A0A060VTP5_ONCMY Loading...

vitamin-K-epoxide reductase (warfarin-sensitive)

AlphaFold DB , UniProt , Accession A0A060VTP5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene vkorc1, Length 169 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	35.9	Very low	58.6	Low	249 Å²	249	106.5 Å²	106.5	100%	1.227	64%	0.641	S	S	*	*				0	94.1	0	-73	170.6	-176.2	0	0	108
2	A	37.5	Very low	61	Low	86 Å²	86	107.3 Å²	107.3	71%	0.711	62%	0.624	S	S	*	*			trans	-108.7	99.1	173.5	0	0	0	0	0	107.5	N4	A2-N4 PolarHBondContact O-N 3.41Å
3	S	43.6	Very low	63.3	Low	113 Å²	113	99.8 Å²	99.8	79%	0.79	58%	0.579	S	S	*	*			trans	-68	76.3	163.7	41.2	0	0	0	0	108.2	S5	S3-S5 PolarHBondContact O-N 3.23Å
4	N	43.4	Very low	65.2	Low	148 Å²	148	95.5 Å²	95.5	79%	0.791	57%	0.567	S	S	*	*			trans	-65.3	87.5	168	-85.2	-7.6	0	0	0	107.8	A2 C6	A2-N4 PolarHBondContact O-N 3.41Å; N4-C6 PolarHBondContact O-N 3.07Å
5	S	45.5	Very low	67	Low	107 Å²	107	100.5 Å²	100.5	75%	0.748	58%	0.579	S	S	*	*			trans	-57.3	103.8	165.8	-71.5	0	0	0	0	107.1	S3 S7	S3-S5 PolarHBondContact O-N 3.23Å; S5-S7 VanDerWaalsContact C-N 3.33Å; S5-S7 PolarHBondContact O-N 3.21Å
6	C	55.4	Low	68.7	Low	49 Å²	49	97.1 Å²	97.1	33%	0.331	56%	0.56	S	S	.	*			trans	-62.3	96.3	174.8	-132.5	0	0	0	0	107.7	N4 G8 V9 L161	N4-C6 PolarHBondContact O-N 3.07Å; C6-G8 PolarHBondContact O-N 3.35Å; C6-V9 HydrophobicContact CB-CG2 4.34Å; C6-V9 PolarHBondContact O-N 3.39Å; C6-L161 VanDerWaalsContact SG-CD2 3.6Å
7	S	62.1	Low	70.2	Confident	116 Å²	116	91.6 Å²	91.6	81%	0.811	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-1.9	-166.8	41.8	0	0	0	0	114.8	S5	S5-S7 VanDerWaalsContact C-N 3.33Å; S5-S7 PolarHBondContact O-N 3.21Å
8	G	70.3	Confident	71.6	Confident	32 Å²	32	91.5 Å²	91.5	33%	0.33	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-14.5	176	0	0	0	0	0	115.9	C6 G160	C6-G8 PolarHBondContact O-N 3.35Å; G8-G160 WeakPolarHBondContact O-CA 3.35Å
9	V	81.4	Confident	72.9	Confident	29 Å²	29	94.1 Å²	94.1	18%	0.176	53%	0.53	C	S	.	.	S	Bend	trans	-87	131.7	-179	-179	0	0	0	0	109.7	C6 K11 E13 R157 L161	C6-V9 HydrophobicContact CB-CG2 4.34Å; C6-V9 PolarHBondContact O-N 3.39Å; V9-K11 PolarHBondContact O-N 3.23Å; V9-E13 HydrophobicContact CG1-CB 4.08Å; V9-E13 HydrophobicContact CG1-CG 4.01Å; V9-R157 HydrophobicContact CG1-CG 4.2Å; V9-R157 HydrophobicContact CG2-CG 4.45Å; V9-L161 HydrophobicContact CG2-CD2 3.73Å; V9-L161 HydrophobicContact CG2-CG 3.84Å
10	P	84.1	Confident	74.1	Confident	36 Å²	36	89.8 Å²	89.8	23%	0.234	51%	0.505	C	S	.	.			trans	-59.3	133.8	179.4	-21.5	31.2	0	0	0	112.3	W12 E13 K156	P10-W12 HydrophobicContact CB-CD2 4.24Å; P10-W12 HydrophobicContact CB-CG 4.26Å; P10-W12 HydrophobicContact CB-CZ2 4.26Å; P10-W12 HydrophobicContact CG-CZ2 4.49Å; P10-W12 PolarHBondContact O-N 2.98Å; P10-W12 VanDerWaalsContact O-N 3.14Å; P10-E13 HydrophobicContact CB-CB 4.4Å; P10-E13 WeakPolarHBondContact O-CB 3.42Å; P10-E13 PolarHBondContact O-N 3.01Å; P10-K156 HydrophobicContact CG-CB 4.32Å
11	K	85.5	Confident	75.2	Confident	207 Å²	207	85.5 Å²	85.5	90%	0.9	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-25.4	-178.1	-65.6	-177.1	179	178.8	0	114	V9 E13	V9-K11 PolarHBondContact O-N 3.23Å; K11-E13 VanDerWaalsContact C-N 3.33Å
12	W	87.9	Confident	78.1	Confident	116 Å²	116	78.2 Å²	78.2	44%	0.439	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-15.5	178.9	57.1	-96.8	0	0	0	113.3	P10 G14 K15 T16 F152	P10-W12 HydrophobicContact CB-CD2 4.24Å; P10-W12 HydrophobicContact CB-CG 4.26Å; P10-W12 HydrophobicContact CB-CZ2 4.26Å; P10-W12 HydrophobicContact CG-CZ2 4.49Å; P10-W12 PolarHBondContact O-N 2.98Å; P10-W12 VanDerWaalsContact O-N 3.14Å; W12-G14 PolarHBondContact O-N 2.86Å; W12-K15 PolarHBondContact O-N 3.15Å; W12-T16 HydrophobicContact CE3-CG2 4.22Å; W12-T16 HydrophobicContact CZ3-CG2 4.04Å; W12-T16 WeakPolarHBondContact O-CB 3.47Å; W12-T16 PolarHBondContact O-N 2.97Å; W12-T16 PolarHBondContact O-OG1 3.47Å; W12-F152 HydrophobicContact CH2-CD1 4.27Å; W12-F152 AromaticContact CH2-CE1 3.85Å; W12-F152 HydrophobicContact CH2-CE1 3.85Å; W12-F152 HydrophobicContact CZ2-CE1 4.44Å
13	E	90.6	Very high	80.9	Confident	9 Å²	9	78 Å²	78	4%	0.042	43%	0.429	C	S	.	.	H	α-helix	trans	-55	-50.7	-172.1	-174.3	-80.6	139.6	0	0	112.7	V9 P10 K11 K15 T16 R17 T153 R157	V9-E13 HydrophobicContact CG1-CB 4.08Å; V9-E13 HydrophobicContact CG1-CG 4.01Å; P10-E13 HydrophobicContact CB-CB 4.4Å; P10-E13 WeakPolarHBondContact O-CB 3.42Å; P10-E13 PolarHBondContact O-N 3.01Å; K11-E13 VanDerWaalsContact C-N 3.33Å; E13-K15 PolarHBondContact O-N 3.41Å; E13-T16 PolarHBondContact O-N 3.36Å; E13-R17 PolarHBondContact O-N 3.07Å; E13-R17 IonicContact OE1-CZ 2.85Å; E13-R17 IonicContact OE1-NE 2.61Å; E13-R17 IonicContact OE1-NH1 3.26Å; E13-R17 PolarHBondContact OE1-NH1 3.3Å; E13-R17 IonicContact OE1-NH2 3.51Å; E13-R17 PolarHBondContact OE1-NH2 3.4Å; E13-R17 IonicContact OE2-NH1 2.85Å; E13-T153 HydrophobicContact CG-CG2 3.83Å; E13-R157 HydrophobicContact CG-CB 4.08Å; E13-R157 IonicContact OE1-NH1 2.76Å; E13-R157 IonicContact OE2-CZ 2.82Å; E13-R157 IonicContact OE2-NH1 3.72Å; E13-R157 PolarHBondContact OE2-NH1 3.01Å
14	G	89.1	Confident	83.4	Confident	40 Å²	40	72.6 Å²	72.6	41%	0.412	39%	0.392	S	S	.	.	H	α-helix	trans	-64.3	-42.4	-178.4	0	0	0	0	0	113.3	W12 L18	W12-G14 PolarHBondContact O-N 2.86Å; G14-L18 WeakPolarHBondContact O-CB 3.18Å; G14-L18 PolarHBondContact O-N 3.19Å
15	K	92.4	Very high	86	Confident	170 Å²	170	67 Å²	67	74%	0.739	36%	0.361	S	S	*	.	H	α-helix	trans	-65.8	-43.5	177.8	-68.5	-174.7	178.6	-176.4	0	111.1	W12 E13 L18 F19	W12-K15 PolarHBondContact O-N 3.15Å; E13-K15 PolarHBondContact O-N 3.41Å; K15-L18 PolarHBondContact O-N 2.94Å; K15-F19 PolarHBondContact O-N 3.21Å
16	T	94.3	Very high	88.4	Confident	46 Å²	46	68.3 Å²	68.3	28%	0.282	35%	0.354	S	S	.	.	H	α-helix	trans	-64.9	-45.6	177.8	-65.2	0	0	0	0	111.6	W12 E13 L18 F19 L20	W12-T16 HydrophobicContact CE3-CG2 4.22Å; W12-T16 HydrophobicContact CZ3-CG2 4.04Å; W12-T16 WeakPolarHBondContact O-CB 3.47Å; W12-T16 PolarHBondContact O-N 2.97Å; W12-T16 PolarHBondContact O-OG1 3.47Å; E13-T16 PolarHBondContact O-N 3.36Å; T16-L18 VanDerWaalsContact C-N 3.33Å; T16-L18 PolarHBondContact O-N 3.24Å; T16-F19 PolarHBondContact O-N 3.38Å; T16-L20 HydrophobicContact CG2-CD1 3.64Å; T16-L20 HydrophobicContact CG2-CG 4.18Å; T16-L20 WeakPolarHBondContact O-CB 3.41Å; T16-L20 WeakPolarHBondContact O-CG 3.49Å; T16-L20 PolarHBondContact O-N 2.98Å
17	R	94.5	Very high	90.3	Very high	5 Å²	5	66.5 Å²	66.5	2%	0.019	34%	0.341	C	S	.	.	H	α-helix	trans	-57.4	-48.3	174.7	-179.3	-174.6	-71.6	118.4	7.1	111	E13 F19 L20 C21 Q96 G100 L150 N154	E13-R17 PolarHBondContact O-N 3.07Å; E13-R17 IonicContact OE1-CZ 2.85Å; E13-R17 IonicContact OE1-NE 2.61Å; E13-R17 IonicContact OE1-NH1 3.26Å; E13-R17 PolarHBondContact OE1-NH1 3.3Å; E13-R17 IonicContact OE1-NH2 3.51Å; E13-R17 PolarHBondContact OE1-NH2 3.4Å; E13-R17 IonicContact OE2-NH1 2.85Å; R17-F19 PolarHBondContact O-N 2.85Å; R17-L20 PolarHBondContact O-N 3.13Å; R17-C21 WeakPolarHBondContact O-CB 3.46Å; R17-C21 PolarHBondContact O-N 3.03Å; R17-C21 PolarHBondContact O-SG 3.35Å; R17-Q96 WeakPolarHBondContact CD-O 3.49Å; R17-G100 PolarHBondContact NH1-O 3.18Å; R17-L150 HydrophobicContact CG-CD2 4.19Å; R17-N154 PolarHBondContact NH2-OD1 3.32Å
18	L	95.2	Very high	91.8	Very high	89 Å²	89	61.2 Å²	61.2	47%	0.466	30%	0.304	S	S	.	.	H	α-helix	trans	-57.3	-50.5	-178.2	-179.6	63.7	0	0	0	111	G14 K15 T16 C21 I22 L97	G14-L18 WeakPolarHBondContact O-CB 3.18Å; G14-L18 PolarHBondContact O-N 3.19Å; K15-L18 PolarHBondContact O-N 2.94Å; T16-L18 VanDerWaalsContact C-N 3.33Å; T16-L18 PolarHBondContact O-N 3.24Å; L18-C21 PolarHBondContact O-N 2.94Å; L18-I22 HydrophobicContact CD1-CD1 3.73Å; L18-I22 HydrophobicContact CD1-CG1 4.24Å; L18-I22 HydrophobicContact CG-CD1 3.87Å; L18-I22 WeakPolarHBondContact O-CB 3.46Å; L18-I22 VanDerWaalsContact O-CG1 3.31Å; L18-I22 WeakPolarHBondContact O-CG1 3.02Å; L18-I22 PolarHBondContact O-N 3.13Å; L18-L97 HydrophobicContact CD1-CD2 3.85Å
19	F	96.7	Very high	93	Very high	141 Å²	141	65.2 Å²	65.2	62%	0.618	31%	0.313	S	S	*	.	H	α-helix	trans	-58.5	-50.7	177.4	176.4	-98.1	0	0	0	112	K15 T16 R17 C21 I22 F23	K15-F19 PolarHBondContact O-N 3.21Å; T16-F19 PolarHBondContact O-N 3.38Å; R17-F19 PolarHBondContact O-N 2.85Å; F19-C21 VanDerWaalsContact C-N 3.34Å; F19-C21 PolarHBondContact O-N 3.26Å; F19-I22 PolarHBondContact O-N 3.26Å; F19-F23 VanDerWaalsContact O-CB 3.3Å; F19-F23 WeakPolarHBondContact O-CB 3.31Å; F19-F23 PolarHBondContact O-N 2.93Å
20	L	96.7	Very high	93.6	Very high	8 Å²	8	65.6 Å²	65.6	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-40.5	-178.8	-71	172.8	0	0	0	112.5	T16 R17 G24 V146 L149 L150	T16-L20 HydrophobicContact CG2-CD1 3.64Å; T16-L20 HydrophobicContact CG2-CG 4.18Å; T16-L20 WeakPolarHBondContact O-CB 3.41Å; T16-L20 WeakPolarHBondContact O-CG 3.49Å; T16-L20 PolarHBondContact O-N 2.98Å; R17-L20 PolarHBondContact O-N 3.13Å; L20-G24 PolarHBondContact O-N 3.18Å; L20-V146 HydrophobicContact CB-CG1 4.34Å; L20-V146 HydrophobicContact CD2-CG1 4.47Å; L20-V146 WeakPolarHBondContact O-CG1 3.36Å; L20-L149 HydrophobicContact CD1-CB 3.66Å; L20-L149 HydrophobicContact CD2-CB 3.9Å; L20-L149 HydrophobicContact CD2-CD1 3.83Å; L20-L149 HydrophobicContact CG-CB 4.46Å; L20-L150 HydrophobicContact CB-CD2 3.74Å; L20-L150 HydrophobicContact CB-CG 3.94Å; L20-L150 HydrophobicContact CD1-CD2 3.96Å; L20-L150 HydrophobicContact CD1-CG 4.06Å
21	C	96.3	Very high	93.9	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-73.3	-39.9	179.7	-63.4	0	0	0	0	112.3	R17 L18 F19 F23 G24 L25 L97	R17-C21 WeakPolarHBondContact O-CB 3.46Å; R17-C21 PolarHBondContact O-N 3.03Å; R17-C21 PolarHBondContact O-SG 3.35Å; L18-C21 PolarHBondContact O-N 2.94Å; F19-C21 VanDerWaalsContact C-N 3.34Å; F19-C21 PolarHBondContact O-N 3.26Å; C21-F23 VanDerWaalsContact C-N 3.33Å; C21-G24 PolarHBondContact O-N 2.78Å; C21-L25 WeakPolarHBondContact O-CB 3.47Å; C21-L25 VanDerWaalsContact O-CG 3.28Å; C21-L25 WeakPolarHBondContact O-CG 3.37Å; C21-L25 PolarHBondContact O-N 2.94Å; C21-L97 HydrophobicContact CB-CD1 3.75Å; C21-L97 HydrophobicContact CB-CD2 3.54Å; C21-L97 HydrophobicContact CB-CG 3.38Å
22	I	97	Very high	94.1	Very high	96 Å²	96	55.8 Å²	55.8	49%	0.492	27%	0.267	S	S	.	.	H	α-helix	trans	-62	-45.6	174.6	-70.8	172	0	0	0	109.9	L18 F19 L25 F26	L18-I22 HydrophobicContact CD1-CD1 3.73Å; L18-I22 HydrophobicContact CD1-CG1 4.24Å; L18-I22 HydrophobicContact CG-CD1 3.87Å; L18-I22 WeakPolarHBondContact O-CB 3.46Å; L18-I22 VanDerWaalsContact O-CG1 3.31Å; L18-I22 WeakPolarHBondContact O-CG1 3.02Å; L18-I22 PolarHBondContact O-N 3.13Å; F19-I22 PolarHBondContact O-N 3.26Å; I22-L25 PolarHBondContact O-N 3.35Å; I22-F26 PolarHBondContact O-N 3.29Å
23	F	97.3	Very high	94.3	Very high	81 Å²	81	55.1 Å²	55.1	36%	0.355	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-43.3	177.6	-174	-115.4	0	0	0	111.8	F19 C21 L25 F26 L27 V146	F19-F23 VanDerWaalsContact O-CB 3.3Å; F19-F23 WeakPolarHBondContact O-CB 3.31Å; F19-F23 PolarHBondContact O-N 2.93Å; C21-F23 VanDerWaalsContact C-N 3.33Å; F23-L25 PolarHBondContact O-N 3.14Å; F23-F26 WeakPolarHBondContact O-CB 3.41Å; F23-F26 PolarHBondContact O-N 3.45Å; F23-L27 HydrophobicContact CD1-CD1 4.08Å; F23-L27 HydrophobicContact CE1-CD1 3.67Å; F23-L27 HydrophobicContact CE1-CG 4.3Å; F23-L27 HydrophobicContact CZ-CD1 4.05Å; F23-L27 HydrophobicContact CZ-CD2 4.25Å; F23-L27 HydrophobicContact CZ-CG 4.27Å; F23-L27 WeakPolarHBondContact O-CG 3.22Å; F23-L27 PolarHBondContact O-N 2.92Å; F23-V146 HydrophobicContact CD1-CG2 3.53Å; F23-V146 HydrophobicContact CE1-CG2 3.88Å
24	G	96.7	Very high	94.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-39.3	174.2	0	0	0	0	0	113.7	L20 C21 L27 S28 Y93	L20-G24 PolarHBondContact O-N 3.18Å; C21-G24 PolarHBondContact O-N 2.78Å; G24-L27 PolarHBondContact O-N 2.88Å; G24-S28 WeakPolarHBondContact O-CB 3.5Å; G24-S28 PolarHBondContact O-N 2.74Å; G24-S28 PolarHBondContact O-OG 3.34Å; G24-Y93 VanDerWaalsContact CA-CE2 3.46Å; G24-Y93 WeakPolarHBondContact O-CD2 3.49Å; G24-Y93 WeakPolarHBondContact O-CE2 3.42Å
25	L	96.6	Very high	94.2	Very high	29 Å²	29	52.9 Å²	52.9	15%	0.152	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-46.1	173.2	-78.2	170.3	0	0	0	111	C21 I22 F23 L27 S28 F29 I90 L97	C21-L25 WeakPolarHBondContact O-CB 3.47Å; C21-L25 VanDerWaalsContact O-CG 3.28Å; C21-L25 WeakPolarHBondContact O-CG 3.37Å; C21-L25 PolarHBondContact O-N 2.94Å; I22-L25 PolarHBondContact O-N 3.35Å; F23-L25 PolarHBondContact O-N 3.14Å; L25-L27 PolarHBondContact O-N 2.96Å; L25-S28 PolarHBondContact O-N 3.47Å; L25-F29 HydrophobicContact CB-CD2 4.45Å; L25-F29 HydrophobicContact CD2-CE2 4.4Å; L25-F29 WeakPolarHBondContact O-CD2 3.45Å; L25-F29 PolarHBondContact O-N 2.9Å; L25-I90 HydrophobicContact CD2-CB 4.47Å; L25-I90 HydrophobicContact CD2-CG2 4.11Å; L25-L97 HydrophobicContact CD1-CD1 3.96Å
26	F	96.8	Very high	94	Very high	135 Å²	135	47.7 Å²	47.7	59%	0.592	23%	0.227	S	C	*	.	H	α-helix	trans	-57.6	-48	176.7	177	-96.7	0	0	0	111.7	I22 F23 S28 F29 Y30	I22-F26 PolarHBondContact O-N 3.29Å; F23-F26 WeakPolarHBondContact O-CB 3.41Å; F23-F26 PolarHBondContact O-N 3.45Å; F26-S28 VanDerWaalsContact C-N 3.34Å; F26-S28 PolarHBondContact O-N 3.01Å; F26-F29 PolarHBondContact O-N 3.43Å; F26-Y30 WeakPolarHBondContact O-CB 3.49Å; F26-Y30 PolarHBondContact O-N 3.44Å
27	L	94.6	Very high	93.7	Very high	12 Å²	12	46.6 Å²	46.6	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-42.5	176.1	-67.5	176.1	0	0	0	112.1	F23 G24 L25 Y30 A31 V139 V146	F23-L27 HydrophobicContact CD1-CD1 4.08Å; F23-L27 HydrophobicContact CE1-CD1 3.67Å; F23-L27 HydrophobicContact CE1-CG 4.3Å; F23-L27 HydrophobicContact CZ-CD1 4.05Å; F23-L27 HydrophobicContact CZ-CD2 4.25Å; F23-L27 HydrophobicContact CZ-CG 4.27Å; F23-L27 WeakPolarHBondContact O-CG 3.22Å; F23-L27 PolarHBondContact O-N 2.92Å; G24-L27 PolarHBondContact O-N 2.88Å; L25-L27 PolarHBondContact O-N 2.96Å; L27-Y30 PolarHBondContact O-N 3.29Å; L27-A31 WeakPolarHBondContact O-CB 3.35Å; L27-A31 PolarHBondContact O-N 3.41Å; L27-V139 HydrophobicContact CB-CG1 4.42Å; L27-V139 HydrophobicContact CD2-CG1 4.34Å; L27-V146 HydrophobicContact CD1-CG2 4.46Å
28	S	94.6	Very high	93.2	Very high	5 Å²	5	49.7 Å²	49.7	4%	0.035	23%	0.233	C	C	.	.	H	α-helix	trans	-66	-43.4	179.2	-56.1	0	0	0	0	112.4	G24 L25 F26 Y30 A31 L32 S86 Y93	G24-S28 WeakPolarHBondContact O-CB 3.5Å; G24-S28 PolarHBondContact O-N 2.74Å; G24-S28 PolarHBondContact O-OG 3.34Å; L25-S28 PolarHBondContact O-N 3.47Å; F26-S28 VanDerWaalsContact C-N 3.34Å; F26-S28 PolarHBondContact O-N 3.01Å; S28-Y30 VanDerWaalsContact C-N 3.35Å; S28-A31 PolarHBondContact O-N 2.87Å; S28-L32 WeakPolarHBondContact O-CB 3.37Å; S28-L32 PolarHBondContact O-N 3.22Å; S28-S86 WeakPolarHBondContact O-CB 3.4Å; S28-Y93 WeakPolarHBondContact OG-CD2 3.43Å; S28-Y93 VanDerWaalsContact OG-CE2 3.3Å; S28-Y93 WeakPolarHBondContact OG-CE2 3.33Å
29	F	94.9	Very high	92.6	Very high	115 Å²	115	50 Å²	50	50%	0.504	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-41.2	175.1	-83.5	-63.1	0	0	0	111.8	L25 F26 L32 H33 I90	L25-F29 HydrophobicContact CB-CD2 4.45Å; L25-F29 HydrophobicContact CD2-CE2 4.4Å; L25-F29 WeakPolarHBondContact O-CD2 3.45Å; L25-F29 PolarHBondContact O-N 2.9Å; F26-F29 PolarHBondContact O-N 3.43Å; F29-L32 PolarHBondContact O-N 3.39Å; F29-H33 WeakPolarHBondContact O-CB 3.44Å; F29-H33 PolarHBondContact O-N 3.39Å; F29-I90 HydrophobicContact CD1-CD1 3.76Å; F29-I90 HydrophobicContact CE1-CD1 3.7Å; F29-I90 HydrophobicContact CE1-CG1 4.45Å; F29-I90 HydrophobicContact CG-CD1 4.28Å; F29-I90 HydrophobicContact CZ-CD1 4.17Å; F29-I90 HydrophobicContact CZ-CG1 4.48Å; F29-I90 HydrophobicContact CZ-CG2 4.23Å
30	Y	93.2	Very high	92.2	Very high	37 Å²	37	53.4 Å²	53.4	15%	0.145	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-45.1	175.6	179.8	-109.2	0	0	0	111.6	F26 L27 S28 L32 H33 V34 M47 C48 V139	F26-Y30 WeakPolarHBondContact O-CB 3.49Å; F26-Y30 PolarHBondContact O-N 3.44Å; L27-Y30 PolarHBondContact O-N 3.29Å; S28-Y30 VanDerWaalsContact C-N 3.35Å; Y30-L32 PolarHBondContact O-N 2.87Å; Y30-H33 PolarHBondContact O-N 3.02Å; Y30-V34 HydrophobicContact CD1-CG2 4.41Å; Y30-V34 HydrophobicContact CD2-CG2 4.4Å; Y30-V34 HydrophobicContact CE1-CG2 3.93Å; Y30-V34 HydrophobicContact CE2-CG2 3.89Å; Y30-V34 WeakPolarHBondContact O-CG2 3.44Å; Y30-V34 PolarHBondContact O-N 2.93Å; Y30-M47 HydrophobicContact CE2-CE 3.74Å; Y30-M47 WeakPolarHBondContact OH-CB 3.34Å; Y30-M47 PolarHBondContact OH-N 3.35Å; Y30-C48 HydrophobicContact CE1-CB 4.19Å; Y30-C48 PolarHBondContact OH-N 3.43Å; Y30-V139 HydrophobicContact CD1-CG2 3.95Å; Y30-V139 HydrophobicContact CE1-CG2 3.92Å
31	A	90.9	Very high	91.7	Very high	5 Å²	5	56.7 Å²	56.7	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-44.4	175.7	0	0	0	0	0	112	L27 S28 H33 V34 E35 F60 V139	L27-A31 WeakPolarHBondContact O-CB 3.35Å; L27-A31 PolarHBondContact O-N 3.41Å; S28-A31 PolarHBondContact O-N 2.87Å; A31-H33 PolarHBondContact O-N 2.93Å; A31-V34 PolarHBondContact O-N 3.02Å; A31-E35 WeakPolarHBondContact O-CB 3.45Å; A31-E35 PolarHBondContact O-N 3.41Å; A31-F60 HydrophobicContact CB-CD2 4.38Å; A31-F60 HydrophobicContact CB-CE1 4.07Å; A31-F60 HydrophobicContact CB-CE2 3.66Å; A31-F60 HydrophobicContact CB-CZ 3.5Å; A31-F60 VanDerWaalsContact CB-CZ 3.5Å; A31-V139 HydrophobicContact CB-CG1 4.39Å
32	L	91.3	Very high	91.1	Very high	33 Å²	33	60.9 Å²	60.9	17%	0.173	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-41.8	176.4	-176.4	63.4	0	0	0	111.8	S28 F29 Y30 E35 I36 P84 I90	S28-L32 WeakPolarHBondContact O-CB 3.37Å; S28-L32 PolarHBondContact O-N 3.22Å; F29-L32 PolarHBondContact O-N 3.39Å; Y30-L32 PolarHBondContact O-N 2.87Å; L32-E35 PolarHBondContact O-N 3.21Å; L32-I36 HydrophobicContact CD1-CD1 3.93Å; L32-I36 HydrophobicContact CD1-CG1 4.32Å; L32-I36 HydrophobicContact CG-CD1 3.86Å; L32-I36 WeakPolarHBondContact O-CB 3.48Å; L32-I36 VanDerWaalsContact O-CG1 3.29Å; L32-I36 WeakPolarHBondContact O-CG1 3.35Å; L32-I36 PolarHBondContact O-N 3.42Å; L32-P84 HydrophobicContact CD1-CB 3.96Å; L32-P84 HydrophobicContact CD1-CG 3.98Å; L32-I90 HydrophobicContact CD2-CD1 3.89Å
33	H	91.4	Very high	90.5	Very high	101 Å²	101	64 Å²	64	47%	0.468	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-47.3	175	173.7	71.1	0	0	0	111.4	F29 Y30 A31 E35 I36 S37	F29-H33 WeakPolarHBondContact O-CB 3.44Å; F29-H33 PolarHBondContact O-N 3.39Å; Y30-H33 PolarHBondContact O-N 3.02Å; A31-H33 PolarHBondContact O-N 2.93Å; H33-E35 PolarHBondContact O-N 2.98Å; H33-I36 PolarHBondContact O-N 3.39Å; H33-S37 PolarHBondContact CE1-OG 3.49Å; H33-S37 VanDerWaalsContact CE1-OG 3.23Å; H33-S37 PolarHBondContact NE2-OG 3.49Å; H33-S37 VanDerWaalsContact O-CB 3.25Å; H33-S37 WeakPolarHBondContact O-CB 3.49Å; H33-S37 PolarHBondContact O-N 3.02Å; H33-S37 PolarHBondContact O-OG 3.41Å
34	V	89.4	Confident	89.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-45.1	178.1	168.1	0	0	0	0	111.1	Y30 A31 S37 R38 Y44 A46 F60	Y30-V34 HydrophobicContact CD1-CG2 4.41Å; Y30-V34 HydrophobicContact CD2-CG2 4.4Å; Y30-V34 HydrophobicContact CE1-CG2 3.93Å; Y30-V34 HydrophobicContact CE2-CG2 3.89Å; Y30-V34 WeakPolarHBondContact O-CG2 3.44Å; Y30-V34 PolarHBondContact O-N 2.93Å; A31-V34 PolarHBondContact O-N 3.02Å; V34-S37 PolarHBondContact O-N 3.3Å; V34-R38 VanDerWaalsContact O-CB 3.25Å; V34-R38 WeakPolarHBondContact O-CB 3.29Å; V34-R38 PolarHBondContact O-N 2.96Å; V34-Y44 HydrophobicContact CG1-CE1 4.4Å; V34-Y44 HydrophobicContact CG2-CE1 4.49Å; V34-A46 HydrophobicContact CB-CB 4.36Å; V34-A46 HydrophobicContact CG1-CB 3.61Å; V34-A46 HydrophobicContact CG2-CB 3.76Å; V34-F60 HydrophobicContact CB-CD2 4.24Å; V34-F60 HydrophobicContact CG1-CD2 3.9Å; V34-F60 HydrophobicContact CG1-CE2 4.45Å
35	E	87.8	Confident	89.1	Confident	3 Å²	3	71.4 Å²	71.4	1%	0.014	32%	0.324	C	S	.	.	H	α-helix	trans	-58.2	-53	177.6	-170.6	178.6	155.9	0	0	110.8	A31 L32 H33 S37 R38 E39 F60 R66 P84	A31-E35 WeakPolarHBondContact O-CB 3.45Å; A31-E35 PolarHBondContact O-N 3.41Å; L32-E35 PolarHBondContact O-N 3.21Å; H33-E35 PolarHBondContact O-N 2.98Å; E35-S37 PolarHBondContact O-N 3.47Å; E35-R38 PolarHBondContact O-N 2.61Å; E35-E39 WeakPolarHBondContact O-CG 3.31Å; E35-E39 PolarHBondContact O-N 2.79Å; E35-F60 HydrophobicContact CB-CB 4.25Å; E35-F60 HydrophobicContact CG-CB 4.43Å; E35-R66 IonicContact OE1-CZ 3.55Å; E35-R66 IonicContact OE1-NE 3.01Å; E35-R66 PolarHBondContact OE1-NE 3.32Å; E35-R66 IonicContact OE1-NH2 3.39Å; E35-R66 PolarHBondContact OE1-NH2 3.04Å; E35-P84 WeakPolarHBondContact OE1-CG 3.42Å; E35-P84 WeakPolarHBondContact OE2-CB 3.47Å
36	I	87.4	Confident	88.4	Confident	61 Å²	61	70.3 Å²	70.3	31%	0.313	32%	0.319	S	S	.	.	H	α-helix	trans	-63.4	-41.8	-179.9	-66.4	169.5	0	0	0	111.7	L32 H33 E39 R40	L32-I36 HydrophobicContact CD1-CD1 3.93Å; L32-I36 HydrophobicContact CD1-CG1 4.32Å; L32-I36 HydrophobicContact CG-CD1 3.86Å; L32-I36 WeakPolarHBondContact O-CB 3.48Å; L32-I36 VanDerWaalsContact O-CG1 3.29Å; L32-I36 WeakPolarHBondContact O-CG1 3.35Å; L32-I36 PolarHBondContact O-N 3.42Å; H33-I36 PolarHBondContact O-N 3.39Å; I36-E39 PolarHBondContact O-N 2.82Å; I36-R40 WeakPolarHBondContact O-CG 3.39Å; I36-R40 PolarHBondContact O-N 2.91Å; I36-R40 VanDerWaalsContact O-N 3.11Å
37	S	88.6	Confident	87.5	Confident	23 Å²	23	71.1 Å²	71.1	16%	0.161	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-44.1	178.8	-65.7	0	0	0	0	111.3	H33 V34 E35 E39 R40 D41	H33-S37 PolarHBondContact CE1-OG 3.49Å; H33-S37 VanDerWaalsContact CE1-OG 3.23Å; H33-S37 PolarHBondContact NE2-OG 3.49Å; H33-S37 VanDerWaalsContact O-CB 3.25Å; H33-S37 WeakPolarHBondContact O-CB 3.49Å; H33-S37 PolarHBondContact O-N 3.02Å; H33-S37 PolarHBondContact O-OG 3.41Å; V34-S37 PolarHBondContact O-N 3.3Å; E35-S37 PolarHBondContact O-N 3.47Å; S37-E39 VanDerWaalsContact C-N 3.34Å; S37-E39 PolarHBondContact O-N 3.32Å; S37-R40 PolarHBondContact O-N 3.4Å; S37-D41 PolarHBondContact O-N 3.31Å
38	R	83.5	Confident	86.9	Confident	69 Å²	69	71.2 Å²	71.2	26%	0.26	33%	0.328	S	S	.	.	H	α-helix	trans	-69.8	-30.2	179.3	-166	70.4	175.9	147.3	14.5	113	V34 E35 D41 P42 E43 Y44 T61	V34-R38 VanDerWaalsContact O-CB 3.25Å; V34-R38 WeakPolarHBondContact O-CB 3.29Å; V34-R38 PolarHBondContact O-N 2.96Å; E35-R38 PolarHBondContact O-N 2.61Å; R38-D41 CarbonylContact O-C 3.34Å; R38-P42 PolarHBondContact NH1-O 2.97Å; R38-P42 PolarHBondContact NH2-O 3.33Å; R38-E43 PolarHBondContact NH1-O 2.76Å; R38-Y44 HydrophobicContact CB-CD1 4.33Å; R38-Y44 WeakPolarHBondContact CD-O 3.45Å; R38-Y44 PolarHBondContact NE-O 3.19Å; R38-Y44 VanDerWaalsContact NH1-C 3.26Å; R38-Y44 PolarHBondContact NH1-O 3.04Å; R38-T61 HydrophobicContact CB-CG2 3.98Å; R38-T61 HydrophobicContact CG-CG2 3.55Å
39	E	83.8	Confident	86.4	Confident	96 Å²	96	72.3 Å²	72.3	45%	0.449	33%	0.334	S	S	.	.	H	α-helix	trans	-70.7	-35.1	172.9	-75	-166.2	130.2	0	0	113.3	E35 I36 S37 R66	E35-E39 WeakPolarHBondContact O-CG 3.31Å; E35-E39 PolarHBondContact O-N 2.79Å; I36-E39 PolarHBondContact O-N 2.82Å; S37-E39 VanDerWaalsContact C-N 3.34Å; S37-E39 PolarHBondContact O-N 3.32Å; E39-R66 IonicContact OE1-CZ 2.97Å; E39-R66 IonicContact OE1-NH1 2.64Å; E39-R66 PolarHBondContact OE1-NH1 3.16Å; E39-R66 IonicContact OE1-NH2 2.69Å; E39-R66 PolarHBondContact OE1-NH2 2.76Å; E39-R66 IonicContact OE2-CZ 3.82Å; E39-R66 IonicContact OE2-NH2 2.78Å; E39-R66 PolarHBondContact OE2-NH2 2.82Å
40	R	86.9	Confident	85.7	Confident	212 Å²	212	73 Å²	73	80%	0.8	34%	0.342	S	S	*	.	H	α-helix	trans	-76.6	-36.3	176.7	-71.2	178.1	-174.7	179.7	2.4	112.2	I36 S37	I36-R40 WeakPolarHBondContact O-CG 3.39Å; I36-R40 PolarHBondContact O-N 2.91Å; I36-R40 VanDerWaalsContact O-N 3.11Å; S37-R40 PolarHBondContact O-N 3.4Å
41	D	88	Confident	84.9	Confident	77 Å²	77	72.8 Å²	72.8	41%	0.412	35%	0.352	S	S	.	.			trans	-132.4	101.3	-178.6	179.8	8.4	0	0	0	110.5	S37 R38 E43 Y44	S37-D41 PolarHBondContact O-N 3.31Å; R38-D41 CarbonylContact O-C 3.34Å; D41-E43 PolarHBondContact O-N 2.85Å; D41-E43 WeakPolarHBondContact OD1-CB 3.48Å; D41-E43 PolarHBondContact OD1-N 2.99Å; D41-Y44 WeakPolarHBondContact O-CB 3.48Å; D41-Y44 PolarHBondContact O-N 3.48Å
42	P	83	Confident	84	Confident	88 Å²	88	78.2 Å²	78.2	57%	0.571	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-6.5	175.5	-23.1	34.4	0	0	0	115.1	R38	R38-P42 PolarHBondContact NH1-O 2.97Å; R38-P42 PolarHBondContact NH2-O 3.33Å
43	E	84.1	Confident	83.1	Confident	161 Å²	161	80.5 Å²	80.5	75%	0.752	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-8.5	173.4	-63.1	-59.6	127.4	0	0	112.7	R38 D41 R45	R38-E43 PolarHBondContact NH1-O 2.76Å; D41-E43 PolarHBondContact O-N 2.85Å; D41-E43 WeakPolarHBondContact OD1-CB 3.48Å; D41-E43 PolarHBondContact OD1-N 2.99Å; E43-R45 PolarHBondContact O-N 2.69Å
44	Y	83.1	Confident	82.7	Confident	53 Å²	53	77.4 Å²	77.4	21%	0.208	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-60	118.2	178.1	175.8	-96.2	0	0	0	113.4	V34 R38 D41 A46	V34-Y44 HydrophobicContact CG1-CE1 4.4Å; V34-Y44 HydrophobicContact CG2-CE1 4.49Å; R38-Y44 HydrophobicContact CB-CD1 4.33Å; R38-Y44 WeakPolarHBondContact CD-O 3.45Å; R38-Y44 PolarHBondContact NE-O 3.19Å; R38-Y44 VanDerWaalsContact NH1-C 3.26Å; R38-Y44 PolarHBondContact NH1-O 3.04Å; D41-Y44 WeakPolarHBondContact O-CB 3.48Å; D41-Y44 PolarHBondContact O-N 3.48Å; Y44-A46 HydrophobicContact CE1-CB 4.08Å
45	R	80.4	Confident	82.3	Confident	185 Å²	185	77.8 Å²	77.8	70%	0.698	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-96.7	128.8	170.1	-88.3	-173.9	166.1	-164.8	-5.1	111.2	E43	E43-R45 PolarHBondContact O-N 2.69Å
46	A	81.9	Confident	82	Confident	5 Å²	5	77.7 Å²	77.7	4%	0.041	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-76.7	151.8	176.5	0	0	0	0	0	111.1	V34 Y44 C48 D49 S57	V34-A46 HydrophobicContact CB-CB 4.36Å; V34-A46 HydrophobicContact CG1-CB 3.61Å; V34-A46 HydrophobicContact CG2-CB 3.76Å; Y44-A46 HydrophobicContact CE1-CB 4.08Å; A46-C48 PolarHBondContact O-N 3.3Å; A46-D49 PolarHBondContact N-OD2 3.4Å; A46-D49 WeakPolarHBondContact O-CB 3.31Å; A46-D49 PolarHBondContact O-N 3.44Å; A46-S57 WeakPolarHBondContact CB-OG 3.37Å
47	M	79.6	Confident	81.7	Confident	152 Å²	152	74.9 Å²	74.9	75%	0.749	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.2	174.8	-61.9	-178.7	-84.3	0	0	113.3	Y30 D49	Y30-M47 HydrophobicContact CE2-CE 3.74Å; Y30-M47 WeakPolarHBondContact OH-CB 3.34Å; Y30-M47 PolarHBondContact OH-N 3.35Å; M47-D49 VanDerWaalsContact C-N 3.32Å
48	C	81.5	Confident	81.2	Confident	15 Å²	15	78.5 Å²	78.5	10%	0.101	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	8	175.1	69.1	0	0	0	0	114.1	Y30 A46 L50 C56 V139	Y30-C48 HydrophobicContact CE1-CB 4.19Å; Y30-C48 PolarHBondContact OH-N 3.43Å; A46-C48 PolarHBondContact O-N 3.3Å; C48-L50 PolarHBondContact O-N 2.91Å; C48-C56 HydrophobicContact CB-CB 4.34Å; C48-C56 WeakPolarHBondContact CB-SG 3.3Å; C48-C56 WeakPolarHBondContact SG-CB 3.39Å; C48-C56 CovalentContact SG-SG 2.04Å; C48-C56 PolarHBondContact SG-SG 3.13Å; C48-V139 HydrophobicContact CB-CG2 3.91Å
49	D	83.5	Confident	81.1	Confident	28 Å²	28	75.9 Å²	75.9	15%	0.15	38%	0.379	C	S	.	.			trans	-83.4	95.5	165.5	-63.5	-30.6	0	0	0	109	A46 M47 V54 S55 C56 S57	A46-D49 PolarHBondContact N-OD2 3.4Å; A46-D49 WeakPolarHBondContact O-CB 3.31Å; A46-D49 PolarHBondContact O-N 3.44Å; M47-D49 VanDerWaalsContact C-N 3.32Å; D49-V54 CarbonylContact C-O 3.49Å; D49-V54 WeakPolarHBondContact CA-O 3.49Å; D49-S55 WeakPolarHBondContact OD1-CA 3.48Å; D49-S55 VanDerWaalsContact OD1-CB 3.3Å; D49-S55 WeakPolarHBondContact OD1-CB 3.4Å; D49-S55 PolarHBondContact OD1-OG 2.89Å; D49-C56 PolarHBondContact OD1-N 3.22Å; D49-S57 PolarHBondContact OD1-N 2.9Å; D49-S57 PolarHBondContact OD1-OG 3.41Å; D49-S57 VanDerWaalsContact OD2-CB 3.27Å; D49-S57 WeakPolarHBondContact OD2-CB 3.39Å; D49-S57 PolarHBondContact OD2-OG 3.06Å
50	L	80	Confident	81	Confident	128 Å²	128	72.3 Å²	72.3	67%	0.67	36%	0.362	S	S	*	.			trans	-95.3	-0.8	-176.1	-59.9	175.3	0	0	0	113.4	C48 V54 V138	C48-L50 PolarHBondContact O-N 2.91Å; L50-V54 HydrophobicContact CB-CB 4.11Å; L50-V54 HydrophobicContact CB-CG1 3.85Å; L50-V54 HydrophobicContact CD1-CG1 4.17Å; L50-V54 HydrophobicContact CG-CG1 4.28Å; L50-V54 PolarHBondContact N-O 2.94Å; L50-V138 HydrophobicContact CD1-CG2 4.25Å
51	G	77.1	Confident	80.7	Confident	34 Å²	34	65.8 Å²	65.8	35%	0.351	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	163.8	-177.8	179.5	0	0	0	0	0	111.5	S53 V54	G51-S53 VanDerWaalsContact C-N 3.26Å; G51-S53 PolarHBondContact O-N 3.48Å; G51-V54 CarbonylContact O-C 3.47Å; G51-V54 PolarHBondContact O-N 3.19Å
52	D	72.6	Confident	80.5	Confident	118 Å²	118	63.2 Å²	63.2	63%	0.631	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-26.1	-173.6	-67.2	-34.5	0	0	0	113.9	K58	D52-K58 PolarHBondContact O-NZ 3.17Å
53	S	72.5	Confident	80.4	Confident	81 Å²	81	65.7 Å²	65.7	57%	0.566	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	2	177.2	-45.4	0	0	0	0	113.7	G51 F136	G51-S53 VanDerWaalsContact C-N 3.26Å; G51-S53 PolarHBondContact O-N 3.48Å; S53-F136 PolarHBondContact O-N 3.49Å
54	V	81.2	Confident	80.4	Confident	36 Å²	36	59.7 Å²	59.7	22%	0.218	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-130.1	72.8	-179.2	-173	0	0	0	0	107.7	D49 L50 G51 F136 V138	D49-V54 CarbonylContact C-O 3.49Å; D49-V54 WeakPolarHBondContact CA-O 3.49Å; L50-V54 HydrophobicContact CB-CB 4.11Å; L50-V54 HydrophobicContact CB-CG1 3.85Å; L50-V54 HydrophobicContact CD1-CG1 4.17Å; L50-V54 HydrophobicContact CG-CG1 4.28Å; L50-V54 PolarHBondContact N-O 2.94Å; G51-V54 CarbonylContact O-C 3.47Å; G51-V54 PolarHBondContact O-N 3.19Å; V54-F136 WeakPolarHBondContact CA-O 3.45Å; V54-F136 HydrophobicContact CG1-CD1 4.25Å; V54-F136 VanDerWaalsContact CG1-O 3.28Å; V54-F136 WeakPolarHBondContact CG1-O 3.47Å; V54-F136 HydrophobicContact CG2-CB 4.32Å; V54-V138 HydrophobicContact CG1-CG2 4.17Å
55	S	81.8	Confident	80.3	Confident	8 Å²	8	57.3 Å²	57.3	6%	0.056	29%	0.294	C	S	.	.			trans	-126.6	116.8	-177.9	179.4	0	0	0	0	112.4	D49 S57 K58 V59	D49-S55 WeakPolarHBondContact OD1-CA 3.48Å; D49-S55 VanDerWaalsContact OD1-CB 3.3Å; D49-S55 WeakPolarHBondContact OD1-CB 3.4Å; D49-S55 PolarHBondContact OD1-OG 2.89Å; S55-S57 PolarHBondContact OG-N 3.46Å; S55-K58 PolarHBondContact OG-N 3.41Å; S55-V59 VanDerWaalsContact O-CG2 3.28Å; S55-V59 WeakPolarHBondContact O-CG2 3.4Å
56	C	81.2	Confident	80.3	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-73.3	-32.6	168.9	-46.7	0	0	0	0	111.4	C48 D49 K58 V59 F60	C48-C56 HydrophobicContact CB-CB 4.34Å; C48-C56 WeakPolarHBondContact CB-SG 3.3Å; C48-C56 WeakPolarHBondContact SG-CB 3.39Å; C48-C56 CovalentContact SG-SG 2.04Å; C48-C56 PolarHBondContact SG-SG 3.13Å; D49-C56 PolarHBondContact OD1-N 3.22Å; C56-K58 PolarHBondContact O-N 3.37Å; C56-V59 PolarHBondContact O-N 3.27Å; C56-V59 VanDerWaalsContact O-N 3.15Å; C56-F60 HydrophobicContact CB-CD2 4.03Å; C56-F60 HydrophobicContact CB-CE2 3.64Å; C56-F60 HydrophobicContact CB-CZ 4.22Å; C56-F60 VanDerWaalsContact O-CD2 3.31Å; C56-F60 WeakPolarHBondContact O-CD2 3.29Å; C56-F60 WeakPolarHBondContact O-CG 3.18Å; C56-F60 PolarHBondContact O-N 2.97Å
57	S	80.4	Confident	80.2	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.014	27%	0.274	C	S	.	.	H	α-helix	trans	-60.7	-45.6	-177.3	-60.7	0	0	0	0	111.1	A46 D49 S55 V59 F60 T61	A46-S57 WeakPolarHBondContact CB-OG 3.37Å; D49-S57 PolarHBondContact OD1-N 2.9Å; D49-S57 PolarHBondContact OD1-OG 3.41Å; D49-S57 VanDerWaalsContact OD2-CB 3.27Å; D49-S57 WeakPolarHBondContact OD2-CB 3.39Å; D49-S57 PolarHBondContact OD2-OG 3.06Å; S55-S57 PolarHBondContact OG-N 3.46Å; S57-V59 VanDerWaalsContact C-N 3.31Å; S57-V59 PolarHBondContact O-N 3.42Å; S57-F60 PolarHBondContact O-N 2.98Å; S57-T61 WeakPolarHBondContact O-CG2 3.45Å; S57-T61 PolarHBondContact O-N 3.46Å; S57-T61 VanDerWaalsContact O-N 3.13Å; S57-T61 PolarHBondContact O-OG1 3.31Å
58	K	78.3	Confident	80.3	Confident	100 Å²	100	47.8 Å²	47.8	44%	0.435	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-40.1	174.6	-68.7	-179.2	-174.1	174.2	0	112.3	D52 S55 C56 T61 S62	D52-K58 PolarHBondContact O-NZ 3.17Å; S55-K58 PolarHBondContact OG-N 3.41Å; C56-K58 PolarHBondContact O-N 3.37Å; K58-T61 PolarHBondContact O-OG1 2.91Å; K58-S62 WeakPolarHBondContact O-CB 3.47Å; K58-S62 PolarHBondContact O-N 3.24Å
59	V	82.1	Confident	79.8	Confident	13 Å²	13	47.2 Å²	47.2	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-67.4	-46.2	-178.8	170.3	0	0	0	0	111.3	S55 C56 S57 S62 L129 L133 D135 C137	S55-V59 VanDerWaalsContact O-CG2 3.28Å; S55-V59 WeakPolarHBondContact O-CG2 3.4Å; C56-V59 PolarHBondContact O-N 3.27Å; C56-V59 VanDerWaalsContact O-N 3.15Å; S57-V59 VanDerWaalsContact C-N 3.31Å; S57-V59 PolarHBondContact O-N 3.42Å; V59-S62 VanDerWaalsContact O-CB 3.32Å; V59-S62 WeakPolarHBondContact O-CB 3.46Å; V59-S62 PolarHBondContact O-N 2.91Å; V59-S62 PolarHBondContact O-OG 3.32Å; V59-L129 HydrophobicContact CB-CD2 4.26Å; V59-L129 HydrophobicContact CG1-CD2 3.77Å; V59-L129 HydrophobicContact CG2-CD2 3.41Å; V59-L129 VanDerWaalsContact CG2-CD2 3.41Å; V59-L133 HydrophobicContact CB-CD2 4.29Å; V59-L133 HydrophobicContact CG2-CD2 3.8Å; V59-D135 HydrophobicContact CG2-CB 3.98Å; V59-C137 HydrophobicContact CB-CB 4.4Å; V59-C137 HydrophobicContact CG1-CB 4.32Å; V59-C137 HydrophobicContact CG2-CB 4.08Å
60	F	81.3	Confident	79.3	Confident	22 Å²	22	49.8 Å²	49.8	10%	0.096	26%	0.261	C	S	.	.	H	α-helix	trans	-73.4	-30.9	-177.1	-62.3	-34.3	0	0	0	113.4	A31 V34 E35 C56 S57 S62 V139	A31-F60 HydrophobicContact CB-CD2 4.38Å; A31-F60 HydrophobicContact CB-CE1 4.07Å; A31-F60 HydrophobicContact CB-CE2 3.66Å; A31-F60 HydrophobicContact CB-CZ 3.5Å; A31-F60 VanDerWaalsContact CB-CZ 3.5Å; V34-F60 HydrophobicContact CB-CD2 4.24Å; V34-F60 HydrophobicContact CG1-CD2 3.9Å; V34-F60 HydrophobicContact CG1-CE2 4.45Å; E35-F60 HydrophobicContact CB-CB 4.25Å; E35-F60 HydrophobicContact CG-CB 4.43Å; C56-F60 HydrophobicContact CB-CD2 4.03Å; C56-F60 HydrophobicContact CB-CE2 3.64Å; C56-F60 HydrophobicContact CB-CZ 4.22Å; C56-F60 VanDerWaalsContact O-CD2 3.31Å; C56-F60 WeakPolarHBondContact O-CD2 3.29Å; C56-F60 WeakPolarHBondContact O-CG 3.18Å; C56-F60 PolarHBondContact O-N 2.97Å; S57-F60 PolarHBondContact O-N 2.98Å; F60-S62 VanDerWaalsContact C-N 3.3Å; F60-V139 HydrophobicContact CZ-CB 4.24Å; F60-V139 HydrophobicContact CZ-CG1 4Å
61	T	80.5	Confident	78.7	Confident	75 Å²	75	45.2 Å²	45.2	46%	0.46	24%	0.238	S	C	.	.	H	α-helix	trans	-82.2	-8.2	173.4	59.2	0	0	0	0	113.6	R38 S57 K58	R38-T61 HydrophobicContact CB-CG2 3.98Å; R38-T61 HydrophobicContact CG-CG2 3.55Å; S57-T61 WeakPolarHBondContact O-CG2 3.45Å; S57-T61 PolarHBondContact O-N 3.46Å; S57-T61 VanDerWaalsContact O-N 3.13Å; S57-T61 PolarHBondContact O-OG1 3.31Å; K58-T61 PolarHBondContact O-OG1 2.91Å
62	S	83.4	Confident	77.9	Confident	22 Å²	22	46.8 Å²	46.8	15%	0.154	24%	0.236	C	C	.	.	S	Bend	trans	-66	159.7	175.4	81.3	0	0	0	0	111.7	K58 V59 F60 W64 G65	K58-S62 WeakPolarHBondContact O-CB 3.47Å; K58-S62 PolarHBondContact O-N 3.24Å; V59-S62 VanDerWaalsContact O-CB 3.32Å; V59-S62 WeakPolarHBondContact O-CB 3.46Å; V59-S62 PolarHBondContact O-N 2.91Å; V59-S62 PolarHBondContact O-OG 3.32Å; F60-S62 VanDerWaalsContact C-N 3.3Å; S62-W64 PolarHBondContact O-N 3.39Å; S62-W64 PolarHBondContact OG-N 3.01Å; S62-G65 PolarHBondContact O-N 2.98Å
63	R	82.2	Confident	77.2	Confident	141 Å²	141	48 Å²	48	53%	0.532	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.5	175.3	70.6	175.1	-176.7	172.1	-0.9	114	G69	R63-G69 VanDerWaalsContact O-CA 3.23Å; R63-G69 WeakPolarHBondContact O-CA 3.47Å
64	W	83.6	Confident	76.5	Confident	34 Å²	34	52.1 Å²	52.1	13%	0.129	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-14.5	179.6	-61.3	-90.2	0	0	0	113	S62 R66 N85 L125 V128 I132 L133	S62-W64 PolarHBondContact O-N 3.39Å; S62-W64 PolarHBondContact OG-N 3.01Å; W64-R66 PolarHBondContact O-N 3.34Å; W64-N85 PolarHBondContact O-ND2 2.96Å; W64-L125 HydrophobicContact CB-CD2 4.4Å; W64-V128 HydrophobicContact CB-CG1 4.05Å; W64-V128 HydrophobicContact CD2-CG1 3.59Å; W64-V128 HydrophobicContact CE3-CG1 4.16Å; W64-V128 HydrophobicContact CG-CG1 3.56Å; W64-V128 HydrophobicContact CG-CG2 4.41Å; W64-V128 HydrophobicContact CZ2-CG1 4.38Å; W64-I132 HydrophobicContact CH2-CB 4.31Å; W64-I132 HydrophobicContact CH2-CG2 3.34Å; W64-I132 HydrophobicContact CZ2-CB 4.25Å; W64-I132 HydrophobicContact CZ2-CD1 3.78Å; W64-I132 HydrophobicContact CZ2-CG2 3.54Å; W64-I132 HydrophobicContact CZ3-CG2 4.31Å; W64-L133 HydrophobicContact CD2-CD1 4.18Å; W64-L133 HydrophobicContact CE3-CD1 3.45Å; W64-L133 VanDerWaalsContact CE3-CD1 3.45Å; W64-L133 HydrophobicContact CH2-CD1 3.92Å; W64-L133 HydrophobicContact CZ3-CD1 3.32Å; W64-L133 HydrophobicContact CZ3-CG 4.37Å
65	G	80.6	Confident	75.2	Confident	4 Å²	4	55.7 Å²	55.7	4%	0.041	26%	0.257	C	S	.	.	S	Bend	trans	-66.1	-18.9	174.8	0	0	0	0	0	113.6	S62 N85	S62-G65 PolarHBondContact O-N 2.98Å; G65-N85 WeakPolarHBondContact O-CB 3.3Å; G65-N85 PolarHBondContact O-N 3.11Å; G65-N85 PolarHBondContact O-ND2 3.33Å; G65-N85 PolarHBondContact O-OD1 3.29Å
66	R	81.9	Confident	73.8	Confident	80 Å²	80	58.6 Å²	58.6	30%	0.302	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-119.2	132	177.5	-66.9	-171.4	165.2	153.6	-11.4	112.4	E35 E39 W64 F68 G69 Q83	E35-R66 IonicContact OE1-CZ 3.55Å; E35-R66 IonicContact OE1-NE 3.01Å; E35-R66 PolarHBondContact OE1-NE 3.32Å; E35-R66 IonicContact OE1-NH2 3.39Å; E35-R66 PolarHBondContact OE1-NH2 3.04Å; E39-R66 IonicContact OE1-CZ 2.97Å; E39-R66 IonicContact OE1-NH1 2.64Å; E39-R66 PolarHBondContact OE1-NH1 3.16Å; E39-R66 IonicContact OE1-NH2 2.69Å; E39-R66 PolarHBondContact OE1-NH2 2.76Å; E39-R66 IonicContact OE2-CZ 3.82Å; E39-R66 IonicContact OE2-NH2 2.78Å; E39-R66 PolarHBondContact OE2-NH2 2.82Å; W64-R66 PolarHBondContact O-N 3.34Å; R66-F68 PolarHBondContact O-N 2.74Å; R66-G69 PolarHBondContact O-N 2.84Å; R66-Q83 WeakPolarHBondContact CA-O 3.34Å
67	G	79.6	Confident	72.5	Confident	1 Å²	1	66 Å²	66	1%	0.01	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	49.6	32.4	176.8	0	0	0	0	0	113.8	G69 L70 V71 Q83 N85	G67-G69 PolarHBondContact O-N 3.4Å; G67-L70 PolarHBondContact O-N 3.42Å; G67-V71 WeakPolarHBondContact O-CG2 3.23Å; G67-V71 PolarHBondContact O-N 2.91Å; G67-V71 VanDerWaalsContact O-N 3.14Å; G67-Q83 PolarHBondContact N-O 3.49Å; G67-N85 PolarHBondContact N-OD1 2.73Å
68	F	80.3	Confident	71.2	Confident	61 Å²	61	73.4 Å²	73.4	27%	0.268	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	54.9	14.2	-172.9	-58.6	-88.4	0	0	0	115.3	R66 L70 N85 L88 Y124 L125	R66-F68 PolarHBondContact O-N 2.74Å; F68-L70 HydrophobicContact CB-CD1 4.39Å; F68-L70 HydrophobicContact CB-CG 4.45Å; F68-L70 PolarHBondContact O-N 3.49Å; F68-N85 PolarHBondContact N-OD1 3.47Å; F68-L88 HydrophobicContact CD2-CD1 4.1Å; F68-L88 HydrophobicContact CE2-CD1 3.38Å; F68-L88 HydrophobicContact CZ-CD1 4.13Å; F68-Y124 HydrophobicContact CB-CD1 4.49Å; F68-Y124 HydrophobicContact CB-CE1 4.05Å; F68-Y124 HydrophobicContact CD1-CD1 4.45Å; F68-Y124 VanDerWaalsContact O-CE1 3.24Å; F68-Y124 WeakPolarHBondContact O-CE1 3.1Å; F68-Y124 PolarHBondContact O-OH 2.97Å; F68-Y124 VanDerWaalsContact O-OH 3.07Å; F68-L125 HydrophobicContact CD1-CD1 3.78Å; F68-L125 HydrophobicContact CD1-CD2 4.05Å; F68-L125 HydrophobicContact CD1-CG 3.89Å; F68-L125 HydrophobicContact CE1-CD1 3.73Å; F68-L125 HydrophobicContact CE1-CG 4.25Å
69	G	72.2	Confident	70.3	Confident	3 Å²	3	70.1 Å²	70.1	3%	0.031	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	65.8	6.8	-170.3	0	0	0	0	0	114.5	R63 R66 G67 Q72 F73	R63-G69 VanDerWaalsContact O-CA 3.23Å; R63-G69 WeakPolarHBondContact O-CA 3.47Å; R66-G69 PolarHBondContact O-N 2.84Å; G67-G69 PolarHBondContact O-N 3.4Å; G69-Q72 WeakPolarHBondContact O-CG 3.45Å; G69-Q72 PolarHBondContact O-NE2 2.92Å; G69-F73 WeakPolarHBondContact O-CD2 3.45Å; G69-F73 VanDerWaalsContact O-CE2 3.3Å; G69-F73 WeakPolarHBondContact O-CE2 3.41Å
70	L	72.9	Confident	69.2	Low	81 Å²	81	75.2 Å²	75.2	42%	0.424	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-36.1	-177.7	-65.7	174.3	0	0	0	111.9	G67 F68 Q72 F73 Y124	G67-L70 PolarHBondContact O-N 3.42Å; F68-L70 HydrophobicContact CB-CD1 4.39Å; F68-L70 HydrophobicContact CB-CG 4.45Å; F68-L70 PolarHBondContact O-N 3.49Å; L70-Q72 PolarHBondContact O-N 3.38Å; L70-F73 PolarHBondContact O-N 3.46Å; L70-Y124 HydrophobicContact CD1-CE1 4.36Å
71	V	66.6	Low	68.3	Low	32 Å²	32	78.9 Å²	78.9	19%	0.194	39%	0.394	C	S	.	.	H	α-helix	trans	-60.1	-34	-176.8	174.4	0	0	0	0	111.8	G67 F73 F74 F75 L81 N82	G67-V71 WeakPolarHBondContact O-CG2 3.23Å; G67-V71 PolarHBondContact O-N 2.91Å; G67-V71 VanDerWaalsContact O-N 3.14Å; V71-F73 PolarHBondContact O-N 2.97Å; V71-F73 VanDerWaalsContact O-N 3.15Å; V71-F74 PolarHBondContact O-N 2.88Å; V71-F74 VanDerWaalsContact O-N 3.15Å; V71-F75 HydrophobicContact CG1-CB 4.29Å; V71-F75 HydrophobicContact CG1-CD2 4.36Å; V71-F75 PolarHBondContact O-N 3.32Å; V71-L81 HydrophobicContact CG1-CB 3.81Å; V71-N82 HydrophobicContact CG1-CB 4.38Å
72	Q	60.4	Low	67.9	Low	67 Å²	67	77.3 Å²	77.3	31%	0.313	38%	0.382	S	S	.	.	H	α-helix	trans	-62.5	-16.8	176.8	66.2	-176.6	-13.2	0	0	115.1	G69 L70	G69-Q72 WeakPolarHBondContact O-CG 3.45Å; G69-Q72 PolarHBondContact O-NE2 2.92Å; L70-Q72 PolarHBondContact O-N 3.38Å
73	F	58.1	Low	67.8	Low	144 Å²	144	79.4 Å²	79.4	63%	0.632	39%	0.39	S	S	*	.	H	α-helix	trans	-88	-21.7	177.3	-71.3	-80.8	0	0	0	113	G69 L70 V71	G69-F73 WeakPolarHBondContact O-CD2 3.45Å; G69-F73 VanDerWaalsContact O-CE2 3.3Å; G69-F73 WeakPolarHBondContact O-CE2 3.41Å; L70-F73 PolarHBondContact O-N 3.46Å; V71-F73 PolarHBondContact O-N 2.97Å; V71-F73 VanDerWaalsContact O-N 3.15Å
74	F	57.9	Low	68	Low	168 Å²	168	73.4 Å²	73.4	74%	0.737	37%	0.369	S	S	*	.	H	α-helix	trans	-111.2	-22.6	-175.1	-67.1	-80.3	0	0	0	113.2	V71	V71-F74 PolarHBondContact O-N 2.88Å; V71-F74 VanDerWaalsContact O-N 3.15Å
75	F	54.3	Low	68.2	Low	110 Å²	110	73.1 Å²	73.1	48%	0.482	37%	0.37	S	S	.	.	S	Bend	trans	-132.6	148.3	-176.6	-68.7	-83.8	0	0	0	110.9	V71 L81	V71-F75 HydrophobicContact CG1-CB 4.29Å; V71-F75 HydrophobicContact CG1-CD2 4.36Å; V71-F75 PolarHBondContact O-N 3.32Å; F75-L81 HydrophobicContact CD2-CD2 4.43Å; F75-L81 HydrophobicContact CE2-CD2 4.21Å; F75-L81 HydrophobicContact CZ-CD2 4.48Å
76	A	52.5	Low	68.6	Low	69 Å²	69	73.4 Å²	73.4	57%	0.57	37%	0.372	S	S	*	.			trans	-55.2	145	176	0	0	0	0	0	110.4	D78 S79	A76-D78 PolarHBondContact O-N 3.17Å; A76-S79 PolarHBondContact N-OG 3.37Å; A76-S79 WeakPolarHBondContact O-CB 3.49Å; A76-S79 PolarHBondContact O-N 3.15Å; A76-S79 PolarHBondContact O-OG 3.45Å
77	K	52.7	Low	69	Low	157 Å²	157	72.1 Å²	72.1	68%	0.683	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-27.7	-175.2	-72.7	-178.8	177.2	178.7	0	114.2	S79 N82	K77-S79 VanDerWaalsContact C-N 3.31Å; K77-N82 PolarHBondContact O-ND2 3.39Å
78	D	53.3	Low	69.5	Low	157 Å²	157	75.1 Å²	75.1	84%	0.84	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	6.8	179.2	-52.8	-45.1	0	0	0	113.9	A76	A76-D78 PolarHBondContact O-N 3.17Å
79	S	59.1	Low	70.1	Confident	31 Å²	31	72.9 Å²	72.9	22%	0.217	38%	0.38	C	S	.	.	S	Bend	trans	-69.9	137	179	-60.2	0	0	0	0	110.2	A76 K77 L81 N82	A76-S79 PolarHBondContact N-OG 3.37Å; A76-S79 WeakPolarHBondContact O-CB 3.49Å; A76-S79 PolarHBondContact O-N 3.15Å; A76-S79 PolarHBondContact O-OG 3.45Å; K77-S79 VanDerWaalsContact C-N 3.31Å; S79-L81 PolarHBondContact O-N 2.93Å; S79-N82 PolarHBondContact O-N 3.17Å
80	V	59.9	Low	71.1	Confident	120 Å²	120	73.6 Å²	73.6	73%	0.727	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-17.8	176.8	-179.6	0	0	0	0	112.8	Q83	V80-Q83 WeakPolarHBondContact O-CG 3.18Å; V80-Q83 PolarHBondContact O-NE2 3.07Å
81	L	61.5	Low	72.1	Confident	100 Å²	100	73.9 Å²	73.9	52%	0.524	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-16.7	176.6	-81.4	76.7	0	0	0	114.6	V71 F75 S79 Q83	V71-L81 HydrophobicContact CG1-CB 3.81Å; F75-L81 HydrophobicContact CD2-CD2 4.43Å; F75-L81 HydrophobicContact CE2-CD2 4.21Å; F75-L81 HydrophobicContact CZ-CD2 4.48Å; S79-L81 PolarHBondContact O-N 2.93Å; L81-Q83 PolarHBondContact O-N 2.94Å
82	N	73.1	Confident	73.5	Confident	41 Å²	41	73.5 Å²	73.5	22%	0.219	38%	0.38	C	S	.	.			trans	-83.3	56.1	178.8	-169.9	28.5	0	0	0	111.4	V71 K77 S79	V71-N82 HydrophobicContact CG1-CB 4.38Å; K77-N82 PolarHBondContact O-ND2 3.39Å; S79-N82 PolarHBondContact O-N 3.17Å
83	Q	81.4	Confident	75.2	Confident	67 Å²	67	70.4 Å²	70.4	31%	0.313	37%	0.365	S	S	.	.			trans	-88.6	156.8	-178.6	-66.1	-62	-28	0	0	111.9	R66 G67 V80 L81 N85 L87	R66-Q83 WeakPolarHBondContact CA-O 3.34Å; G67-Q83 PolarHBondContact N-O 3.49Å; V80-Q83 WeakPolarHBondContact O-CG 3.18Å; V80-Q83 PolarHBondContact O-NE2 3.07Å; L81-Q83 PolarHBondContact O-N 2.94Å; Q83-N85 PolarHBondContact O-N 3.46Å; Q83-L87 HydrophobicContact CB-CD2 3.97Å; Q83-L87 HydrophobicContact CG-CD2 3.91Å
84	P	85.3	Confident	76.9	Confident	14 Å²	14	66.9 Å²	66.9	9%	0.091	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-45.5	133.2	163.4	-31.1	38.6	0	0	0	112.2	L32 E35 S86 L87 L88	L32-P84 HydrophobicContact CD1-CB 3.96Å; L32-P84 HydrophobicContact CD1-CG 3.98Å; E35-P84 WeakPolarHBondContact OE1-CG 3.42Å; E35-P84 WeakPolarHBondContact OE2-CB 3.47Å; P84-S86 VanDerWaalsContact CB-OG 3.25Å; P84-S86 WeakPolarHBondContact CB-OG 3.38Å; P84-S86 PolarHBondContact O-N 3.28Å; P84-L87 HydrophobicContact CB-CB 4.27Å; P84-L87 WeakPolarHBondContact O-CB 3.42Å; P84-L87 PolarHBondContact O-N 3.07Å; P84-L88 PolarHBondContact O-N 3.43Å
85	N	88.7	Confident	78.6	Confident	28 Å²	28	63.5 Å²	63.5	15%	0.15	34%	0.344	C	S	.	.	H	α-helix	trans	-59.5	-30.6	174.4	-67.4	-14.4	0	0	0	111.3	W64 G65 G67 F68 Q83 L87 L88 G89	W64-N85 PolarHBondContact O-ND2 2.96Å; G65-N85 WeakPolarHBondContact O-CB 3.3Å; G65-N85 PolarHBondContact O-N 3.11Å; G65-N85 PolarHBondContact O-ND2 3.33Å; G65-N85 PolarHBondContact O-OD1 3.29Å; G67-N85 PolarHBondContact N-OD1 2.73Å; F68-N85 PolarHBondContact N-OD1 3.47Å; Q83-N85 PolarHBondContact O-N 3.46Å; N85-L87 VanDerWaalsContact C-N 3.29Å; N85-L87 PolarHBondContact O-N 3.34Å; N85-L88 WeakPolarHBondContact O-CB 3.27Å; N85-L88 PolarHBondContact O-N 3.49Å; N85-G89 PolarHBondContact O-N 2.9Å
86	S	89.1	Confident	80.5	Confident	11 Å²	11	58.4 Å²	58.4	8%	0.077	32%	0.322	C	S	.	.	H	α-helix	trans	-58.6	-37.7	173.5	54.3	0	0	0	0	112.2	S28 P84 G89 I90	S28-S86 WeakPolarHBondContact O-CB 3.4Å; P84-S86 VanDerWaalsContact CB-OG 3.25Å; P84-S86 WeakPolarHBondContact CB-OG 3.38Å; P84-S86 PolarHBondContact O-N 3.28Å; S86-G89 PolarHBondContact O-N 3.31Å; S86-I90 WeakPolarHBondContact O-CG1 3.47Å; S86-I90 PolarHBondContact O-N 3.06Å
87	L	90.5	Very high	82.4	Confident	53 Å²	53	56.8 Å²	56.8	28%	0.277	30%	0.304	S	S	.	.	H	α-helix	trans	-67.4	-40.3	174.7	-174.8	62.5	0	0	0	112	Q83 P84 N85 G89 I90 I91	Q83-L87 HydrophobicContact CB-CD2 3.97Å; Q83-L87 HydrophobicContact CG-CD2 3.91Å; P84-L87 HydrophobicContact CB-CB 4.27Å; P84-L87 WeakPolarHBondContact O-CB 3.42Å; P84-L87 PolarHBondContact O-N 3.07Å; N85-L87 VanDerWaalsContact C-N 3.29Å; N85-L87 PolarHBondContact O-N 3.34Å; L87-G89 PolarHBondContact O-N 3.37Å; L87-I90 HydrophobicContact CD1-CD1 4.4Å; L87-I90 WeakPolarHBondContact O-CB 3.45Å; L87-I90 PolarHBondContact O-N 2.74Å; L87-I90 VanDerWaalsContact O-N 3.16Å; L87-I91 HydrophobicContact CG-CD1 4.39Å; L87-I91 WeakPolarHBondContact O-CG1 3.46Å; L87-I91 PolarHBondContact O-N 3.4Å
88	L	89.7	Confident	84.3	Confident	63 Å²	63	52.3 Å²	52.3	33%	0.33	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-36.9	173.6	-59.6	179	0	0	0	111.3	F68 P84 N85 I91 F92	F68-L88 HydrophobicContact CD2-CD1 4.1Å; F68-L88 HydrophobicContact CE2-CD1 3.38Å; F68-L88 HydrophobicContact CZ-CD1 4.13Å; P84-L88 PolarHBondContact O-N 3.43Å; N85-L88 WeakPolarHBondContact O-CB 3.27Å; N85-L88 PolarHBondContact O-N 3.49Å; L88-I91 PolarHBondContact O-N 3.25Å; L88-F92 VanDerWaalsContact O-CB 3.28Å; L88-F92 WeakPolarHBondContact O-CB 3.21Å; L88-F92 PolarHBondContact O-N 3.28Å
89	G	92.6	Very high	86	Confident	14 Å²	14	47.4 Å²	47.4	14%	0.144	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-48	170.3	0	0	0	0	0	112.8	N85 S86 L87 I91 F92 Y93	N85-G89 PolarHBondContact O-N 2.9Å; S86-G89 PolarHBondContact O-N 3.31Å; L87-G89 PolarHBondContact O-N 3.37Å; G89-I91 VanDerWaalsContact C-N 3.35Å; G89-I91 PolarHBondContact O-N 2.98Å; G89-F92 WeakPolarHBondContact O-CB 3.48Å; G89-F92 PolarHBondContact O-N 2.94Å; G89-Y93 WeakPolarHBondContact O-CD2 3.37Å; G89-Y93 PolarHBondContact O-N 2.97Å
90	I	94.4	Very high	87.4	Confident	19 Å²	19	46.1 Å²	46.1	10%	0.097	26%	0.261	C	S	.	.	H	α-helix	trans	-57.4	-48.4	177.2	-65.7	167.7	0	0	0	110.9	L25 F29 L32 S86 L87 F92 T94	L25-I90 HydrophobicContact CD2-CB 4.47Å; L25-I90 HydrophobicContact CD2-CG2 4.11Å; F29-I90 HydrophobicContact CD1-CD1 3.76Å; F29-I90 HydrophobicContact CE1-CD1 3.7Å; F29-I90 HydrophobicContact CE1-CG1 4.45Å; F29-I90 HydrophobicContact CG-CD1 4.28Å; F29-I90 HydrophobicContact CZ-CD1 4.17Å; F29-I90 HydrophobicContact CZ-CG1 4.48Å; F29-I90 HydrophobicContact CZ-CG2 4.23Å; L32-I90 HydrophobicContact CD2-CD1 3.89Å; S86-I90 WeakPolarHBondContact O-CG1 3.47Å; S86-I90 PolarHBondContact O-N 3.06Å; L87-I90 HydrophobicContact CD1-CD1 4.4Å; L87-I90 WeakPolarHBondContact O-CB 3.45Å; L87-I90 PolarHBondContact O-N 2.74Å; L87-I90 VanDerWaalsContact O-N 3.16Å; I90-F92 PolarHBondContact O-N 3.23Å; I90-T94 VanDerWaalsContact O-CB 3.31Å; I90-T94 WeakPolarHBondContact O-CB 3.39Å; I90-T94 PolarHBondContact O-N 2.96Å; I90-T94 PolarHBondContact O-OG1 3.38Å
91	I	93.2	Very high	88.6	Confident	86 Å²	86	47.7 Å²	47.7	44%	0.441	26%	0.261	S	S	.	.	H	α-helix	trans	-60.9	-47.1	178.4	-65.5	167.3	0	0	0	110	L87 L88 G89 T94 L95	L87-I91 HydrophobicContact CG-CD1 4.39Å; L87-I91 WeakPolarHBondContact O-CG1 3.46Å; L87-I91 PolarHBondContact O-N 3.4Å; L88-I91 PolarHBondContact O-N 3.25Å; G89-I91 VanDerWaalsContact C-N 3.35Å; G89-I91 PolarHBondContact O-N 2.98Å; I91-T94 PolarHBondContact O-N 2.89Å; I91-L95 HydrophobicContact CG2-CD1 3.76Å; I91-L95 HydrophobicContact CG2-CG 4.31Å; I91-L95 WeakPolarHBondContact O-CB 3.32Å; I91-L95 VanDerWaalsContact O-CG 3.27Å; I91-L95 WeakPolarHBondContact O-CG 3.48Å; I91-L95 PolarHBondContact O-N 3.45Å
92	F	94.9	Very high	89.7	Confident	25 Å²	25	45.2 Å²	45.2	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-57.8	-53.4	179.2	170.4	-106.5	0	0	0	112.5	L88 G89 I90 T94 L95 Q96 A114 N147 L150	L88-F92 VanDerWaalsContact O-CB 3.28Å; L88-F92 WeakPolarHBondContact O-CB 3.21Å; L88-F92 PolarHBondContact O-N 3.28Å; G89-F92 WeakPolarHBondContact O-CB 3.48Å; G89-F92 PolarHBondContact O-N 2.94Å; I90-F92 PolarHBondContact O-N 3.23Å; F92-T94 VanDerWaalsContact C-N 3.32Å; F92-T94 PolarHBondContact O-N 3.48Å; F92-L95 PolarHBondContact O-N 2.97Å; F92-Q96 HydrophobicContact CD1-CG 4.48Å; F92-Q96 HydrophobicContact CD2-CG 4.15Å; F92-Q96 HydrophobicContact CE1-CG 4.15Å; F92-Q96 HydrophobicContact CE2-CG 3.78Å; F92-Q96 VanDerWaalsContact CE2-NE2 3.27Å; F92-Q96 HydrophobicContact CG-CG 4.48Å; F92-Q96 HydrophobicContact CZ-CG 3.78Å; F92-Q96 WeakPolarHBondContact O-CB 3.36Å; F92-Q96 WeakPolarHBondContact O-CG 3.41Å; F92-Q96 PolarHBondContact O-N 3.03Å; F92-A114 HydrophobicContact CD2-CB 4.46Å; F92-A114 HydrophobicContact CE2-CB 4.17Å; F92-A114 WeakPolarHBondContact CE2-O 3.42Å; F92-N147 WeakPolarHBondContact CE1-OD1 3.42Å; F92-L150 HydrophobicContact CE1-CD1 4.01Å; F92-L150 HydrophobicContact CZ-CD1 4.44Å
93	Y	96.3	Very high	89.9	Confident	1 Å²	1	48.7 Å²	48.7	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-67.4	-33.2	-178	-63.9	-56.6	0	0	0	112.6	G24 S28 G89 Q96 L97 T143 V146 N147 L150	G24-Y93 VanDerWaalsContact CA-CE2 3.46Å; G24-Y93 WeakPolarHBondContact O-CD2 3.49Å; G24-Y93 WeakPolarHBondContact O-CE2 3.42Å; S28-Y93 WeakPolarHBondContact OG-CD2 3.43Å; S28-Y93 VanDerWaalsContact OG-CE2 3.3Å; S28-Y93 WeakPolarHBondContact OG-CE2 3.33Å; G89-Y93 WeakPolarHBondContact O-CD2 3.37Å; G89-Y93 PolarHBondContact O-N 2.97Å; Y93-Q96 PolarHBondContact O-N 3.39Å; Y93-L97 PolarHBondContact O-N 3.17Å; Y93-L97 VanDerWaalsContact O-N 3.07Å; Y93-T143 WeakPolarHBondContact OH-CG2 3.28Å; Y93-V146 HydrophobicContact CE1-CG1 3.76Å; Y93-N147 WeakPolarHBondContact CE1-OD1 3.48Å; Y93-N147 PolarHBondContact OH-OD1 2.89Å; Y93-L150 HydrophobicContact CD1-CD1 3.75Å; Y93-L150 HydrophobicContact CE1-CD1 3.58Å
94	T	94.8	Very high	90	Very high	70 Å²	70	47.9 Å²	47.9	43%	0.429	28%	0.276	S	S	.	.	H	α-helix	trans	-65.4	-45.9	173.9	-56.2	0	0	0	0	111.3	I90 I91 F92 Q96 L97 A98	I90-T94 VanDerWaalsContact O-CB 3.31Å; I90-T94 WeakPolarHBondContact O-CB 3.39Å; I90-T94 PolarHBondContact O-N 2.96Å; I90-T94 PolarHBondContact O-OG1 3.38Å; I91-T94 PolarHBondContact O-N 2.89Å; F92-T94 VanDerWaalsContact C-N 3.32Å; F92-T94 PolarHBondContact O-N 3.48Å; T94-Q96 VanDerWaalsContact C-N 3.33Å; T94-Q96 PolarHBondContact O-N 2.88Å; T94-L97 PolarHBondContact O-N 2.99Å; T94-A98 WeakPolarHBondContact O-CB 3.34Å; T94-A98 PolarHBondContact O-N 2.86Å
95	L	93.2	Very high	89.9	Confident	97 Å²	97	50.1 Å²	50.1	51%	0.508	29%	0.292	S	S	.	.	H	α-helix	trans	-63.3	-39.3	176.2	-72.7	173.1	0	0	0	111.9	I91 F92 L97 A98 L99	I91-L95 HydrophobicContact CG2-CD1 3.76Å; I91-L95 HydrophobicContact CG2-CG 4.31Å; I91-L95 WeakPolarHBondContact O-CB 3.32Å; I91-L95 VanDerWaalsContact O-CG 3.27Å; I91-L95 WeakPolarHBondContact O-CG 3.48Å; I91-L95 PolarHBondContact O-N 3.45Å; F92-L95 PolarHBondContact O-N 2.97Å; L95-L97 VanDerWaalsContact C-N 3.34Å; L95-L97 PolarHBondContact O-N 3.44Å; L95-A98 PolarHBondContact O-N 3.42Å; L95-L99 VanDerWaalsContact O-CB 3.32Å; L95-L99 WeakPolarHBondContact O-CB 3.46Å; L95-L99 WeakPolarHBondContact O-CG 3.08Å; L95-L99 PolarHBondContact O-N 2.96Å
96	Q	94	Very high	89.9	Confident	3 Å²	3	58.6 Å²	58.6	1%	0.014	32%	0.322	C	S	.	.	H	α-helix	trans	-59.9	-43	175.5	-73.4	-77.1	-23.9	0	0	111.8	R17 F92 Y93 T94 G100 L111 S115 N154	R17-Q96 WeakPolarHBondContact CD-O 3.49Å; F92-Q96 HydrophobicContact CD1-CG 4.48Å; F92-Q96 HydrophobicContact CD2-CG 4.15Å; F92-Q96 HydrophobicContact CE1-CG 4.15Å; F92-Q96 HydrophobicContact CE2-CG 3.78Å; F92-Q96 VanDerWaalsContact CE2-NE2 3.27Å; F92-Q96 HydrophobicContact CG-CG 4.48Å; F92-Q96 HydrophobicContact CZ-CG 3.78Å; F92-Q96 WeakPolarHBondContact O-CB 3.36Å; F92-Q96 WeakPolarHBondContact O-CG 3.41Å; F92-Q96 PolarHBondContact O-N 3.03Å; Y93-Q96 PolarHBondContact O-N 3.39Å; T94-Q96 VanDerWaalsContact C-N 3.33Å; T94-Q96 PolarHBondContact O-N 2.88Å; Q96-G100 WeakPolarHBondContact O-CA 3.3Å; Q96-G100 PolarHBondContact O-N 3.27Å; Q96-L111 HydrophobicContact CB-CD2 4.42Å; Q96-L111 HydrophobicContact CG-CD2 4.48Å; Q96-L111 PolarHBondContact NE2-O 2.98Å; Q96-S115 PolarHBondContact NE2-OG 3.43Å; Q96-N154 PolarHBondContact OE1-ND2 3.32Å
97	L	93.3	Very high	89.8	Confident	36 Å²	36	58.4 Å²	58.4	19%	0.188	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-49	174.9	-77.1	171.1	0	0	0	112.3	L18 C21 L25 Y93 T94 L95 G100 Q101	L18-L97 HydrophobicContact CD1-CD2 3.85Å; C21-L97 HydrophobicContact CB-CD1 3.75Å; C21-L97 HydrophobicContact CB-CD2 3.54Å; C21-L97 HydrophobicContact CB-CG 3.38Å; L25-L97 HydrophobicContact CD1-CD1 3.96Å; Y93-L97 PolarHBondContact O-N 3.17Å; Y93-L97 VanDerWaalsContact O-N 3.07Å; T94-L97 PolarHBondContact O-N 2.99Å; L95-L97 VanDerWaalsContact C-N 3.34Å; L95-L97 PolarHBondContact O-N 3.44Å; L97-G100 PolarHBondContact O-N 3.43Å; L97-Q101 PolarHBondContact O-N 3.4Å; L97-Q101 PolarHBondContact O-NE2 3.48Å
98	A	91.9	Very high	89.7	Confident	62 Å²	62	56 Å²	56	51%	0.512	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-51.2	-176.9	0	0	0	0	0	111.8	T94 L95 G100 Q101	T94-A98 WeakPolarHBondContact O-CB 3.34Å; T94-A98 PolarHBondContact O-N 2.86Å; L95-A98 PolarHBondContact O-N 3.42Å; A98-G100 VanDerWaalsContact C-N 3.26Å; A98-G100 PolarHBondContact O-N 3.43Å; A98-Q101 PolarHBondContact O-N 3.47Å
99	L	89.8	Confident	89.7	Confident	54 Å²	54	57.9 Å²	57.9	28%	0.283	32%	0.315	S	S	.	.	H	α-helix	trans	-67.9	-28.9	177.8	-67.2	175.8	0	0	0	112	L95 Q101 S102 L110 L111	L95-L99 VanDerWaalsContact O-CB 3.32Å; L95-L99 WeakPolarHBondContact O-CB 3.46Å; L95-L99 WeakPolarHBondContact O-CG 3.08Å; L95-L99 PolarHBondContact O-N 2.96Å; L99-Q101 PolarHBondContact O-N 2.9Å; L99-S102 WeakPolarHBondContact O-CB 3.03Å; L99-S102 PolarHBondContact O-N 3.01Å; L99-L110 HydrophobicContact CD1-CB 4.33Å; L99-L111 HydrophobicContact CB-CD1 4.2Å; L99-L111 HydrophobicContact CB-CD2 3.7Å; L99-L111 HydrophobicContact CB-CG 3.8Å; L99-L111 HydrophobicContact CD1-CD2 4.43Å; L99-L111 HydrophobicContact CD1-CG 4.48Å
100	G	87.1	Confident	89.7	Confident	5 Å²	5	61.3 Å²	61.3	5%	0.052	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-21.6	176.1	0	0	0	0	0	114.7	R17 Q96 L97 A98 S102 R157	R17-G100 PolarHBondContact NH1-O 3.18Å; Q96-G100 WeakPolarHBondContact O-CA 3.3Å; Q96-G100 PolarHBondContact O-N 3.27Å; L97-G100 PolarHBondContact O-N 3.43Å; A98-G100 VanDerWaalsContact C-N 3.26Å; A98-G100 PolarHBondContact O-N 3.43Å; G100-S102 VanDerWaalsContact C-N 3.3Å; G100-R157 PolarHBondContact O-NH1 2.96Å; G100-R157 VanDerWaalsContact O-NH1 3.16Å; G100-R157 PolarHBondContact O-NH2 3.01Å
101	Q	85.8	Confident	89.6	Confident	152 Å²	152	60.4 Å²	60.4	71%	0.71	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-18.9	173.5	-55.7	-49.4	-59.9	0	0	112.7	L97 A98 L99	L97-Q101 PolarHBondContact O-N 3.4Å; L97-Q101 PolarHBondContact O-NE2 3.48Å; A98-Q101 PolarHBondContact O-N 3.47Å; L99-Q101 PolarHBondContact O-N 2.9Å
102	S	84.8	Confident	89.7	Confident	49 Å²	49	56.6 Å²	56.6	34%	0.343	31%	0.305	S	S	.	.			trans	-89.1	128.5	-177.5	-173.3	0	0	0	0	112.3	L99 G100 S104 R157	L99-S102 WeakPolarHBondContact O-CB 3.03Å; L99-S102 PolarHBondContact O-N 3.01Å; G100-S102 VanDerWaalsContact C-N 3.3Å; S102-S104 PolarHBondContact O-N 2.98Å; S102-S104 WeakPolarHBondContact OG-CB 3.2Å; S102-S104 PolarHBondContact OG-N 2.87Å; S102-R157 PolarHBondContact O-NH2 3.02Å
103	V	77.3	Confident	89.6	Confident	113 Å²	113	59.4 Å²	59.4	69%	0.685	32%	0.321	S	S	*	.			trans	-81.6	6.8	174.9	-69.5	0	0	0	0	113.8
104	S	83.9	Confident	89.5	Confident	51 Å²	51	61 Å²	61	36%	0.357	34%	0.335	S	S	.	.			trans	-72.5	137.4	-178.2	179.1	0	0	0	0	113	S102 R106 A107 A108	S102-S104 PolarHBondContact O-N 2.98Å; S102-S104 WeakPolarHBondContact OG-CB 3.2Å; S102-S104 PolarHBondContact OG-N 2.87Å; S104-R106 PolarHBondContact O-N 2.86Å; S104-R106 PolarHBondContact OG-N 3.38Å; S104-A107 WeakPolarHBondContact O-CB 3.33Å; S104-A107 PolarHBondContact O-N 3.34Å; S104-A107 VanDerWaalsContact O-N 3.11Å; S104-A108 PolarHBondContact O-N 2.98Å
105	S	83	Confident	89.4	Confident	60 Å²	60	57.7 Å²	57.7	42%	0.42	31%	0.314	S	S	.	.	H	α-helix	trans	-59.5	-33.4	172.8	-52.2	0	0	0	0	112.6	A108 F109	S105-A108 PolarHBondContact O-N 3.46Å; S105-F109 PolarHBondContact O-N 3.45Å
106	R	87.6	Confident	89.5	Confident	206 Å²	206	60 Å²	60	78%	0.777	32%	0.316	S	S	*	.	H	α-helix	trans	-65.4	-42.6	175.3	-66.5	-176.6	-175.7	165.9	1.2	111.1	S104 F109 L110	S104-R106 PolarHBondContact O-N 2.86Å; S104-R106 PolarHBondContact OG-N 3.38Å; R106-F109 PolarHBondContact O-N 3.26Å; R106-L110 WeakPolarHBondContact O-CG 3.49Å; R106-L110 PolarHBondContact O-N 3.39Å
107	A	88.6	Confident	89.5	Confident	8 Å²	8	64.7 Å²	64.7	7%	0.066	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-41.7	176	0	0	0	0	0	111.4	S104 F109 L110 L111	S104-A107 WeakPolarHBondContact O-CB 3.33Å; S104-A107 PolarHBondContact O-N 3.34Å; S104-A107 VanDerWaalsContact O-N 3.11Å; A107-F109 PolarHBondContact O-N 2.95Å; A107-L110 PolarHBondContact O-N 3.47Å; A107-L111 WeakPolarHBondContact O-CB 3.41Å; A107-L111 VanDerWaalsContact O-CG 3.29Å; A107-L111 WeakPolarHBondContact O-CG 3.28Å; A107-L111 PolarHBondContact O-N 3.34Å
108	A	88.1	Confident	89.5	Confident	3 Å²	3	64 Å²	64	3%	0.025	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-39.7	175.4	0	0	0	0	0	112.9	S104 S105 V112 L161	S104-A108 PolarHBondContact O-N 2.98Å; S105-A108 PolarHBondContact O-N 3.46Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 2.06Å; A108-L161 HydrophobicContact CB-CD1 3.65Å
109	F	89.8	Confident	89.6	Confident	101 Å²	101	62 Å²	62	44%	0.443	32%	0.324	S	S	.	.	H	α-helix	trans	-63.3	-48	173.6	176.8	-98.3	0	0	0	112	S105 R106 A107 L111 V112 L113	S105-F109 PolarHBondContact O-N 3.45Å; R106-F109 PolarHBondContact O-N 3.26Å; A107-F109 PolarHBondContact O-N 2.95Å; F109-L111 VanDerWaalsContact C-N 3.33Å; F109-L111 PolarHBondContact O-N 2.91Å; F109-V112 PolarHBondContact O-N 3.16Å; F109-L113 HydrophobicContact CE1-CD2 4.34Å; F109-L113 WeakPolarHBondContact O-CB 3.01Å; F109-L113 PolarHBondContact O-N 2.77Å
110	L	92.4	Very high	89.7	Confident	86 Å²	86	62.3 Å²	62.3	45%	0.45	33%	0.334	S	S	.	.	H	α-helix	trans	-61.5	-39.5	178.2	-70.2	175.2	0	0	0	112.3	L99 R106 A107 L113 A114	L99-L110 HydrophobicContact CD1-CB 4.33Å; R106-L110 WeakPolarHBondContact O-CG 3.49Å; R106-L110 PolarHBondContact O-N 3.39Å; A107-L110 PolarHBondContact O-N 3.47Å; L110-L113 PolarHBondContact O-N 2.78Å; L110-A114 WeakPolarHBondContact O-CB 3.39Å; L110-A114 PolarHBondContact O-N 2.83Å
111	L	92.9	Very high	89.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.2	-46.9	174.8	-79.4	166.8	0	0	0	112	Q96 L99 A107 F109 S115 N154	Q96-L111 HydrophobicContact CB-CD2 4.42Å; Q96-L111 HydrophobicContact CG-CD2 4.48Å; Q96-L111 PolarHBondContact NE2-O 2.98Å; L99-L111 HydrophobicContact CB-CD1 4.2Å; L99-L111 HydrophobicContact CB-CD2 3.7Å; L99-L111 HydrophobicContact CB-CG 3.8Å; L99-L111 HydrophobicContact CD1-CD2 4.43Å; L99-L111 HydrophobicContact CD1-CG 4.48Å; A107-L111 WeakPolarHBondContact O-CB 3.41Å; A107-L111 VanDerWaalsContact O-CG 3.29Å; A107-L111 WeakPolarHBondContact O-CG 3.28Å; A107-L111 PolarHBondContact O-N 3.34Å; F109-L111 VanDerWaalsContact C-N 3.33Å; F109-L111 PolarHBondContact O-N 2.91Å; L111-S115 WeakPolarHBondContact O-CB 3.5Å; L111-S115 PolarHBondContact O-N 2.93Å; L111-S115 PolarHBondContact O-OG 3.42Å; L111-S115 VanDerWaalsContact O-OG 3.04Å; L111-N154 HydrophobicContact CB-CB 4.46Å; L111-N154 PolarHBondContact O-ND2 2.86Å
112	V	93.6	Very high	90.2	Very high	6 Å²	6	55.9 Å²	55.9	4%	0.036	31%	0.307	C	S	.	.	H	α-helix	trans	-65	-43.8	177.5	170.1	0	0	0	0	111	A108 F109 S115 W116 N154 L155 R158	A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 2.06Å; F109-V112 PolarHBondContact O-N 3.16Å; V112-S115 PolarHBondContact O-N 3.44Å; V112-W116 PolarHBondContact O-N 2.91Å; V112-N154 HydrophobicContact CG2-CB 3.84Å; V112-L155 HydrophobicContact CG1-CD2 3.79Å; V112-L155 HydrophobicContact CG2-CD2 4.27Å; V112-R158 HydrophobicContact CG2-CB 4.15Å
113	L	94.3	Very high	90.6	Very high	85 Å²	85	59.2 Å²	59.2	45%	0.445	32%	0.32	S	S	.	.	H	α-helix	trans	-60.3	-48.7	177.7	-178.3	64.6	0	0	0	111.3	F109 L110 S115 W116 V117	F109-L113 HydrophobicContact CE1-CD2 4.34Å; F109-L113 WeakPolarHBondContact O-CB 3.01Å; F109-L113 PolarHBondContact O-N 2.77Å; L110-L113 PolarHBondContact O-N 2.78Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 3.36Å; L113-W116 WeakPolarHBondContact O-CB 3.28Å; L113-W116 PolarHBondContact O-N 3.21Å; L113-V117 WeakPolarHBondContact O-CG2 3.38Å; L113-V117 PolarHBondContact O-N 2.9Å
114	A	92.7	Very high	91.3	Very high	35 Å²	35	57.6 Å²	57.6	29%	0.289	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-40.1	176.6	0	0	0	0	0	111.9	F92 L110 V117 S118	F92-A114 HydrophobicContact CD2-CB 4.46Å; F92-A114 HydrophobicContact CE2-CB 4.17Å; F92-A114 WeakPolarHBondContact CE2-O 3.42Å; L110-A114 WeakPolarHBondContact O-CB 3.39Å; L110-A114 PolarHBondContact O-N 2.83Å; A114-V117 PolarHBondContact O-N 3.42Å; A114-S118 WeakPolarHBondContact O-CB 3.27Å; A114-S118 PolarHBondContact O-N 3.4Å
115	S	94.3	Very high	91.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-37.1	175.5	-68	0	0	0	0	112.9	Q96 L111 V112 L113 S118 M119 N154	Q96-S115 PolarHBondContact NE2-OG 3.43Å; L111-S115 WeakPolarHBondContact O-CB 3.5Å; L111-S115 PolarHBondContact O-N 2.93Å; L111-S115 PolarHBondContact O-OG 3.42Å; L111-S115 VanDerWaalsContact O-OG 3.04Å; V112-S115 PolarHBondContact O-N 3.44Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 3.36Å; S115-S118 PolarHBondContact O-N 2.99Å; S115-M119 WeakPolarHBondContact O-CB 3.42Å; S115-M119 PolarHBondContact O-N 3.03Å; S115-N154 PolarHBondContact OG-ND2 3.44Å
116	W	94.9	Very high	91.9	Very high	144 Å²	144	55 Å²	55	55%	0.545	29%	0.285	S	S	.	.	H	α-helix	trans	-64.8	-44.5	174.2	-90.8	113.9	0	0	0	112.5	V112 L113 S118 M119 A120 L151	V112-W116 PolarHBondContact O-N 2.91Å; L113-W116 WeakPolarHBondContact O-CB 3.28Å; L113-W116 PolarHBondContact O-N 3.21Å; W116-S118 VanDerWaalsContact C-N 3.33Å; W116-S118 PolarHBondContact O-N 3.47Å; W116-M119 WeakPolarHBondContact O-CB 3.5Å; W116-M119 PolarHBondContact O-N 2.91Å; W116-A120 PolarHBondContact O-N 3Å; W116-L151 HydrophobicContact CD2-CD1 4.34Å; W116-L151 HydrophobicContact CD2-CD2 4.26Å; W116-L151 HydrophobicContact CE3-CD2 4.38Å; W116-L151 HydrophobicContact CG-CD1 4.18Å; W116-L151 HydrophobicContact CZ2-CD2 4.44Å
117	V	93	Very high	91.9	Very high	102 Å²	102	46.4 Å²	46.4	62%	0.618	26%	0.261	S	S	*	.	H	α-helix	trans	-59.8	-46.2	175.3	173.7	0	0	0	0	110.5	L113 A114 M119 A120 G121	L113-V117 WeakPolarHBondContact O-CG2 3.38Å; L113-V117 PolarHBondContact O-N 2.9Å; A114-V117 PolarHBondContact O-N 3.42Å; V117-M119 VanDerWaalsContact C-N 3.31Å; V117-M119 PolarHBondContact O-N 3.29Å; V117-A120 PolarHBondContact O-N 3.07Å; V117-G121 PolarHBondContact O-N 3.18Å
118	S	93.1	Very high	91.9	Very high	22 Å²	22	46.4 Å²	46.4	15%	0.154	26%	0.259	C	S	.	.	H	α-helix	trans	-60.7	-39.2	176.3	-179.1	0	0	0	0	112.5	A114 S115 W116 G121 S122 N147	A114-S118 WeakPolarHBondContact O-CB 3.27Å; A114-S118 PolarHBondContact O-N 3.4Å; S115-S118 PolarHBondContact O-N 2.99Å; W116-S118 VanDerWaalsContact C-N 3.33Å; W116-S118 PolarHBondContact O-N 3.47Å; S118-G121 PolarHBondContact O-N 3.19Å; S118-S122 WeakPolarHBondContact O-CB 3.24Å; S118-S122 PolarHBondContact O-N 3.2Å; S118-S122 PolarHBondContact O-OG 3.3Å; S118-N147 PolarHBondContact OG-ND2 2.99Å; S118-N147 PolarHBondContact OG-OD1 3.14Å
119	M	94.6	Very high	91.8	Very high	20 Å²	20	46.9 Å²	46.9	10%	0.099	26%	0.262	C	S	.	.	H	α-helix	trans	-65.5	-45.4	175.7	-173.5	53.2	57.4	0	0	112.3	S115 W116 V117 G121 S122 L123 N147 F148 L151	S115-M119 WeakPolarHBondContact O-CB 3.42Å; S115-M119 PolarHBondContact O-N 3.03Å; W116-M119 WeakPolarHBondContact O-CB 3.5Å; W116-M119 PolarHBondContact O-N 2.91Å; V117-M119 VanDerWaalsContact C-N 3.31Å; V117-M119 PolarHBondContact O-N 3.29Å; M119-G121 VanDerWaalsContact C-N 3.33Å; M119-G121 PolarHBondContact O-N 3.49Å; M119-S122 WeakPolarHBondContact O-CB 3.4Å; M119-S122 PolarHBondContact O-N 2.92Å; M119-S122 VanDerWaalsContact O-N 3.13Å; M119-L123 HydrophobicContact CG-CD1 4.34Å; M119-L123 WeakPolarHBondContact O-CG 3.33Å; M119-L123 PolarHBondContact O-N 3.46Å; M119-L123 HydrophobicContact SD-CG 4.34Å; M119-N147 HydrophobicContact CE-CB 4.25Å; M119-F148 HydrophobicContact CE-CB 3.58Å; M119-F148 HydrophobicContact CE-CD2 3.98Å; M119-F148 HydrophobicContact CE-CG 4.28Å; M119-F148 VanDerWaalsContact CE-N 3.28Å; M119-L151 HydrophobicContact CB-CD2 4.37Å; M119-L151 HydrophobicContact CE-CD2 4.48Å; M119-L151 HydrophobicContact CG-CD2 4.37Å
120	A	92.6	Very high	91.6	Very high	60 Å²	60	45.4 Å²	45.4	50%	0.496	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-44.8	176.8	0	0	0	0	0	111.3	W116 V117 S122 L123 Y124	W116-A120 PolarHBondContact O-N 3Å; V117-A120 PolarHBondContact O-N 3.07Å; A120-S122 VanDerWaalsContact C-N 3.34Å; A120-S122 PolarHBondContact O-N 3.28Å; A120-L123 PolarHBondContact O-N 3.07Å; A120-Y124 WeakPolarHBondContact O-CB 3.3Å; A120-Y124 PolarHBondContact O-N 2.96Å
121	G	91.1	Very high	91.4	Very high	14 Å²	14	50 Å²	50	14%	0.144	29%	0.285	C	S	.	.	H	α-helix	trans	-61.6	-39.7	173.5	0	0	0	0	0	113	V117 S118 M119 Y124 L125	V117-G121 PolarHBondContact O-N 3.18Å; S118-G121 PolarHBondContact O-N 3.19Å; M119-G121 VanDerWaalsContact C-N 3.33Å; M119-G121 PolarHBondContact O-N 3.49Å; G121-Y124 PolarHBondContact O-N 2.62Å; G121-L125 WeakPolarHBondContact O-CG 3.4Å; G121-L125 PolarHBondContact O-N 3.17Å
122	S	92.6	Very high	91	Very high	9 Å²	9	54.5 Å²	54.5	6%	0.063	31%	0.308	C	S	.	.	H	α-helix	trans	-63.8	-45.2	177.2	-60.1	0	0	0	0	112	S118 M119 A120 L125 A126 N147	S118-S122 WeakPolarHBondContact O-CB 3.24Å; S118-S122 PolarHBondContact O-N 3.2Å; S118-S122 PolarHBondContact O-OG 3.3Å; M119-S122 WeakPolarHBondContact O-CB 3.4Å; M119-S122 PolarHBondContact O-N 2.92Å; M119-S122 VanDerWaalsContact O-N 3.13Å; A120-S122 VanDerWaalsContact C-N 3.34Å; A120-S122 PolarHBondContact O-N 3.28Å; S122-L125 PolarHBondContact O-N 3.35Å; S122-A126 VanDerWaalsContact O-CB 3.27Å; S122-A126 WeakPolarHBondContact O-CB 2.85Å; S122-A126 PolarHBondContact O-N 2.04Å; S122-N147 PolarHBondContact OG-ND2 2.99Å
123	L	93.1	Very high	90.5	Very high	118 Å²	118	56.1 Å²	56.1	62%	0.618	32%	0.316	S	S	*	.	H	α-helix	trans	-64.7	-41	177	-69.7	173.4	0	0	0	111.9	M119 A120 A126 G127	M119-L123 HydrophobicContact CG-CD1 4.34Å; M119-L123 WeakPolarHBondContact O-CG 3.33Å; M119-L123 PolarHBondContact O-N 3.46Å; M119-L123 HydrophobicContact SD-CG 4.34Å; A120-L123 PolarHBondContact O-N 3.07Å; L123-A126 PolarHBondContact O-N 3.4Å; L123-G127 PolarHBondContact O-N 3.41Å
124	Y	91.6	Very high	89.8	Confident	79 Å²	79	54.6 Å²	54.6	31%	0.31	32%	0.321	S	S	.	.	H	α-helix	trans	-60.4	-50.9	174.7	167.5	-101.9	0	0	0	111.5	F68 L70 A120 G121 A126 G127 V128	F68-Y124 HydrophobicContact CB-CD1 4.49Å; F68-Y124 HydrophobicContact CB-CE1 4.05Å; F68-Y124 HydrophobicContact CD1-CD1 4.45Å; F68-Y124 VanDerWaalsContact O-CE1 3.24Å; F68-Y124 WeakPolarHBondContact O-CE1 3.1Å; F68-Y124 PolarHBondContact O-OH 2.97Å; F68-Y124 VanDerWaalsContact O-OH 3.07Å; L70-Y124 HydrophobicContact CD1-CE1 4.36Å; A120-Y124 WeakPolarHBondContact O-CB 3.3Å; A120-Y124 PolarHBondContact O-N 2.96Å; G121-Y124 PolarHBondContact O-N 2.62Å; Y124-A126 VanDerWaalsContact C-N 3.33Å; Y124-A126 PolarHBondContact O-N 2.93Å; Y124-G127 PolarHBondContact O-N 3.44Å; Y124-V128 HydrophobicContact CE1-CG2 4.15Å; Y124-V128 HydrophobicContact CE2-CG2 4.12Å; Y124-V128 WeakPolarHBondContact O-CG2 3.3Å; Y124-V128 PolarHBondContact O-N 2.78Å
125	L	88.8	Confident	89.4	Confident	23 Å²	23	54 Å²	54	12%	0.12	31%	0.313	C	S	.	.	H	α-helix	trans	-66.6	-33.8	179.3	-68	175.3	0	0	0	112.5	W64 F68 G121 S122 G127 V128 L129 Y144	W64-L125 HydrophobicContact CB-CD2 4.4Å; F68-L125 HydrophobicContact CD1-CD1 3.78Å; F68-L125 HydrophobicContact CD1-CD2 4.05Å; F68-L125 HydrophobicContact CD1-CG 3.89Å; F68-L125 HydrophobicContact CE1-CD1 3.73Å; F68-L125 HydrophobicContact CE1-CG 4.25Å; G121-L125 WeakPolarHBondContact O-CG 3.4Å; G121-L125 PolarHBondContact O-N 3.17Å; S122-L125 PolarHBondContact O-N 3.35Å; L125-G127 VanDerWaalsContact C-N 3.34Å; L125-V128 WeakPolarHBondContact O-CB 2.99Å; L125-V128 PolarHBondContact O-N 3.21Å; L125-L129 WeakPolarHBondContact O-CB 3.36Å; L125-L129 WeakPolarHBondContact O-CG 3.19Å; L125-L129 PolarHBondContact O-N 3.36Å; L125-Y144 HydrophobicContact CB-CE1 4.38Å; L125-Y144 WeakPolarHBondContact CB-OH 3.27Å
126	A	90.6	Very high	88.9	Confident	34 Å²	34	59.4 Å²	59.4	28%	0.281	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-41.6	172.3	0	0	0	0	0	111.7	S122 L123 Y124 L129 A130 Y144	S122-A126 VanDerWaalsContact O-CB 3.27Å; S122-A126 WeakPolarHBondContact O-CB 2.85Å; S122-A126 PolarHBondContact O-N 2.04Å; L123-A126 PolarHBondContact O-N 3.4Å; Y124-A126 VanDerWaalsContact C-N 3.33Å; Y124-A126 PolarHBondContact O-N 2.93Å; A126-L129 PolarHBondContact O-N 3.46Å; A126-A130 WeakPolarHBondContact O-CB 3.35Å; A126-A130 PolarHBondContact O-N 3.38Å; A126-Y144 HydrophobicContact CB-CD2 4.12Å; A126-Y144 HydrophobicContact CB-CE2 3.78Å
127	G	88.6	Confident	88.6	Confident	26 Å²	26	52.6 Å²	52.6	27%	0.268	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-42.7	172.9	0	0	0	0	0	112.4	L123 Y124 L125 L129 A130 F131	L123-G127 PolarHBondContact O-N 3.41Å; Y124-G127 PolarHBondContact O-N 3.44Å; L125-G127 VanDerWaalsContact C-N 3.34Å; G127-L129 PolarHBondContact O-N 2.87Å; G127-A130 PolarHBondContact O-N 2.89Å; G127-F131 WeakPolarHBondContact O-CB 3.28Å; G127-F131 VanDerWaalsContact O-CD2 3.31Å; G127-F131 WeakPolarHBondContact O-CD2 3.38Å; G127-F131 PolarHBondContact O-N 2.93Å
128	V	88	Confident	88.4	Confident	7 Å²	7	50.2 Å²	50.2	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-45.2	175	168.8	0	0	0	0	111.5	W64 Y124 L125 I132 L133	W64-V128 HydrophobicContact CB-CG1 4.05Å; W64-V128 HydrophobicContact CD2-CG1 3.59Å; W64-V128 HydrophobicContact CE3-CG1 4.16Å; W64-V128 HydrophobicContact CG-CG1 3.56Å; W64-V128 HydrophobicContact CG-CG2 4.41Å; W64-V128 HydrophobicContact CZ2-CG1 4.38Å; Y124-V128 HydrophobicContact CE1-CG2 4.15Å; Y124-V128 HydrophobicContact CE2-CG2 4.12Å; Y124-V128 WeakPolarHBondContact O-CG2 3.3Å; Y124-V128 PolarHBondContact O-N 2.78Å; L125-V128 WeakPolarHBondContact O-CB 2.99Å; L125-V128 PolarHBondContact O-N 3.21Å; V128-I132 HydrophobicContact CB-CD1 4.32Å; V128-I132 HydrophobicContact CG1-CB 4.46Å; V128-I132 HydrophobicContact CG1-CD1 4.29Å; V128-I132 HydrophobicContact CG2-CD1 4Å; V128-I132 WeakPolarHBondContact O-CA 3.43Å; V128-I132 VanDerWaalsContact O-CB 3.3Å; V128-I132 WeakPolarHBondContact O-CB 3.49Å; V128-I132 PolarHBondContact O-N 3.21Å; V128-L133 HydrophobicContact CG1-CD1 3.61Å; V128-L133 PolarHBondContact O-N 2.84Å
129	L	85.6	Confident	88.3	Confident	14 Å²	14	49.7 Å²	49.7	7%	0.073	29%	0.292	C	S	.	.	I	π-helix	trans	-60	-48.5	176.7	-79.1	161.6	0	0	0	111.7	V59 L125 A126 G127 G134 D135 C137 C140 Y144	V59-L129 HydrophobicContact CB-CD2 4.26Å; V59-L129 HydrophobicContact CG1-CD2 3.77Å; V59-L129 HydrophobicContact CG2-CD2 3.41Å; V59-L129 VanDerWaalsContact CG2-CD2 3.41Å; L125-L129 WeakPolarHBondContact O-CB 3.36Å; L125-L129 WeakPolarHBondContact O-CG 3.19Å; L125-L129 PolarHBondContact O-N 3.36Å; A126-L129 PolarHBondContact O-N 3.46Å; G127-L129 PolarHBondContact O-N 2.87Å; L129-G134 PolarHBondContact O-N 3.15Å; L129-D135 WeakPolarHBondContact CD2-O 3.44Å; L129-C137 HydrophobicContact CD1-CB 4.45Å; L129-C137 HydrophobicContact CD2-CB 4.01Å; L129-C140 HydrophobicContact CD1-CB 3.95Å; L129-Y144 HydrophobicContact CD1-CE2 3.97Å; L129-Y144 VanDerWaalsContact CD1-OH 3.23Å; L129-Y144 WeakPolarHBondContact CD1-OH 3.31Å
130	A	85.4	Confident	88.1	Confident	69 Å²	69	49.2 Å²	49.2	57%	0.57	29%	0.291	S	S	*	.	I	π-helix	trans	-73.3	-41.4	-174.6	0	0	0	0	0	113.6	A126 G127	A126-A130 WeakPolarHBondContact O-CB 3.35Å; A126-A130 PolarHBondContact O-N 3.38Å; G127-A130 PolarHBondContact O-N 2.89Å
131	F	87.5	Confident	88.1	Confident	183 Å²	183	48.8 Å²	48.8	80%	0.803	28%	0.282	S	S	*	.	I	π-helix	trans	-104.5	-21.7	-170.1	-63.4	-69.8	0	0	0	114.3	G127	G127-F131 WeakPolarHBondContact O-CB 3.28Å; G127-F131 VanDerWaalsContact O-CD2 3.31Å; G127-F131 WeakPolarHBondContact O-CD2 3.38Å; G127-F131 PolarHBondContact O-N 2.93Å
132	I	85.7	Confident	88.2	Confident	95 Å²	95	49.8 Å²	49.8	49%	0.487	29%	0.287	S	S	.	.	I	π-helix	trans	-111.8	-53.2	-173.6	-46.6	179.2	0	0	0	112.1	W64 V128	W64-I132 HydrophobicContact CH2-CB 4.31Å; W64-I132 HydrophobicContact CH2-CG2 3.34Å; W64-I132 HydrophobicContact CZ2-CB 4.25Å; W64-I132 HydrophobicContact CZ2-CD1 3.78Å; W64-I132 HydrophobicContact CZ2-CG2 3.54Å; W64-I132 HydrophobicContact CZ3-CG2 4.31Å; V128-I132 HydrophobicContact CB-CD1 4.32Å; V128-I132 HydrophobicContact CG1-CB 4.46Å; V128-I132 HydrophobicContact CG1-CD1 4.29Å; V128-I132 HydrophobicContact CG2-CD1 4Å; V128-I132 WeakPolarHBondContact O-CA 3.43Å; V128-I132 VanDerWaalsContact O-CB 3.3Å; V128-I132 WeakPolarHBondContact O-CB 3.49Å; V128-I132 PolarHBondContact O-N 3.21Å
133	L	82.3	Confident	88.3	Confident	40 Å²	40	50.6 Å²	50.6	21%	0.209	29%	0.291	C	S	.	.	I	π-helix	trans	-80.5	-36.5	-179.2	-83.2	65.2	0	0	0	111.6	V59 W64 V128 D135	V59-L133 HydrophobicContact CB-CD2 4.29Å; V59-L133 HydrophobicContact CG2-CD2 3.8Å; W64-L133 HydrophobicContact CD2-CD1 4.18Å; W64-L133 HydrophobicContact CE3-CD1 3.45Å; W64-L133 VanDerWaalsContact CE3-CD1 3.45Å; W64-L133 HydrophobicContact CH2-CD1 3.92Å; W64-L133 HydrophobicContact CZ3-CD1 3.32Å; W64-L133 HydrophobicContact CZ3-CG 4.37Å; V128-L133 HydrophobicContact CG1-CD1 3.61Å; V128-L133 PolarHBondContact O-N 2.84Å; L133-D135 HydrophobicContact CB-CB 4.35Å; L133-D135 PolarHBondContact O-N 2.73Å
134	G	80.6	Confident	88.4	Confident	53 Å²	53	46.8 Å²	46.8	55%	0.546	27%	0.269	S	S	.	.			trans	68.8	21.4	-173.5	0	0	0	0	0	113.1	L129	L129-G134 PolarHBondContact O-N 3.15Å
135	D	83.7	Confident	88.6	Confident	23 Å²	23	46.8 Å²	46.8	12%	0.123	28%	0.277	C	S	.	.			trans	-111.7	140.9	-179.3	-81.9	-53.7	0	0	0	110.8	V59 L129 L133	V59-D135 HydrophobicContact CG2-CB 3.98Å; L129-D135 WeakPolarHBondContact CD2-O 3.44Å; L133-D135 HydrophobicContact CB-CB 4.35Å; L133-D135 PolarHBondContact O-N 2.73Å
136	F	83.4	Confident	89	Confident	112 Å²	112	45.9 Å²	45.9	49%	0.491	27%	0.273	S	S	.	.			trans	-97.4	109.1	174.4	-171.6	-101.2	0	0	0	111	S53 V54 V138 V141	S53-F136 PolarHBondContact O-N 3.49Å; V54-F136 WeakPolarHBondContact CA-O 3.45Å; V54-F136 HydrophobicContact CG1-CD1 4.25Å; V54-F136 VanDerWaalsContact CG1-O 3.28Å; V54-F136 WeakPolarHBondContact CG1-O 3.47Å; V54-F136 HydrophobicContact CG2-CB 4.32Å; F136-V138 HydrophobicContact CD1-CG2 4.09Å; F136-V138 HydrophobicContact CE1-CG2 3.9Å; F136-V141 HydrophobicContact CD2-CG2 4.43Å; F136-V141 HydrophobicContact CE2-CG2 3.8Å; F136-V141 HydrophobicContact CZ-CG2 3.95Å
137	C	87.9	Confident	89.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	26%	0.261	C	S	.	.			trans	-98.8	104.4	178.2	171.2	0	0	0	0	111.4	V59 L129 V139 C140 V141	V59-C137 HydrophobicContact CB-CB 4.4Å; V59-C137 HydrophobicContact CG1-CB 4.32Å; V59-C137 HydrophobicContact CG2-CB 4.08Å; L129-C137 HydrophobicContact CD1-CB 4.45Å; L129-C137 HydrophobicContact CD2-CB 4.01Å; C137-V139 VanDerWaalsContact C-N 3.31Å; C137-V139 PolarHBondContact O-N 3.19Å; C137-C140 HydrophobicContact CB-CB 3.59Å; C137-C140 WeakPolarHBondContact CB-SG 3.32Å; C137-C140 WeakPolarHBondContact O-CB 3.48Å; C137-C140 PolarHBondContact O-N 3.31Å; C137-C140 VanDerWaalsContact O-N 3.15Å; C137-C140 WeakPolarHBondContact SG-CB 3.45Å; C137-C140 PolarHBondContact SG-N 3.19Å; C137-C140 CovalentContact SG-SG 2.06Å; C137-C140 PolarHBondContact SG-SG 3Å; C137-V141 WeakPolarHBondContact O-CG2 3.49Å; C137-V141 PolarHBondContact O-N 2.67Å
138	V	88.8	Confident	89.7	Confident	53 Å²	53	49.1 Å²	49.1	32%	0.321	27%	0.274	S	S	.	.	H	α-helix	trans	-59.4	-40.6	-179.2	179.3	0	0	0	0	112.1	L50 V54 F136 C140 V141 S142	L50-V138 HydrophobicContact CD1-CG2 4.25Å; V54-V138 HydrophobicContact CG1-CG2 4.17Å; F136-V138 HydrophobicContact CD1-CG2 4.09Å; F136-V138 HydrophobicContact CE1-CG2 3.9Å; V138-C140 VanDerWaalsContact C-N 3.34Å; V138-C140 PolarHBondContact O-N 3.45Å; V138-V141 PolarHBondContact O-N 3.19Å; V138-S142 WeakPolarHBondContact O-CB 3.25Å; V138-S142 PolarHBondContact O-N 3.45Å; V138-S142 PolarHBondContact O-OG 2.97Å
139	V	92.1	Very high	90.1	Very high	10 Å²	10	52.1 Å²	52.1	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-42.5	177.8	175.8	0	0	0	0	111	L27 Y30 A31 C48 F60 C137 S142 T143	L27-V139 HydrophobicContact CB-CG1 4.42Å; L27-V139 HydrophobicContact CD2-CG1 4.34Å; Y30-V139 HydrophobicContact CD1-CG2 3.95Å; Y30-V139 HydrophobicContact CE1-CG2 3.92Å; A31-V139 HydrophobicContact CB-CG1 4.39Å; C48-V139 HydrophobicContact CB-CG2 3.91Å; F60-V139 HydrophobicContact CZ-CB 4.24Å; F60-V139 HydrophobicContact CZ-CG1 4Å; C137-V139 VanDerWaalsContact C-N 3.31Å; C137-V139 PolarHBondContact O-N 3.19Å; V139-S142 PolarHBondContact O-N 3.39Å; V139-T143 WeakPolarHBondContact O-CB 3.23Å; V139-T143 PolarHBondContact O-N 3.34Å; V139-T143 PolarHBondContact O-OG1 2.97Å
140	C	90.2	Very high	90.6	Very high	10 Å²	10	51.5 Å²	51.5	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-66.3	-49	179.2	-49.7	0	0	0	0	110.9	L129 C137 V138 S142 T143 Y144	L129-C140 HydrophobicContact CD1-CB 3.95Å; C137-C140 HydrophobicContact CB-CB 3.59Å; C137-C140 WeakPolarHBondContact CB-SG 3.32Å; C137-C140 WeakPolarHBondContact O-CB 3.48Å; C137-C140 PolarHBondContact O-N 3.31Å; C137-C140 VanDerWaalsContact O-N 3.15Å; C137-C140 WeakPolarHBondContact SG-CB 3.45Å; C137-C140 PolarHBondContact SG-N 3.19Å; C137-C140 CovalentContact SG-SG 2.06Å; C137-C140 PolarHBondContact SG-SG 3Å; V138-C140 VanDerWaalsContact C-N 3.34Å; V138-C140 PolarHBondContact O-N 3.45Å; C140-S142 VanDerWaalsContact C-N 3.3Å; C140-S142 PolarHBondContact O-N 3.02Å; C140-T143 WeakPolarHBondContact O-CA 3.5Å; C140-T143 VanDerWaalsContact O-CB 3.29Å; C140-T143 WeakPolarHBondContact O-CB 3.43Å; C140-T143 PolarHBondContact O-N 3.43Å; C140-Y144 HydrophobicContact CB-CE1 4.43Å; C140-Y144 HydrophobicContact CB-CE2 4.17Å; C140-Y144 WeakPolarHBondContact O-CD1 3.31Å; C140-Y144 WeakPolarHBondContact O-CD2 3.45Å; C140-Y144 WeakPolarHBondContact O-CE1 3.44Å; C140-Y144 PolarHBondContact O-N 3.16Å
141	V	91.9	Very high	91.1	Very high	51 Å²	51	48.7 Å²	48.7	31%	0.309	26%	0.261	S	S	.	.	H	α-helix	trans	-58.5	-43.6	176	174.7	0	0	0	0	111.1	F136 C137 V138 T143 Y144 V145	F136-V141 HydrophobicContact CD2-CG2 4.43Å; F136-V141 HydrophobicContact CE2-CG2 3.8Å; F136-V141 HydrophobicContact CZ-CG2 3.95Å; C137-V141 WeakPolarHBondContact O-CG2 3.49Å; C137-V141 PolarHBondContact O-N 2.67Å; V138-V141 PolarHBondContact O-N 3.19Å; V141-T143 VanDerWaalsContact C-N 3.3Å; V141-T143 PolarHBondContact O-N 3.4Å; V141-Y144 WeakPolarHBondContact O-CB 3.43Å; V141-Y144 PolarHBondContact O-N 3.25Å; V141-V145 WeakPolarHBondContact O-CG2 3.39Å; V141-V145 PolarHBondContact O-N 3.46Å
142	S	94.1	Very high	91.5	Very high	36 Å²	36	44.3 Å²	44.3	25%	0.252	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-42	175.6	-57.7	0	0	0	0	111.7	V138 V139 C140 Y144 V145 V146	V138-S142 WeakPolarHBondContact O-CB 3.25Å; V138-S142 PolarHBondContact O-N 3.45Å; V138-S142 PolarHBondContact O-OG 2.97Å; V139-S142 PolarHBondContact O-N 3.39Å; C140-S142 VanDerWaalsContact C-N 3.3Å; C140-S142 PolarHBondContact O-N 3.02Å; S142-Y144 VanDerWaalsContact C-N 3.34Å; S142-Y144 PolarHBondContact O-N 2.7Å; S142-V145 PolarHBondContact O-N 2.88Å; S142-V146 VanDerWaalsContact O-CG2 3.3Å; S142-V146 WeakPolarHBondContact O-CG2 3.3Å; S142-V146 PolarHBondContact O-N 2.88Å
143	T	95.1	Very high	91.9	Very high	26 Å²	26	39.9 Å²	39.9	16%	0.16	22%	0.219	C	C	.	.	H	α-helix	trans	-62.2	-40.7	176.5	-58.6	0	0	0	0	111.3	Y93 V139 C140 V141 V146 N147	Y93-T143 WeakPolarHBondContact OH-CG2 3.28Å; V139-T143 WeakPolarHBondContact O-CB 3.23Å; V139-T143 PolarHBondContact O-N 3.34Å; V139-T143 PolarHBondContact O-OG1 2.97Å; C140-T143 WeakPolarHBondContact O-CA 3.5Å; C140-T143 VanDerWaalsContact O-CB 3.29Å; C140-T143 WeakPolarHBondContact O-CB 3.43Å; C140-T143 PolarHBondContact O-N 3.43Å; V141-T143 VanDerWaalsContact C-N 3.3Å; V141-T143 PolarHBondContact O-N 3.4Å; T143-V146 PolarHBondContact O-N 2.93Å; T143-N147 WeakPolarHBondContact O-CB 3.38Å; T143-N147 PolarHBondContact O-N 2.97Å; T143-N147 PolarHBondContact O-ND2 2.92Å; T143-N147 PolarHBondContact O-OD1 3.44Å
144	Y	94.4	Very high	92.5	Very high	37 Å²	37	38 Å²	38	15%	0.145	21%	0.21	C	C	.	.	H	α-helix	trans	-64.7	-42.1	177.6	-53.1	-23.1	0	0	0	111.9	L125 A126 L129 C140 V141 S142 N147 F148	L125-Y144 HydrophobicContact CB-CE1 4.38Å; L125-Y144 WeakPolarHBondContact CB-OH 3.27Å; A126-Y144 HydrophobicContact CB-CD2 4.12Å; A126-Y144 HydrophobicContact CB-CE2 3.78Å; L129-Y144 HydrophobicContact CD1-CE2 3.97Å; L129-Y144 VanDerWaalsContact CD1-OH 3.23Å; L129-Y144 WeakPolarHBondContact CD1-OH 3.31Å; C140-Y144 HydrophobicContact CB-CE1 4.43Å; C140-Y144 HydrophobicContact CB-CE2 4.17Å; C140-Y144 WeakPolarHBondContact O-CD1 3.31Å; C140-Y144 WeakPolarHBondContact O-CD2 3.45Å; C140-Y144 WeakPolarHBondContact O-CE1 3.44Å; C140-Y144 PolarHBondContact O-N 3.16Å; V141-Y144 WeakPolarHBondContact O-CB 3.43Å; V141-Y144 PolarHBondContact O-N 3.25Å; S142-Y144 VanDerWaalsContact C-N 3.34Å; S142-Y144 PolarHBondContact O-N 2.7Å; Y144-N147 PolarHBondContact O-N 2.85Å; Y144-F148 PolarHBondContact O-N 3.33Å
145	V	96.5	Very high	93.1	Very high	80 Å²	80	38.7 Å²	38.7	49%	0.485	20%	0.2	S	C	.	.	H	α-helix	trans	-61.8	-46	174.2	174.8	0	0	0	0	110.7	V141 S142 N147 F148 L149	V141-V145 WeakPolarHBondContact O-CG2 3.39Å; V141-V145 PolarHBondContact O-N 3.46Å; S142-V145 PolarHBondContact O-N 2.88Å; V145-N147 VanDerWaalsContact C-N 3.33Å; V145-N147 PolarHBondContact O-N 3.25Å; V145-F148 WeakPolarHBondContact O-CB 3.2Å; V145-F148 PolarHBondContact O-N 2.95Å; V145-L149 HydrophobicContact CG1-CD1 4.03Å; V145-L149 HydrophobicContact CG1-CG 4.41Å; V145-L149 WeakPolarHBondContact O-CG 2.96Å; V145-L149 PolarHBondContact O-N 3.42Å
146	V	97.1	Very high	93.5	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.024	22%	0.215	C	C	.	.	H	α-helix	trans	-58.7	-45	176.4	172	0	0	0	0	111.3	L20 F23 L27 Y93 S142 T143 F148 L149 L150	L20-V146 HydrophobicContact CB-CG1 4.34Å; L20-V146 HydrophobicContact CD2-CG1 4.47Å; L20-V146 WeakPolarHBondContact O-CG1 3.36Å; F23-V146 HydrophobicContact CD1-CG2 3.53Å; F23-V146 HydrophobicContact CE1-CG2 3.88Å; L27-V146 HydrophobicContact CD1-CG2 4.46Å; Y93-V146 HydrophobicContact CE1-CG1 3.76Å; S142-V146 VanDerWaalsContact O-CG2 3.3Å; S142-V146 WeakPolarHBondContact O-CG2 3.3Å; S142-V146 PolarHBondContact O-N 2.88Å; T143-V146 PolarHBondContact O-N 2.93Å; V146-F148 VanDerWaalsContact C-N 3.3Å; V146-F148 PolarHBondContact O-N 3.04Å; V146-L149 PolarHBondContact O-N 3.15Å; V146-L150 HydrophobicContact CG1-CD1 4.04Å; V146-L150 HydrophobicContact CG1-CG 4.5Å; V146-L150 WeakPolarHBondContact O-CB 3.39Å; V146-L150 WeakPolarHBondContact O-CG 3.25Å; V146-L150 PolarHBondContact O-N 2.96Å
147	N	97	Very high	93.8	Very high	7 Å²	7	37.9 Å²	37.9	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-38.4	178.7	-68.8	-17.2	0	0	0	112	F92 Y93 S118 M119 S122 T143 Y144 V145 L150 L151	F92-N147 WeakPolarHBondContact CE1-OD1 3.42Å; Y93-N147 WeakPolarHBondContact CE1-OD1 3.48Å; Y93-N147 PolarHBondContact OH-OD1 2.89Å; S118-N147 PolarHBondContact OG-ND2 2.99Å; S118-N147 PolarHBondContact OG-OD1 3.14Å; M119-N147 HydrophobicContact CE-CB 4.25Å; S122-N147 PolarHBondContact OG-ND2 2.99Å; T143-N147 WeakPolarHBondContact O-CB 3.38Å; T143-N147 PolarHBondContact O-N 2.97Å; T143-N147 PolarHBondContact O-ND2 2.92Å; T143-N147 PolarHBondContact O-OD1 3.44Å; Y144-N147 PolarHBondContact O-N 2.85Å; V145-N147 VanDerWaalsContact C-N 3.33Å; V145-N147 PolarHBondContact O-N 3.25Å; N147-L150 PolarHBondContact O-N 3.15Å; N147-L151 PolarHBondContact O-N 2.6Å
148	F	96.6	Very high	93.9	Very high	121 Å²	121	41.6 Å²	41.6	53%	0.531	21%	0.209	S	C	.	.	H	α-helix	trans	-64.8	-47.7	175.3	-178.4	-99.5	0	0	0	112.3	M119 Y144 V145 V146 L150 L151 F152	M119-F148 HydrophobicContact CE-CB 3.58Å; M119-F148 HydrophobicContact CE-CD2 3.98Å; M119-F148 HydrophobicContact CE-CG 4.28Å; M119-F148 VanDerWaalsContact CE-N 3.28Å; Y144-F148 PolarHBondContact O-N 3.33Å; V145-F148 WeakPolarHBondContact O-CB 3.2Å; V145-F148 PolarHBondContact O-N 2.95Å; V146-F148 VanDerWaalsContact C-N 3.3Å; V146-F148 PolarHBondContact O-N 3.04Å; F148-L150 VanDerWaalsContact C-N 3.29Å; F148-L150 PolarHBondContact O-N 2.97Å; F148-L151 WeakPolarHBondContact O-CB 3.29Å; F148-L151 PolarHBondContact O-N 3.04Å; F148-F152 PolarHBondContact O-N 3.24Å
149	L	96.8	Very high	93.9	Very high	70 Å²	70	43.3 Å²	43.3	37%	0.366	22%	0.22	S	C	.	.	H	α-helix	trans	-64.1	-35.8	178.3	-65.4	175.8	0	0	0	111.8	L20 V145 V146 F152 T153	L20-L149 HydrophobicContact CD1-CB 3.66Å; L20-L149 HydrophobicContact CD2-CB 3.9Å; L20-L149 HydrophobicContact CD2-CD1 3.83Å; L20-L149 HydrophobicContact CG-CB 4.46Å; V145-L149 HydrophobicContact CG1-CD1 4.03Å; V145-L149 HydrophobicContact CG1-CG 4.41Å; V145-L149 WeakPolarHBondContact O-CG 2.96Å; V145-L149 PolarHBondContact O-N 3.42Å; V146-L149 PolarHBondContact O-N 3.15Å; L149-F152 PolarHBondContact O-N 3.22Å; L149-T153 WeakPolarHBondContact O-CB 3.48Å; L149-T153 PolarHBondContact O-N 3.42Å; L149-T153 PolarHBondContact O-OG1 2.9Å
150	L	95.9	Very high	93.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.3	-43.5	173.3	-78.8	172.3	0	0	0	112.2	R17 L20 F92 Y93 V146 N147 F148 F152 T153 N154	R17-L150 HydrophobicContact CG-CD2 4.19Å; L20-L150 HydrophobicContact CB-CD2 3.74Å; L20-L150 HydrophobicContact CB-CG 3.94Å; L20-L150 HydrophobicContact CD1-CD2 3.96Å; L20-L150 HydrophobicContact CD1-CG 4.06Å; F92-L150 HydrophobicContact CE1-CD1 4.01Å; F92-L150 HydrophobicContact CZ-CD1 4.44Å; Y93-L150 HydrophobicContact CD1-CD1 3.75Å; Y93-L150 HydrophobicContact CE1-CD1 3.58Å; V146-L150 HydrophobicContact CG1-CD1 4.04Å; V146-L150 HydrophobicContact CG1-CG 4.5Å; V146-L150 WeakPolarHBondContact O-CB 3.39Å; V146-L150 WeakPolarHBondContact O-CG 3.25Å; V146-L150 PolarHBondContact O-N 2.96Å; N147-L150 PolarHBondContact O-N 3.15Å; F148-L150 VanDerWaalsContact C-N 3.29Å; F148-L150 PolarHBondContact O-N 2.97Å; L150-F152 VanDerWaalsContact C-N 3.34Å; L150-F152 PolarHBondContact O-N 3.37Å; L150-T153 PolarHBondContact O-N 3.26Å; L150-N154 WeakPolarHBondContact O-CB 3.47Å; L150-N154 VanDerWaalsContact O-CG 3.26Å; L150-N154 PolarHBondContact O-N 3.45Å; L150-N154 PolarHBondContact O-ND2 3.5Å
151	L	96.1	Very high	93.5	Very high	11 Å²	11	43.3 Å²	43.3	6%	0.058	22%	0.219	C	C	.	.	H	α-helix	trans	-57.7	-48.5	174.5	177	59.6	0	0	0	110.8	W116 M119 N147 F148 T153 N154 L155	W116-L151 HydrophobicContact CD2-CD1 4.34Å; W116-L151 HydrophobicContact CD2-CD2 4.26Å; W116-L151 HydrophobicContact CE3-CD2 4.38Å; W116-L151 HydrophobicContact CG-CD1 4.18Å; W116-L151 HydrophobicContact CZ2-CD2 4.44Å; M119-L151 HydrophobicContact CB-CD2 4.37Å; M119-L151 HydrophobicContact CE-CD2 4.48Å; M119-L151 HydrophobicContact CG-CD2 4.37Å; N147-L151 PolarHBondContact O-N 2.6Å; F148-L151 WeakPolarHBondContact O-CB 3.29Å; F148-L151 PolarHBondContact O-N 3.04Å; L151-T153 PolarHBondContact O-N 3.47Å; L151-N154 PolarHBondContact O-N 2.92Å; L151-L155 HydrophobicContact CD1-CD1 4.12Å; L151-L155 HydrophobicContact CD1-CG 4.15Å; L151-L155 HydrophobicContact CG-CD1 4.06Å; L151-L155 WeakPolarHBondContact O-CB 3.45Å; L151-L155 VanDerWaalsContact O-CG 3.31Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 2.87Å
152	F	95.3	Very high	93.1	Very high	91 Å²	91	45 Å²	45	40%	0.399	22%	0.224	S	C	.	.	H	α-helix	trans	-58.8	-46.7	177.2	179.1	-102	0	0	0	112.2	W12 F148 L149 L150 N154 L155 K156	W12-F152 HydrophobicContact CH2-CD1 4.27Å; W12-F152 AromaticContact CH2-CE1 3.85Å; W12-F152 HydrophobicContact CH2-CE1 3.85Å; W12-F152 HydrophobicContact CZ2-CE1 4.44Å; F148-F152 PolarHBondContact O-N 3.24Å; L149-F152 PolarHBondContact O-N 3.22Å; L150-F152 VanDerWaalsContact C-N 3.34Å; L150-F152 PolarHBondContact O-N 3.37Å; F152-N154 VanDerWaalsContact C-N 3.34Å; F152-N154 PolarHBondContact O-N 3.42Å; F152-L155 PolarHBondContact O-N 2.99Å; F152-K156 HydrophobicContact CE1-CG 4.14Å; F152-K156 HydrophobicContact CE2-CG 4.35Å; F152-K156 HydrophobicContact CZ-CD 4.44Å; F152-K156 HydrophobicContact CZ-CG 4.06Å; F152-K156 WeakPolarHBondContact O-CG 3.18Å; F152-K156 PolarHBondContact O-N 2.66Å
153	T	94.2	Very high	92.6	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-43.7	178.4	-58	0	0	0	0	111.2	E13 L149 L150 L151 K156 R157	E13-T153 HydrophobicContact CG-CG2 3.83Å; L149-T153 WeakPolarHBondContact O-CB 3.48Å; L149-T153 PolarHBondContact O-N 3.42Å; L149-T153 PolarHBondContact O-OG1 2.9Å; L150-T153 PolarHBondContact O-N 3.26Å; L151-T153 PolarHBondContact O-N 3.47Å; T153-K156 PolarHBondContact O-N 2.9Å; T153-R157 PolarHBondContact O-N 3.5Å
154	N	94.4	Very high	91.9	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-68.9	-37.7	179.2	-73	-24.5	0	0	0	112.9	R17 Q96 L111 V112 S115 L150 L151 F152 R157 R158	R17-N154 PolarHBondContact NH2-OD1 3.32Å; Q96-N154 PolarHBondContact OE1-ND2 3.32Å; L111-N154 HydrophobicContact CB-CB 4.46Å; L111-N154 PolarHBondContact O-ND2 2.86Å; V112-N154 HydrophobicContact CG2-CB 3.84Å; S115-N154 PolarHBondContact OG-ND2 3.44Å; L150-N154 WeakPolarHBondContact O-CB 3.47Å; L150-N154 VanDerWaalsContact O-CG 3.26Å; L150-N154 PolarHBondContact O-N 3.45Å; L150-N154 PolarHBondContact O-ND2 3.5Å; L151-N154 PolarHBondContact O-N 2.92Å; F152-N154 VanDerWaalsContact C-N 3.34Å; F152-N154 PolarHBondContact O-N 3.42Å; N154-R157 PolarHBondContact O-N 3.39Å; N154-R158 WeakPolarHBondContact O-CB 3.35Å; N154-R158 PolarHBondContact O-N 3.34Å
155	L	93.6	Very high	91.1	Very high	66 Å²	66	51.1 Å²	51.1	35%	0.346	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-47	173.7	-73.6	171	0	0	0	111.2	V112 L151 F152 R157 R158 T159	V112-L155 HydrophobicContact CG1-CD2 3.79Å; V112-L155 HydrophobicContact CG2-CD2 4.27Å; L151-L155 HydrophobicContact CD1-CD1 4.12Å; L151-L155 HydrophobicContact CD1-CG 4.15Å; L151-L155 HydrophobicContact CG-CD1 4.06Å; L151-L155 WeakPolarHBondContact O-CB 3.45Å; L151-L155 VanDerWaalsContact O-CG 3.31Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 2.87Å; F152-L155 PolarHBondContact O-N 2.99Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 3.38Å; L155-R158 PolarHBondContact O-N 2.97Å; L155-T159 PolarHBondContact O-N 2.88Å; L155-T159 PolarHBondContact O-OG1 2.99Å
156	K	91.8	Very high	90.1	Very high	100 Å²	100	52.7 Å²	52.7	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-61.1	-40.7	176.8	-70.9	-63.8	-175.9	-176.2	0	112.3	P10 F152 T153 G160	P10-K156 HydrophobicContact CG-CB 4.32Å; F152-K156 HydrophobicContact CE1-CG 4.14Å; F152-K156 HydrophobicContact CE2-CG 4.35Å; F152-K156 HydrophobicContact CZ-CD 4.44Å; F152-K156 HydrophobicContact CZ-CG 4.06Å; F152-K156 WeakPolarHBondContact O-CG 3.18Å; F152-K156 PolarHBondContact O-N 2.66Å; T153-K156 PolarHBondContact O-N 2.9Å; K156-G160 PolarHBondContact O-N 3.13Å
157	R	89.9	Confident	89	Confident	18 Å²	18	61.1 Å²	61.1	7%	0.068	30%	0.303	C	S	.	.	H	α-helix	trans	-60.8	-47.7	173.3	-177.9	178.9	179.8	125.6	-17.8	111.7	V9 E13 G100 S102 T153 N154 L155 G160 L161	V9-R157 HydrophobicContact CG1-CG 4.2Å; V9-R157 HydrophobicContact CG2-CG 4.45Å; E13-R157 HydrophobicContact CG-CB 4.08Å; E13-R157 IonicContact OE1-NH1 2.76Å; E13-R157 IonicContact OE2-CZ 2.82Å; E13-R157 IonicContact OE2-NH1 3.72Å; E13-R157 PolarHBondContact OE2-NH1 3.01Å; G100-R157 PolarHBondContact O-NH1 2.96Å; G100-R157 VanDerWaalsContact O-NH1 3.16Å; G100-R157 PolarHBondContact O-NH2 3.01Å; S102-R157 PolarHBondContact O-NH2 3.02Å; T153-R157 PolarHBondContact O-N 3.5Å; N154-R157 PolarHBondContact O-N 3.39Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 3.38Å; R157-G160 PolarHBondContact O-N 2.89Å; R157-L161 HydrophobicContact CG-CD1 3.98Å; R157-L161 HydrophobicContact CG-CG 4.4Å; R157-L161 WeakPolarHBondContact O-CG 3.43Å; R157-L161 PolarHBondContact O-N 2.83Å
158	R	89.9	Confident	87.5	Confident	79 Å²	79	66.3 Å²	66.3	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-59.7	-49.9	-179.4	-179.2	178.5	171.4	-175.7	-3.5	111.5	V112 N154 L155 G160 L161 E162	V112-R158 HydrophobicContact CG2-CB 4.15Å; N154-R158 WeakPolarHBondContact O-CB 3.35Å; N154-R158 PolarHBondContact O-N 3.34Å; L155-R158 PolarHBondContact O-N 2.97Å; R158-G160 VanDerWaalsContact C-N 3.29Å; R158-G160 PolarHBondContact O-N 3.23Å; R158-L161 PolarHBondContact O-N 2.67Å; R158-E162 HydrophobicContact CG-CG 4.46Å; R158-E162 IonicContact CZ-OE1 3.52Å; R158-E162 IonicContact NE-OE1 3.78Å; R158-E162 PolarHBondContact NE-OE1 2.98Å; R158-E162 IonicContact NH2-OE1 3.84Å; R158-E162 PolarHBondContact NH2-OE1 3.32Å; R158-E162 WeakPolarHBondContact O-CG 3.21Å; R158-E162 PolarHBondContact O-N 3.42Å
159	T	89.9	Confident	85.5	Confident	90 Å²	90	66.3 Å²	66.3	55%	0.552	37%	0.368	S	S	*	.	H	α-helix	trans	-59.9	-40.2	176.7	-53.4	0	0	0	0	111.7	L155 E162 A163	L155-T159 PolarHBondContact O-N 2.88Å; L155-T159 PolarHBondContact O-OG1 2.99Å; T159-E162 PolarHBondContact O-N 2.85Å; T159-A163 WeakPolarHBondContact O-CB 3.25Å; T159-A163 PolarHBondContact O-N 3.44Å
160	G	86.3	Confident	84.9	Confident	5 Å²	5	66.1 Å²	66.1	5%	0.052	37%	0.369	C	S	.	.	H	α-helix	trans	-62.4	-41.2	176.1	0	0	0	0	0	113.6	G8 K156 R157 R158 V164	G8-G160 WeakPolarHBondContact O-CA 3.35Å; K156-G160 PolarHBondContact O-N 3.13Å; R157-G160 PolarHBondContact O-N 2.89Å; R158-G160 VanDerWaalsContact C-N 3.29Å; R158-G160 PolarHBondContact O-N 3.23Å; G160-V164 WeakPolarHBondContact O-CG2 3.17Å; G160-V164 PolarHBondContact O-N 3.05Å
161	L	85.8	Confident	84.4	Confident	14 Å²	14	69.6 Å²	69.6	7%	0.073	39%	0.388	C	S	.	.	H	α-helix	trans	-71.7	-39.4	177.4	-68.6	172.9	0	0	0	112.5	C6 V9 A108 R157 R158 V164 K165	C6-L161 VanDerWaalsContact SG-CD2 3.6Å; V9-L161 HydrophobicContact CG2-CD2 3.73Å; V9-L161 HydrophobicContact CG2-CG 3.84Å; A108-L161 HydrophobicContact CB-CD1 3.65Å; R157-L161 HydrophobicContact CG-CD1 3.98Å; R157-L161 HydrophobicContact CG-CG 4.4Å; R157-L161 WeakPolarHBondContact O-CG 3.43Å; R157-L161 PolarHBondContact O-N 2.83Å; R158-L161 PolarHBondContact O-N 2.67Å; L161-V164 PolarHBondContact O-N 3.3Å; L161-K165 PolarHBondContact O-N 3.49Å; L161-K165 VanDerWaalsContact O-N 3.13Å
162	E	84.8	Confident	83.7	Confident	86 Å²	86	72.8 Å²	72.8	40%	0.402	41%	0.406	S	S	.	.	H	α-helix	trans	-64.6	-42.9	176.3	-74.2	175.6	177.4	0	0	111.3	R158 T159 V164 K165 T166	R158-E162 HydrophobicContact CG-CG 4.46Å; R158-E162 IonicContact CZ-OE1 3.52Å; R158-E162 IonicContact NE-OE1 3.78Å; R158-E162 PolarHBondContact NE-OE1 2.98Å; R158-E162 IonicContact NH2-OE1 3.84Å; R158-E162 PolarHBondContact NH2-OE1 3.32Å; R158-E162 WeakPolarHBondContact O-CG 3.21Å; R158-E162 PolarHBondContact O-N 3.42Å; T159-E162 PolarHBondContact O-N 2.85Å; E162-V164 VanDerWaalsContact C-N 3.28Å; E162-V164 PolarHBondContact O-N 2.92Å; E162-K165 WeakPolarHBondContact O-CB 3.39Å; E162-K165 PolarHBondContact O-N 2.64Å; E162-K165 VanDerWaalsContact O-N 3.13Å; E162-T166 PolarHBondContact O-N 2.75Å; E162-T166 VanDerWaalsContact O-N 3.07Å; E162-T166 PolarHBondContact O-OG1 3.37Å
163	A	83.1	Confident	83	Confident	48 Å²	48	71.8 Å²	71.8	40%	0.397	41%	0.407	S	S	.	.	H	α-helix	trans	-62.1	-33	177.3	0	0	0	0	0	113.5	T159 K167	T159-A163 WeakPolarHBondContact O-CB 3.25Å; T159-A163 PolarHBondContact O-N 3.44Å; A163-K167 WeakPolarHBondContact O-CG 3.34Å
164	V	79.9	Confident	82.3	Confident	34 Å²	34	76.1 Å²	76.1	21%	0.206	43%	0.431	C	S	.	.	H	α-helix	trans	-70.7	-44.2	173.7	172.7	0	0	0	0	110.3	G160 L161 E162 T166 K167 T168	G160-V164 WeakPolarHBondContact O-CG2 3.17Å; G160-V164 PolarHBondContact O-N 3.05Å; L161-V164 PolarHBondContact O-N 3.3Å; E162-V164 VanDerWaalsContact C-N 3.28Å; E162-V164 PolarHBondContact O-N 2.92Å; V164-T166 VanDerWaalsContact C-N 3.31Å; V164-T166 PolarHBondContact O-N 3.43Å; V164-K167 PolarHBondContact O-N 3.11Å; V164-K167 VanDerWaalsContact O-N 3.07Å; V164-T168 PolarHBondContact O-N 2.78Å; V164-T168 PolarHBondContact O-OG1 2.69Å
165	K	77.6	Confident	81.5	Confident	146 Å²	146	81.1 Å²	81.1	64%	0.635	46%	0.46	S	S	*	.	H	α-helix	trans	-58.7	-41.5	179.7	-170.6	179.1	178	-174.2	0	112.3	L161 E162 K167 T168 G169	L161-K165 PolarHBondContact O-N 3.49Å; L161-K165 VanDerWaalsContact O-N 3.13Å; E162-K165 WeakPolarHBondContact O-CB 3.39Å; E162-K165 PolarHBondContact O-N 2.64Å; E162-K165 VanDerWaalsContact O-N 3.13Å; K165-K167 VanDerWaalsContact C-N 3.29Å; K165-K167 PolarHBondContact O-N 2.84Å; K165-T168 PolarHBondContact O-N 2.99Å; K165-G169 PolarHBondContact O-N 2.91Å
166	T	76.3	Confident	80.7	Confident	113 Å²	113	82.2 Å²	82.2	69%	0.693	47%	0.468	S	S	*	.	H	α-helix	trans	-67.6	-24.6	177.3	-54.1	0	0	0	0	113.6	E162 V164	E162-T166 PolarHBondContact O-N 2.75Å; E162-T166 VanDerWaalsContact O-N 3.07Å; E162-T166 PolarHBondContact O-OG1 3.37Å; V164-T166 VanDerWaalsContact C-N 3.31Å; V164-T166 PolarHBondContact O-N 3.43Å
167	K	72.9	Confident	79.8	Confident	182 Å²	182	80.8 Å²	80.8	79%	0.791	47%	0.47	S	S	*	.	H	α-helix	trans	-84.3	-16.9	177.6	-72	179.5	179.8	-175	0	113.6	A163 V164 K165	A163-K167 WeakPolarHBondContact O-CG 3.34Å; V164-K167 PolarHBondContact O-N 3.11Å; V164-K167 VanDerWaalsContact O-N 3.07Å; K165-K167 VanDerWaalsContact C-N 3.29Å; K165-K167 PolarHBondContact O-N 2.84Å
168	T	67.2	Low	79	Confident	116 Å²	116	86.1 Å²	86.1	71%	0.712	50%	0.504	S	S	*	.	H	α-helix	trans	-106.6	-17.2	-174.5	-49.9	0	0	0	0	113	V164 K165	V164-T168 PolarHBondContact O-N 2.78Å; V164-T168 PolarHBondContact O-OG1 2.69Å; K165-T168 PolarHBondContact O-N 2.99Å
169	G	53.8	Low	78	Confident	120 Å²	120	86.7 Å²	86.7	100%	1.237	52%	0.523	S	S	*	.			trans	-94	0	170.7	0	0	0	0	0	111.2	K165	K165-G169 PolarHBondContact O-N 2.91Å

Retrieved 169 of 169 residues in 370.3 ms (Link to these results)

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