.	.	H	α-helix	trans	-59.5	-43.4	173.3	-72.3	-173.2	154.5	0	0	111.4	K15 V95 G96 R101 E102 A103	K15-E99 IonicContact NZ-OE1 3.66Å; V95-E99 PolarHBondContact O-N 3.46Å; G96-E99 PolarHBondContact O-N 2.98Å; E99-R101 PolarHBondContact O-N 3.42Å; E99-E102 PolarHBondContact O-N 2.97Å; E99-A103 PolarHBondContact O-N 3.28Å
100	H	85	Confident	81.6	Confident	129 Å²	129	95.9 Å²	95.9	60%	0.597	45%	0.446	S	S	*	.	H	α-helix	trans	-63.9	-40.8	177.6	-178.7	-94	0	0	0	112.8	G96 Y97 R98 A103 K104	G96-H100 WeakPolarHBondContact O-CB 3.36Å; G96-H100 PolarHBondContact O-N 3.32Å; Y97-H100 PolarHBondContact O-N 3.41Å; R98-H100 VanDerWaalsContact C-N 3.33Å; R98-H100 PolarHBondContact O-N 2.92Å; H100-A103 PolarHBondContact O-N 2.86Å; H100-K104 WeakPolarHBondContact O-CB 3.37Å; H100-K104 PolarHBondContact O-N 3.08Å
101	R	84.8	Confident	79.9	Confident	116 Å²	116	100.4 Å²	100.4	44%	0.438	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-44.6	174.1	-87.2	-86.3	-167.7	167.8	4.3	111.9	Y97 R98 E99 K104 H105	Y97-R101 HydrophobicContact CD1-CG 4.33Å; Y97-R101 HydrophobicContact CE1-CG 3.85Å; Y97-R101 WeakPolarHBondContact O-CB 3.37Å; Y97-R101 PolarHBondContact O-N 2.9Å; Y97-R101 PolarHBondContact OH-NE 2.91Å; Y97-R101 PolarHBondContact OH-NH2 2.9Å; R98-R101 PolarHBondContact O-N 3.43Å; E99-R101 PolarHBondContact O-N 3.42Å; R101-K104 PolarHBondContact O-N 3.42Å; R101-H105 PolarHBondContact O-CD2 2.82Å; R101-H105 VanDerWaalsContact O-CD2 3.23Å; R101-H105 PolarHBondContact O-N 2.87Å; R101-H105 VanDerWaalsContact O-N 3.15Å
102	E	85.4	Confident	78.2	Confident	51 Å²	51	106 Å²	106	24%	0.238	49%	0.493	C	S	.	.	H	α-helix	trans	-63.6	-41.8	178.3	-71.7	177.7	-176.2	0	0	111.6	R98 E99 H105 K106 F109	R98-E102 IonicContact NE-OE1 3.01Å; R98-E102 WeakPolarHBondContact O-CG 3.45Å; R98-E102 PolarHBondContact O-N 3.37Å; E99-E102 PolarHBondContact O-N 2.97Å; E102-H105 PolarHBondContact O-N 3.3Å; E102-K106 PolarHBondContact O-N 3.31Å; E102-F109 HydrophobicContact CG-CD2 4.48Å
103	A	86.1	Confident	76.6	Confident	73 Å²	73	113.9 Å²	113.9	60%	0.603	52%	0.524	S	S	*	.	H	α-helix	trans	-62.5	-43.3	175.4	0	0	0	0	0	112.3	E99 H100 H105	E99-A103 PolarHBondContact O-N 3.28Å; H100-A103 PolarHBondContact O-N 2.86Å; A103-H105 PolarHBondContact O-N 2.88Å
104	K	87.8	Confident	74.8	Confident	158 Å²	158	111.3 Å²	111.3	69%	0.687	53%	0.528	S	S	*	.	H	α-helix	trans	-63.1	-41	179.7	-175.1	176.4	-178.2	177.9	0	112.8	H100 R101	H100-K104 WeakPolarHBondContact O-CB 3.37Å; H100-K104 PolarHBondContact O-N 3.08Å; R101-K104 PolarHBondContact O-N 3.42Å
105	H	86.1	Confident	73.1	Confident	84 Å²	84	111.5 Å²	111.5	39%	0.389	54%	0.536	S	S	.	.	H	α-helix	trans	-94.2	-2.9	-175.3	-68.6	-71.5	0	0	0	113.9	R101 E102 A103 R107 F109	R101-H105 PolarHBondContact O-CD2 2.82Å; R101-H105 VanDerWaalsContact O-CD2 3.23Å; R101-H105 PolarHBondContact O-N 2.87Å; R101-H105 VanDerWaalsContact O-N 3.15Å; E102-H105 PolarHBondContact O-N 3.3Å; A103-H105 PolarHBondContact O-N 2.88Å; H105-R107 PolarHBondContact O-N 3.18Å; H105-F109 HydrophobicContact CB-CE2 3.59Å; H105-F109 HydrophobicContact CB-CZ 3.82Å; H105-F109 AromaticContact CD2-CE2 3.87Å; H105-F109 AromaticContact CG-CE2 3.89Å
106	K	82.1	Confident	71.9	Confident	201 Å²	201	114 Å²	114	87%	0.874	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	25.5	-174.9	-61.2	-174.7	-179.6	-178.5	0	113.7	E102	E102-K106 PolarHBondContact O-N 3.31Å
107	R	78.6	Confident	70.8	Confident	185 Å²	185	114.2 Å²	114.2	70%	0.698	54%	0.541	S	S	*	.	S	Bend	trans	-126.4	129.1	179.3	-75.9	-174.2	-179.6	-167.2	1.1	108.1	H105 F109	H105-R107 PolarHBondContact O-N 3.18Å; R107-F109 HydrophobicContact CB-CE2 4.4Å; R107-F109 HydrophobicContact CB-CZ 4.27Å; R107-F109 WeakPolarHBondContact O-CD2 3.38Å; R107-F109 PolarHBondContact O-N 3.48Å
108	K	71.1	Confident	69.9	Low	186 Å²	186	111 Å²	111	81%	0.809	55%	0.546	S	S	*	.			trans	-76.1	100.6	168.9	-70.3	-174.4	179.3	178	0	107.9	Y110	K108-Y110 PolarHBondContact O-N 3.36Å
109	F	66.1	Low	69.4	Low	119 Å²	119	111.2 Å²	111.2	52%	0.522	56%	0.559	S	S	.	*			trans	-73	-14	177	-69	-73.9	0	0	0	113	E102 H105 R107	E102-F109 HydrophobicContact CG-CD2 4.48Å; H105-F109 HydrophobicContact CB-CE2 3.59Å; H105-F109 HydrophobicContact CB-CZ 3.82Å; H105-F109 AromaticContact CD2-CE2 3.87Å; H105-F109 AromaticContact CG-CE2 3.89Å; R107-F109 HydrophobicContact CB-CE2 4.4Å; R107-F109 HydrophobicContact CB-CZ 4.27Å; R107-F109 WeakPolarHBondContact O-CD2 3.38Å; R107-F109 PolarHBondContact O-N 3.48Å
110	Y	62.3	Low	69.2	Low	96 Å²	96	108.4 Å²	108.4	38%	0.376	55%	0.547	S	S	.	.	S	Bend	trans	-123.4	132	-176.6	-76.6	-87	0	0	0	111.5	R98 K108 D117	R98-Y110 HydrophobicContact CG-CD2 4.29Å; R98-Y110 HydrophobicContact CG-CE2 4.14Å; R98-Y110 VanDerWaalsContact CZ-CE1 3.49Å; R98-Y110 VanDerWaalsContact CZ-CE2 3.42Å; R98-Y110 VanDerWaalsContact NH1-CZ 3.31Å; K108-Y110 PolarHBondContact O-N 3.36Å; Y110-D117 WeakPolarHBondContact CB-OD2 3.29Å; Y110-D117 HydrophobicContact CD1-CB 3.88Å; Y110-D117 WeakPolarHBondContact CD1-OD2 3.41Å; Y110-D117 HydrophobicContact CE1-CB 4.06Å
111	K	50.3	Low	68.8	Low	186 Å²	186	104.1 Å²	104.1	81%	0.809	53%	0.527	S	S	*	.			trans	-96	120.5	-169	-125.4	-179	-177.8	-178.3	0	110.4
112	D	48.9	Very low	68.7	Low	139 Å²	139	101.7 Å²	101.7	74%	0.743	53%	0.527	S	S	*	.			trans	59.4	133	165.6	-126.3	-44.4	0	0	0	120.7	G114	D112-G114 PolarHBondContact O-N 2.9Å
113	K	48.1	Very low	68.7	Low	181 Å²	181	101 Å²	101	79%	0.787	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-1.3	-174	-113.7	172	175.3	178.2	0	114
114	G	46.9	Very low	68.6	Low	71 Å²	71	98.9 Å²	98.9	73%	0.732	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-21.7	-172.4	0	0	0	0	0	115.7	D112	D112-G114 PolarHBondContact O-N 2.9Å
115	S	50.4	Low	68.5	Low	66 Å²	66	92.8 Å²	92.8	46%	0.462	48%	0.478	S	S	.	.	S	Bend	trans	-123.9	114.1	174.8	53.6	0	0	0	0	108.6	D117	S115-D117 PolarHBondContact O-N 3.33Å
116	I	56.3	Low	68.7	Low	73 Å²	73	92 Å²	92	37%	0.374	48%	0.477	S	S	.	.			trans	-51.3	112.1	171.7	-52.8	177.9	0	0	0	107.2	G118 L120 F121	I116-G118 PolarHBondContact O-N 3.25Å; I116-L120 HydrophobicContact CG2-CB 4.43Å; I116-F121 HydrophobicContact CB-CB 4.22Å; I116-F121 HydrophobicContact CB-CD2 4.24Å; I116-F121 HydrophobicContact CD1-CD2 4.16Å; I116-F121 HydrophobicContact CG2-CB 3.56Å; I116-F121 HydrophobicContact CG2-CD2 4.08Å; I116-F121 HydrophobicContact CG2-CG 4.33Å
117	D	62.4	Low	69.1	Low	38 Å²	38	82.6 Å²	82.6	20%	0.203	44%	0.436	C	S	.	.			trans	-52.9	136.1	179.4	-76	-63.7	0	0	0	109.7	R98 Y110 S115 G119 L120 F121	R98-D117 IonicContact CZ-OD2 2.69Å; R98-D117 IonicContact NH1-OD2 3.85Å; R98-D117 IonicContact NH2-OD2 3.78Å; R98-D117 PolarHBondContact NH2-OD2 2.78Å; Y110-D117 WeakPolarHBondContact CB-OD2 3.29Å; Y110-D117 HydrophobicContact CD1-CB 3.88Å; Y110-D117 WeakPolarHBondContact CD1-OD2 3.41Å; Y110-D117 HydrophobicContact CE1-CB 4.06Å; S115-D117 PolarHBondContact O-N 3.33Å; D117-G119 PolarHBondContact O-N 2.8Å; D117-L120 PolarHBondContact O-N 2.95Å; D117-F121 PolarHBondContact O-N 2.99Å
118	G	65.8	Low	69.6	Low	58 Å²	58	73.9 Å²	73.9	60%	0.598	40%	0.403	S	S	*	.	H	α-helix	trans	-50.3	-35.1	-173.3	0	0	0	0	0	113.9	I116 C122	I116-G118 PolarHBondContact O-N 3.25Å; G118-C122 WeakPolarHBondContact O-CB 3.37Å; G118-C122 PolarHBondContact O-N 3.37Å
119	G	71.1	Confident	70.6	Confident	39 Å²	39	69.5 Å²	69.5	40%	0.402	39%	0.388	S	S	.	.	H	α-helix	trans	-68.9	-43	175.7	0	0	0	0	0	114.5	D117 T123	D117-G119 PolarHBondContact O-N 2.8Å; G119-T123 WeakPolarHBondContact O-CG2 3.32Å; G119-T123 PolarHBondContact O-N 3.36Å; G119-T123 PolarHBondContact O-OG1 2.88Å
120	L	77.6	Confident	72	Confident	28 Å²	28	69.1 Å²	69.1	15%	0.147	39%	0.386	C	S	.	.	H	α-helix	trans	-73.5	-33.8	177.4	-174.2	63.4	0	0	0	111.4	V95 I116 D117 T123 Y124	V95-L120 HydrophobicContact CG2-CD1 3.77Å; I116-L120 HydrophobicContact CG2-CB 4.43Å; D117-L120 PolarHBondContact O-N 2.95Å; L120-T123 PolarHBondContact O-OG1 2.99Å; L120-T123 VanDerWaalsContact O-OG1 3.07Å; L120-Y124 VanDerWaalsContact O-CB 3.28Å; L120-Y124 WeakPolarHBondContact O-CB 3.47Å; L120-Y124 PolarHBondContact O-N 3.4Å
121	F	77.5	Confident	73.5	Confident	39 Å²	39	66.1 Å²	66.1	17%	0.171	38%	0.375	C	S	.	.	H	α-helix	trans	-63.8	-45.3	172.8	-176.6	-102.9	0	0	0	111.7	I116 D117 Y124 V125 I201	I116-F121 HydrophobicContact CB-CB 4.22Å; I116-F121 HydrophobicContact CB-CD2 4.24Å; I116-F121 HydrophobicContact CD1-CD2 4.16Å; I116-F121 HydrophobicContact CG2-CB 3.56Å; I116-F121 HydrophobicContact CG2-CD2 4.08Å; I116-F121 HydrophobicContact CG2-CG 4.33Å; D117-F121 PolarHBondContact O-N 2.99Å; F121-Y124 WeakPolarHBondContact O-CB 3.23Å; F121-Y124 PolarHBondContact O-N 2.93Å; F121-V125 HydrophobicContact CD1-CG2 4.16Å; F121-V125 HydrophobicContact CD2-CG2 4.45Å; F121-V125 HydrophobicContact CE1-CG2 3.76Å; F121-V125 HydrophobicContact CE2-CG2 4.08Å; F121-V125 HydrophobicContact CG-CG2 4.5Å; F121-V125 HydrophobicContact CZ-CG2 3.73Å; F121-V125 WeakPolarHBondContact O-CG2 3.13Å; F121-V125 PolarHBondContact O-N 2.82Å; F121-I201 HydrophobicContact CE2-CG2 3.24Å; F121-I201 HydrophobicContact CZ-CG2 3.23Å
122	C	82.1	Confident	75.6	Confident	64 Å²	64	58.4 Å²	58.4	43%	0.432	34%	0.343	S	S	.	.	H	α-helix	trans	-61.6	-49.2	179.4	-174.1	0	0	0	0	111.3	G118 Y124 V125 I126	G118-C122 WeakPolarHBondContact O-CB 3.37Å; G118-C122 PolarHBondContact O-N 3.37Å; C122-Y124 VanDerWaalsContact C-N 3.26Å; C122-Y124 PolarHBondContact O-N 2.97Å; C122-V125 PolarHBondContact O-N 3.23Å; C122-I126 WeakPolarHBondContact O-CB 3.3Å; C122-I126 VanDerWaalsContact O-CG1 3.26Å; C122-I126 WeakPolarHBondContact O-CG1 3.49Å; C122-I126 PolarHBondContact O-N 2.97Å; C122-I126 VanDerWaalsContact SG-CD1 3.58Å
123	T	85.1	Confident	77.9	Confident	38 Å²	38	53.8 Å²	53.8	23%	0.233	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-36.4	177.2	54.6	0	0	0	0	112	G119 L120 S127	G119-T123 WeakPolarHBondContact O-CG2 3.32Å; G119-T123 PolarHBondContact O-N 3.36Å; G119-T123 PolarHBondContact O-OG1 2.88Å; L120-T123 PolarHBondContact O-OG1 2.99Å; L120-T123 VanDerWaalsContact O-OG1 3.07Å; T123-S127 WeakPolarHBondContact O-CB 3.4Å; T123-S127 PolarHBondContact O-N 3.47Å
124	Y	83.5	Confident	80.2	Confident	28 Å²	28	47.9 Å²	47.9	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-52	174.8	-171.2	-107	0	0	0	113	R22 V91 L120 F121 C122 I126 S127 L128 E197 I201	R22-Y124 WeakPolarHBondContact CD-OH 3.4Å; V91-Y124 HydrophobicContact CG1-CD2 4.37Å; L120-Y124 VanDerWaalsContact O-CB 3.28Å; L120-Y124 WeakPolarHBondContact O-CB 3.47Å; L120-Y124 PolarHBondContact O-N 3.4Å; F121-Y124 WeakPolarHBondContact O-CB 3.23Å; F121-Y124 PolarHBondContact O-N 2.93Å; C122-Y124 VanDerWaalsContact C-N 3.26Å; C122-Y124 PolarHBondContact O-N 2.97Å; Y124-I126 PolarHBondContact O-N 3.38Å; Y124-S127 WeakPolarHBondContact O-CB 3.48Å; Y124-S127 PolarHBondContact O-N 3Å; Y124-S127 VanDerWaalsContact O-N 3.14Å; Y124-S127 PolarHBondContact O-OG 3.46Å; Y124-L128 HydrophobicContact CD1-CD1 3.91Å; Y124-L128 HydrophobicContact CD1-CG 4.46Å; Y124-L128 HydrophobicContact CE1-CD1 3.44Å; Y124-L128 VanDerWaalsContact CE1-CD1 3.44Å; Y124-L128 HydrophobicContact CE1-CG 4.12Å; Y124-L128 PolarHBondContact O-N 3.44Å; Y124-E197 PolarHBondContact OH-OE1 3.29Å; Y124-E197 PolarHBondContact OH-OE2 3.3Å; Y124-I201 HydrophobicContact CD1-CD1 3.96Å; Y124-I201 HydrophobicContact CE1-CD1 3.56Å
125	V	86.5	Confident	82.5	Confident	29 Å²	29	44.6 Å²	44.6	18%	0.176	27%	0.269	C	S	.	.	H	α-helix	trans	-61.6	-44.6	179.7	171.1	0	0	0	0	111	F121 C122 S127 L128 I129 L198 I201	F121-V125 HydrophobicContact CD1-CG2 4.16Å; F121-V125 HydrophobicContact CD2-CG2 4.45Å; F121-V125 HydrophobicContact CE1-CG2 3.76Å; F121-V125 HydrophobicContact CE2-CG2 4.08Å; F121-V125 HydrophobicContact CG-CG2 4.5Å; F121-V125 HydrophobicContact CZ-CG2 3.73Å; F121-V125 WeakPolarHBondContact O-CG2 3.13Å; F121-V125 PolarHBondContact O-N 2.82Å; C122-V125 PolarHBondContact O-N 3.23Å; V125-S127 VanDerWaalsContact C-N 3.29Å; V125-S127 PolarHBondContact O-N 3.33Å; V125-L128 PolarHBondContact O-N 2.88Å; V125-I129 HydrophobicContact CG1-CD1 4Å; V125-I129 WeakPolarHBondContact O-CG1 3.36Å; V125-I129 PolarHBondContact O-N 2.89Å; V125-L198 HydrophobicContact CG1-CD1 4.1Å; V125-I201 HydrophobicContact CG2-CG2 4.33Å
126	I	89.6	Confident	84.8	Confident	69 Å²	69	44.1 Å²	44.1	35%	0.354	26%	0.263	S	S	.	.	H	α-helix	trans	-58.2	-44	175.4	-70.4	170.5	0	0	0	110.3	C122 Y124 L128 I129 F130	C122-I126 WeakPolarHBondContact O-CB 3.3Å; C122-I126 VanDerWaalsContact O-CG1 3.26Å; C122-I126 WeakPolarHBondContact O-CG1 3.49Å; C122-I126 PolarHBondContact O-N 2.97Å; C122-I126 VanDerWaalsContact SG-CD1 3.58Å; Y124-I126 PolarHBondContact O-N 3.38Å; I126-L128 VanDerWaalsContact C-N 3.33Å; I126-L128 PolarHBondContact O-N 2.79Å; I126-I129 PolarHBondContact O-N 3.5Å; I126-F130 HydrophobicContact CG2-CD2 3.55Å; I126-F130 HydrophobicContact CG2-CE2 3.48Å; I126-F130 VanDerWaalsContact CG2-CE2 3.48Å; I126-F130 VanDerWaalsContact O-CD2 3.26Å; I126-F130 WeakPolarHBondContact O-CD2 3.3Å; I126-F130 PolarHBondContact O-N 3.38Å
127	S	90.6	Very high	86.7	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-37.6	178.4	81	0	0	0	0	113.3	V91 T123 Y124 V125 K131	V91-S127 VanDerWaalsContact CG2-CB 3.47Å; V91-S127 WeakPolarHBondContact CG2-OG 3.22Å; T123-S127 WeakPolarHBondContact O-CB 3.4Å; T123-S127 PolarHBondContact O-N 3.47Å; Y124-S127 WeakPolarHBondContact O-CB 3.48Å; Y124-S127 PolarHBondContact O-N 3Å; Y124-S127 VanDerWaalsContact O-N 3.14Å; Y124-S127 PolarHBondContact O-OG 3.46Å; V125-S127 VanDerWaalsContact C-N 3.29Å; V125-S127 PolarHBondContact O-N 3.33Å; S127-K131 WeakPolarHBondContact O-CB 3.22Å; S127-K131 WeakPolarHBondContact O-CG 3.37Å; S127-K131 PolarHBondContact O-N 2.88Å
128	L	89.8	Confident	88.4	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-68.5	-39.3	177.1	-73.7	178.3	0	0	0	111.7	Y124 V125 I126 K131 T132 E197 I201	Y124-L128 HydrophobicContact CD1-CD1 3.91Å; Y124-L128 HydrophobicContact CD1-CG 4.46Å; Y124-L128 HydrophobicContact CE1-CD1 3.44Å; Y124-L128 VanDerWaalsContact CE1-CD1 3.44Å; Y124-L128 HydrophobicContact CE1-CG 4.12Å; Y124-L128 PolarHBondContact O-N 3.44Å; V125-L128 PolarHBondContact O-N 2.88Å; I126-L128 VanDerWaalsContact C-N 3.33Å; I126-L128 PolarHBondContact O-N 2.79Å; L128-K131 PolarHBondContact O-N 3.36Å; L128-T132 WeakPolarHBondContact O-CB 3.47Å; L128-T132 PolarHBondContact O-N 2.83Å; L128-T132 PolarHBondContact O-OG1 3.36Å; L128-E197 HydrophobicContact CD1-CG 4.11Å; L128-I201 HydrophobicContact CD1-CD1 4.31Å
129	I	92.3	Very high	89.8	Confident	94 Å²	94	40.5 Å²	40.5	48%	0.482	24%	0.237	S	C	.	.	H	α-helix	trans	-62.7	-49.3	174.7	-67.8	168.3	0	0	0	110	V125 I126 K131 T132 G133	V125-I129 HydrophobicContact CG1-CD1 4Å; V125-I129 WeakPolarHBondContact O-CG1 3.36Å; V125-I129 PolarHBondContact O-N 2.89Å; I126-I129 PolarHBondContact O-N 3.5Å; I129-K131 PolarHBondContact O-N 3.46Å; I129-T132 PolarHBondContact O-N 2.85Å; I129-G133 PolarHBondContact O-N 3.43Å
130	F	94.9	Very high	90.9	Very high	111 Å²	111	42.7 Å²	42.7	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-61.6	-42.6	177.5	-83.4	-67.7	0	0	0	112.5	P87 I126 G133 F134	P87-F130 HydrophobicContact CG-CB 4Å; I126-F130 HydrophobicContact CG2-CD2 3.55Å; I126-F130 HydrophobicContact CG2-CE2 3.48Å; I126-F130 VanDerWaalsContact CG2-CE2 3.48Å; I126-F130 VanDerWaalsContact O-CD2 3.26Å; I126-F130 WeakPolarHBondContact O-CD2 3.3Å; I126-F130 PolarHBondContact O-N 3.38Å; F130-G133 PolarHBondContact O-N 3.49Å; F130-F134 HydrophobicContact CB-CD2 4.5Å; F130-F134 HydrophobicContact CB-CE2 4.12Å; F130-F134 HydrophobicContact CD1-CE2 4.25Å; F130-F134 HydrophobicContact CD1-CZ 4.04Å; F130-F134 WeakPolarHBondContact O-CB 3.42Å; F130-F134 WeakPolarHBondContact O-CD2 3.5Å; F130-F134 VanDerWaalsContact O-CG 3.3Å; F130-F134 WeakPolarHBondContact O-CG 3.36Å; F130-F134 PolarHBondContact O-N 2.89Å
131	K	93.2	Very high	91.7	Very high	32 Å²	32	43.1 Å²	43.1	14%	0.139	25%	0.247	C	C	.	.	H	α-helix	trans	-56.9	-52	174	-86.5	179.5	174	177.3	0	112.2	V84 P87 S88 S127 L128 I129 G133 F134 E135	V84-K131 HydrophobicContact CG1-CG 4.38Å; P87-K131 HydrophobicContact CB-CG 4.1Å; P87-K131 HydrophobicContact CG-CG 4.19Å; S88-K131 WeakPolarHBondContact OG-CE 3.25Å; S88-K131 PolarHBondContact OG-NZ 3.25Å; S127-K131 WeakPolarHBondContact O-CB 3.22Å; S127-K131 WeakPolarHBondContact O-CG 3.37Å; S127-K131 PolarHBondContact O-N 2.88Å; L128-K131 PolarHBondContact O-N 3.36Å; I129-K131 PolarHBondContact O-N 3.46Å; K131-G133 VanDerWaalsContact C-N 3.31Å; K131-G133 PolarHBondContact O-N 3.32Å; K131-F134 PolarHBondContact O-N 3.24Å; K131-E135 WeakPolarHBondContact O-CG 3.5Å; K131-E135 PolarHBondContact O-N 3.35Å
132	T	94.5	Very high	92.5	Very high	24 Å²	24	41.5 Å²	41.5	15%	0.147	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-42.6	-178.6	-52.3	0	0	0	0	110.4	L128 I129 E135 V136 I191	L128-T132 WeakPolarHBondContact O-CB 3.47Å; L128-T132 PolarHBondContact O-N 2.83Å; L128-T132 PolarHBondContact O-OG1 3.36Å; I129-T132 PolarHBondContact O-N 2.85Å; T132-E135 PolarHBondContact O-N 2.93Å; T132-V136 HydrophobicContact CG2-CG2 4.36Å; T132-V136 WeakPolarHBondContact O-CB 3.33Å; T132-V136 VanDerWaalsContact O-CG2 3.29Å; T132-V136 WeakPolarHBondContact O-CG2 3.35Å; T132-V136 PolarHBondContact O-N 3.42Å; T132-I191 HydrophobicContact CG2-CG2 4.44Å
133	G	96.8	Very high	93.1	Very high	43 Å²	43	43.7 Å²	43.7	44%	0.443	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-44.5	176	0	0	0	0	0	113	I129 F130 K131 G137	I129-G133 PolarHBondContact O-N 3.43Å; F130-G133 PolarHBondContact O-N 3.49Å; K131-G133 VanDerWaalsContact C-N 3.31Å; K131-G133 PolarHBondContact O-N 3.32Å; G133-G137 WeakPolarHBondContact O-CA 3.27Å; G133-G137 PolarHBondContact O-N 3.38Å
134	F	96.9	Very high	93.5	Very high	57 Å²	57	50.3 Å²	50.3	25%	0.25	26%	0.262	C	S	.	.	H	α-helix	trans	-66.5	-46.8	175.4	-65.9	-40.8	0	0	0	111.9	M83 V84 P87 F130 K131 V136 G137 F138	M83-F134 HydrophobicContact CB-CB 4.48Å; M83-F134 HydrophobicContact CB-CD2 4.19Å; M83-F134 HydrophobicContact CB-CG 4.18Å; M83-F134 HydrophobicContact CE-CD1 4.11Å; M83-F134 HydrophobicContact CE-CE1 3.53Å; M83-F134 HydrophobicContact CE-CE2 4.06Å; M83-F134 HydrophobicContact CE-CZ 3.51Å; M83-F134 WeakPolarHBondContact O-CD2 3.23Å; V84-F134 HydrophobicContact CG2-CB 4.06Å; P87-F134 HydrophobicContact CG-CD2 4.39Å; P87-F134 HydrophobicContact CG-CE2 4.21Å; F130-F134 HydrophobicContact CB-CD2 4.5Å; F130-F134 HydrophobicContact CB-CE2 4.12Å; F130-F134 HydrophobicContact CD1-CE2 4.25Å; F130-F134 HydrophobicContact CD1-CZ 4.04Å; F130-F134 WeakPolarHBondContact O-CB 3.42Å; F130-F134 WeakPolarHBondContact O-CD2 3.5Å; F130-F134 VanDerWaalsContact O-CG 3.3Å; F130-F134 WeakPolarHBondContact O-CG 3.36Å; F130-F134 PolarHBondContact O-N 2.89Å; K131-F134 PolarHBondContact O-N 3.24Å; F134-V136 PolarHBondContact O-N 3.22Å; F134-G137 PolarHBondContact O-N 3.14Å; F134-F138 HydrophobicContact CB-CD2 4.44Å; F134-F138 WeakPolarHBondContact O-CB 3.43Å; F134-F138 VanDerWaalsContact O-CD2 3.25Å; F134-F138 WeakPolarHBondContact O-CD2 3.32Å; F134-F138 PolarHBondContact O-N 3.46Å
135	E	96.4	Very high	93.9	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-57.3	-48.5	177.7	-70.5	-79.8	-162	0	0	111.8	R32 Q80 V84 K131 T132 L139 I191	R32-E135 IonicContact CZ-OE1 3.66Å; R32-E135 IonicContact CZ-OE2 3.8Å; R32-E135 VanDerWaalsContact NH1-CD 3.27Å; R32-E135 IonicContact NH1-OE1 4Å; R32-E135 PolarHBondContact NH1-OE1 2.94Å; R32-E135 IonicContact NH1-OE2 3.83Å; R32-E135 PolarHBondContact NH1-OE2 3.17Å; R32-E135 IonicContact NH2-OE2 2.78Å; Q80-E135 PolarHBondContact NE2-OE2 3.41Å; V84-E135 HydrophobicContact CG1-CG 4.37Å; V84-E135 HydrophobicContact CG2-CG 3.73Å; K131-E135 WeakPolarHBondContact O-CG 3.5Å; K131-E135 PolarHBondContact O-N 3.35Å; T132-E135 PolarHBondContact O-N 2.93Å; E135-L139 WeakPolarHBondContact O-CB 3.28Å; E135-L139 WeakPolarHBondContact O-CG 3.31Å; E135-L139 PolarHBondContact O-N 2.95Å; E135-L139 VanDerWaalsContact O-N 3.08Å; E135-I191 HydrophobicContact CB-CD1 3.93Å; E135-I191 HydrophobicContact CB-CG1 3.59Å; E135-I191 HydrophobicContact CG-CG1 4.39Å
136	V	97.4	Very high	94	Very high	56 Å²	56	53 Å²	53	34%	0.339	27%	0.274	S	S	.	.	H	α-helix	trans	-65.8	-45.5	177.9	172.8	0	0	0	0	110.9	T132 F134 F138 L139 L140 I191	T132-V136 HydrophobicContact CG2-CG2 4.36Å; T132-V136 WeakPolarHBondContact O-CB 3.33Å; T132-V136 VanDerWaalsContact O-CG2 3.29Å; T132-V136 WeakPolarHBondContact O-CG2 3.35Å; T132-V136 PolarHBondContact O-N 3.42Å; F134-V136 PolarHBondContact O-N 3.22Å; V136-F138 PolarHBondContact O-N 3.19Å; V136-L139 PolarHBondContact O-N 3.02Å; V136-L140 HydrophobicContact CG1-CD1 3.85Å; V136-L140 HydrophobicContact CG1-CG 4.24Å; V136-L140 WeakPolarHBondContact O-CB 3.28Å; V136-L140 VanDerWaalsContact O-CG 3.32Å; V136-L140 WeakPolarHBondContact O-CG 3.37Å; V136-L140 PolarHBondContact O-N 3.33Å; V136-I191 HydrophobicContact CG2-CD1 3.79Å; V136-I191 HydrophobicContact CG2-CG1 4.19Å; V136-I191 HydrophobicContact CG2-CG2 4.31Å
137	G	97.1	Very high	93.9	Very high	36 Å²	36	57 Å²	57	37%	0.371	30%	0.297	S	S	.	.	H	α-helix	trans	-59.6	-45.2	-179.8	0	0	0	0	0	112.8	G133 F134 L140 A141	G133-G137 WeakPolarHBondContact O-CA 3.27Å; G133-G137 PolarHBondContact O-N 3.38Å; F134-G137 PolarHBondContact O-N 3.14Å; G137-L140 PolarHBondContact O-N 2.89Å; G137-A141 VanDerWaalsContact O-CB 3.31Å; G137-A141 WeakPolarHBondContact O-CB 3.44Å; G137-A141 PolarHBondContact O-N 2.98Å
138	F	96.6	Very high	93.9	Very high	37 Å²	37	57.4 Å²	57.4	16%	0.162	30%	0.301	C	S	.	.	H	α-helix	trans	-68.8	-38.1	176.5	-84.2	-79.2	0	0	0	112.6	L79 Q80 M83 F134 V136 A141 F142	L79-F138 HydrophobicContact CB-CE1 3.81Å; L79-F138 HydrophobicContact CB-CZ 3.91Å; Q80-F138 HydrophobicContact CB-CB 3.96Å; Q80-F138 HydrophobicContact CB-CD1 3.88Å; Q80-F138 HydrophobicContact CB-CD2 3.87Å; Q80-F138 HydrophobicContact CB-CE1 4.33Å; Q80-F138 HydrophobicContact CB-CE2 4.35Å; Q80-F138 HydrophobicContact CB-CG 3.63Å; Q80-F138 HydrophobicContact CG-CB 3.7Å; Q80-F138 HydrophobicContact CG-CD2 3.92Å; Q80-F138 HydrophobicContact CG-CG 3.82Å; M83-F138 HydrophobicContact CB-CE2 3.87Å; M83-F138 HydrophobicContact CB-CZ 4.47Å; M83-F138 HydrophobicContact CG-CE2 3.94Å; M83-F138 HydrophobicContact CG-CZ 4.09Å; F134-F138 HydrophobicContact CB-CD2 4.44Å; F134-F138 WeakPolarHBondContact O-CB 3.43Å; F134-F138 VanDerWaalsContact O-CD2 3.25Å; F134-F138 WeakPolarHBondContact O-CD2 3.32Å; F134-F138 PolarHBondContact O-N 3.46Å; V136-F138 PolarHBondContact O-N 3.19Å; F138-A141 PolarHBondContact O-N 3.03Å; F138-F142 VanDerWaalsContact O-CB 3.3Å; F138-F142 WeakPolarHBondContact O-CB 3.15Å; F138-F142 PolarHBondContact O-N 3.17Å
139	L	95.4	Very high	93.6	Very high	20 Å²	20	60.4 Å²	60.4	11%	0.105	31%	0.314	C	S	.	.	H	α-helix	trans	-63.7	-41.6	174	-78.7	177.9	0	0	0	112.2	W77 E135 V136 F142 Y143 F149 V184 I188 I191	W77-L139 HydrophobicContact CH2-CD2 4.01Å; E135-L139 WeakPolarHBondContact O-CB 3.28Å; E135-L139 WeakPolarHBondContact O-CG 3.31Å; E135-L139 PolarHBondContact O-N 2.95Å; E135-L139 VanDerWaalsContact O-N 3.08Å; V136-L139 PolarHBondContact O-N 3.02Å; L139-F142 PolarHBondContact O-N 3.4Å; L139-Y143 WeakPolarHBondContact O-CB 3.46Å; L139-Y143 PolarHBondContact O-N 3.32Å; L139-F149 HydrophobicContact CD2-CE1 4.43Å; L139-V184 HydrophobicContact CD2-CG1 4.36Å; L139-V184 HydrophobicContact CD2-CG2 4.27Å; L139-I188 HydrophobicContact CD1-CG1 4.39Å; L139-I191 HydrophobicContact CD1-CD1 3.48Å; L139-I191 VanDerWaalsContact CD1-CD1 3.48Å
140	L	95.9	Very high	93.3	Very high	86 Å²	86	57.7 Å²	57.7	45%	0.45	31%	0.31	S	S	.	.	H	α-helix	trans	-65.4	-47	175.1	-71.1	175.8	0	0	0	111	V136 G137 F142 Y143 Y144	V136-L140 HydrophobicContact CG1-CD1 3.85Å; V136-L140 HydrophobicContact CG1-CG 4.24Å; V136-L140 WeakPolarHBondContact O-CB 3.28Å; V136-L140 VanDerWaalsContact O-CG 3.32Å; V136-L140 WeakPolarHBondContact O-CG 3.37Å; V136-L140 PolarHBondContact O-N 3.33Å; G137-L140 PolarHBondContact O-N 2.89Å; L140-F142 VanDerWaalsContact C-N 3.28Å; L140-F142 PolarHBondContact O-N 2.65Å; L140-Y143 PolarHBondContact O-N 3.1Å; L140-Y143 VanDerWaalsContact O-N 3.17Å; L140-Y144 HydrophobicContact CB-CD2 4.45Å; L140-Y144 HydrophobicContact CB-CE2 4.39Å; L140-Y144 HydrophobicContact CD2-CE2 4.49Å; L140-Y144 WeakPolarHBondContact O-CD2 3.29Å; L140-Y144 PolarHBondContact O-N 3.18Å
141	A	94.5	Very high	93	Very high	36 Å²	36	53 Å²	53	30%	0.298	29%	0.29	S	S	.	.	H	α-helix	trans	-57	-44.2	175.5	0	0	0	0	0	111.1	G137 F138 Y143 Y144 L145	G137-A141 VanDerWaalsContact O-CB 3.31Å; G137-A141 WeakPolarHBondContact O-CB 3.44Å; G137-A141 PolarHBondContact O-N 2.98Å; F138-A141 PolarHBondContact O-N 3.03Å; A141-Y143 PolarHBondContact O-N 3.33Å; A141-Y144 PolarHBondContact O-N 3.34Å; A141-L145 HydrophobicContact CB-CD1 4.44Å; A141-L145 WeakPolarHBondContact O-CB 3.45Å; A141-L145 WeakPolarHBondContact O-CD1 3.5Å; A141-L145 PolarHBondContact O-N 3.15Å
142	F	94.2	Very high	92.8	Very high	5 Å²	5	54.6 Å²	54.6	2%	0.022	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-47.8	175.8	-166.9	-78.3	0	0	0	111.6	Q73 W77 F138 L139 L140 Y144 L145 Y146 F149 L180	Q73-F142 HydrophobicContact CB-CE2 4.08Å; Q73-F142 HydrophobicContact CG-CE2 3.91Å; Q73-F142 HydrophobicContact CG-CZ 3.99Å; W77-F142 HydrophobicContact CZ2-CD2 4.24Å; W77-F142 HydrophobicContact CZ2-CE2 4.41Å; W77-F142 AromaticContact NE1-CD2 4Å; W77-F142 AromaticContact NE1-CE2 3.56Å; F138-F142 VanDerWaalsContact O-CB 3.3Å; F138-F142 WeakPolarHBondContact O-CB 3.15Å; F138-F142 PolarHBondContact O-N 3.17Å; L139-F142 PolarHBondContact O-N 3.4Å; L140-F142 VanDerWaalsContact C-N 3.28Å; L140-F142 PolarHBondContact O-N 2.65Å; F142-Y144 VanDerWaalsContact C-N 3.35Å; F142-Y144 PolarHBondContact O-N 3.43Å; F142-L145 PolarHBondContact O-N 2.81Å; F142-Y146 AromaticContact CD1-CD2 3.79Å; F142-Y146 HydrophobicContact CD1-CD2 3.79Å; F142-Y146 HydrophobicContact CD1-CE2 4.5Å; F142-Y146 AromaticContact CD2-CD2 3.69Å; F142-Y146 HydrophobicContact CD2-CD2 3.69Å; F142-Y146 AromaticContact CD2-CE2 3.56Å; F142-Y146 HydrophobicContact CD2-CE2 3.56Å; F142-Y146 AromaticContact CE1-CD2 3.55Å; F142-Y146 HydrophobicContact CE1-CD2 3.55Å; F142-Y146 HydrophobicContact CE1-CE2 4.29Å; F142-Y146 HydrophobicContact CE1-CG 4.21Å; F142-Y146 AromaticContact CE2-CD2 3.48Å; F142-Y146 HydrophobicContact CE2-CD2 3.48Å; F142-Y146 VanDerWaalsContact CE2-CD2 3.48Å; F142-Y146 AromaticContact CE2-CE2 3.33Å; F142-Y146 HydrophobicContact CE2-CE2 3.33Å; F142-Y146 AromaticContact CG-CD2 3.82Å; F142-Y146 HydrophobicContact CG-CD2 3.82Å; F142-Y146 HydrophobicContact CG-CE2 4.13Å; F142-Y146 AromaticContact CZ-CD2 3.36Å; F142-Y146 HydrophobicContact CZ-CD2 3.36Å; F142-Y146 AromaticContact CZ-CE2 3.7Å; F142-Y146 HydrophobicContact CZ-CE2 3.7Å; F142-Y146 HydrophobicContact CZ-CG 4.12Å; F142-Y146 VanDerWaalsContact O-CD2 3.31Å; F142-Y146 WeakPolarHBondContact O-CD2 3.24Å; F142-Y146 PolarHBondContact O-N 3.25Å; F142-F149 AromaticContact CD1-CD1 3.93Å; F142-F149 HydrophobicContact CD1-CD1 3.93Å; F142-F149 HydrophobicContact CD1-CE1 4.01Å; F142-F149 HydrophobicContact CE1-CD1 4.23Å; F142-L180 HydrophobicContact CD1-CD1 4.28Å; F142-L180 HydrophobicContact CD2-CD1 4.49Å; F142-L180 HydrophobicContact CE1-CD1 3.45Å; F142-L180 VanDerWaalsContact CE1-CD1 3.45Å; F142-L180 HydrophobicContact CE1-CD2 3.74Å; F142-L180 HydrophobicContact CE1-CG 4.18Å; F142-L180 HydrophobicContact CE2-CD1 3.68Å; F142-L180 HydrophobicContact CZ-CD1 3.11Å; F142-L180 HydrophobicContact CZ-CD2 3.77Å; F142-L180 HydrophobicContact CZ-CG 4.07Å
143	Y	93.6	Very high	92.6	Very high	111 Å²	111	58.3 Å²	58.3	44%	0.435	32%	0.321	S	S	.	.	H	α-helix	trans	-59.5	-44.3	179	-179.5	-97.7	0	0	0	112.2	L139 L140 A141 N147 G148 F149	L139-Y143 WeakPolarHBondContact O-CB 3.46Å; L139-Y143 PolarHBondContact O-N 3.32Å; L140-Y143 PolarHBondContact O-N 3.1Å; L140-Y143 VanDerWaalsContact O-N 3.17Å; A141-Y143 PolarHBondContact O-N 3.33Å; Y143-N147 WeakPolarHBondContact O-CA 3.48Å; Y143-N147 PolarHBondContact O-N 2.98Å; Y143-N147 VanDerWaalsContact O-N 3.08Å; Y143-G148 PolarHBondContact O-N 3.04Å; Y143-F149 HydrophobicContact CD2-CD2 4.15Å; Y143-F149 AromaticContact CD2-CE2 3.7Å; Y143-F149 HydrophobicContact CD2-CE2 3.7Å; Y143-F149 HydrophobicContact CD2-CZ 4.15Å; Y143-F149 HydrophobicContact CE2-CE2 4.44Å
144	Y	93.3	Very high	92.4	Very high	177 Å²	177	58.9 Å²	58.9	69%	0.694	31%	0.314	S	S	*	.	H	α-helix	trans	-73.6	-38.6	179.6	-72.7	-62.8	0	0	0	113.4	L140 A141 F142	L140-Y144 HydrophobicContact CB-CD2 4.45Å; L140-Y144 HydrophobicContact CB-CE2 4.39Å; L140-Y144 HydrophobicContact CD2-CE2 4.49Å; L140-Y144 WeakPolarHBondContact O-CD2 3.29Å; L140-Y144 PolarHBondContact O-N 3.18Å; A141-Y144 PolarHBondContact O-N 3.34Å; F142-Y144 VanDerWaalsContact C-N 3.35Å; F142-Y144 PolarHBondContact O-N 3.43Å
145	L	92.2	Very high	92.2	Very high	80 Å²	80	57.4 Å²	57.4	42%	0.419	31%	0.308	S	S	.	.	H	α-helix	trans	-69.5	-38	179.5	-94.6	87	0	0	0	112.7	I71 L76 A141 F142	I71-L145 HydrophobicContact CD1-CD2 4.43Å; L76-L145 HydrophobicContact CD1-CD2 4.2Å; A141-L145 HydrophobicContact CB-CD1 4.44Å; A141-L145 WeakPolarHBondContact O-CB 3.45Å; A141-L145 WeakPolarHBondContact O-CD1 3.5Å; A141-L145 PolarHBondContact O-N 3.15Å; F142-L145 PolarHBondContact O-N 2.81Å
146	Y	89.5	Confident	92.2	Very high	33 Å²	33	65.5 Å²	65.5	13%	0.129	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	9.7	-175.2	-58.1	-70.1	0	0	0	113.7	I71 Q73 L76 F142 G148	I71-Y146 PolarHBondContact O-OH 3.32Å; Q73-Y146 WeakPolarHBondContact CA-OH 3.08Å; Q73-Y146 HydrophobicContact CG-CD1 4.3Å; Q73-Y146 HydrophobicContact CG-CD2 4.39Å; Q73-Y146 HydrophobicContact CG-CE1 3.69Å; Q73-Y146 HydrophobicContact CG-CE2 3.78Å; Q73-Y146 WeakPolarHBondContact CG-OH 3.15Å; Q73-Y146 PolarHBondContact N-OH 3.03Å; L76-Y146 HydrophobicContact CD1-CE2 3.62Å; L76-Y146 WeakPolarHBondContact CD1-OH 3.34Å; F142-Y146 AromaticContact CD1-CD2 3.79Å; F142-Y146 HydrophobicContact CD1-CD2 3.79Å; F142-Y146 HydrophobicContact CD1-CE2 4.5Å; F142-Y146 AromaticContact CD2-CD2 3.69Å; F142-Y146 HydrophobicContact CD2-CD2 3.69Å; F142-Y146 AromaticContact CD2-CE2 3.56Å; F142-Y146 HydrophobicContact CD2-CE2 3.56Å; F142-Y146 AromaticContact CE1-CD2 3.55Å; F142-Y146 HydrophobicContact CE1-CD2 3.55Å; F142-Y146 HydrophobicContact CE1-CE2 4.29Å; F142-Y146 HydrophobicContact CE1-CG 4.21Å; F142-Y146 AromaticContact CE2-CD2 3.48Å; F142-Y146 HydrophobicContact CE2-CD2 3.48Å; F142-Y146 VanDerWaalsContact CE2-CD2 3.48Å; F142-Y146 AromaticContact CE2-CE2 3.33Å; F142-Y146 HydrophobicContact CE2-CE2 3.33Å; F142-Y146 AromaticContact CG-CD2 3.82Å; F142-Y146 HydrophobicContact CG-CD2 3.82Å; F142-Y146 HydrophobicContact CG-CE2 4.13Å; F142-Y146 AromaticContact CZ-CD2 3.36Å; F142-Y146 HydrophobicContact CZ-CD2 3.36Å; F142-Y146 AromaticContact CZ-CE2 3.7Å; F142-Y146 HydrophobicContact CZ-CE2 3.7Å; F142-Y146 HydrophobicContact CZ-CG 4.12Å; F142-Y146 VanDerWaalsContact O-CD2 3.31Å; F142-Y146 WeakPolarHBondContact O-CD2 3.24Å; F142-Y146 PolarHBondContact O-N 3.25Å; Y146-G148 PolarHBondContact O-N 3.08Å
147	N	87.8	Confident	92.1	Very high	153 Å²	153	62.9 Å²	62.9	82%	0.818	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	40.6	-178.8	-160.9	27.4	0	0	0	112.8	Y143	Y143-N147 WeakPolarHBondContact O-CA 3.48Å; Y143-N147 PolarHBondContact O-N 2.98Å; Y143-N147 VanDerWaalsContact O-N 3.08Å
148	G	88.9	Confident	92.1	Very high	11 Å²	11	65.9 Å²	65.9	11%	0.113	33%	0.334	C	S	.	.	S	Bend	trans	127.3	-168.8	-178.9	0	0	0	0	0	115.2	Y143 Y146	Y143-G148 PolarHBondContact O-N 3.04Å; Y146-G148 PolarHBondContact O-N 3.08Å
149	F	84.8	Confident	92.1	Very high	65 Å²	65	67.6 Å²	67.6	29%	0.285	34%	0.343	S	S	.	.	S	Bend	trans	-105.7	22.1	-178.8	-61.4	-70.1	0	0	0	113	L139 F142 Y143 L180 V184	L139-F149 HydrophobicContact CD2-CE1 4.43Å; F142-F149 AromaticContact CD1-CD1 3.93Å; F142-F149 HydrophobicContact CD1-CD1 3.93Å; F142-F149 HydrophobicContact CD1-CE1 4.01Å; F142-F149 HydrophobicContact CE1-CD1 4.23Å; Y143-F149 HydrophobicContact CD2-CD2 4.15Å; Y143-F149 AromaticContact CD2-CE2 3.7Å; Y143-F149 HydrophobicContact CD2-CE2 3.7Å; Y143-F149 HydrophobicContact CD2-CZ 4.15Å; Y143-F149 HydrophobicContact CE2-CE2 4.44Å; F149-L180 WeakPolarHBondContact O-CD2 3.4Å; F149-V184 HydrophobicContact CD1-CG1 4.2Å; F149-V184 HydrophobicContact CD1-CG2 3.56Å; F149-V184 HydrophobicContact CE1-CG1 4.07Å; F149-V184 HydrophobicContact CE1-CG2 3.72Å; F149-V184 HydrophobicContact CG-CG2 4.5Å; F149-V184 HydrophobicContact CZ-CG1 4.41Å
150	G	85	Confident	92	Very high	38 Å²	38	75 Å²	75	39%	0.392	38%	0.377	S	S	.	.			trans	-105.3	143.2	179.9	0	0	0	0	0	111.9
151	V	88.1	Confident	92	Very high	11 Å²	11	73.8 Å²	73.8	7%	0.067	37%	0.374	C	S	.	.			trans	-109.5	101	166.5	-174.5	0	0	0	0	106.9	I170 A173 K176 K177 L180	V151-I170 HydrophobicContact CG1-CD1 4.4Å; V151-A173 HydrophobicContact CG1-CB 4.28Å; V151-K176 HydrophobicContact CG1-CB 4.42Å; V151-K176 HydrophobicContact CG2-CB 4.33Å; V151-K177 HydrophobicContact CB-CB 4.38Å; V151-K177 HydrophobicContact CG2-CB 4.48Å; V151-L180 HydrophobicContact CG2-CD2 4.16Å
152	P	89.6	Confident	92.1	Very high	66 Å²	66	72.9 Å²	72.9	43%	0.429	37%	0.365	S	S	.	.			trans	-67.7	149.4	177	29.6	-34.3	0	0	0	110.2	M155 I170	P152-M155 HydrophobicContact CG-CG 3.82Å; P152-M155 HydrophobicContact CG-SD 3.99Å; P152-I170 VanDerWaalsContact O-CD1 3.23Å; P152-I170 WeakPolarHBondContact O-CD1 3.27Å
153	I	90.8	Very high	92	Very high	102 Å²	102	76.5 Å²	76.5	52%	0.523	39%	0.389	S	S	.	.	S	Bend	trans	-77.7	-32	177.9	-56.5	171	0	0	0	110.6	Y169 I170 A173	I153-Y169 WeakPolarHBondContact O-CA 3.45Å; I153-I170 PolarHBondContact O-N 3.39Å; I153-I170 VanDerWaalsContact O-N 3.11Å; I153-A173 HydrophobicContact CB-CB 4.47Å; I153-A173 HydrophobicContact CG1-CB 3.94Å
154	L	93.3	Very high	92.1	Very high	56 Å²	56	77.2 Å²	77.2	29%	0.293	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.5	-177.8	173	68.4	0	0	0	109.7	D167 C168 Y169	L154-D167 HydrophobicContact CD1-CB 3.61Å; L154-C168 WeakPolarHBondContact CA-O 3.43Å; L154-Y169 HydrophobicContact CD1-CD1 4.23Å; L154-Y169 HydrophobicContact CD1-CE1 3.85Å; L154-Y169 HydrophobicContact CD1-CE2 4.29Å
155	M	92.4	Very high	92.2	Very high	26 Å²	26	72.8 Å²	72.8	13%	0.128	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.9	171.4	-58.9	-161.6	-62	0	0	109.9	F51 F68 F69 P152 C168 I170	F51-M155 HydrophobicContact CE2-CE 4.18Å; F68-M155 HydrophobicContact CB-CE 3.32Å; F68-M155 HydrophobicContact CB-SD 4.16Å; F68-M155 HydrophobicContact CD1-CB 4.5Å; F68-M155 HydrophobicContact CD1-CE 3.78Å; F68-M155 HydrophobicContact CD1-SD 3.68Å; F68-M155 HydrophobicContact CD2-CB 4.33Å; F68-M155 HydrophobicContact CD2-CE 3.5Å; F68-M155 HydrophobicContact CD2-SD 4.38Å; F68-M155 HydrophobicContact CE1-CB 4.12Å; F68-M155 HydrophobicContact CE1-CE 4.46Å; F68-M155 HydrophobicContact CE1-SD 4.13Å; F68-M155 HydrophobicContact CE2-CB 3.94Å; F68-M155 HydrophobicContact CE2-CE 4.22Å; F68-M155 HydrophobicContact CG-CE 3.25Å; F68-M155 HydrophobicContact CG-SD 3.84Å; F68-M155 HydrophobicContact CZ-CB 3.84Å; F69-M155 HydrophobicContact CE2-CE 3.69Å; F69-M155 HydrophobicContact CZ-CE 4.05Å; P152-M155 HydrophobicContact CG-CG 3.82Å; P152-M155 HydrophobicContact CG-SD 3.99Å; M155-C168 PolarHBondContact N-O 3.36Å; M155-C168 PolarHBondContact O-N 3.35Å; M155-I170 HydrophobicContact CE-CD1 3.5Å; M155-I170 HydrophobicContact CE-CG1 4.01Å; M155-I170 HydrophobicContact CG-CD1 4.06Å; M155-I170 HydrophobicContact SD-CD1 3.82Å
156	R	95.7	Very high	92.4	Very high	170 Å²	170	69.5 Å²	69.5	64%	0.642	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.4	-179.2	-71.1	-173.5	175.9	99.9	1	109.3	F68 T165 D167	F68-R156 WeakPolarHBondContact CZ-O 3.34Å; R156-T165 HydrophobicContact CB-CG2 3.79Å; R156-T165 HydrophobicContact CG-CG2 4.34Å; R156-D167 IonicContact NE-OD1 3.73Å
157	C	96.3	Very high	92.8	Very high	1 Å²	1	70.2 Å²	70.2	1%	0.007	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.8	-175.1	-171.6	0	0	0	0	111.8	C64 F68 T165 V166	C64-C157 WeakPolarHBondContact CA-SG 3.31Å; C64-C157 HydrophobicContact CB-CB 3.78Å; C64-C157 WeakPolarHBondContact CB-SG 3.26Å; C64-C157 WeakPolarHBondContact SG-CB 3.35Å; C64-C157 CovalentContact SG-SG 2.02Å; C64-C157 PolarHBondContact SG-SG 3.38Å; F68-C157 HydrophobicContact CE2-CB 3.8Å; F68-C157 HydrophobicContact CZ-CB 4.31Å; C157-T165 CarbonylContact O-C 3.49Å; C157-T165 VanDerWaalsContact O-CA 3.28Å; C157-T165 WeakPolarHBondContact O-CA 3.41Å; C157-V166 HydrophobicContact CB-CG2 3.84Å; C157-V166 PolarHBondContact N-O 2.96Å; C157-V166 PolarHBondContact O-N 3.48Å
158	T	96	Very high	93.2	Very high	100 Å²	100	63 Å²	63	61%	0.613	34%	0.343	S	S	*	.			trans	-127.7	18.2	176.6	45.7	0	0	0	0	113	T165	T158-T165 HydrophobicContact CG2-CG2 3.96Å; T158-T165 WeakPolarHBondContact CG2-OG1 3.39Å
159	E	96.1	Very high	93.5	Very high	73 Å²	73	67.7 Å²	67.7	34%	0.341	36%	0.358	S	S	.	.			trans	-79	149.1	-176.6	-71.2	-61.4	152.3	0	0	112.7	H67 C162	H67-E159 HydrophobicContact CB-CG 3.83Å; H67-E159 IonicContact CE1-OE1 3.82Å; H67-E159 PolarHBondContact CE1-OE1 3.36Å; H67-E159 IonicContact CG-OE1 2.76Å; H67-E159 IonicContact ND1-OE1 2.7Å; H67-E159 PolarHBondContact ND1-OE1 2.65Å; H67-E159 IonicContact NE2-OE1 2.95Å; E159-C162 WeakPolarHBondContact O-CA 3.26Å; E159-C162 WeakPolarHBondContact O-CB 3.38Å; E159-C162 PolarHBondContact O-N 2.76Å; E159-C162 PolarHBondContact O-SG 3.01Å
160	E	94.4	Very high	93.9	Very high	175 Å²	175	65 Å²	65	82%	0.818	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	137.7	173.2	-63.8	-171.5	170.9	0	0	110.3	A63	A63-E160 WeakPolarHBondContact CB-O 3.47Å
161	P	95.8	Very high	94.1	Very high	60 Å²	60	64.6 Å²	64.6	39%	0.39	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	cis	-97	28.1	13.2	39.1	-38.5	0	0	0	114.8	Q57 P58	Q57-P161 VanDerWaalsContact CG-O 3.28Å; Q57-P161 WeakPolarHBondContact CG-O 3.45Å; P58-P161 WeakPolarHBondContact O-CG 3.46Å
162	C	95.7	Very high	94.3	Very high	17 Å²	17	67.8 Å²	67.8	12%	0.115	35%	0.35	C	S	.	.			trans	-69.5	134.4	-179	-53.8	0	0	0	0	111.4	C60 C64 E159 N164 V166	C60-C162 VanDerWaalsContact CA-SG 3.59Å; C60-C162 HydrophobicContact CB-CB 4.11Å; C60-C162 WeakPolarHBondContact CB-SG 3.02Å; C60-C162 WeakPolarHBondContact SG-CB 3.34Å; C60-C162 CovalentContact SG-SG 2.03Å; C60-C162 PolarHBondContact SG-SG 2.98Å; C64-C162 PolarHBondContact SG-SG 2.58Å; E159-C162 WeakPolarHBondContact O-CA 3.26Å; E159-C162 WeakPolarHBondContact O-CB 3.38Å; E159-C162 PolarHBondContact O-N 2.76Å; E159-C162 PolarHBondContact O-SG 3.01Å; C162-N164 PolarHBondContact O-N 3.07Å; C162-V166 HydrophobicContact CB-CG2 4.44Å
163	P	93.9	Very high	94.4	Very high	81 Å²	81	64.9 Å²	64.9	53%	0.526	33%	0.332	S	S	.	.	S	Bend	trans	-74.4	-26.3	-173.1	28.4	-35.1	0	0	0	113.9
164	N	94.6	Very high	94.4	Very high	126 Å²	126	65.5 Å²	65.5	67%	0.674	33%	0.334	S	S	*	.	S	Bend	trans	-152.8	-176.7	179.9	-70.9	-63.7	0	0	0	108.2	C162 V166	C162-N164 PolarHBondContact O-N 3.07Å; N164-V166 PolarHBondContact O-N 3.22Å; N164-V166 VanDerWaalsContact O-N 3.16Å
165	T	95.9	Very high	94.3	Very high	85 Å²	85	67.6 Å²	67.6	52%	0.521	34%	0.343	S	S	.	.			trans	-60.7	117.4	167.6	-49.1	0	0	0	0	110.5	R156 C157 T158	R156-T165 HydrophobicContact CB-CG2 3.79Å; R156-T165 HydrophobicContact CG-CG2 4.34Å; C157-T165 CarbonylContact O-C 3.49Å; C157-T165 VanDerWaalsContact O-CA 3.28Å; C157-T165 WeakPolarHBondContact O-CA 3.41Å; T158-T165 HydrophobicContact CG2-CG2 3.96Å; T158-T165 WeakPolarHBondContact CG2-OG1 3.39Å
166	V	96.8	Very high	94.3	Very high	10 Å²	10	66.6 Å²	66.6	6%	0.061	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	144.8	177.6	-61.4	0	0	0	0	111	T55 C157 C162 N164	T55-V166 HydrophobicContact CG2-CG1 4.35Å; C157-V166 HydrophobicContact CB-CG2 3.84Å; C157-V166 PolarHBondContact N-O 2.96Å; C157-V166 PolarHBondContact O-N 3.48Å; C162-V166 HydrophobicContact CB-CG2 4.44Å; N164-V166 PolarHBondContact O-N 3.22Å; N164-V166 VanDerWaalsContact O-N 3.16Å
167	D	96.8	Very high	94.1	Very high	49 Å²	49	62 Å²	62	26%	0.262	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	120.6	175.5	-76.5	-25.1	0	0	0	109.8	C53 N54 L154 R156 Y169	C53-D167 CarbonylContact C-O 3.57Å; C53-D167 WeakPolarHBondContact CA-O 3.3Å; N54-D167 PolarHBondContact N-O 3.24Å; L154-D167 HydrophobicContact CD1-CB 3.61Å; R156-D167 IonicContact NE-OD1 3.73Å; D167-Y169 HydrophobicContact CB-CE2 4.22Å
168	C	96.2	Very high	94	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	135.5	176.7	-59.7	0	0	0	0	111.4	F51 V52 C53 L154 M155	F51-C168 HydrophobicContact CE1-CB 4.05Å; F51-C168 HydrophobicContact CE2-CB 3.78Å; F51-C168 HydrophobicContact CZ-CB 3.37Å; V52-C168 CarbonylContact O-C 3.52Å; V52-C168 VanDerWaalsContact O-CA 3.28Å; V52-C168 WeakPolarHBondContact O-CA 3.47Å; C53-C168 HydrophobicContact CB-CB 4.13Å; C53-C168 WeakPolarHBondContact CB-SG 3.49Å; C53-C168 WeakPolarHBondContact SG-CB 3.5Å; C53-C168 CovalentContact SG-SG 2.05Å; C53-C168 PolarHBondContact SG-SG 3.34Å; L154-C168 WeakPolarHBondContact CA-O 3.43Å; M155-C168 PolarHBondContact N-O 3.36Å; M155-C168 PolarHBondContact O-N 3.35Å
169	Y	95.1	Very high	93.9	Very high	110 Å²	110	62.2 Å²	62.2	43%	0.431	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.6	-174.3	-62.3	-89.6	0	0	0	111	F51 V52 I153 L154 D167	F51-Y169 WeakPolarHBondContact CD2-O 3.23Å; V52-Y169 PolarHBondContact N-O 3.13Å; V52-Y169 PolarHBondContact O-N 2.76Å; I153-Y169 WeakPolarHBondContact O-CA 3.45Å; L154-Y169 HydrophobicContact CD1-CD1 4.23Å; L154-Y169 HydrophobicContact CD1-CE1 3.85Å; L154-Y169 HydrophobicContact CD1-CE2 4.29Å; D167-Y169 HydrophobicContact CB-CE2 4.22Å
170	I	92.7	Very high	93.7	Very high	10 Å²	10	58.8 Å²	58.8	5%	0.051	30%	0.302	C	S	.	.			trans	-98.1	121.9	176.5	-62.4	158.8	0	0	0	109.5	F51 F69 V151 P152 I153 M155 A173 K176	F51-I170 HydrophobicContact CD2-CG1 4.23Å; F51-I170 HydrophobicContact CE2-CG1 4.17Å; F69-I170 HydrophobicContact CE2-CD1 4.25Å; F69-I170 HydrophobicContact CE2-CG1 4.2Å; F69-I170 HydrophobicContact CZ-CD1 3.7Å; F69-I170 HydrophobicContact CZ-CG1 3.96Å; V151-I170 HydrophobicContact CG1-CD1 4.4Å; P152-I170 VanDerWaalsContact O-CD1 3.23Å; P152-I170 WeakPolarHBondContact O-CD1 3.27Å; I153-I170 PolarHBondContact O-N 3.39Å; I153-I170 VanDerWaalsContact O-N 3.11Å; M155-I170 HydrophobicContact CE-CD1 3.5Å; M155-I170 HydrophobicContact CE-CG1 4.01Å; M155-I170 HydrophobicContact CG-CD1 4.06Å; M155-I170 HydrophobicContact SD-CD1 3.82Å; I170-A173 HydrophobicContact CG2-CB 4.49Å; I170-K176 HydrophobicContact CG2-CD 4.24Å
171	A	90.8	Very high	93.7	Very high	29 Å²	29	55.7 Å²	55.7	24%	0.24	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	148	173	0	0	0	0	0	112.6	D50 A173 K176	D50-A171 HydrophobicContact CB-CB 3.44Å; D50-A171 VanDerWaalsContact CB-CB 3.44Å; A171-A173 PolarHBondContact O-N 3.4Å; A171-A173 VanDerWaalsContact O-N 3.13Å; A171-K176 WeakPolarHBondContact O-CE 3.02Å
172	R	91.2	Very high	93.6	Very high	77 Å²	77	55.7 Å²	55.7	29%	0.291	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	30.2	177.1	-62.5	177.5	-72.1	-93.9	-5.8	113.4	V43 D50 M174 E175 K176	V43-R172 HydrophobicContact CG1-CB 4.47Å; V43-R172 PolarHBondContact O-NE 3.04Å; V43-R172 PolarHBondContact O-NH2 3.11Å; D50-R172 IonicContact OD2-CZ 3.05Å; D50-R172 VanDerWaalsContact OD2-CZ 3.31Å; D50-R172 IonicContact OD2-NH1 2.94Å; D50-R172 PolarHBondContact OD2-NH1 2.87Å; D50-R172 IonicContact OD2-NH2 3.89Å; D50-R172 PolarHBondContact OD2-NH2 3.44Å; R172-M174 PolarHBondContact O-N 2.92Å; R172-M174 VanDerWaalsContact O-N 3.15Å; R172-E175 HydrophobicContact CB-CB 4.26Å; R172-E175 HydrophobicContact CB-CG 4.46Å; R172-E175 VanDerWaalsContact CD-OE2 3.29Å; R172-E175 WeakPolarHBondContact CD-OE2 3.38Å; R172-E175 PolarHBondContact O-N 3.49Å; R172-K176 WeakPolarHBondContact O-CG 2.81Å; R172-K176 PolarHBondContact O-N 2.9Å
173	A	91.4	Very high	93.5	Very high	6 Å²	6	54.9 Å²	54.9	5%	0.05	27%	0.274	C	S	.	.	H	α-helix	trans	-54.5	-37.1	-176	0	0	0	0	0	113.3	V151 I153 I170 A171 K177	V151-A173 HydrophobicContact CG1-CB 4.28Å; I153-A173 HydrophobicContact CB-CB 4.47Å; I153-A173 HydrophobicContact CG1-CB 3.94Å; I170-A173 HydrophobicContact CG2-CB 4.49Å; A171-A173 PolarHBondContact O-N 3.4Å; A171-A173 VanDerWaalsContact O-N 3.13Å; A173-K177 VanDerWaalsContact O-CB 3.23Å; A173-K177 WeakPolarHBondContact O-CB 3.33Å; A173-K177 PolarHBondContact O-N 3.24Å
174	M	90.9	Very high	93.6	Very high	115 Å²	115	51.5 Å²	51.5	57%	0.567	25%	0.252	S	S	*	.	H	α-helix	trans	-68.6	-40.9	177	-66	-59.9	-71.7	0	0	112.9	R172 K177 I178	R172-M174 PolarHBondContact O-N 2.92Å; R172-M174 VanDerWaalsContact O-N 3.15Å; M174-K177 PolarHBondContact O-N 2.87Å; M174-I178 VanDerWaalsContact O-CG1 3.29Å; M174-I178 WeakPolarHBondContact O-CG1 3.44Å; M174-I178 PolarHBondContact O-N 2.87Å
175	E	92	Very high	93.6	Very high	100 Å²	100	48.7 Å²	48.7	47%	0.467	24%	0.242	S	C	.	.	H	α-helix	trans	-64.9	-44.9	176.2	-63	172.2	-160.5	0	0	110.8	V43 R172 K177 I178 F179	V43-E175 HydrophobicContact CG1-CB 4.42Å; V43-E175 HydrophobicContact CG2-CB 4.25Å; R172-E175 HydrophobicContact CB-CB 4.26Å; R172-E175 HydrophobicContact CB-CG 4.46Å; R172-E175 VanDerWaalsContact CD-OE2 3.29Å; R172-E175 WeakPolarHBondContact CD-OE2 3.38Å; R172-E175 PolarHBondContact O-N 3.49Å; E175-K177 VanDerWaalsContact C-N 3.3Å; E175-K177 PolarHBondContact O-N 3.28Å; E175-I178 PolarHBondContact O-N 3.45Å; E175-F179 PolarHBondContact O-N 3.47Å
176	K	92.3	Very high	93.5	Very high	5 Å²	5	45.2 Å²	45.2	2%	0.022	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-43.4	174.5	-66	-178.1	-174.6	-176	0	111.6	V43 W44 E47 V151 I170 A171 R172 F179 L180	V43-K176 HydrophobicContact CG1-CD 4.46Å; V43-K176 HydrophobicContact CG1-CG 3.44Å; V43-K176 VanDerWaalsContact CG1-CG 3.44Å; W44-K176 HydrophobicContact CH2-CB 3.88Å; W44-K176 HydrophobicContact CH2-CG 3.82Å; W44-K176 HydrophobicContact CZ2-CB 3.84Å; W44-K176 HydrophobicContact CZ2-CD 4.11Å; W44-K176 HydrophobicContact CZ2-CG 3.63Å; W44-K176 HydrophobicContact CZ3-CG 4.48Å; E47-K176 WeakPolarHBondContact OE1-CE 3.42Å; E47-K176 IonicContact OE1-NZ 3.31Å; E47-K176 PolarHBondContact OE1-NZ 3.13Å; V151-K176 HydrophobicContact CG1-CB 4.42Å; V151-K176 HydrophobicContact CG2-CB 4.33Å; I170-K176 HydrophobicContact CG2-CD 4.24Å; A171-K176 WeakPolarHBondContact O-CE 3.02Å; R172-K176 WeakPolarHBondContact O-CG 2.81Å; R172-K176 PolarHBondContact O-N 2.9Å; K176-F179 PolarHBondContact O-N 2.94Å; K176-L180 VanDerWaalsContact O-CB 3.29Å; K176-L180 WeakPolarHBondContact O-CB 3.44Å; K176-L180 PolarHBondContact O-N 2.89Å
177	K	92.4	Very high	93.5	Very high	72 Å²	72	44.8 Å²	44.8	31%	0.313	22%	0.218	S	C	.	.	H	α-helix	trans	-63.2	-45.4	177.8	-176.8	175.1	177.4	178.5	0	111.8	V151 A173 M174 E175 L180 Y181	V151-K177 HydrophobicContact CB-CB 4.38Å; V151-K177 HydrophobicContact CG2-CB 4.48Å; A173-K177 VanDerWaalsContact O-CB 3.23Å; A173-K177 WeakPolarHBondContact O-CB 3.33Å; A173-K177 PolarHBondContact O-N 3.24Å; M174-K177 PolarHBondContact O-N 2.87Å; E175-K177 VanDerWaalsContact C-N 3.3Å; E175-K177 PolarHBondContact O-N 3.28Å; K177-L180 WeakPolarHBondContact O-CB 3.33Å; K177-L180 PolarHBondContact O-N 3.36Å; K177-Y181 HydrophobicContact CD-CE2 4.18Å; K177-Y181 HydrophobicContact CG-CD2 3.89Å; K177-Y181 HydrophobicContact CG-CE2 3.57Å; K177-Y181 WeakPolarHBondContact O-CD2 3.22Å; K177-Y181 PolarHBondContact O-N 3.34Å
178	I	93.1	Very high	93.4	Very high	101 Å²	101	47 Å²	47	52%	0.518	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-48.2	177.5	-69.2	163.5	0	0	0	110.6	M174 E175 L180 Y181 I182	M174-I178 VanDerWaalsContact O-CG1 3.29Å; M174-I178 WeakPolarHBondContact O-CG1 3.44Å; M174-I178 PolarHBondContact O-N 2.87Å; E175-I178 PolarHBondContact O-N 3.45Å; I178-L180 VanDerWaalsContact C-N 3.3Å; I178-L180 PolarHBondContact O-N 2.92Å; I178-Y181 PolarHBondContact O-N 2.92Å; I178-I182 HydrophobicContact CG2-CD1 3.96Å; I178-I182 WeakPolarHBondContact O-CG1 3.16Å; I178-I182 PolarHBondContact O-N 3.06Å
179	F	93.2	Very high	93.3	Very high	5 Å²	5	51.6 Å²	51.6	2%	0.022	25%	0.252	C	S	.	.	H	α-helix	trans	-56.5	-46.5	175.6	172.8	-95.9	0	0	0	111.6	V35 Y36 V39 W44 I74 W77 E175 K176 Y181 I182 M183	V35-F179 HydrophobicContact CG1-CD2 3.79Å; V35-F179 HydrophobicContact CG1-CE2 3.77Å; Y36-F179 HydrophobicContact CD2-CZ 4.35Å; V39-F179 HydrophobicContact CB-CD2 3.67Å; V39-F179 HydrophobicContact CB-CE2 3.93Å; V39-F179 HydrophobicContact CB-CG 4.49Å; V39-F179 HydrophobicContact CG1-CB 4.16Å; V39-F179 HydrophobicContact CG1-CD2 3.69Å; V39-F179 HydrophobicContact CG1-CE2 4.3Å; V39-F179 HydrophobicContact CG1-CG 4.03Å; V39-F179 HydrophobicContact CG2-CD2 3.89Å; V39-F179 HydrophobicContact CG2-CE2 4.39Å; W44-F179 HydrophobicContact CH2-CB 4Å; W44-F179 AromaticContact CH2-CD1 3.32Å; W44-F179 HydrophobicContact CH2-CD1 3.32Å; W44-F179 AromaticContact CH2-CE1 3.99Å; W44-F179 HydrophobicContact CH2-CE1 3.99Å; W44-F179 AromaticContact CH2-CG 3.84Å; W44-F179 HydrophobicContact CH2-CG 3.84Å; W44-F179 HydrophobicContact CZ2-CD1 4.31Å; W44-F179 HydrophobicContact CZ3-CB 4.1Å; W44-F179 AromaticContact CZ3-CD1 3.56Å; W44-F179 HydrophobicContact CZ3-CD1 3.56Å; W44-F179 HydrophobicContact CZ3-CD2 4.45Å; W44-F179 HydrophobicContact CZ3-CE1 4.04Å; W44-F179 AromaticContact CZ3-CG 3.78Å; W44-F179 HydrophobicContact CZ3-CG 3.78Å; I74-F179 HydrophobicContact CD1-CE1 3.97Å; I74-F179 HydrophobicContact CD1-CZ 3.76Å; W77-F179 AromaticContact CD1-CE1 3.99Å; W77-F179 HydrophobicContact CG-CE1 4.48Å; E175-F179 PolarHBondContact O-N 3.47Å; K176-F179 PolarHBondContact O-N 2.94Å; F179-Y181 PolarHBondContact O-N 3.28Å; F179-I182 PolarHBondContact O-N 3.07Å; F179-M183 HydrophobicContact CD1-CG 4.14Å; F179-M183 HydrophobicContact CD2-CG 4.27Å; F179-M183 HydrophobicContact CE1-CG 3.71Å; F179-M183 HydrophobicContact CE2-CG 3.85Å; F179-M183 HydrophobicContact CE2-SD 4.2Å; F179-M183 HydrophobicContact CG-CG 4.42Å; F179-M183 HydrophobicContact CZ-CE 4.3Å; F179-M183 HydrophobicContact CZ-CG 3.57Å; F179-M183 HydrophobicContact CZ-SD 4.08Å; F179-M183 WeakPolarHBondContact O-CG 3.15Å; F179-M183 PolarHBondContact O-N 3.29Å
180	L	93	Very high	93.2	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-58.3	-46.7	179.5	179.9	62.1	0	0	0	111.7	W77 F142 F149 V151 K176 K177 I178 I182 M183 V184	W77-L180 HydrophobicContact CZ2-CD1 3.71Å; F142-L180 HydrophobicContact CD1-CD1 4.28Å; F142-L180 HydrophobicContact CD2-CD1 4.49Å; F142-L180 HydrophobicContact CE1-CD1 3.45Å; F142-L180 VanDerWaalsContact CE1-CD1 3.45Å; F142-L180 HydrophobicContact CE1-CD2 3.74Å; F142-L180 HydrophobicContact CE1-CG 4.18Å; F142-L180 HydrophobicContact CE2-CD1 3.68Å; F142-L180 HydrophobicContact CZ-CD1 3.11Å; F142-L180 HydrophobicContact CZ-CD2 3.77Å; F142-L180 HydrophobicContact CZ-CG 4.07Å; F149-L180 WeakPolarHBondContact O-CD2 3.4Å; V151-L180 HydrophobicContact CG2-CD2 4.16Å; K176-L180 VanDerWaalsContact O-CB 3.29Å; K176-L180 WeakPolarHBondContact O-CB 3.44Å; K176-L180 PolarHBondContact O-N 2.89Å; K177-L180 WeakPolarHBondContact O-CB 3.33Å; K177-L180 PolarHBondContact O-N 3.36Å; I178-L180 VanDerWaalsContact C-N 3.3Å; I178-L180 PolarHBondContact O-N 2.92Å; L180-I182 PolarHBondContact O-N 2.94Å; L180-M183 PolarHBondContact O-N 3.17Å; L180-V184 HydrophobicContact CD1-CG2 4.07Å; L180-V184 HydrophobicContact CG-CG2 4.36Å; L180-V184 WeakPolarHBondContact O-CB 3.34Å; L180-V184 VanDerWaalsContact O-CG2 3.26Å; L180-V184 WeakPolarHBondContact O-CG2 3.46Å; L180-V184 PolarHBondContact O-N 3.33Å
181	Y	93.8	Very high	93.2	Very high	110 Å²	110	47.5 Å²	47.5	43%	0.431	24%	0.238	S	C	.	.	H	α-helix	trans	-62.3	-42.2	176.7	-81.4	-66.7	0	0	0	112.7	K177 I178 F179 M183 V184 C185	K177-Y181 HydrophobicContact CD-CE2 4.18Å; K177-Y181 HydrophobicContact CG-CD2 3.89Å; K177-Y181 HydrophobicContact CG-CE2 3.57Å; K177-Y181 WeakPolarHBondContact O-CD2 3.22Å; K177-Y181 PolarHBondContact O-N 3.34Å; I178-Y181 PolarHBondContact O-N 2.92Å; F179-Y181 PolarHBondContact O-N 3.28Å; Y181-M183 VanDerWaalsContact C-N 3.31Å; Y181-M183 PolarHBondContact O-N 2.9Å; Y181-V184 PolarHBondContact O-N 3.47Å; Y181-C185 VanDerWaalsContact O-CB 3.24Å; Y181-C185 WeakPolarHBondContact O-CB 3.35Å; Y181-C185 PolarHBondContact O-N 3.35Å; Y181-C185 PolarHBondContact O-SG 3.26Å
182	I	94.2	Very high	93.4	Very high	61 Å²	61	48.8 Å²	48.8	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-59.9	-45.2	177	-66.2	167.6	0	0	0	110.1	F31 V35 I178 F179 L180 T186	F31-I182 HydrophobicContact CE1-CG2 3.85Å; F31-I182 HydrophobicContact CZ-CG2 4.16Å; V35-I182 HydrophobicContact CG1-CG2 4.06Å; V35-I182 HydrophobicContact CG2-CG2 4.33Å; I178-I182 HydrophobicContact CG2-CD1 3.96Å; I178-I182 WeakPolarHBondContact O-CG1 3.16Å; I178-I182 PolarHBondContact O-N 3.06Å; F179-I182 PolarHBondContact O-N 3.07Å; L180-I182 PolarHBondContact O-N 2.94Å; I182-T186 HydrophobicContact CG2-CG2 4.47Å; I182-T186 WeakPolarHBondContact O-CB 3.26Å; I182-T186 VanDerWaalsContact O-CG2 3.23Å; I182-T186 WeakPolarHBondContact O-CG2 3.39Å; I182-T186 PolarHBondContact O-N 3.42Å; I182-T186 PolarHBondContact O-OG1 3.42Å
183	M	93.6	Very high	93.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67	-40.5	179.5	-68	-63.5	-77.6	0	0	112.6	R32 V35 W77 L81 F179 L180 Y181 T186 S187	R32-M183 HydrophobicContact CG-SD 4.41Å; V35-M183 HydrophobicContact CG1-SD 4.4Å; W77-M183 HydrophobicContact CB-CE 4.07Å; W77-M183 HydrophobicContact CD2-CB 3.92Å; W77-M183 HydrophobicContact CD2-CE 3.92Å; W77-M183 HydrophobicContact CD2-CG 4.35Å; W77-M183 HydrophobicContact CE3-CB 3.92Å; W77-M183 HydrophobicContact CE3-CE 3.62Å; W77-M183 HydrophobicContact CG-CE 4.12Å; W77-M183 HydrophobicContact CH2-CB 3.73Å; W77-M183 HydrophobicContact CZ2-CB 3.74Å; W77-M183 HydrophobicContact CZ3-CB 3.8Å; W77-M183 HydrophobicContact CZ3-CE 4.37Å; L81-M183 HydrophobicContact CD1-CE 4.4Å; F179-M183 HydrophobicContact CD1-CG 4.14Å; F179-M183 HydrophobicContact CD2-CG 4.27Å; F179-M183 HydrophobicContact CE1-CG 3.71Å; F179-M183 HydrophobicContact CE2-CG 3.85Å; F179-M183 HydrophobicContact CE2-SD 4.2Å; F179-M183 HydrophobicContact CG-CG 4.42Å; F179-M183 HydrophobicContact CZ-CE 4.3Å; F179-M183 HydrophobicContact CZ-CG 3.57Å; F179-M183 HydrophobicContact CZ-SD 4.08Å; F179-M183 WeakPolarHBondContact O-CG 3.15Å; F179-M183 PolarHBondContact O-N 3.29Å; L180-M183 PolarHBondContact O-N 3.17Å; Y181-M183 VanDerWaalsContact C-N 3.31Å; Y181-M183 PolarHBondContact O-N 2.9Å; M183-T186 WeakPolarHBondContact CA-OG1 3.34Å; M183-T186 PolarHBondContact O-OG1 3.09Å; M183-S187 WeakPolarHBondContact O-CB 3.5Å; M183-S187 PolarHBondContact O-N 2.95Å; M183-S187 PolarHBondContact O-OG 2.74Å
184	V	95.1	Very high	93.3	Very high	10 Å²	10	46.8 Å²	46.8	6%	0.061	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-49.1	176.5	171.8	0	0	0	0	111.1	W77 L139 F149 L180 Y181 T186 S187 I188	W77-V184 HydrophobicContact CH2-CG2 3.9Å; W77-V184 HydrophobicContact CZ2-CG2 3.82Å; L139-V184 HydrophobicContact CD2-CG1 4.36Å; L139-V184 HydrophobicContact CD2-CG2 4.27Å; F149-V184 HydrophobicContact CD1-CG1 4.2Å; F149-V184 HydrophobicContact CD1-CG2 3.56Å; F149-V184 HydrophobicContact CE1-CG1 4.07Å; F149-V184 HydrophobicContact CE1-CG2 3.72Å; F149-V184 HydrophobicContact CG-CG2 4.5Å; F149-V184 HydrophobicContact CZ-CG1 4.41Å; L180-V184 HydrophobicContact CD1-CG2 4.07Å; L180-V184 HydrophobicContact CG-CG2 4.36Å; L180-V184 WeakPolarHBondContact O-CB 3.34Å; L180-V184 VanDerWaalsContact O-CG2 3.26Å; L180-V184 WeakPolarHBondContact O-CG2 3.46Å; L180-V184 PolarHBondContact O-N 3.33Å; Y181-V184 PolarHBondContact O-N 3.47Å; V184-T186 PolarHBondContact O-N 3.5Å; V184-S187 WeakPolarHBondContact O-CB 3.25Å; V184-S187 PolarHBondContact O-N 2.92Å; V184-S187 VanDerWaalsContact O-N 3.13Å; V184-I188 HydrophobicContact CG1-CD1 3.9Å; V184-I188 WeakPolarHBondContact O-CG1 3.28Å; V184-I188 PolarHBondContact O-N 3.26Å
185	C	95.4	Very high	93.3	Very high	67 Å²	67	45.1 Å²	45.1	45%	0.453	24%	0.236	S	C	.	.	H	α-helix	trans	-58.8	-46.4	178.8	-72.4	0	0	0	0	111.5	Y181 S187 I188 L189	Y181-C185 VanDerWaalsContact O-CB 3.24Å; Y181-C185 WeakPolarHBondContact O-CB 3.35Å; Y181-C185 PolarHBondContact O-N 3.35Å; Y181-C185 PolarHBondContact O-SG 3.26Å; C185-S187 VanDerWaalsContact C-N 3.32Å; C185-S187 PolarHBondContact O-N 3Å; C185-I188 PolarHBondContact O-N 3.14Å; C185-L189 WeakPolarHBondContact O-CD1 3.45Å; C185-L189 PolarHBondContact O-N 2.71Å
186	T	94.5	Very high	93.2	Very high	12 Å²	12	43.3 Å²	43.3	7%	0.074	23%	0.234	C	C	.	.	H	α-helix	trans	-65.5	-34.1	177	53	0	0	0	0	112.5	V28 F31 R32 I182 M183 V184 L189 C190	V28-T186 HydrophobicContact CG1-CG2 4.4Å; F31-T186 HydrophobicContact CD1-CG2 3.83Å; F31-T186 HydrophobicContact CE1-CG2 3.78Å; R32-T186 WeakPolarHBondContact CD-OG1 3.36Å; R32-T186 HydrophobicContact CG-CG2 4.3Å; R32-T186 VanDerWaalsContact CG-OG1 3.29Å; R32-T186 WeakPolarHBondContact CG-OG1 3.35Å; I182-T186 HydrophobicContact CG2-CG2 4.47Å; I182-T186 WeakPolarHBondContact O-CB 3.26Å; I182-T186 VanDerWaalsContact O-CG2 3.23Å; I182-T186 WeakPolarHBondContact O-CG2 3.39Å; I182-T186 PolarHBondContact O-N 3.42Å; I182-T186 PolarHBondContact O-OG1 3.42Å; M183-T186 WeakPolarHBondContact CA-OG1 3.34Å; M183-T186 PolarHBondContact O-OG1 3.09Å; V184-T186 PolarHBondContact O-N 3.5Å; T186-L189 PolarHBondContact O-N 3.26Å; T186-C190 WeakPolarHBondContact O-CB 3.46Å; T186-C190 PolarHBondContact O-N 3.08Å; T186-C190 PolarHBondContact O-SG 3.02Å; T186-C190 VanDerWaalsContact O-SG 3.36Å
187	S	95	Very high	93	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.2	-42.1	173.6	-57.3	0	0	0	0	112.1	R32 W77 Q80 M183 V184 C185 C190 I191	R32-S187 VanDerWaalsContact CZ-OG 3.27Å; R32-S187 PolarHBondContact NH1-OG 2.97Å; R32-S187 PolarHBondContact NH2-OG 3.31Å; W77-S187 WeakPolarHBondContact CZ3-OG 3.48Å; Q80-S187 PolarHBondContact NE2-OG 3.43Å; M183-S187 WeakPolarHBondContact O-CB 3.5Å; M183-S187 PolarHBondContact O-N 2.95Å; M183-S187 PolarHBondContact O-OG 2.74Å; V184-S187 WeakPolarHBondContact O-CB 3.25Å; V184-S187 PolarHBondContact O-N 2.92Å; V184-S187 VanDerWaalsContact O-N 3.13Å; C185-S187 VanDerWaalsContact C-N 3.32Å; C185-S187 PolarHBondContact O-N 3Å; S187-C190 WeakPolarHBondContact O-CB 3.18Å; S187-C190 PolarHBondContact O-N 3.06Å; S187-I191 WeakPolarHBondContact O-CG1 3.24Å; S187-I191 PolarHBondContact O-N 3.41Å
188	I	95.4	Very high	92.8	Very high	96 Å²	96	41.5 Å²	41.5	49%	0.492	23%	0.228	S	C	.	.	H	α-helix	trans	-62.2	-44.5	174.7	-66.6	167	0	0	0	110.5	L139 V184 C185 C190 I191 A192	L139-I188 HydrophobicContact CD1-CG1 4.39Å; V184-I188 HydrophobicContact CG1-CD1 3.9Å; V184-I188 WeakPolarHBondContact O-CG1 3.28Å; V184-I188 PolarHBondContact O-N 3.26Å; C185-I188 PolarHBondContact O-N 3.14Å; I188-C190 PolarHBondContact O-N 3.27Å; I188-I191 PolarHBondContact O-N 2.9Å; I188-A192 WeakPolarHBondContact O-CB 3.44Å; I188-A192 PolarHBondContact O-N 2.93Å
189	L	94.2	Very high	92.6	Very high	96 Å²	96	41.6 Å²	41.6	50%	0.503	23%	0.229	S	C	.	.	H	α-helix	trans	-57.9	-45.3	172.9	-90.3	143.8	0	0	0	111.8	C185 T186 I191 A192 L193	C185-L189 WeakPolarHBondContact O-CD1 3.45Å; C185-L189 PolarHBondContact O-N 2.71Å; T186-L189 PolarHBondContact O-N 3.26Å; L189-I191 PolarHBondContact O-N 2.97Å; L189-A192 PolarHBondContact O-N 2.87Å; L189-L193 WeakPolarHBondContact O-CB 3.41Å; L189-L193 VanDerWaalsContact O-CG 3.29Å; L189-L193 WeakPolarHBondContact O-CG 3.42Å; L189-L193 PolarHBondContact O-N 2.82Å
190	C	92.6	Very high	92.2	Very high	4 Å²	4	46.3 Å²	46.3	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-59.7	-44.7	174.5	-77.7	0	0	0	0	112.1	V28 T186 S187 I188 L193 N194	V28-C190 VanDerWaalsContact CG1-SG 3.53Å; T186-C190 WeakPolarHBondContact O-CB 3.46Å; T186-C190 PolarHBondContact O-N 3.08Å; T186-C190 PolarHBondContact O-SG 3.02Å; T186-C190 VanDerWaalsContact O-SG 3.36Å; S187-C190 WeakPolarHBondContact O-CB 3.18Å; S187-C190 PolarHBondContact O-N 3.06Å; I188-C190 PolarHBondContact O-N 3.27Å; C190-L193 PolarHBondContact O-N 3.36Å; C190-N194 WeakPolarHBondContact O-CB 3.31Å; C190-N194 PolarHBondContact O-N 3.41Å; C190-N194 PolarHBondContact O-ND2 3.21Å
191	I	94.2	Very high	91.8	Very high	31 Å²	31	46.7 Å²	46.7	16%	0.159	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-47.4	177.8	-69.9	162.7	0	0	0	110.3	T132 E135 V136 L139 S187 I188 L189 L193 N194 L195	T132-I191 HydrophobicContact CG2-CG2 4.44Å; E135-I191 HydrophobicContact CB-CD1 3.93Å; E135-I191 HydrophobicContact CB-CG1 3.59Å; E135-I191 HydrophobicContact CG-CG1 4.39Å; V136-I191 HydrophobicContact CG2-CD1 3.79Å; V136-I191 HydrophobicContact CG2-CG1 4.19Å; V136-I191 HydrophobicContact CG2-CG2 4.31Å; L139-I191 HydrophobicContact CD1-CD1 3.48Å; L139-I191 VanDerWaalsContact CD1-CD1 3.48Å; S187-I191 WeakPolarHBondContact O-CG1 3.24Å; S187-I191 PolarHBondContact O-N 3.41Å; I188-I191 PolarHBondContact O-N 2.9Å; L189-I191 PolarHBondContact O-N 2.97Å; I191-L193 PolarHBondContact O-N 3.34Å; I191-N194 PolarHBondContact O-N 3.48Å; I191-L195 VanDerWaalsContact O-CB 3.24Å; I191-L195 WeakPolarHBondContact O-CB 3.15Å; I191-L195 PolarHBondContact O-N 3.41Å
192	A	93.3	Very high	91.3	Very high	56 Å²	56	44.8 Å²	44.8	46%	0.463	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-43.5	178.7	0	0	0	0	0	112	I188 L189 L195 S196	I188-A192 WeakPolarHBondContact O-CB 3.44Å; I188-A192 PolarHBondContact O-N 2.93Å; L189-A192 PolarHBondContact O-N 2.87Å; A192-L195 PolarHBondContact O-N 3.23Å; A192-S196 VanDerWaalsContact O-CB 3.28Å; A192-S196 WeakPolarHBondContact O-CB 3.45Å; A192-S196 PolarHBondContact O-N 3.48Å; A192-S196 PolarHBondContact O-OG 3.44Å
193	L	90.5	Very high	90.9	Very high	37 Å²	37	49.6 Å²	49.6	19%	0.194	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-47.3	177.2	-72.2	173.6	0	0	0	111.6	W24 L25 L189 C190 I191 L195 S196 E197	W24-L193 HydrophobicContact CB-CD1 4.08Å; L25-L193 HydrophobicContact CD1-CB 4.5Å; L25-L193 HydrophobicContact CD2-CB 3.5Å; L25-L193 VanDerWaalsContact CD2-CB 3.5Å; L25-L193 HydrophobicContact CD2-CD1 4.06Å; L25-L193 HydrophobicContact CD2-CG 4.45Å; L25-L193 HydrophobicContact CG-CB 3.86Å; L25-L193 HydrophobicContact CG-CD1 4.25Å; L189-L193 WeakPolarHBondContact O-CB 3.41Å; L189-L193 VanDerWaalsContact O-CG 3.29Å; L189-L193 WeakPolarHBondContact O-CG 3.42Å; L189-L193 PolarHBondContact O-N 2.82Å; C190-L193 PolarHBondContact O-N 3.36Å; I191-L193 PolarHBondContact O-N 3.34Å; L193-L195 VanDerWaalsContact C-N 3.34Å; L193-L195 PolarHBondContact O-N 2.84Å; L193-S196 PolarHBondContact O-N 3.41Å; L193-S196 PolarHBondContact O-OG 2.9Å; L193-E197 PolarHBondContact O-N 3.47Å
194	N	90.5	Very high	90.4	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-40.8	177	-75.3	-58.3	0	0	0	111.7	C190 I191 E197 L198	C190-N194 WeakPolarHBondContact O-CB 3.31Å; C190-N194 PolarHBondContact O-N 3.41Å; C190-N194 PolarHBondContact O-ND2 3.21Å; I191-N194 PolarHBondContact O-N 3.48Å; N194-E197 PolarHBondContact O-N 2.9Å; N194-L198 WeakPolarHBondContact O-CB 3.38Å; N194-L198 PolarHBondContact O-N 3.43Å
195	L	91.3	Very high	89.6	Confident	80 Å²	80	57.8 Å²	57.8	42%	0.419	30%	0.299	S	S	.	.	H	α-helix	trans	-68.3	-43.3	177.3	-176.2	61.9	0	0	0	111.5	I191 A192 L193 E197 L198 L199	I191-L195 VanDerWaalsContact O-CB 3.24Å; I191-L195 WeakPolarHBondContact O-CB 3.15Å; I191-L195 PolarHBondContact O-N 3.41Å; A192-L195 PolarHBondContact O-N 3.23Å; L193-L195 VanDerWaalsContact C-N 3.34Å; L193-L195 PolarHBondContact O-N 2.84Å; L195-E197 VanDerWaalsContact C-N 3.27Å; L195-E197 PolarHBondContact O-N 2.88Å; L195-L198 PolarHBondContact O-N 3.44Å; L195-L199 HydrophobicContact CD1-CD1 4.38Å; L195-L199 HydrophobicContact CD1-CG 4.23Å; L195-L199 HydrophobicContact CG-CD1 3.98Å; L195-L199 HydrophobicContact CG-CG 4.28Å; L195-L199 WeakPolarHBondContact O-CB 3.32Å; L195-L199 VanDerWaalsContact O-CG 3.22Å; L195-L199 WeakPolarHBondContact O-CG 3.3Å; L195-L199 PolarHBondContact O-N 2.87Å
196	S	89.7	Confident	89.1	Confident	61 Å²	61	58.9 Å²	58.9	43%	0.427	30%	0.3	S	S	.	.	H	α-helix	trans	-61.3	-37.9	176.9	72.2	0	0	0	0	111.9	A192 L193 Y200	A192-S196 VanDerWaalsContact O-CB 3.28Å; A192-S196 WeakPolarHBondContact O-CB 3.45Å; A192-S196 PolarHBondContact O-N 3.48Å; A192-S196 PolarHBondContact O-OG 3.44Å; L193-S196 PolarHBondContact O-N 3.41Å; L193-S196 PolarHBondContact O-OG 2.9Å; S196-Y200 VanDerWaalsContact O-CB 3.31Å; S196-Y200 WeakPolarHBondContact O-CB 3.21Å; S196-Y200 PolarHBondContact O-N 2.85Å
197	E	88.1	Confident	88.5	Confident	6 Å²	6	65.9 Å²	65.9	3%	0.028	33%	0.325	C	S	.	.	H	α-helix	trans	-68	-44.8	174.8	-178.4	164.2	-146.9	0	0	111.8	Y124 L128 L193 N194 L195 L199 Y200 I201	Y124-E197 PolarHBondContact OH-OE1 3.29Å; Y124-E197 PolarHBondContact OH-OE2 3.3Å; L128-E197 HydrophobicContact CD1-CG 4.11Å; L193-E197 PolarHBondContact O-N 3.47Å; N194-E197 PolarHBondContact O-N 2.9Å; L195-E197 VanDerWaalsContact C-N 3.27Å; L195-E197 PolarHBondContact O-N 2.88Å; E197-L199 VanDerWaalsContact C-N 3.34Å; E197-L199 PolarHBondContact O-N 3.46Å; E197-Y200 PolarHBondContact O-N 2.99Å; E197-I201 HydrophobicContact CG-CD1 3.89Å; E197-I201 WeakPolarHBondContact O-CB 3.44Å; E197-I201 VanDerWaalsContact O-CG1 3.28Å; E197-I201 WeakPolarHBondContact O-CG1 3.07Å; E197-I201 PolarHBondContact O-N 3.31Å
198	L	87.8	Confident	87.7	Confident	34 Å²	34	70.8 Å²	70.8	18%	0.178	34%	0.344	C	S	.	.	H	α-helix	trans	-59.2	-46	175.4	-176.4	64	0	0	0	111.1	V125 N194 L195 I201 V202	V125-L198 HydrophobicContact CG1-CD1 4.1Å; N194-L198 WeakPolarHBondContact O-CB 3.38Å; N194-L198 PolarHBondContact O-N 3.43Å; L195-L198 PolarHBondContact O-N 3.44Å; L198-I201 PolarHBondContact O-N 3.1Å; L198-V202 HydrophobicContact CD1-CG2 4.43Å; L198-V202 WeakPolarHBondContact O-CB 3.3Å; L198-V202 VanDerWaalsContact O-CG2 3.25Å; L198-V202 WeakPolarHBondContact O-CG2 3.38Å; L198-V202 PolarHBondContact O-N 3.17Å
199	L	88.4	Confident	86.8	Confident	102 Å²	102	71.2 Å²	71.2	53%	0.534	34%	0.344	S	S	.	.	H	α-helix	trans	-63.7	-45.1	177.6	-70.9	173.4	0	0	0	111.9	L195 E197 I201 V202 W203	L195-L199 HydrophobicContact CD1-CD1 4.38Å; L195-L199 HydrophobicContact CD1-CG 4.23Å; L195-L199 HydrophobicContact CG-CD1 3.98Å; L195-L199 HydrophobicContact CG-CG 4.28Å; L195-L199 WeakPolarHBondContact O-CB 3.32Å; L195-L199 VanDerWaalsContact O-CG 3.22Å; L195-L199 WeakPolarHBondContact O-CG 3.3Å; L195-L199 PolarHBondContact O-N 2.87Å; E197-L199 VanDerWaalsContact C-N 3.34Å; E197-L199 PolarHBondContact O-N 3.46Å; L199-I201 VanDerWaalsContact C-N 3.28Å; L199-I201 PolarHBondContact O-N 2.69Å; L199-V202 PolarHBondContact O-N 3.47Å; L199-W203 WeakPolarHBondContact O-CB 3.25Å; L199-W203 PolarHBondContact O-N 3.34Å
200	Y	86.6	Confident	86.1	Confident	104 Å²	104	73.3 Å²	73.3	41%	0.408	35%	0.349	S	S	.	.	H	α-helix	trans	-57.5	-44	175.9	173	-99.2	0	0	0	111.4	T18 S196 E197 K204	T18-Y200 HydrophobicContact CG2-CD1 4.17Å; T18-Y200 HydrophobicContact CG2-CE1 3.54Å; S196-Y200 VanDerWaalsContact O-CB 3.31Å; S196-Y200 WeakPolarHBondContact O-CB 3.21Å; S196-Y200 PolarHBondContact O-N 2.85Å; E197-Y200 PolarHBondContact O-N 2.99Å; Y200-K204 HydrophobicContact CE1-CD 4.24Å; Y200-K204 VanDerWaalsContact O-CB 3.28Å; Y200-K204 WeakPolarHBondContact O-CB 3.25Å; Y200-K204 PolarHBondContact O-N 3.49Å
201	I	82.8	Confident	85.1	Confident	10 Å²	10	76 Å²	76	5%	0.051	37%	0.368	C	S	.	.	H	α-helix	trans	-65.9	-48.8	179.4	-76	170.9	0	0	0	111.5	F121 Y124 V125 L128 E197 L198 L199 W203 K204 Q205	F121-I201 HydrophobicContact CE2-CG2 3.24Å; F121-I201 HydrophobicContact CZ-CG2 3.23Å; Y124-I201 HydrophobicContact CD1-CD1 3.96Å; Y124-I201 HydrophobicContact CE1-CD1 3.56Å; V125-I201 HydrophobicContact CG2-CG2 4.33Å; L128-I201 HydrophobicContact CD1-CD1 4.31Å; E197-I201 HydrophobicContact CG-CD1 3.89Å; E197-I201 WeakPolarHBondContact O-CB 3.44Å; E197-I201 VanDerWaalsContact O-CG1 3.28Å; E197-I201 WeakPolarHBondContact O-CG1 3.07Å; E197-I201 PolarHBondContact O-N 3.31Å; L198-I201 PolarHBondContact O-N 3.1Å; L199-I201 VanDerWaalsContact C-N 3.28Å; L199-I201 PolarHBondContact O-N 2.69Å; I201-W203 VanDerWaalsContact C-N 3.35Å; I201-K204 PolarHBondContact O-N 3.11Å; I201-Q205 WeakPolarHBondContact O-CB 3.28Å; I201-Q205 PolarHBondContact O-N 2.97Å
202	V	84.1	Confident	83.5	Confident	70 Å²	70	84.7 Å²	84.7	42%	0.424	40%	0.399	S	S	.	.	H	α-helix	trans	-61.1	-46.2	178.3	170.4	0	0	0	0	110.1	L198 L199 K204 Q205 L206	L198-V202 HydrophobicContact CD1-CG2 4.43Å; L198-V202 WeakPolarHBondContact O-CB 3.3Å; L198-V202 VanDerWaalsContact O-CG2 3.25Å; L198-V202 WeakPolarHBondContact O-CG2 3.38Å; L198-V202 PolarHBondContact O-N 3.17Å; L199-V202 PolarHBondContact O-N 3.47Å; V202-K204 PolarHBondContact O-N 2.78Å; V202-Q205 PolarHBondContact O-N 3.43Å; V202-L206 HydrophobicContact CG1-CD1 3.85Å; V202-L206 HydrophobicContact CG1-CG 4.32Å; V202-L206 WeakPolarHBondContact O-CB 3.47Å; V202-L206 VanDerWaalsContact O-CG 3.3Å; V202-L206 WeakPolarHBondContact O-CG 3.16Å; V202-L206 PolarHBondContact O-N 3.24Å
203	W	85.4	Confident	81.9	Confident	161 Å²	161	91.6 Å²	91.6	61%	0.61	41%	0.413	S	S	*	.	H	α-helix	trans	-58.6	-48.4	177.1	-175.4	-101.2	0	0	0	112.2	L199 I201 Q205 L206 W207	L199-W203 WeakPolarHBondContact O-CB 3.25Å; L199-W203 PolarHBondContact O-N 3.34Å; I201-W203 VanDerWaalsContact C-N 3.35Å; W203-Q205 VanDerWaalsContact C-N 3.28Å; W203-Q205 PolarHBondContact O-N 3.11Å; W203-L206 PolarHBondContact O-N 3.27Å; W203-W207 AromaticContact CD1-CE3 3.96Å; W203-W207 AromaticContact CE2-CE3 3.93Å; W203-W207 HydrophobicContact CZ2-CE3 4.29Å; W203-W207 HydrophobicContact CZ2-CZ3 4.25Å; W203-W207 AromaticContact NE1-CE3 3.22Å; W203-W207 AromaticContact NE1-CZ3 3.42Å; W203-W207 WeakPolarHBondContact O-CB 3.43Å; W203-W207 PolarHBondContact O-N 2.76Å
204	K	82.7	Confident	80	Confident	95 Å²	95	99.4 Å²	99.4	41%	0.413	44%	0.441	S	S	.	.	H	α-helix	trans	-61.5	-36.8	176.7	-175.2	175	-175.3	172.8	0	112.2	Y200 I201 V202 R208	Y200-K204 HydrophobicContact CE1-CD 4.24Å; Y200-K204 VanDerWaalsContact O-CB 3.28Å; Y200-K204 WeakPolarHBondContact O-CB 3.25Å; Y200-K204 PolarHBondContact O-N 3.49Å; I201-K204 PolarHBondContact O-N 3.11Å; V202-K204 PolarHBondContact O-N 2.78Å; K204-R208 WeakPolarHBondContact O-CB 3.35Å; K204-R208 WeakPolarHBondContact O-CG 3.25Å; K204-R208 PolarHBondContact O-N 3.32Å; K204-R208 VanDerWaalsContact O-N 3.08Å
205	Q	79.6	Confident	78.1	Confident	87 Å²	87	103.2 Å²	103.2	41%	0.407	46%	0.464	S	S	.	.	H	α-helix	trans	-69.6	-44.9	177.6	-162.5	74.6	-5.6	0	0	111.5	I201 V202 W203 R208 H209	I201-Q205 WeakPolarHBondContact O-CB 3.28Å; I201-Q205 PolarHBondContact O-N 2.97Å; V202-Q205 PolarHBondContact O-N 3.43Å; W203-Q205 VanDerWaalsContact C-N 3.28Å; W203-Q205 PolarHBondContact O-N 3.11Å; Q205-R208 PolarHBondContact O-N 3.13Å; Q205-H209 PolarHBondContact O-N 3.47Å
206	L	84.1	Confident	76.1	Confident	90 Å²	90	103.4 Å²	103.4	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-60.8	-47.8	175.6	-71	172.1	0	0	0	110.9	V202 W203 R208 H209 F210	V202-L206 HydrophobicContact CG1-CD1 3.85Å; V202-L206 HydrophobicContact CG1-CG 4.32Å; V202-L206 WeakPolarHBondContact O-CB 3.47Å; V202-L206 VanDerWaalsContact O-CG 3.3Å; V202-L206 WeakPolarHBondContact O-CG 3.16Å; V202-L206 PolarHBondContact O-N 3.24Å; W203-L206 PolarHBondContact O-N 3.27Å; L206-R208 PolarHBondContact O-N 3.16Å; L206-H209 WeakPolarHBondContact O-CB 3.32Å; L206-H209 PolarHBondContact O-N 3.07Å; L206-H209 VanDerWaalsContact O-N 3.08Å; L206-F210 WeakPolarHBondContact O-CD2 3.44Å; L206-F210 PolarHBondContact O-N 3.22Å
207	W	82.7	Confident	74.5	Confident	160 Å²	160	105.4 Å²	105.4	61%	0.606	48%	0.479	S	S	*	.	H	α-helix	trans	-60.2	-44.9	178	-157.2	-33	0	0	0	111.4	W203 H209 F210 S211	W203-W207 AromaticContact CD1-CE3 3.96Å; W203-W207 AromaticContact CE2-CE3 3.93Å; W203-W207 HydrophobicContact CZ2-CE3 4.29Å; W203-W207 HydrophobicContact CZ2-CZ3 4.25Å; W203-W207 AromaticContact NE1-CE3 3.22Å; W203-W207 AromaticContact NE1-CZ3 3.42Å; W203-W207 WeakPolarHBondContact O-CB 3.43Å; W203-W207 PolarHBondContact O-N 2.76Å; W207-H209 VanDerWaalsContact C-N 3.28Å; W207-H209 PolarHBondContact O-N 3.03Å; W207-F210 PolarHBondContact O-N 3.15Å; W207-S211 VanDerWaalsContact CD1-OG 3.28Å; W207-S211 WeakPolarHBondContact O-CB 3.49Å; W207-S211 PolarHBondContact O-N 3.25Å; W207-S211 PolarHBondContact O-OG 3.46Å
208	R	78.1	Confident	72.7	Confident	103 Å²	103	111.7 Å²	111.7	39%	0.389	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-36.4	175	-75.3	-169	-66	-167.6	1.4	112.8	K204 Q205 L206 R212	K204-R208 WeakPolarHBondContact O-CB 3.35Å; K204-R208 WeakPolarHBondContact O-CG 3.25Å; K204-R208 PolarHBondContact O-N 3.32Å; K204-R208 VanDerWaalsContact O-N 3.08Å; Q205-R208 PolarHBondContact O-N 3.13Å; L206-R208 PolarHBondContact O-N 3.16Å; R208-R212 WeakPolarHBondContact O-CB 3.45Å; R208-R212 WeakPolarHBondContact O-CG 3.22Å; R208-R212 PolarHBondContact O-N 3.27Å; R208-R212 VanDerWaalsContact O-N 3.15Å
209	H	76.2	Confident	71	Confident	105 Å²	105	117.2 Å²	117.2	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-70	-43.3	176.2	-164.2	79.2	0	0	0	111.8	Q205 L206 W207 R212 R213	Q205-H209 PolarHBondContact O-N 3.47Å; L206-H209 WeakPolarHBondContact O-CB 3.32Å; L206-H209 PolarHBondContact O-N 3.07Å; L206-H209 VanDerWaalsContact O-N 3.08Å; W207-H209 VanDerWaalsContact C-N 3.28Å; W207-H209 PolarHBondContact O-N 3.03Å; H209-R212 PolarHBondContact O-N 3.09Å; H209-R213 PolarHBondContact O-N 3.03Å
210	F	79.4	Confident	69.1	Low	140 Å²	140	118.8 Å²	118.8	61%	0.614	54%	0.539	S	S	*	.	H	α-helix	trans	-64.4	-47.5	175.8	-89.7	-78.1	0	0	0	112.3	L206 W207 R212 R213 Y214	L206-F210 WeakPolarHBondContact O-CD2 3.44Å; L206-F210 PolarHBondContact O-N 3.22Å; W207-F210 PolarHBondContact O-N 3.15Å; F210-R212 VanDerWaalsContact C-N 3.29Å; F210-R212 PolarHBondContact O-N 3.03Å; F210-R213 CarbonylContact O-C 3.59Å; F210-R213 PolarHBondContact O-N 3.41Å; F210-Y214 WeakPolarHBondContact O-CB 3.48Å; F210-Y214 PolarHBondContact O-N 3.19Å
211	S	71.1	Confident	67.5	Low	61 Å²	61	118.9 Å²	118.9	43%	0.427	55%	0.545	S	S	.	.	H	α-helix	trans	-64.6	-29.7	177.2	-68.6	0	0	0	0	113.2	W207 Y214 V215	W207-S211 VanDerWaalsContact CD1-OG 3.28Å; W207-S211 WeakPolarHBondContact O-CB 3.49Å; W207-S211 PolarHBondContact O-N 3.25Å; W207-S211 PolarHBondContact O-OG 3.46Å; S211-Y214 PolarHBondContact O-N 3.04Å; S211-V215 PolarHBondContact O-N 3.33Å
212	R	61.9	Low	66.3	Low	212 Å²	212	124.1 Å²	124.1	80%	0.8	57%	0.573	S	S	*	*	H	α-helix	trans	-69.5	-32	170.8	-83.4	-173.7	-174.9	-166.2	1.8	113	R208 H209 F210 Y214	R208-R212 WeakPolarHBondContact O-CB 3.45Å; R208-R212 WeakPolarHBondContact O-CG 3.22Å; R208-R212 PolarHBondContact O-N 3.27Å; R208-R212 VanDerWaalsContact O-N 3.15Å; H209-R212 PolarHBondContact O-N 3.09Å; F210-R212 VanDerWaalsContact C-N 3.29Å; F210-R212 PolarHBondContact O-N 3.03Å; R212-Y214 VanDerWaalsContact C-N 3.32Å
213	R	59.3	Low	64.7	Low	201 Å²	201	128.7 Å²	128.7	76%	0.758	59%	0.586	S	S	*	*	H	α-helix	trans	-76.1	-20.2	171.6	-73.4	-165.4	-173.3	-170.3	1.1	113.2	H209 F210	H209-R213 PolarHBondContact O-N 3.03Å; F210-R213 CarbonylContact O-C 3.59Å; F210-R213 PolarHBondContact O-N 3.41Å
214	Y	50.6	Low	63.1	Low	202 Å²	202	126.1 Å²	126.1	79%	0.792	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	5.1	-177	-147.5	-91.8	0	0	0	114	F210 S211 R212 P216	F210-Y214 WeakPolarHBondContact O-CB 3.48Å; F210-Y214 PolarHBondContact O-N 3.19Å; S211-Y214 PolarHBondContact O-N 3.04Å; R212-Y214 VanDerWaalsContact C-N 3.32Å; Y214-P216 WeakPolarHBondContact O-CD 3.28Å; Y214-P216 VanDerWaalsContact O-N 3.07Å
215	V	51.3	Low	61.7	Low	84 Å²	84	124.8 Å²	124.8	51%	0.509	59%	0.587	S	S	.	*			trans	-62.5	113.7	170.8	178.1	0	0	0	0	107.4	S211	S211-V215 PolarHBondContact O-N 3.33Å
216	P	48.4	Very low	60.3	Low	84 Å²	84	127.3 Å²	127.3	55%	0.545	60%	0.599	S	S	.	*			trans	-70.3	153.8	178.1	29.8	-28.9	0	0	0	108.9	Y214 E218	Y214-P216 WeakPolarHBondContact O-CD 3.28Å; Y214-P216 VanDerWaalsContact O-N 3.07Å; P216-E218 PolarHBondContact O-N 2.92Å
217	V	55.6	Low	58.6	Low	102 Å²	102	128.9 Å²	128.9	62%	0.618	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48	-4.1	178.9	171.7	0	0	0	0	115.3	Q219 Q220 I221	V217-Q219 PolarHBondContact O-N 3.31Å; V217-Q220 PolarHBondContact O-N 3.49Å; V217-I221 HydrophobicContact CG1-CD1 4.24Å; V217-I221 HydrophobicContact CG1-CG1 4.41Å; V217-I221 PolarHBondContact O-N 2.97Å
218	E	50.2	Low	56.8	Low	138 Å²	138	127.9 Å²	127.9	65%	0.645	61%	0.609	S	S	*	*	H	α-helix	trans	-65.3	-33.8	-174.5	-133.3	178.6	146.5	0	0	114.7	P216 I221 L222	P216-E218 PolarHBondContact O-N 2.92Å; E218-I221 PolarHBondContact O-N 3.45Å; E218-L222 PolarHBondContact O-N 3.47Å
219	Q	52.1	Low	55.3	Low	150 Å²	150	127.1 Å²	127.1	70%	0.701	62%	0.616	S	S	*	*	H	α-helix	trans	-74.8	-25	176.6	-78.5	-172.3	-13.4	0	0	113.4	V217 K223	V217-Q219 PolarHBondContact O-N 3.31Å; Q219-K223 VanDerWaalsContact O-CB 3.3Å; Q219-K223 WeakPolarHBondContact O-CB 3.49Å; Q219-K223 PolarHBondContact O-N 3.32Å
220	Q	48.5	Very low	53.6	Low	136 Å²	136	126.6 Å²	126.6	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-73.7	-34.2	174.2	-99.7	159.9	-44.2	0	0	111.6	V217 N224	V217-Q220 PolarHBondContact O-N 3.49Å; Q220-N224 VanDerWaalsContact O-CB 3.25Å; Q220-N224 WeakPolarHBondContact O-CB 3.5Å; Q220-N224 VanDerWaalsContact O-CG 3.23Å; Q220-N224 PolarHBondContact O-N 3.22Å
221	I	54.3	Low	51.7	Low	105 Å²	105	126 Å²	126	54%	0.538	63%	0.627	S	S	.	*	H	α-helix	trans	-68.2	-45.8	176.9	-61.9	171.9	0	0	0	110.8	V217 E218 K223 N224 S225	V217-I221 HydrophobicContact CG1-CD1 4.24Å; V217-I221 HydrophobicContact CG1-CG1 4.41Å; V217-I221 PolarHBondContact O-N 2.97Å; E218-I221 PolarHBondContact O-N 3.45Å; I221-K223 VanDerWaalsContact C-N 3.33Å; I221-K223 PolarHBondContact O-N 3.4Å; I221-N224 PolarHBondContact O-N 3.47Å; I221-S225 WeakPolarHBondContact O-CB 3.42Å; I221-S225 PolarHBondContact O-N 3.44Å; I221-S225 PolarHBondContact O-OG 2.95Å
222	L	57.6	Low	50.1	Low	121 Å²	121	128.9 Å²	128.9	63%	0.634	64%	0.638	S	S	*	*	H	α-helix	trans	-65.1	-34.2	176.8	-97.4	152.7	0	0	0	113.3	E218 Q226	E218-L222 PolarHBondContact O-N 3.47Å; L222-Q226 WeakPolarHBondContact O-CG 3.48Å; L222-Q226 PolarHBondContact O-N 3.26Å; L222-Q226 VanDerWaalsContact O-N 3.16Å
223	K	50.3	Low	48.9	Very low	165 Å²	165	127.8 Å²	127.8	72%	0.717	64%	0.639	S	S	*	*	H	α-helix	trans	-76.5	-34	177.5	-150.9	174.5	-172.2	-176.6	0	112.3	Q219 I221 L227	Q219-K223 VanDerWaalsContact O-CB 3.3Å; Q219-K223 WeakPolarHBondContact O-CB 3.49Å; Q219-K223 PolarHBondContact O-N 3.32Å; I221-K223 VanDerWaalsContact C-N 3.33Å; I221-K223 PolarHBondContact O-N 3.4Å; K223-L227 PolarHBondContact O-N 2.93Å
224	N	50.9	Low	47.8	Very low	108 Å²	108	121.1 Å²	121.1	58%	0.578	63%	0.633	S	S	*	*	H	α-helix	trans	-72.6	-36.5	172.1	-75.7	-0.4	0	0	0	112.2	Q220 I221 L227 H228	Q220-N224 VanDerWaalsContact O-CB 3.25Å; Q220-N224 WeakPolarHBondContact O-CB 3.5Å; Q220-N224 VanDerWaalsContact O-CG 3.23Å; Q220-N224 PolarHBondContact O-N 3.22Å; I221-N224 PolarHBondContact O-N 3.47Å; N224-L227 PolarHBondContact O-N 3.23Å; N224-H228 PolarHBondContact O-N 3.49Å
225	S	53.1	Low	46.7	Very low	66 Å²	66	120 Å²	120	46%	0.462	63%	0.633	S	S	.	*	H	α-helix	trans	-65.5	-35.9	173.4	-79.9	0	0	0	0	112.8	I221 L227 H228 V229	I221-S225 WeakPolarHBondContact O-CB 3.42Å; I221-S225 PolarHBondContact O-N 3.44Å; I221-S225 PolarHBondContact O-OG 2.95Å; S225-L227 VanDerWaalsContact C-N 3.33Å; S225-H228 PolarHBondContact O-N 3.15Å; S225-V229 VanDerWaalsContact O-CG2 3.25Å; S225-V229 WeakPolarHBondContact O-CG2 3.34Å; S225-V229 PolarHBondContact O-N 3.07Å; S225-V229 VanDerWaalsContact O-N 3.11Å
226	Q	51.1	Low	45.4	Very low	140 Å²	140	122.2 Å²	122.2	65%	0.654	65%	0.646	S	S	*	*	H	α-helix	trans	-68.9	-30.7	173.3	-79.3	-83.5	-55.7	0	0	112.7	L222	L222-Q226 WeakPolarHBondContact O-CG 3.48Å; L222-Q226 PolarHBondContact O-N 3.26Å; L222-Q226 VanDerWaalsContact O-N 3.16Å
227	L	48.9	Very low	44.2	Very low	123 Å²	123	123.9 Å²	123.9	64%	0.644	66%	0.66	S	S	*	*	H	α-helix	trans	-71.8	-42.2	174	-144.5	86.2	0	0	0	111.5	K223 N224 S225 V229 S230 D231	K223-L227 PolarHBondContact O-N 2.93Å; N224-L227 PolarHBondContact O-N 3.23Å; S225-L227 VanDerWaalsContact C-N 3.33Å; L227-V229 PolarHBondContact O-N 3.47Å; L227-S230 PolarHBondContact O-N 3.36Å; L227-D231 PolarHBondContact O-N 3.01Å
228	H	43.7	Very low	42.7	Very low	139 Å²	139	124.5 Å²	124.5	64%	0.644	67%	0.669	S	S	*	*	H	α-helix	trans	-68.9	-31	-179.7	-132.6	-75.2	0	0	0	113.2	N224 S225 S230 D232	N224-H228 PolarHBondContact O-N 3.49Å; S225-H228 PolarHBondContact O-N 3.15Å; H228-S230 VanDerWaalsContact C-N 3.3Å; H228-D232 PolarHBondContact O-N 3.04Å
229	V	47.3	Very low	41.5	Very low	88 Å²	88	125.7 Å²	125.7	53%	0.533	67%	0.674	S	S	.	*	H	α-helix	trans	-73.9	-20	175.2	171.3	0	0	0	0	112.5	S225 L227	S225-V229 VanDerWaalsContact O-CG2 3.25Å; S225-V229 WeakPolarHBondContact O-CG2 3.34Å; S225-V229 PolarHBondContact O-N 3.07Å; S225-V229 VanDerWaalsContact O-N 3.11Å; L227-V229 PolarHBondContact O-N 3.47Å
230	S	40.1	Very low	40.1	Very low	94 Å²	94	125.5 Å²	125.5	66%	0.657	67%	0.673	S	S	*	*	H	α-helix	trans	-82.4	-32.1	174.6	-77.3	0	0	0	0	113.4	L227 H228	L227-S230 PolarHBondContact O-N 3.36Å; H228-S230 VanDerWaalsContact C-N 3.3Å
231	D	39.7	Very low	38.9	Very low	127 Å²	127	127.4 Å²	127.4	68%	0.679	69%	0.687	S	S	*	*	H	α-helix	trans	-78.3	-31.3	176.5	-91.3	-48	0	0	0	113.1	L227 K233 G234	L227-D231 PolarHBondContact O-N 3.01Å; D231-K233 PolarHBondContact O-N 3.02Å; D231-G234 PolarHBondContact O-N 3.44Å; D231-G234 VanDerWaalsContact O-N 3.07Å
232	D	38.1	Very low	37.5	Very low	122 Å²	122	129.3 Å²	129.3	65%	0.652	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-10	-178.8	-135.7	-38.7	0	0	0	113.9	H228 G234	H228-D232 PolarHBondContact O-N 3.04Å; D232-G234 VanDerWaalsContact C-N 3.3Å
233	K	36.1	Very low	35.8	Very low	188 Å²	188	129 Å²	129	82%	0.817	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-1.2	169.6	-74.2	-174.3	179.4	176.9	0	113.2	D231	D231-K233 PolarHBondContact O-N 3.02Å
234	G	35	Very low	34.7	Very low	62 Å²	62	127.9 Å²	127.9	64%	0.639	70%	0.7	S	S	*	*	S	Bend	trans	-100.2	-12.3	-172.2	0	0	0	0	0	116.4	D231 D232	D231-G234 PolarHBondContact O-N 3.44Å; D231-G234 VanDerWaalsContact O-N 3.07Å; D232-G234 VanDerWaalsContact C-N 3.3Å
235	F	29.4	Very low	33.5	Very low	179 Å²	179	131 Å²	131	79%	0.785	71%	0.709	S	S	*	*	S	Bend	trans	-160.1	88.7	-171.7	-158	-100.5	0	0	0	113.8
236	T	23.7	Very low	32.2	Very low	129 Å²	129	134.3 Å²	134.3	79%	0.791	73%	0.725	S	S	*	*			trans	168.3	105	130.3	38.9	0	0	0	0	109.4
237	S	22.7	Very low	30.9	Very low	120 Å²	120	133.5 Å²	133.5	84%	0.839	73%	0.734	S	S	*	*				178	88.5	123.3	-156.8	0	0	0	0	108.3
238	S	24.4	Very low	29.8	Very low	114 Å²	114	134 Å²	134	80%	0.797	74%	0.742	S	S	*	*			trans	-93	136.1	158.5	-53.8	0	0	0	0	107.2
239	E	24.2	Very low	29.1	Very low	163 Å²	163	133.1 Å²	133.1	76%	0.762	75%	0.749	S	S	*	*			trans	85	99.4	168.1	-69.3	-176.9	72.6	0	0	118.7
240	Q	22.8	Very low	28.2	Very low	146 Å²	146	138.1 Å²	138.1	68%	0.682	77%	0.766	S	S	*	*				159	100.5	103.8	-81.3	-63.8	-38	0	0	109.6
241	L	24.6	Very low	27.7	Very low	177 Å²	177	139.6 Å²	139.6	93%	0.927	77%	0.773	S	S	*	*				-160.9	105	128.2	-161.6	65.6	0	0	0	110
242	E	23.2	Very low	27.2	Very low	144 Å²	144	138.1 Å²	138.1	67%	0.673	78%	0.779	S	S	*	*			trans	-61.1	158.1	168.8	-166	-179.8	147.8	0	0	112.4
243	N	23.1	Very low	26.7	Very low	116 Å²	116	136.4 Å²	136.4	62%	0.62	78%	0.782	S	S	*	*			trans	93.1	98.5	165.6	-64.6	-44.1	0	0	0	119.1
244	T	25.9	Very low	26.2	Very low	140 Å²	140	135.1 Å²	135.1	86%	0.859	78%	0.784	S	S	*	*				-147.5	111.9	112.7	-67.5	0	0	0	0	109.7
245	K	26	Very low	25.9	Very low	175 Å²	175	140.8 Å²	140.8	76%	0.761	83%	0.825	S	S	*	*			trans	-61.3	133.8	165.6	-74	168.5	178.8	169.8	0	110.3
246	V	25.6	Very low	25.7	Very low	135 Å²	135	138.9 Å²	138.9	82%	0.818	83%	0.827	S	S	*	*				-147.2	105.7	127.6	178	0	0	0	0	107.6
247	C	24.6	Very low	25.8	Very low	122 Å²	122	139.4 Å²	139.4	82%	0.824	83%	0.829	S	S	*	*			trans	-89.2	140.9	160.2	-69.8	0	0	0	0	108.3
248	T	26.5	Very low	26	Very low	134 Å²	134	140.5 Å²	140.5	82%	0.822	83%	0.828	S	S	*	*			trans	-125.8	148.8	143.5	35	0	0	0	0	109.8
249	P	28.5	Very low	26.1	Very low	120 Å²	120	142.1 Å²	142.1	78%	0.779	83%	0.83	S	S	*	*			trans	-103.1	148.7	-159.2	36	-25.8	0	0	0	112.4
250	E	27.7	Very low	26.2	Very low	194 Å²	194	140.8 Å²	140.8	91%	0.907	83%	0.834	S	S	*	*			trans	-140.8	139	146.1	-113.4	179.1	127.2	0	0	109.2
251	P	30.9	Very low	26.4	Very low	124 Å²	124	140.4 Å²	140.4	81%	0.805	84%	0.844	S	S	*	*			trans	-88.8	161.9	-161.7	36.2	-34.3	0	0	0	113.2
252	A	28.8	Very low	26.5	Very low	96 Å²	96	137.8 Å²	137.8	79%	0.793	84%	0.838	S	S	*	*			trans	-74.9	160.4	167.3	0	0	0	0	0	112.8
253	A	26.9	Very low	26.8	Very low	87 Å²	87	137.3 Å²	137.3	72%	0.719	85%	0.851	S	S	*	*			trans	119.8	117.4	138.9	0	0	0	0	0	116.8
254	D	25.9	Very low	27.1	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	87%	0.87	S	S	*	*			trans	45.8	136.7	137.4	-56.5	-32	0	0	0	122.6
255	A	27.9	Very low	27.2	Very low	181 Å²	181	139 Å²	139	100%	1.496	87%	0.871	S	S	*	*			trans	86.9	0	166.7	0	0	0	0	0	118.4

Retrieved 255 of 255 residues in 487.6 ms (Link to these results)

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