A0A060XS81_ONCMY Loading...

Nuclear apoptosis inducing factor 1

AlphaFold DB , UniProt , Accession A0A060XS81, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110523268, Length 333 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	35.4	Very low	46.1	Very low	243 Å²	243	156.4 Å²	156.4	100%	1.197	79%	0.79	S	S	*	*				0	92	0	-72.3	-75.4	-146.6	0	0	108	S3	M1-S3 PolarHBondContact O-N 3.29Å
2	A	34.5	Very low	48.9	Very low	99 Å²	99	146.8 Å²	146.8	82%	0.818	74%	0.739	S	S	*	*			trans	-75.5	117.9	180	0	0	0	0	0	109.4	N4	A2-N4 PolarHBondContact O-N 3.03Å
3	S	35.6	Very low	51.5	Low	97 Å²	97	139.4 Å²	139.4	68%	0.678	71%	0.71	S	S	*	*			trans	-73.1	108.1	171.9	39.1	0	0	0	0	109.2	M1 T5	M1-S3 PolarHBondContact O-N 3.29Å; S3-T5 PolarHBondContact O-N 3.07Å
4	N	38.6	Very low	53.7	Low	147 Å²	147	140.5 Å²	140.5	79%	0.786	71%	0.711	S	S	*	*			trans	-69.5	81.4	166.8	-102.4	34.2	0	0	0	109	A2 K6	A2-N4 PolarHBondContact O-N 3.03Å; N4-K6 VanDerWaalsContact C-N 3.26Å; N4-K6 PolarHBondContact O-N 3.15Å
5	T	38.9	Very low	55.7	Low	120 Å²	120	142.2 Å²	142.2	74%	0.736	71%	0.705	S	S	*	*			trans	-67.2	87.7	166.1	45	0	0	0	0	108.3	S3 K7	S3-T5 PolarHBondContact O-N 3.07Å; T5-K7 VanDerWaalsContact C-N 3.32Å; T5-K7 PolarHBondContact O-N 3.37Å
6	K	46	Very low	57.7	Low	190 Å²	190	133.4 Å²	133.4	83%	0.826	66%	0.662	S	S	*	*			trans	-62.3	95.9	170.7	-77.1	168	177.5	165.7	0	108	N4 R8	N4-K6 VanDerWaalsContact C-N 3.26Å; N4-K6 PolarHBondContact O-N 3.15Å; K6-R8 PolarHBondContact O-N 3.08Å
7	K	44.5	Very low	59.5	Low	195 Å²	195	127 Å²	127	85%	0.848	63%	0.631	S	S	*	*			trans	-44.4	129.5	165.7	-83.3	176.3	173.4	175.6	0	108.3	T5 K9	T5-K7 VanDerWaalsContact C-N 3.32Å; T5-K7 PolarHBondContact O-N 3.37Å; K7-K9 PolarHBondContact O-N 2.81Å
8	R	47	Very low	61.1	Low	249 Å²	249	124 Å²	124	94%	0.94	62%	0.615	S	S	*	*			trans	-47.9	111.8	172.5	-88	179.7	166.3	156.4	-4.4	108.2	K6 M10	K6-R8 PolarHBondContact O-N 3.08Å; R8-M10 PolarHBondContact O-N 2.88Å
9	K	54.4	Low	62.6	Low	126 Å²	126	119.5 Å²	119.5	55%	0.548	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-56.1	131.9	169.7	-90.8	178.3	163.9	-176.4	0	107.3	K7 E67	K7-K9 PolarHBondContact O-N 2.81Å; K9-E67 WeakPolarHBondContact CD-OE1 3.46Å; K9-E67 VanDerWaalsContact NZ-CD 3.26Å; K9-E67 IonicContact NZ-OE1 2.78Å; K9-E67 PolarHBondContact NZ-OE1 2.94Å; K9-E67 IonicContact NZ-OE2 2.77Å; K9-E67 PolarHBondContact NZ-OE2 3.49Å
10	M	59.6	Low	64	Low	109 Å²	109	113.5 Å²	113.5	54%	0.537	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-55.9	139.4	177.5	-172.1	163.8	67.9	0	0	109.8	R8 T60	R8-M10 PolarHBondContact O-N 2.88Å; M10-T60 VanDerWaalsContact CE-OG1 3.3Å; M10-T60 WeakPolarHBondContact CE-OG1 3.22Å
11	N	72.3	Confident	65.2	Low	145 Å²	145	108.1 Å²	108.1	78%	0.775	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-53.3	155.2	172.2	-72.9	-53.3	0	0	0	110.2	S13 R63	N11-S13 PolarHBondContact O-N 2.91Å; N11-R63 PolarHBondContact O-NH2 3.33Å
12	F	79.8	Confident	67.8	Low	41 Å²	41	99.7 Å²	99.7	18%	0.18	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-59.1	123.2	168.5	-73.1	-103.2	0	0	0	108.9	E16 V17 I20 R63 E67 K71	F12-E16 WeakPolarHBondContact CA-OE2 3.22Å; F12-E16 HydrophobicContact CD1-CB 4.17Å; F12-V17 HydrophobicContact CB-CG2 3.96Å; F12-I20 HydrophobicContact CD1-CD1 3.94Å; F12-I20 HydrophobicContact CE1-CD1 3.85Å; F12-R63 VanDerWaalsContact CA-NH2 3.35Å; F12-E67 HydrophobicContact CZ-CB 4.31Å; F12-K71 HydrophobicContact CB-CD 4.42Å; F12-K71 HydrophobicContact CD1-CG 4.05Å; F12-K71 HydrophobicContact CD2-CB 4.26Å; F12-K71 HydrophobicContact CD2-CD 3.78Å; F12-K71 HydrophobicContact CD2-CG 3.9Å; F12-K71 HydrophobicContact CE1-CB 4.12Å; F12-K71 HydrophobicContact CE1-CG 4.04Å; F12-K71 HydrophobicContact CE2-CB 3.77Å; F12-K71 HydrophobicContact CE2-CD 4.13Å; F12-K71 HydrophobicContact CE2-CG 3.93Å; F12-K71 HydrophobicContact CG-CD 4.05Å; F12-K71 HydrophobicContact CG-CG 3.96Å; F12-K71 HydrophobicContact CZ-CB 3.68Å; F12-K71 HydrophobicContact CZ-CG 3.99Å
13	S	82.8	Confident	70.5	Confident	51 Å²	51	96.1 Å²	96.1	36%	0.357	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-65	157.4	170.3	66.9	0	0	0	0	110.4	N11 R15 E16 V17	N11-S13 PolarHBondContact O-N 2.91Å; S13-R15 VanDerWaalsContact C-N 3.29Å; S13-R15 PolarHBondContact O-N 2.88Å; S13-E16 WeakPolarHBondContact CB-OE2 3.39Å; S13-E16 PolarHBondContact N-OE2 3.36Å; S13-E16 PolarHBondContact O-N 2.54Å; S13-E16 VanDerWaalsContact O-N 3.1Å; S13-E16 VanDerWaalsContact OG-CD 3.26Å; S13-E16 WeakPolarHBondContact OG-CG 3.15Å; S13-E16 PolarHBondContact OG-N 3.34Å; S13-E16 PolarHBondContact OG-OE2 3.1Å; S13-V17 WeakPolarHBondContact O-CG2 3.5Å; S13-V17 PolarHBondContact O-N 3.48Å; S13-V17 VanDerWaalsContact O-N 3.09Å
14	E	81.9	Confident	73	Confident	155 Å²	155	91.5 Å²	91.5	72%	0.724	43%	0.428	S	S	*	.	H	α-helix	trans	-57.2	-43	179.6	-173.3	165.9	-149.8	0	0	112	E16 V17 E18	E14-E16 VanDerWaalsContact C-N 3.34Å; E14-E16 PolarHBondContact O-N 2.93Å; E14-V17 WeakPolarHBondContact O-CB 3.47Å; E14-V17 PolarHBondContact O-N 3.45Å; E14-V17 VanDerWaalsContact O-N 3.1Å; E14-E18 WeakPolarHBondContact O-CG 3.38Å; E14-E18 PolarHBondContact O-N 3.05Å
15	R	84.3	Confident	75.3	Confident	166 Å²	166	88.4 Å²	88.4	63%	0.626	41%	0.409	S	S	*	.	H	α-helix	trans	-59.6	-40	174.6	-179.4	174.9	-71.5	-161.4	-2.2	113.2	S13 V17 E18 I19 V58	S13-R15 VanDerWaalsContact C-N 3.29Å; S13-R15 PolarHBondContact O-N 2.88Å; R15-V17 VanDerWaalsContact C-N 3.31Å; R15-E18 PolarHBondContact O-N 3.4Å; R15-I19 WeakPolarHBondContact O-CG1 3.24Å; R15-I19 PolarHBondContact O-N 3.2Å; R15-I19 VanDerWaalsContact O-N 3.11Å; R15-V58 HydrophobicContact CG-CB 4.42Å
16	E	88.2	Confident	77.5	Confident	2 Å²	2	88.7 Å²	88.7	1%	0.009	40%	0.4	C	S	.	.	H	α-helix	trans	-66.6	-37.4	176.8	-69.4	165.8	127	0	0	111	F12 S13 E14 I20 V58 T59 R63	F12-E16 WeakPolarHBondContact CA-OE2 3.22Å; F12-E16 HydrophobicContact CD1-CB 4.17Å; S13-E16 WeakPolarHBondContact CB-OE2 3.39Å; S13-E16 PolarHBondContact N-OE2 3.36Å; S13-E16 PolarHBondContact O-N 2.54Å; S13-E16 VanDerWaalsContact O-N 3.1Å; S13-E16 VanDerWaalsContact OG-CD 3.26Å; S13-E16 WeakPolarHBondContact OG-CG 3.15Å; S13-E16 PolarHBondContact OG-N 3.34Å; S13-E16 PolarHBondContact OG-OE2 3.1Å; E14-E16 VanDerWaalsContact C-N 3.34Å; E14-E16 PolarHBondContact O-N 2.93Å; E16-I20 WeakPolarHBondContact O-CD1 3.48Å; E16-I20 WeakPolarHBondContact O-CG1 3.5Å; E16-I20 PolarHBondContact O-N 3.47Å; E16-V58 HydrophobicContact CG-CG2 4.28Å; E16-T59 WeakPolarHBondContact CG-OG1 3.46Å; E16-T59 WeakPolarHBondContact OE1-CB 3.28Å; E16-T59 VanDerWaalsContact OE1-CG2 3.24Å; E16-T59 WeakPolarHBondContact OE1-CG2 3.49Å; E16-T59 PolarHBondContact OE1-OG1 3.32Å; E16-R63 VanDerWaalsContact CD-NH2 3.35Å; E16-R63 IonicContact OE1-CZ 2.65Å; E16-R63 IonicContact OE1-NE 3.69Å; E16-R63 PolarHBondContact OE1-NE 3.32Å; E16-R63 IonicContact OE1-NH2 3.86Å; E16-R63 PolarHBondContact OE1-NH2 3.48Å; E16-R63 IonicContact OE2-CZ 2.64Å; E16-R63 IonicContact OE2-NE 2.84Å; E16-R63 IonicContact OE2-NH2 3.12Å; E16-R63 PolarHBondContact OE2-NH2 2.94Å
17	V	87.2	Confident	79.2	Confident	24 Å²	24	80.7 Å²	80.7	15%	0.145	37%	0.366	C	S	.	.	H	α-helix	trans	-66.6	-43.8	176.5	175.2	0	0	0	0	110.9	F12 S13 E14 R15 I19 I20 V21 M75	F12-V17 HydrophobicContact CB-CG2 3.96Å; S13-V17 WeakPolarHBondContact O-CG2 3.5Å; S13-V17 PolarHBondContact O-N 3.48Å; S13-V17 VanDerWaalsContact O-N 3.09Å; E14-V17 WeakPolarHBondContact O-CB 3.47Å; E14-V17 PolarHBondContact O-N 3.45Å; E14-V17 VanDerWaalsContact O-N 3.1Å; R15-V17 VanDerWaalsContact C-N 3.31Å; V17-I19 PolarHBondContact O-N 3Å; V17-I20 PolarHBondContact O-N 3.45Å; V17-V21 WeakPolarHBondContact O-CG2 3.3Å; V17-V21 PolarHBondContact O-N 2.9Å; V17-M75 HydrophobicContact CG1-CE 3.6Å; V17-M75 HydrophobicContact CG1-SD 3.89Å
18	E	88.8	Confident	81.1	Confident	73 Å²	73	75.3 Å²	75.3	34%	0.341	34%	0.343	S	S	.	.	H	α-helix	trans	-55.3	-50.9	174.8	-75.6	169.6	178.7	0	0	111.5	E14 R15 I20 V21 E22 M107	E14-E18 WeakPolarHBondContact O-CG 3.38Å; E14-E18 PolarHBondContact O-N 3.05Å; R15-E18 PolarHBondContact O-N 3.4Å; E18-I20 VanDerWaalsContact C-N 3.32Å; E18-I20 PolarHBondContact O-N 2.92Å; E18-V21 PolarHBondContact O-N 3.26Å; E18-V21 VanDerWaalsContact O-N 3.16Å; E18-E22 WeakPolarHBondContact O-CB 3.48Å; E18-E22 WeakPolarHBondContact O-CG 3.25Å; E18-E22 PolarHBondContact O-N 3.13Å; E18-M107 HydrophobicContact CB-CE 4.22Å; E18-M107 HydrophobicContact CG-CE 3.48Å; E18-M107 VanDerWaalsContact CG-CE 3.48Å
19	I	90.6	Very high	82.4	Confident	38 Å²	38	69.4 Å²	69.4	20%	0.195	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-38.5	179.5	-66.1	-62.9	0	0	0	111.8	R15 V17 V21 E22 E23 K54 V55 V58	R15-I19 WeakPolarHBondContact O-CG1 3.24Å; R15-I19 PolarHBondContact O-N 3.2Å; R15-I19 VanDerWaalsContact O-N 3.11Å; V17-I19 PolarHBondContact O-N 3Å; I19-V21 VanDerWaalsContact C-N 3.35Å; I19-V21 PolarHBondContact O-N 3.28Å; I19-E22 PolarHBondContact O-N 2.84Å; I19-E23 VanDerWaalsContact O-CB 3.32Å; I19-E23 WeakPolarHBondContact O-CB 3.48Å; I19-E23 PolarHBondContact O-N 3.04Å; I19-K54 HydrophobicContact CG2-CB 3.98Å; I19-V55 HydrophobicContact CG2-CG2 4.18Å; I19-V58 HydrophobicContact CB-CG2 4.4Å; I19-V58 HydrophobicContact CG1-CG1 4.26Å; I19-V58 HydrophobicContact CG1-CG2 4Å
20	I	90.3	Very high	83.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-47.3	174.7	-71.5	166.6	0	0	0	110.3	F12 E16 V17 E18 I24 V55 V68 K71 W72	F12-I20 HydrophobicContact CD1-CD1 3.94Å; F12-I20 HydrophobicContact CE1-CD1 3.85Å; E16-I20 WeakPolarHBondContact O-CD1 3.48Å; E16-I20 WeakPolarHBondContact O-CG1 3.5Å; E16-I20 PolarHBondContact O-N 3.47Å; V17-I20 PolarHBondContact O-N 3.45Å; E18-I20 VanDerWaalsContact C-N 3.32Å; E18-I20 PolarHBondContact O-N 2.92Å; I20-I24 HydrophobicContact CG2-CD1 3.62Å; I20-I24 VanDerWaalsContact O-CB 3.3Å; I20-I24 WeakPolarHBondContact O-CB 2.73Å; I20-I24 WeakPolarHBondContact O-CD1 3.21Å; I20-I24 WeakPolarHBondContact O-CG1 3.4Å; I20-I24 PolarHBondContact O-N 2.95Å; I20-V55 HydrophobicContact CD1-CG2 4.24Å; I20-V55 HydrophobicContact CG1-CG2 3.44Å; I20-V55 VanDerWaalsContact CG1-CG2 3.44Å; I20-V68 HydrophobicContact CD1-CG1 4.29Å; I20-V68 HydrophobicContact CG1-CG1 4.24Å; I20-K71 HydrophobicContact CD1-CG 4.08Å; I20-W72 HydrophobicContact CG2-CE3 4.21Å
21	V	89.3	Confident	84.5	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-67.3	-44.9	-179.2	178.4	0	0	0	0	111.2	V17 E18 I19 E23 I24 E25 W72 M75 M107 R110 I111	V17-V21 WeakPolarHBondContact O-CG2 3.3Å; V17-V21 PolarHBondContact O-N 2.9Å; E18-V21 PolarHBondContact O-N 3.26Å; E18-V21 VanDerWaalsContact O-N 3.16Å; I19-V21 VanDerWaalsContact C-N 3.35Å; I19-V21 PolarHBondContact O-N 3.28Å; V21-E23 PolarHBondContact O-N 3.44Å; V21-I24 PolarHBondContact O-N 3.49Å; V21-E25 WeakPolarHBondContact O-CB 3.42Å; V21-E25 PolarHBondContact O-N 3.49Å; V21-W72 HydrophobicContact CG2-CZ3 4.36Å; V21-M75 HydrophobicContact CG2-CE 3.35Å; V21-M107 HydrophobicContact CB-SD 3.72Å; V21-M107 HydrophobicContact CG1-SD 3.76Å; V21-M107 HydrophobicContact CG2-CG 4.25Å; V21-M107 HydrophobicContact CG2-SD 3.62Å; V21-R110 HydrophobicContact CG1-CG 4.24Å; V21-I111 HydrophobicContact CG1-CG1 4.05Å; V21-I111 HydrophobicContact CG2-CD1 3.91Å; V21-I111 HydrophobicContact CG2-CG1 3.92Å
22	E	90.1	Very high	84.7	Confident	66 Å²	66	55.2 Å²	55.2	31%	0.308	26%	0.259	S	S	.	.	H	α-helix	trans	-58.9	-46.4	178.3	-78.5	179.3	-174.2	0	0	112.6	E18 I19 E25 K26 R110	E18-E22 WeakPolarHBondContact O-CB 3.48Å; E18-E22 WeakPolarHBondContact O-CG 3.25Å; E18-E22 PolarHBondContact O-N 3.13Å; I19-E22 PolarHBondContact O-N 2.84Å; E22-E25 PolarHBondContact O-N 3.48Å; E22-K26 WeakPolarHBondContact O-CG 3.45Å; E22-K26 PolarHBondContact O-N 2.91Å; E22-K26 VanDerWaalsContact O-N 3.09Å; E22-R110 IonicContact OE1-NH1 3.36Å
23	E	90.8	Very high	84.5	Confident	23 Å²	23	57 Å²	57	11%	0.107	27%	0.27	C	S	.	.	H	α-helix	trans	-75.4	-33.9	-175.9	-159.6	60.7	-145	0	0	111.6	I19 V21 E25 K26 Q27 I51 K54	I19-E23 VanDerWaalsContact O-CB 3.32Å; I19-E23 WeakPolarHBondContact O-CB 3.48Å; I19-E23 PolarHBondContact O-N 3.04Å; V21-E23 PolarHBondContact O-N 3.44Å; E23-E25 VanDerWaalsContact C-N 3.32Å; E23-K26 PolarHBondContact O-N 3.46Å; E23-K26 IonicContact OE2-NZ 3.22Å; E23-K26 PolarHBondContact OE2-NZ 3.23Å; E23-Q27 WeakPolarHBondContact O-CG 3.34Å; E23-Q27 PolarHBondContact O-N 3.31Å; E23-I51 HydrophobicContact CB-CG1 3.92Å; E23-I51 HydrophobicContact CB-CG2 4.47Å; E23-I51 HydrophobicContact CG-CB 4.29Å; E23-I51 HydrophobicContact CG-CG1 3.57Å; E23-K54 HydrophobicContact CG-CG 4.35Å
24	I	88.7	Confident	83.3	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-68.5	-32.6	172.2	-68.2	173.8	0	0	0	111.5	I20 V21 Q27 K28 V32 W48 I51 W72 L114	I20-I24 HydrophobicContact CG2-CD1 3.62Å; I20-I24 VanDerWaalsContact O-CB 3.3Å; I20-I24 WeakPolarHBondContact O-CB 2.73Å; I20-I24 WeakPolarHBondContact O-CD1 3.21Å; I20-I24 WeakPolarHBondContact O-CG1 3.4Å; I20-I24 PolarHBondContact O-N 2.95Å; V21-I24 PolarHBondContact O-N 3.49Å; I24-Q27 CarbonylContact O-C 3.27Å; I24-Q27 VanDerWaalsContact O-C 3.27Å; I24-Q27 PolarHBondContact O-N 3.24Å; I24-K28 WeakPolarHBondContact O-CA 3.37Å; I24-K28 PolarHBondContact O-N 3.05Å; I24-V32 HydrophobicContact CG2-CG2 3.65Å; I24-W48 HydrophobicContact CD1-CH2 3.9Å; I24-W48 HydrophobicContact CD1-CZ3 3.95Å; I24-W48 HydrophobicContact CG1-CZ3 4.48Å; I24-I51 HydrophobicContact CD1-CD1 4.42Å; I24-I51 HydrophobicContact CG1-CD1 3.52Å; I24-I51 HydrophobicContact CG1-CG1 4.41Å; I24-W72 HydrophobicContact CB-CH2 4.43Å; I24-W72 HydrophobicContact CB-CZ3 4.47Å; I24-W72 HydrophobicContact CD1-CB 3.98Å; I24-W72 HydrophobicContact CD1-CD2 3.26Å; I24-W72 HydrophobicContact CD1-CE3 3.36Å; I24-W72 HydrophobicContact CD1-CG 3.54Å; I24-W72 HydrophobicContact CD1-CH2 4.44Å; I24-W72 HydrophobicContact CD1-CZ2 4.37Å; I24-W72 HydrophobicContact CD1-CZ3 3.96Å; I24-W72 HydrophobicContact CG2-CD2 4.37Å; I24-W72 HydrophobicContact CG2-CH2 3.74Å; I24-W72 HydrophobicContact CG2-CZ2 3.53Å; I24-W72 HydrophobicContact CG2-CZ3 4.22Å; I24-L114 HydrophobicContact CG2-CD2 3.92Å
25	E	85.6	Confident	82.2	Confident	82 Å²	82	63.5 Å²	63.5	38%	0.383	29%	0.293	S	S	.	.	H	α-helix	trans	-65.5	-43.1	172.9	-179.7	171.7	-159.6	0	0	111.9	V21 E22 E23 Q27 K28 R110 L114	V21-E25 WeakPolarHBondContact O-CB 3.42Å; V21-E25 PolarHBondContact O-N 3.49Å; E22-E25 PolarHBondContact O-N 3.48Å; E23-E25 VanDerWaalsContact C-N 3.32Å; E25-Q27 PolarHBondContact O-N 3.37Å; E25-K28 VanDerWaalsContact O-CB 3.22Å; E25-K28 WeakPolarHBondContact O-CB 3.32Å; E25-K28 PolarHBondContact O-N 3.11Å; E25-K28 VanDerWaalsContact O-N 3.16Å; E25-R110 IonicContact OE2-CZ 3.65Å; E25-R110 IonicContact OE2-NE 3.06Å; E25-R110 PolarHBondContact OE2-NE 2.95Å; E25-R110 IonicContact OE2-NH2 2.86Å; E25-R110 PolarHBondContact OE2-NH2 2.89Å; E25-L114 HydrophobicContact CB-CD1 4.02Å; E25-L114 HydrophobicContact CG-CD1 3.94Å
26	K	85.4	Confident	81.3	Confident	127 Å²	127	57.9 Å²	57.9	55%	0.552	28%	0.275	S	S	*	.	H	α-helix	trans	-60.3	-37.1	173.3	-67.3	173.8	-158.9	160.1	0	112	E22 E23 K28	E22-K26 WeakPolarHBondContact O-CG 3.45Å; E22-K26 PolarHBondContact O-N 2.91Å; E22-K26 VanDerWaalsContact O-N 3.09Å; E23-K26 PolarHBondContact O-N 3.46Å; E23-K26 IonicContact OE2-NZ 3.22Å; E23-K26 PolarHBondContact OE2-NZ 3.23Å; K26-K28 VanDerWaalsContact C-N 3.34Å
27	Q	82.8	Confident	79.7	Confident	22 Å²	22	61.4 Å²	61.4	10%	0.103	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	20.4	179.8	-60.8	179.7	-3.2	0	0	113.1	E23 I24 E25 H29 T30 L31 A47 I51	E23-Q27 WeakPolarHBondContact O-CG 3.34Å; E23-Q27 PolarHBondContact O-N 3.31Å; I24-Q27 CarbonylContact O-C 3.27Å; I24-Q27 VanDerWaalsContact O-C 3.27Å; I24-Q27 PolarHBondContact O-N 3.24Å; E25-Q27 PolarHBondContact O-N 3.37Å; Q27-H29 VanDerWaalsContact C-N 3.27Å; Q27-H29 PolarHBondContact O-N 3.37Å; Q27-T30 PolarHBondContact O-N 3.35Å; Q27-L31 HydrophobicContact CB-CD1 4.1Å; Q27-L31 HydrophobicContact CB-CG 4.26Å; Q27-L31 PolarHBondContact O-N 3.46Å; Q27-A47 PolarHBondContact NE2-O 2.89Å; Q27-A47 VanDerWaalsContact OE1-CA 3.3Å; Q27-A47 PolarHBondContact OE1-O 2.95Å; Q27-I51 VanDerWaalsContact OE1-CD1 3.25Å
28	K	83.2	Confident	78.6	Confident	82 Å²	82	64 Å²	64	36%	0.357	34%	0.336	S	S	.	.	H	α-helix	trans	-51	-45.1	-176	-176.8	-174.6	-173.2	170.4	0	112.7	I24 E25 K26 T30 V32 N33 L114	I24-K28 WeakPolarHBondContact O-CA 3.37Å; I24-K28 PolarHBondContact O-N 3.05Å; E25-K28 VanDerWaalsContact O-CB 3.22Å; E25-K28 WeakPolarHBondContact O-CB 3.32Å; E25-K28 PolarHBondContact O-N 3.11Å; E25-K28 VanDerWaalsContact O-N 3.16Å; K26-K28 VanDerWaalsContact C-N 3.34Å; K28-T30 PolarHBondContact O-N 3.1Å; K28-V32 HydrophobicContact CG-CB 4.08Å; K28-V32 WeakPolarHBondContact O-CA 3.47Å; K28-V32 WeakPolarHBondContact O-CB 3.42Å; K28-V32 PolarHBondContact O-N 3.1Å; K28-N33 PolarHBondContact O-N 3.09Å; K28-L114 HydrophobicContact CB-CD1 4.02Å; K28-L114 HydrophobicContact CD-CD1 3.62Å; K28-L114 VanDerWaalsContact CE-O 3.31Å; K28-L114 WeakPolarHBondContact CE-O 3.48Å; K28-L114 HydrophobicContact CG-CD1 3.71Å; K28-L114 HydrophobicContact CG-CG 4.4Å
29	H	75.1	Confident	78.1	Confident	124 Å²	124	62.5 Å²	62.5	57%	0.574	33%	0.332	S	S	*	.	H	α-helix	trans	-66	-24.1	-178.6	65.8	-79.8	0	0	0	113.4	Q27	Q27-H29 VanDerWaalsContact C-N 3.27Å; Q27-H29 PolarHBondContact O-N 3.37Å
30	T	78.8	Confident	77.7	Confident	18 Å²	18	64.6 Å²	64.6	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-95.5	-37.9	-179.3	-41.9	0	0	0	0	112.7	Q27 K28 V39 K44 A47	Q27-T30 PolarHBondContact O-N 3.35Å; K28-T30 PolarHBondContact O-N 3.1Å; T30-V39 HydrophobicContact CG2-CG1 3.69Å; T30-K44 HydrophobicContact CG2-CG 4.35Å; T30-K44 WeakPolarHBondContact O-CE 3.3Å; T30-A47 HydrophobicContact CG2-CB 4.05Å
31	L	79.1	Confident	77.3	Confident	31 Å²	31	72 Å²	72	16%	0.162	38%	0.381	C	S	.	.	H	α-helix	trans	-109.6	-25.3	-168.8	-66.2	-175.2	0	0	0	114.9	Q27 K44 A47 W48 I51	Q27-L31 HydrophobicContact CB-CD1 4.1Å; Q27-L31 HydrophobicContact CB-CG 4.26Å; Q27-L31 PolarHBondContact O-N 3.46Å; L31-K44 HydrophobicContact CD2-CB 4.38Å; L31-A47 HydrophobicContact CD1-CB 4.2Å; L31-A47 HydrophobicContact CD2-CB 3.98Å; L31-A47 HydrophobicContact CG-CB 4.1Å; L31-W48 HydrophobicContact CD1-CD2 4.16Å; L31-W48 HydrophobicContact CD1-CZ2 4.2Å; L31-W48 HydrophobicContact CD2-CD2 4.41Å; L31-W48 HydrophobicContact CD2-CG 4.3Å; L31-W48 HydrophobicContact CD2-CZ2 4.42Å; L31-I51 HydrophobicContact CD1-CD1 3.3Å
32	V	76.8	Confident	77.1	Confident	33 Å²	33	77.5 Å²	77.5	20%	0.2	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-36.9	-171.5	-175.5	0	0	0	0	112.2	I24 K28 H34 W72 L114	I24-V32 HydrophobicContact CG2-CG2 3.65Å; K28-V32 HydrophobicContact CG-CB 4.08Å; K28-V32 WeakPolarHBondContact O-CA 3.47Å; K28-V32 WeakPolarHBondContact O-CB 3.42Å; K28-V32 PolarHBondContact O-N 3.1Å; V32-H34 PolarHBondContact O-N 3.36Å; V32-W72 HydrophobicContact CG2-CZ2 4.26Å; V32-L114 HydrophobicContact CG1-CG 4.31Å; V32-L114 WeakPolarHBondContact CG1-O 3.43Å; V32-L114 HydrophobicContact CG2-CD2 4.01Å; V32-L114 HydrophobicContact CG2-CG 4.32Å
33	N	74.9	Confident	76.9	Confident	78 Å²	78	76.1 Å²	76.1	42%	0.417	41%	0.409	S	S	.	.			trans	-63.2	134.3	-173.8	-139.5	35.1	0	0	0	111.5	K28 F35 N36	K28-N33 PolarHBondContact O-N 3.09Å; N33-F35 VanDerWaalsContact C-N 3.33Å; N33-N36 PolarHBondContact O-ND2 3Å; N33-N36 PolarHBondContact O-OD1 3.17Å
34	H	58.1	Low	76.7	Confident	182 Å²	182	78 Å²	78	84%	0.843	42%	0.417	S	S	*	.	S	Bend	trans	-68.4	-36.1	-177.4	-167.6	68	0	0	0	111.3	V32 N36	V32-H34 PolarHBondContact O-N 3.36Å; H34-N36 PolarHBondContact O-N 2.88Å; H34-N36 VanDerWaalsContact O-N 3.13Å
35	F	58.3	Low	76.7	Confident	162 Å²	162	80.5 Å²	80.5	71%	0.711	43%	0.43	S	S	*	.			trans	-81.9	91.4	175.3	-158.6	-103.8	0	0	0	110.5	N33 A37	N33-F35 VanDerWaalsContact C-N 3.33Å; F35-A37 HydrophobicContact CD1-CB 3.94Å; F35-A37 HydrophobicContact CE1-CB 3.41Å; F35-A37 VanDerWaalsContact CE1-CB 3.41Å; F35-A37 HydrophobicContact CE2-CB 4.31Å; F35-A37 HydrophobicContact CZ-CB 3.62Å
36	N	64.7	Low	76.9	Confident	47 Å²	47	80.6 Å²	80.6	25%	0.251	43%	0.434	S	S	.	.			trans	-97.2	20.7	178	-72.6	-71.9	0	0	0	112.9	N33 H34 G38 V39 K44	N33-N36 PolarHBondContact O-ND2 3Å; N33-N36 PolarHBondContact O-OD1 3.17Å; H34-N36 PolarHBondContact O-N 2.88Å; H34-N36 VanDerWaalsContact O-N 3.13Å; N36-G38 PolarHBondContact O-N 2.78Å; N36-V39 HydrophobicContact CB-CB 4.4Å; N36-V39 PolarHBondContact O-N 2.85Å; N36-K44 PolarHBondContact ND2-NZ 3.33Å; N36-K44 VanDerWaalsContact OD1-CE 3.31Å; N36-K44 WeakPolarHBondContact OD1-CE 3.2Å; N36-K44 PolarHBondContact OD1-NZ 2.9Å
37	A	54.5	Low	77.1	Confident	76 Å²	76	75 Å²	75	63%	0.628	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	108.5	-179.5	0	0	0	0	0	109.5	F35	F35-A37 HydrophobicContact CD1-CB 3.94Å; F35-A37 HydrophobicContact CE1-CB 3.41Å; F35-A37 VanDerWaalsContact CE1-CB 3.41Å; F35-A37 HydrophobicContact CE2-CB 4.31Å; F35-A37 HydrophobicContact CZ-CB 3.62Å
38	G	65.1	Low	77.6	Confident	79 Å²	79	75.5 Å²	75.5	81%	0.814	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.6	-9.3	-177.8	0	0	0	0	0	116.2	N36 T40	N36-G38 PolarHBondContact O-N 2.78Å; G38-T40 PolarHBondContact O-N 2.86Å
39	V	78	Confident	78	Confident	41 Å²	41	75 Å²	75	25%	0.248	41%	0.412	C	S	.	.			trans	-83.3	108.6	175.7	-174.5	0	0	0	0	110	T30 N36 A43 K44	T30-V39 HydrophobicContact CG2-CG1 3.69Å; N36-V39 HydrophobicContact CB-CB 4.4Å; N36-V39 PolarHBondContact O-N 2.85Å; V39-A43 HydrophobicContact CG1-CB 4.18Å; V39-K44 HydrophobicContact CG1-CD 4.38Å; V39-K44 HydrophobicContact CG1-CG 3.66Å
40	T	81.7	Confident	78.8	Confident	83 Å²	83	73 Å²	73	51%	0.509	40%	0.403	S	S	.	.			trans	-67.5	153.9	178.5	68.1	0	0	0	0	112	G38 I42 A43 K44	G38-T40 PolarHBondContact O-N 2.86Å; T40-I42 PolarHBondContact O-N 2.7Å; T40-A43 PolarHBondContact O-N 3.06Å; T40-A43 VanDerWaalsContact O-N 3.13Å; T40-A43 WeakPolarHBondContact OG1-CB 3.29Å; T40-A43 PolarHBondContact OG1-N 3.21Å; T40-A43 VanDerWaalsContact OG1-N 3.15Å; T40-K44 PolarHBondContact O-N 3.35Å; T40-K44 VanDerWaalsContact O-N 3.15Å
41	H	81.9	Confident	79.5	Confident	155 Å²	155	72.1 Å²	72.1	72%	0.718	40%	0.398	S	S	*	.	H	α-helix	trans	-56.4	-35.3	173.4	-178.7	-97.6	0	0	0	112.1	K44 N45	H41-K44 PolarHBondContact O-N 2.95Å; H41-N45 WeakPolarHBondContact O-CB 3.42Å; H41-N45 PolarHBondContact O-N 3.32Å
42	I	85.9	Confident	80.1	Confident	116 Å²	116	72 Å²	72	60%	0.595	40%	0.397	S	S	*	.	H	α-helix	trans	-64.5	-45.1	177.4	-61.1	170.1	0	0	0	110.7	T40 K44 N45 N46	T40-I42 PolarHBondContact O-N 2.7Å; I42-K44 VanDerWaalsContact C-N 3.35Å; I42-K44 PolarHBondContact O-N 2.84Å; I42-N45 PolarHBondContact O-N 2.82Å; I42-N45 VanDerWaalsContact O-N 3.17Å; I42-N46 VanDerWaalsContact O-CG 3.31Å; I42-N46 PolarHBondContact O-N 2.96Å
43	A	85.3	Confident	80.8	Confident	37 Å²	37	76.8 Å²	76.8	31%	0.306	42%	0.415	S	S	.	.	H	α-helix	trans	-61.1	-43.1	177.3	0	0	0	0	0	111.8	V39 T40 N45 N46 A47	V39-A43 HydrophobicContact CG1-CB 4.18Å; T40-A43 PolarHBondContact O-N 3.06Å; T40-A43 VanDerWaalsContact O-N 3.13Å; T40-A43 WeakPolarHBondContact OG1-CB 3.29Å; T40-A43 PolarHBondContact OG1-N 3.21Å; T40-A43 VanDerWaalsContact OG1-N 3.15Å; A43-N45 VanDerWaalsContact C-N 3.34Å; A43-N45 PolarHBondContact O-N 3.22Å; A43-N46 PolarHBondContact O-N 2.64Å; A43-A47 VanDerWaalsContact O-CB 3.28Å; A43-A47 WeakPolarHBondContact O-CB 3.47Å; A43-A47 PolarHBondContact O-N 3.28Å
44	K	86.6	Confident	81.6	Confident	63 Å²	63	78 Å²	78	27%	0.274	42%	0.417	S	S	.	.	H	α-helix	trans	-61.2	-42.2	173.8	-66.9	-172.7	173.4	-177.8	0	111.9	T30 L31 N36 V39 T40 H41 I42 A47 W48	T30-K44 HydrophobicContact CG2-CG 4.35Å; T30-K44 WeakPolarHBondContact O-CE 3.3Å; L31-K44 HydrophobicContact CD2-CB 4.38Å; N36-K44 PolarHBondContact ND2-NZ 3.33Å; N36-K44 VanDerWaalsContact OD1-CE 3.31Å; N36-K44 WeakPolarHBondContact OD1-CE 3.2Å; N36-K44 PolarHBondContact OD1-NZ 2.9Å; V39-K44 HydrophobicContact CG1-CD 4.38Å; V39-K44 HydrophobicContact CG1-CG 3.66Å; T40-K44 PolarHBondContact O-N 3.35Å; T40-K44 VanDerWaalsContact O-N 3.15Å; H41-K44 PolarHBondContact O-N 2.95Å; I42-K44 VanDerWaalsContact C-N 3.35Å; I42-K44 PolarHBondContact O-N 2.84Å; K44-A47 WeakPolarHBondContact O-CB 3.41Å; K44-A47 PolarHBondContact O-N 3.21Å; K44-W48 PolarHBondContact O-N 3.04Å; K44-W48 VanDerWaalsContact O-N 3.13Å
45	N	89.1	Confident	83	Confident	53 Å²	53	69.3 Å²	69.3	28%	0.283	38%	0.377	S	S	.	.	H	α-helix	trans	-66.9	-42.3	179.5	-168.8	61.3	0	0	0	112.1	H41 I42 A43 A47 W48 I49	H41-N45 WeakPolarHBondContact O-CB 3.42Å; H41-N45 PolarHBondContact O-N 3.32Å; I42-N45 PolarHBondContact O-N 2.82Å; I42-N45 VanDerWaalsContact O-N 3.17Å; A43-N45 VanDerWaalsContact C-N 3.34Å; A43-N45 PolarHBondContact O-N 3.22Å; N45-A47 VanDerWaalsContact C-N 3.35Å; N45-A47 PolarHBondContact O-N 3.41Å; N45-W48 PolarHBondContact O-N 2.93Å; N45-I49 WeakPolarHBondContact ND2-CD1 3.37Å; N45-I49 WeakPolarHBondContact O-CG1 3.43Å; N45-I49 PolarHBondContact O-N 3Å
46	N	90	Very high	84.5	Confident	84 Å²	84	64.3 Å²	64.3	45%	0.449	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-41.5	176.7	-70.8	-11.6	0	0	0	111.8	I42 A43 W48 I49 E50	I42-N46 VanDerWaalsContact O-CG 3.31Å; I42-N46 PolarHBondContact O-N 2.96Å; A43-N46 PolarHBondContact O-N 2.64Å; N46-W48 VanDerWaalsContact C-N 3.34Å; N46-W48 PolarHBondContact O-N 3.35Å; N46-I49 PolarHBondContact O-N 3.34Å; N46-I49 VanDerWaalsContact O-N 3.13Å; N46-E50 PolarHBondContact O-N 3.38Å
47	A	90.4	Very high	85.7	Confident	9 Å²	9	66 Å²	66	7%	0.074	38%	0.378	C	S	.	.	H	α-helix	trans	-55	-49.2	173.6	0	0	0	0	0	111.2	Q27 T30 L31 A43 K44 N45 I49 E50 I51	Q27-A47 PolarHBondContact NE2-O 2.89Å; Q27-A47 VanDerWaalsContact OE1-CA 3.3Å; Q27-A47 PolarHBondContact OE1-O 2.95Å; T30-A47 HydrophobicContact CG2-CB 4.05Å; L31-A47 HydrophobicContact CD1-CB 4.2Å; L31-A47 HydrophobicContact CD2-CB 3.98Å; L31-A47 HydrophobicContact CG-CB 4.1Å; A43-A47 VanDerWaalsContact O-CB 3.28Å; A43-A47 WeakPolarHBondContact O-CB 3.47Å; A43-A47 PolarHBondContact O-N 3.28Å; K44-A47 WeakPolarHBondContact O-CB 3.41Å; K44-A47 PolarHBondContact O-N 3.21Å; N45-A47 VanDerWaalsContact C-N 3.35Å; N45-A47 PolarHBondContact O-N 3.41Å; A47-I49 PolarHBondContact O-N 3.45Å; A47-E50 PolarHBondContact O-N 3.13Å; A47-I51 WeakPolarHBondContact O-CG1 3.4Å; A47-I51 PolarHBondContact O-N 3.36Å
48	W	93	Very high	87.1	Confident	32 Å²	32	65 Å²	65	12%	0.121	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-37.5	174.4	-78.5	116.2	0	0	0	114.1	I24 L31 K44 N45 N46 I51 L52 L65 V68 K69 W72	I24-W48 HydrophobicContact CD1-CH2 3.9Å; I24-W48 HydrophobicContact CD1-CZ3 3.95Å; I24-W48 HydrophobicContact CG1-CZ3 4.48Å; L31-W48 HydrophobicContact CD1-CD2 4.16Å; L31-W48 HydrophobicContact CD1-CZ2 4.2Å; L31-W48 HydrophobicContact CD2-CD2 4.41Å; L31-W48 HydrophobicContact CD2-CG 4.3Å; L31-W48 HydrophobicContact CD2-CZ2 4.42Å; K44-W48 PolarHBondContact O-N 3.04Å; K44-W48 VanDerWaalsContact O-N 3.13Å; N45-W48 PolarHBondContact O-N 2.93Å; N46-W48 VanDerWaalsContact C-N 3.34Å; N46-W48 PolarHBondContact O-N 3.35Å; W48-I51 HydrophobicContact CD2-CD1 4.44Å; W48-I51 HydrophobicContact CE3-CD1 3.84Å; W48-I51 HydrophobicContact CZ3-CD1 4.04Å; W48-I51 PolarHBondContact O-N 3.25Å; W48-L52 WeakPolarHBondContact O-CB 3.45Å; W48-L52 PolarHBondContact O-N 3.03Å; W48-L65 HydrophobicContact CB-CD1 3.74Å; W48-L65 VanDerWaalsContact O-CD1 3.28Å; W48-L65 WeakPolarHBondContact O-CD1 3.42Å; W48-V68 HydrophobicContact CZ3-CG1 4.37Å; W48-K69 HydrophobicContact CD2-CD 4.36Å; W48-K69 HydrophobicContact CD2-CG 3.76Å; W48-K69 HydrophobicContact CE3-CG 3.79Å; W48-K69 HydrophobicContact CG-CD 4.44Å; W48-K69 HydrophobicContact CG-CG 4.3Å; W48-K69 HydrophobicContact CH2-CG 4.33Å; W48-K69 HydrophobicContact CZ2-CG 4.28Å; W48-K69 HydrophobicContact CZ3-CG 4.09Å; W48-W72 HydrophobicContact CH2-CB 3.97Å; W48-W72 AromaticContact CH2-CD1 3.55Å; W48-W72 AromaticContact CH2-CG 3.87Å; W48-W72 HydrophobicContact CH2-CG 3.87Å; W48-W72 HydrophobicContact CZ3-CB 4.41Å
49	I	91.4	Very high	88	Confident	72 Å²	72	62.1 Å²	62.1	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-40.6	176.6	-70.6	167.8	0	0	0	110.8	N45 N46 A47 L52 K53 L65	N45-I49 WeakPolarHBondContact ND2-CD1 3.37Å; N45-I49 WeakPolarHBondContact O-CG1 3.43Å; N45-I49 PolarHBondContact O-N 3Å; N46-I49 PolarHBondContact O-N 3.34Å; N46-I49 VanDerWaalsContact O-N 3.13Å; A47-I49 PolarHBondContact O-N 3.45Å; I49-L52 WeakPolarHBondContact O-CB 3.17Å; I49-L52 PolarHBondContact O-N 3.05Å; I49-K53 WeakPolarHBondContact O-CB 3.32Å; I49-K53 PolarHBondContact O-N 3.48Å; I49-L65 HydrophobicContact CG1-CD1 4.46Å; I49-L65 HydrophobicContact CG1-CD2 4.39Å
50	E	91.9	Very high	87.9	Confident	81 Å²	81	65.7 Å²	65.7	38%	0.379	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-42	175.7	-75.4	-59.8	120.8	0	0	111.7	N46 A47 L52 K53 K54	N46-E50 PolarHBondContact O-N 3.38Å; A47-E50 PolarHBondContact O-N 3.13Å; E50-L52 VanDerWaalsContact C-N 3.34Å; E50-L52 PolarHBondContact O-N 3.48Å; E50-K53 WeakPolarHBondContact O-CB 3.45Å; E50-K53 PolarHBondContact O-N 2.93Å; E50-K54 WeakPolarHBondContact O-CG 3.45Å; E50-K54 PolarHBondContact O-N 2.89Å
51	I	91.9	Very high	87.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-58.4	-48.6	172.1	-64.4	161.3	0	0	0	110.3	E23 I24 Q27 L31 A47 W48 K53 K54 V55 V68	E23-I51 HydrophobicContact CB-CG1 3.92Å; E23-I51 HydrophobicContact CB-CG2 4.47Å; E23-I51 HydrophobicContact CG-CB 4.29Å; E23-I51 HydrophobicContact CG-CG1 3.57Å; I24-I51 HydrophobicContact CD1-CD1 4.42Å; I24-I51 HydrophobicContact CG1-CD1 3.52Å; I24-I51 HydrophobicContact CG1-CG1 4.41Å; Q27-I51 VanDerWaalsContact OE1-CD1 3.25Å; L31-I51 HydrophobicContact CD1-CD1 3.3Å; A47-I51 WeakPolarHBondContact O-CG1 3.4Å; A47-I51 PolarHBondContact O-N 3.36Å; W48-I51 HydrophobicContact CD2-CD1 4.44Å; W48-I51 HydrophobicContact CE3-CD1 3.84Å; W48-I51 HydrophobicContact CZ3-CD1 4.04Å; W48-I51 PolarHBondContact O-N 3.25Å; I51-K53 VanDerWaalsContact C-N 3.27Å; I51-K53 PolarHBondContact O-N 3.26Å; I51-K54 PolarHBondContact O-N 3.24Å; I51-K54 VanDerWaalsContact O-N 3.15Å; I51-V55 HydrophobicContact CG2-CG2 4.17Å; I51-V55 VanDerWaalsContact O-CG2 3.3Å; I51-V55 WeakPolarHBondContact O-CG2 3.49Å; I51-V55 PolarHBondContact O-N 2.99Å; I51-V68 HydrophobicContact CG2-CG1 3.97Å
52	L	92	Very high	87.3	Confident	28 Å²	28	62.9 Å²	62.9	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-56.7	-43	178.6	178.8	65.7	0	0	0	111.7	W48 I49 E50 V55 N56 R63 L65 V68	W48-L52 WeakPolarHBondContact O-CB 3.45Å; W48-L52 PolarHBondContact O-N 3.03Å; I49-L52 WeakPolarHBondContact O-CB 3.17Å; I49-L52 PolarHBondContact O-N 3.05Å; E50-L52 VanDerWaalsContact C-N 3.34Å; E50-L52 PolarHBondContact O-N 3.48Å; L52-V55 PolarHBondContact O-N 3.43Å; L52-N56 VanDerWaalsContact O-CB 3.29Å; L52-N56 WeakPolarHBondContact O-CB 3.46Å; L52-N56 PolarHBondContact O-N 2.89Å; L52-R63 WeakPolarHBondContact CD1-O 3.35Å; L52-L65 HydrophobicContact CB-CD1 3.96Å; L52-L65 HydrophobicContact CD2-CB 4Å; L52-L65 HydrophobicContact CD2-CD1 4.1Å; L52-V68 HydrophobicContact CD1-CG2 3.66Å
53	K	92.3	Very high	87.1	Confident	134 Å²	134	58.2 Å²	58.2	58%	0.583	33%	0.325	S	S	*	.	H	α-helix	trans	-62.4	-42.5	178.4	-175.1	-179.4	177.9	-176.8	0	111.8	I49 E50 I51 A57	I49-K53 WeakPolarHBondContact O-CB 3.32Å; I49-K53 PolarHBondContact O-N 3.48Å; E50-K53 WeakPolarHBondContact O-CB 3.45Å; E50-K53 PolarHBondContact O-N 2.93Å; I51-K53 VanDerWaalsContact C-N 3.27Å; I51-K53 PolarHBondContact O-N 3.26Å; K53-A57 WeakPolarHBondContact O-CB 3.41Å; K53-A57 PolarHBondContact O-N 2.97Å
54	K	90.8	Very high	87.2	Confident	103 Å²	103	62.5 Å²	62.5	45%	0.448	34%	0.339	S	S	.	.	H	α-helix	trans	-66.8	-40.9	176.7	-67	-68.9	-175.5	174	0	112.2	I19 E23 E50 I51 A57	I19-K54 HydrophobicContact CG2-CB 3.98Å; E23-K54 HydrophobicContact CG-CG 4.35Å; E50-K54 WeakPolarHBondContact O-CG 3.45Å; E50-K54 PolarHBondContact O-N 2.89Å; I51-K54 PolarHBondContact O-N 3.24Å; I51-K54 VanDerWaalsContact O-N 3.15Å; K54-A57 WeakPolarHBondContact O-CB 3.28Å; K54-A57 PolarHBondContact O-N 3.13Å
55	V	89	Confident	87.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.7	-51.9	174.8	173.7	0	0	0	0	110	I19 I20 I51 L52 A57 V58 T59 V68	I19-V55 HydrophobicContact CG2-CG2 4.18Å; I20-V55 HydrophobicContact CD1-CG2 4.24Å; I20-V55 HydrophobicContact CG1-CG2 3.44Å; I20-V55 VanDerWaalsContact CG1-CG2 3.44Å; I51-V55 HydrophobicContact CG2-CG2 4.17Å; I51-V55 VanDerWaalsContact O-CG2 3.3Å; I51-V55 WeakPolarHBondContact O-CG2 3.49Å; I51-V55 PolarHBondContact O-N 2.99Å; L52-V55 PolarHBondContact O-N 3.43Å; V55-A57 PolarHBondContact O-N 3.15Å; V55-A57 VanDerWaalsContact O-N 3.08Å; V55-V58 WeakPolarHBondContact O-CG2 3.44Å; V55-V58 PolarHBondContact O-N 2.99Å; V55-T59 WeakPolarHBondContact CG1-OG1 3.45Å; V55-T59 WeakPolarHBondContact O-CB 3.47Å; V55-T59 PolarHBondContact O-N 3.47Å; V55-T59 PolarHBondContact O-OG1 2.97Å; V55-V68 HydrophobicContact CG1-CG2 4.36Å
56	N	89.1	Confident	87.1	Confident	57 Å²	57	62 Å²	62	31%	0.305	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-22.3	179.2	-79	-18.2	0	0	0	113.6	L52 R63	L52-N56 VanDerWaalsContact O-CB 3.29Å; L52-N56 WeakPolarHBondContact O-CB 3.46Å; L52-N56 PolarHBondContact O-N 2.89Å; N56-R63 PolarHBondContact ND2-O 3.32Å; N56-R63 PolarHBondContact OD1-N 3.4Å; N56-R63 PolarHBondContact OD1-O 3.46Å
57	A	88.9	Confident	87	Confident	84 Å²	84	60.3 Å²	60.3	69%	0.694	34%	0.338	S	S	*	.	H	α-helix	trans	-72.3	-26.4	173.6	0	0	0	0	0	113.8	K53 K54 V55	K53-A57 WeakPolarHBondContact O-CB 3.41Å; K53-A57 PolarHBondContact O-N 2.97Å; K54-A57 WeakPolarHBondContact O-CB 3.28Å; K54-A57 PolarHBondContact O-N 3.13Å; V55-A57 PolarHBondContact O-N 3.15Å; V55-A57 VanDerWaalsContact O-N 3.08Å
58	V	85.1	Confident	86.9	Confident	54 Å²	54	59.9 Å²	59.9	33%	0.327	33%	0.334	S	S	.	.	H	α-helix	trans	-104.9	-15.4	179.2	-61.1	0	0	0	0	113.1	R15 E16 I19 V55	R15-V58 HydrophobicContact CG-CB 4.42Å; E16-V58 HydrophobicContact CG-CG2 4.28Å; I19-V58 HydrophobicContact CB-CG2 4.4Å; I19-V58 HydrophobicContact CG1-CG1 4.26Å; I19-V58 HydrophobicContact CG1-CG2 4Å; V55-V58 WeakPolarHBondContact O-CG2 3.44Å; V55-V58 PolarHBondContact O-N 2.99Å
59	T	83.6	Confident	86.7	Confident	19 Å²	19	62 Å²	62	12%	0.117	34%	0.344	C	S	.	.			trans	-77.1	140	-178.9	-76.6	0	0	0	0	111.5	E16 V55 C61 R63	E16-T59 WeakPolarHBondContact CG-OG1 3.46Å; E16-T59 WeakPolarHBondContact OE1-CB 3.28Å; E16-T59 VanDerWaalsContact OE1-CG2 3.24Å; E16-T59 WeakPolarHBondContact OE1-CG2 3.49Å; E16-T59 PolarHBondContact OE1-OG1 3.32Å; V55-T59 WeakPolarHBondContact CG1-OG1 3.45Å; V55-T59 WeakPolarHBondContact O-CB 3.47Å; V55-T59 PolarHBondContact O-N 3.47Å; V55-T59 PolarHBondContact O-OG1 2.97Å; T59-C61 WeakPolarHBondContact CG2-O 3.47Å; T59-R63 HydrophobicContact CG2-CG 4.09Å
60	T	75.2	Confident	86.6	Confident	115 Å²	115	65 Å²	65	71%	0.706	36%	0.355	S	S	*	.	S	Bend	trans	-85.6	-14	174.5	53.1	0	0	0	0	113.8	M10	M10-T60 VanDerWaalsContact CE-OG1 3.3Å; M10-T60 WeakPolarHBondContact CE-OG1 3.22Å
61	C	74.7	Confident	86.5	Confident	67 Å²	67	63.8 Å²	63.8	45%	0.453	35%	0.348	S	S	.	.	S	Bend	trans	-136.1	117.1	179	-63.6	0	0	0	0	111.1	T59 R63	T59-C61 WeakPolarHBondContact CG2-O 3.47Å; C61-R63 PolarHBondContact O-N 3.07Å
62	P	76.5	Confident	86.5	Confident	113 Å²	113	64.1 Å²	64.1	73%	0.734	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-53.1	124.6	-171	23.8	-34.4	0	0	0	111.8
63	R	82.3	Confident	86.3	Confident	18 Å²	18	65.3 Å²	65.3	7%	0.068	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-97.6	155.3	176.7	-64.9	-176.9	-172.8	-80	-2.8	109.8	N11 F12 E16 L52 N56 T59 C61 E67 V68	N11-R63 PolarHBondContact O-NH2 3.33Å; F12-R63 VanDerWaalsContact CA-NH2 3.35Å; E16-R63 VanDerWaalsContact CD-NH2 3.35Å; E16-R63 IonicContact OE1-CZ 2.65Å; E16-R63 IonicContact OE1-NE 3.69Å; E16-R63 PolarHBondContact OE1-NE 3.32Å; E16-R63 IonicContact OE1-NH2 3.86Å; E16-R63 PolarHBondContact OE1-NH2 3.48Å; E16-R63 IonicContact OE2-CZ 2.64Å; E16-R63 IonicContact OE2-NE 2.84Å; E16-R63 IonicContact OE2-NH2 3.12Å; E16-R63 PolarHBondContact OE2-NH2 2.94Å; L52-R63 WeakPolarHBondContact CD1-O 3.35Å; N56-R63 PolarHBondContact ND2-O 3.32Å; N56-R63 PolarHBondContact OD1-N 3.4Å; N56-R63 PolarHBondContact OD1-O 3.46Å; T59-R63 HydrophobicContact CG2-CG 4.09Å; C61-R63 PolarHBondContact O-N 3.07Å; R63-E67 WeakPolarHBondContact CA-OE2 3.33Å; R63-V68 HydrophobicContact CB-CG2 4.44Å
64	E	87.4	Confident	86.1	Confident	126 Å²	126	62.6 Å²	62.6	59%	0.589	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-100.4	157.5	175.8	-67.7	-179.6	-177.8	0	0	111.8	A66 E67 V68	E64-A66 PolarHBondContact O-N 2.88Å; E64-E67 HydrophobicContact CB-CG 4.34Å; E64-E67 PolarHBondContact N-OE2 3.37Å; E64-E67 WeakPolarHBondContact O-CB 3.48Å; E64-E67 PolarHBondContact O-N 2.77Å; E64-V68 PolarHBondContact O-N 3.09Å
65	L	88.1	Confident	86	Confident	39 Å²	39	58.5 Å²	58.5	20%	0.204	34%	0.335	C	S	.	.	H	α-helix	trans	-53.4	-39.7	179.6	-166.4	65.3	0	0	0	112.5	W48 I49 L52 E67 V68 K69	W48-L65 HydrophobicContact CB-CD1 3.74Å; W48-L65 VanDerWaalsContact O-CD1 3.28Å; W48-L65 WeakPolarHBondContact O-CD1 3.42Å; I49-L65 HydrophobicContact CG1-CD1 4.46Å; I49-L65 HydrophobicContact CG1-CD2 4.39Å; L52-L65 HydrophobicContact CB-CD1 3.96Å; L52-L65 HydrophobicContact CD2-CB 4Å; L52-L65 HydrophobicContact CD2-CD1 4.1Å; L65-E67 VanDerWaalsContact C-N 3.33Å; L65-E67 PolarHBondContact O-N 2.88Å; L65-V68 PolarHBondContact O-N 3.16Å; L65-K69 HydrophobicContact CG-CD 4.42Å; L65-K69 WeakPolarHBondContact O-CB 3.41Å; L65-K69 WeakPolarHBondContact O-CG 3.28Å; L65-K69 PolarHBondContact O-N 3.37Å
66	A	85	Confident	85.9	Confident	67 Å²	67	61 Å²	61	55%	0.554	35%	0.346	S	S	*	.	H	α-helix	trans	-64.5	-37.3	179	0	0	0	0	0	112.2	E64 K70	E64-A66 PolarHBondContact O-N 2.88Å; A66-K70 VanDerWaalsContact O-CB 3.3Å; A66-K70 WeakPolarHBondContact O-CB 3.15Å; A66-K70 PolarHBondContact O-N 2.65Å
67	E	88.3	Confident	85.8	Confident	49 Å²	49	61.7 Å²	61.7	23%	0.229	35%	0.352	C	S	.	.	H	α-helix	trans	-69.5	-40.8	179.6	-60.2	-178.5	129.9	0	0	111.2	K9 F12 R63 E64 L65 K70 K71	K9-E67 WeakPolarHBondContact CD-OE1 3.46Å; K9-E67 VanDerWaalsContact NZ-CD 3.26Å; K9-E67 IonicContact NZ-OE1 2.78Å; K9-E67 PolarHBondContact NZ-OE1 2.94Å; K9-E67 IonicContact NZ-OE2 2.77Å; K9-E67 PolarHBondContact NZ-OE2 3.49Å; F12-E67 HydrophobicContact CZ-CB 4.31Å; R63-E67 WeakPolarHBondContact CA-OE2 3.33Å; E64-E67 HydrophobicContact CB-CG 4.34Å; E64-E67 PolarHBondContact N-OE2 3.37Å; E64-E67 WeakPolarHBondContact O-CB 3.48Å; E64-E67 PolarHBondContact O-N 2.77Å; L65-E67 VanDerWaalsContact C-N 3.33Å; L65-E67 PolarHBondContact O-N 2.88Å; E67-K70 PolarHBondContact O-N 2.95Å; E67-K71 WeakPolarHBondContact O-CB 3.3Å; E67-K71 PolarHBondContact O-N 3.26Å
68	V	88.8	Confident	85.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-67.2	-44.7	177	177.6	0	0	0	0	111.2	I20 W48 I51 L52 V55 R63 E64 L65 K70 K71 W72	I20-V68 HydrophobicContact CD1-CG1 4.29Å; I20-V68 HydrophobicContact CG1-CG1 4.24Å; W48-V68 HydrophobicContact CZ3-CG1 4.37Å; I51-V68 HydrophobicContact CG2-CG1 3.97Å; L52-V68 HydrophobicContact CD1-CG2 3.66Å; V55-V68 HydrophobicContact CG1-CG2 4.36Å; R63-V68 HydrophobicContact CB-CG2 4.44Å; E64-V68 PolarHBondContact O-N 3.09Å; L65-V68 PolarHBondContact O-N 3.16Å; V68-K70 VanDerWaalsContact C-N 3.34Å; V68-K70 PolarHBondContact O-N 3.17Å; V68-K71 PolarHBondContact O-N 2.96Å; V68-W72 PolarHBondContact O-N 3.41Å
69	K	89.3	Confident	85.7	Confident	75 Å²	75	58.7 Å²	58.7	33%	0.326	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-44.4	174.9	-76.5	178.2	177.4	177.8	0	111.8	W48 L65 W72 S73	W48-K69 HydrophobicContact CD2-CD 4.36Å; W48-K69 HydrophobicContact CD2-CG 3.76Å; W48-K69 HydrophobicContact CE3-CG 3.79Å; W48-K69 HydrophobicContact CG-CD 4.44Å; W48-K69 HydrophobicContact CG-CG 4.3Å; W48-K69 HydrophobicContact CH2-CG 4.33Å; W48-K69 HydrophobicContact CZ2-CG 4.28Å; W48-K69 HydrophobicContact CZ3-CG 4.09Å; L65-K69 HydrophobicContact CG-CD 4.42Å; L65-K69 WeakPolarHBondContact O-CB 3.41Å; L65-K69 WeakPolarHBondContact O-CG 3.28Å; L65-K69 PolarHBondContact O-N 3.37Å; K69-W72 PolarHBondContact O-N 3.05Å; K69-S73 PolarHBondContact O-N 3.16Å
70	K	88.9	Confident	85.7	Confident	137 Å²	137	61.3 Å²	61.3	60%	0.596	33%	0.328	S	S	*	.	H	α-helix	trans	-61.5	-48.3	175.9	-177.7	176.2	178.3	176.6	0	111.1	A66 E67 V68 W72 S73 D74	A66-K70 VanDerWaalsContact O-CB 3.3Å; A66-K70 WeakPolarHBondContact O-CB 3.15Å; A66-K70 PolarHBondContact O-N 2.65Å; E67-K70 PolarHBondContact O-N 2.95Å; V68-K70 VanDerWaalsContact C-N 3.34Å; V68-K70 PolarHBondContact O-N 3.17Å; K70-W72 VanDerWaalsContact C-N 3.3Å; K70-W72 PolarHBondContact O-N 3.47Å; K70-S73 WeakPolarHBondContact O-CA 3.33Å; K70-S73 WeakPolarHBondContact O-CB 3.45Å; K70-S73 PolarHBondContact O-N 3.39Å; K70-D74 PolarHBondContact O-N 3.13Å
71	K	90.2	Very high	86.1	Confident	54 Å²	54	61.5 Å²	61.5	24%	0.235	32%	0.316	C	S	.	.	H	α-helix	trans	-57.2	-43.5	178.8	-179.8	57.8	177.4	178.1	0	112.1	F12 I20 E67 V68 D74 M75	F12-K71 HydrophobicContact CB-CD 4.42Å; F12-K71 HydrophobicContact CD1-CG 4.05Å; F12-K71 HydrophobicContact CD2-CB 4.26Å; F12-K71 HydrophobicContact CD2-CD 3.78Å; F12-K71 HydrophobicContact CD2-CG 3.9Å; F12-K71 HydrophobicContact CE1-CB 4.12Å; F12-K71 HydrophobicContact CE1-CG 4.04Å; F12-K71 HydrophobicContact CE2-CB 3.77Å; F12-K71 HydrophobicContact CE2-CD 4.13Å; F12-K71 HydrophobicContact CE2-CG 3.93Å; F12-K71 HydrophobicContact CG-CD 4.05Å; F12-K71 HydrophobicContact CG-CG 3.96Å; F12-K71 HydrophobicContact CZ-CB 3.68Å; F12-K71 HydrophobicContact CZ-CG 3.99Å; I20-K71 HydrophobicContact CD1-CG 4.08Å; E67-K71 WeakPolarHBondContact O-CB 3.3Å; E67-K71 PolarHBondContact O-N 3.26Å; V68-K71 PolarHBondContact O-N 2.96Å; K71-D74 PolarHBondContact O-N 3.5Å; K71-M75 HydrophobicContact CD-CG 4.42Å; K71-M75 HydrophobicContact CD-SD 4.24Å; K71-M75 HydrophobicContact CG-SD 4.04Å; K71-M75 VanDerWaalsContact O-CG 3.24Å; K71-M75 WeakPolarHBondContact O-CG 3.32Å; K71-M75 PolarHBondContact O-N 3.45Å
72	W	91.1	Very high	86.5	Confident	8 Å²	8	61 Å²	61	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-43.6	173.8	175.5	-118.2	0	0	0	112.3	I20 V21 I24 V32 W48 V68 K69 K70 M75 K76 I111 L114	I20-W72 HydrophobicContact CG2-CE3 4.21Å; V21-W72 HydrophobicContact CG2-CZ3 4.36Å; I24-W72 HydrophobicContact CB-CH2 4.43Å; I24-W72 HydrophobicContact CB-CZ3 4.47Å; I24-W72 HydrophobicContact CD1-CB 3.98Å; I24-W72 HydrophobicContact CD1-CD2 3.26Å; I24-W72 HydrophobicContact CD1-CE3 3.36Å; I24-W72 HydrophobicContact CD1-CG 3.54Å; I24-W72 HydrophobicContact CD1-CH2 4.44Å; I24-W72 HydrophobicContact CD1-CZ2 4.37Å; I24-W72 HydrophobicContact CD1-CZ3 3.96Å; I24-W72 HydrophobicContact CG2-CD2 4.37Å; I24-W72 HydrophobicContact CG2-CH2 3.74Å; I24-W72 HydrophobicContact CG2-CZ2 3.53Å; I24-W72 HydrophobicContact CG2-CZ3 4.22Å; V32-W72 HydrophobicContact CG2-CZ2 4.26Å; W48-W72 HydrophobicContact CH2-CB 3.97Å; W48-W72 AromaticContact CH2-CD1 3.55Å; W48-W72 AromaticContact CH2-CG 3.87Å; W48-W72 HydrophobicContact CH2-CG 3.87Å; W48-W72 HydrophobicContact CZ3-CB 4.41Å; V68-W72 PolarHBondContact O-N 3.41Å; K69-W72 PolarHBondContact O-N 3.05Å; K70-W72 VanDerWaalsContact C-N 3.3Å; K70-W72 PolarHBondContact O-N 3.47Å; W72-M75 HydrophobicContact CE3-CE 4.45Å; W72-M75 HydrophobicContact CZ3-CE 4.48Å; W72-M75 PolarHBondContact O-N 2.87Å; W72-K76 HydrophobicContact CD2-CG 4.28Å; W72-K76 HydrophobicContact CZ2-CD 4.04Å; W72-K76 HydrophobicContact CZ2-CG 3.96Å; W72-K76 WeakPolarHBondContact O-CG 3.32Å; W72-K76 PolarHBondContact O-N 3.03Å; W72-I111 HydrophobicContact CH2-CG2 4.21Å; W72-I111 HydrophobicContact CZ3-CG1 4.33Å; W72-I111 HydrophobicContact CZ3-CG2 4.49Å; W72-L114 HydrophobicContact CH2-CD2 3.64Å; W72-L114 HydrophobicContact CZ2-CD2 4.07Å
73	S	88.2	Confident	86.8	Confident	53 Å²	53	56.3 Å²	56.3	37%	0.371	28%	0.275	S	S	.	.	H	α-helix	trans	-59.2	-48.2	176.4	-165.9	0	0	0	0	112.1	K69 K70 M75 K76 T77	K69-S73 PolarHBondContact O-N 3.16Å; K70-S73 WeakPolarHBondContact O-CA 3.33Å; K70-S73 WeakPolarHBondContact O-CB 3.45Å; K70-S73 PolarHBondContact O-N 3.39Å; S73-M75 VanDerWaalsContact C-N 3.28Å; S73-M75 PolarHBondContact O-N 3.46Å; S73-K76 PolarHBondContact O-N 3.26Å; S73-T77 PolarHBondContact O-N 3.18Å; S73-T77 PolarHBondContact O-OG1 3.02Å
74	D	88	Confident	86.7	Confident	77 Å²	77	58.3 Å²	58.3	41%	0.412	30%	0.296	S	S	.	.	H	α-helix	trans	-61.7	-36.3	178.8	-64.1	-17.8	0	0	0	111.6	K70 K71 T77 E78	K70-D74 PolarHBondContact O-N 3.13Å; K71-D74 PolarHBondContact O-N 3.5Å; D74-T77 WeakPolarHBondContact CA-OG1 3.38Å; D74-T77 PolarHBondContact O-OG1 3.45Å; D74-E78 VanDerWaalsContact O-CB 3.28Å; D74-E78 WeakPolarHBondContact O-CB 3.42Å; D74-E78 PolarHBondContact O-N 3.29Å
75	M	88.4	Confident	86.3	Confident	17 Å²	17	58 Å²	58	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-67.9	-41.4	175.4	-73	168.3	57.5	0	0	112.3	V17 V21 K71 W72 S73 E78 V79 I111	V17-M75 HydrophobicContact CG1-CE 3.6Å; V17-M75 HydrophobicContact CG1-SD 3.89Å; V21-M75 HydrophobicContact CG2-CE 3.35Å; K71-M75 HydrophobicContact CD-CG 4.42Å; K71-M75 HydrophobicContact CD-SD 4.24Å; K71-M75 HydrophobicContact CG-SD 4.04Å; K71-M75 VanDerWaalsContact O-CG 3.24Å; K71-M75 WeakPolarHBondContact O-CG 3.32Å; K71-M75 PolarHBondContact O-N 3.45Å; W72-M75 HydrophobicContact CE3-CE 4.45Å; W72-M75 HydrophobicContact CZ3-CE 4.48Å; W72-M75 PolarHBondContact O-N 2.87Å; S73-M75 VanDerWaalsContact C-N 3.28Å; S73-M75 PolarHBondContact O-N 3.46Å; M75-E78 PolarHBondContact O-N 2.96Å; M75-V79 WeakPolarHBondContact O-CB 3.44Å; M75-V79 VanDerWaalsContact O-CG2 3.26Å; M75-V79 WeakPolarHBondContact O-CG2 3.45Å; M75-V79 PolarHBondContact O-N 3.37Å; M75-I111 HydrophobicContact CB-CD1 4.42Å; M75-I111 HydrophobicContact CE-CD1 3.42Å; M75-I111 VanDerWaalsContact CE-CD1 3.42Å; M75-I111 HydrophobicContact CE-CG1 4.45Å
76	K	87.4	Confident	85.6	Confident	53 Å²	53	56.7 Å²	56.7	23%	0.23	29%	0.289	C	S	.	.	H	α-helix	trans	-62.7	-43.6	175.6	-70.1	-173.3	-67.4	177.2	0	111.7	W72 S73 R80 L115	W72-K76 HydrophobicContact CD2-CG 4.28Å; W72-K76 HydrophobicContact CZ2-CD 4.04Å; W72-K76 HydrophobicContact CZ2-CG 3.96Å; W72-K76 WeakPolarHBondContact O-CG 3.32Å; W72-K76 PolarHBondContact O-N 3.03Å; S73-K76 PolarHBondContact O-N 3.26Å; K76-R80 WeakPolarHBondContact O-CB 3.46Å; K76-R80 WeakPolarHBondContact O-CG 3.34Å; K76-R80 PolarHBondContact O-N 3.49Å; K76-R80 PolarHBondContact O-NE 2.98Å; K76-L115 HydrophobicContact CB-CD1 4.38Å; K76-L115 HydrophobicContact CD-CD2 3.63Å; K76-L115 HydrophobicContact CG-CD1 4.18Å; K76-L115 HydrophobicContact CG-CD2 3.94Å
77	T	86.8	Confident	85	Confident	71 Å²	71	60.1 Å²	60.1	44%	0.436	29%	0.288	S	S	.	.	H	α-helix	trans	-66.4	-43.6	178.8	50.9	0	0	0	0	111.1	S73 D74 V79 R80 R81	S73-T77 PolarHBondContact O-N 3.18Å; S73-T77 PolarHBondContact O-OG1 3.02Å; D74-T77 WeakPolarHBondContact CA-OG1 3.38Å; D74-T77 PolarHBondContact O-OG1 3.45Å; T77-V79 PolarHBondContact O-N 2.95Å; T77-R80 PolarHBondContact O-N 2.95Å; T77-R81 WeakPolarHBondContact O-CB 3.39Å; T77-R81 PolarHBondContact O-N 2.88Å
78	E	85.9	Confident	84.3	Confident	71 Å²	71	60 Å²	60	33%	0.332	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-42.6	177.5	-179.5	57	-164	0	0	112.2	D74 M75 R81 K82	D74-E78 VanDerWaalsContact O-CB 3.28Å; D74-E78 WeakPolarHBondContact O-CB 3.42Å; D74-E78 PolarHBondContact O-N 3.29Å; M75-E78 PolarHBondContact O-N 2.96Å; E78-R81 PolarHBondContact O-N 3.2Å; E78-R81 IonicContact OE1-CZ 3.66Å; E78-R81 IonicContact OE1-NE 3.77Å; E78-R81 IonicContact OE1-NH2 2.73Å; E78-R81 PolarHBondContact OE1-NH2 3.47Å; E78-R81 IonicContact OE2-CZ 3.63Å; E78-R81 IonicContact OE2-NE 2.97Å; E78-R81 PolarHBondContact OE2-NE 3.28Å; E78-R81 IonicContact OE2-NH2 3.4Å; E78-R81 PolarHBondContact OE2-NH2 3.03Å; E78-K82 WeakPolarHBondContact O-CB 3.28Å; E78-K82 WeakPolarHBondContact O-CG 3.46Å; E78-K82 PolarHBondContact O-N 2.88Å; E78-K82 WeakPolarHBondContact OE1-CE 3.3Å
79	V	86.3	Confident	83.2	Confident	3 Å²	3	62 Å²	62	2%	0.018	31%	0.311	C	S	.	.	H	α-helix	trans	-63.3	-45.2	175.5	170.2	0	0	0	0	111	M75 T77 R81 K82 V83 Q108 I111 C112	M75-V79 WeakPolarHBondContact O-CB 3.44Å; M75-V79 VanDerWaalsContact O-CG2 3.26Å; M75-V79 WeakPolarHBondContact O-CG2 3.45Å; M75-V79 PolarHBondContact O-N 3.37Å; T77-V79 PolarHBondContact O-N 2.95Å; V79-R81 PolarHBondContact O-N 3.18Å; V79-K82 PolarHBondContact O-N 3.47Å; V79-V83 HydrophobicContact CG1-CG2 4.33Å; V79-V83 VanDerWaalsContact O-CG2 3.26Å; V79-V83 WeakPolarHBondContact O-CG2 3.49Å; V79-V83 PolarHBondContact O-N 3.47Å; V79-Q108 HydrophobicContact CG2-CB 4.11Å; V79-Q108 HydrophobicContact CG2-CG 4Å; V79-I111 HydrophobicContact CB-CG2 4.18Å; V79-I111 HydrophobicContact CG1-CB 4.48Å; V79-I111 HydrophobicContact CG1-CG2 4.23Å; V79-I111 HydrophobicContact CG2-CB 3.99Å; V79-I111 HydrophobicContact CG2-CD1 4.06Å; V79-I111 HydrophobicContact CG2-CG2 3.86Å; V79-C112 HydrophobicContact CG1-CB 4.04Å
80	R	83.3	Confident	82.1	Confident	75 Å²	75	62.6 Å²	62.6	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-59.6	-45.9	175.7	-81.1	-174.2	-78.9	-120.5	6.2	112.4	K76 T77 K82 V83 A84 I120	K76-R80 WeakPolarHBondContact O-CB 3.46Å; K76-R80 WeakPolarHBondContact O-CG 3.34Å; K76-R80 PolarHBondContact O-N 3.49Å; K76-R80 PolarHBondContact O-NE 2.98Å; T77-R80 PolarHBondContact O-N 2.95Å; R80-K82 PolarHBondContact O-N 2.94Å; R80-V83 PolarHBondContact O-N 3.27Å; R80-A84 WeakPolarHBondContact O-CB 3.45Å; R80-A84 PolarHBondContact O-N 3.45Å; R80-I120 HydrophobicContact CG-CG1 4.35Å
81	R	83.7	Confident	80.8	Confident	118 Å²	118	62.9 Å²	62.9	45%	0.445	32%	0.321	S	S	.	.	H	α-helix	trans	-59.3	-46.1	177.2	-170.6	-165.8	67.6	70.6	0.7	111.3	T77 E78 V79 A84 Q85	T77-R81 WeakPolarHBondContact O-CB 3.39Å; T77-R81 PolarHBondContact O-N 2.88Å; E78-R81 PolarHBondContact O-N 3.2Å; E78-R81 IonicContact OE1-CZ 3.66Å; E78-R81 IonicContact OE1-NE 3.77Å; E78-R81 IonicContact OE1-NH2 2.73Å; E78-R81 PolarHBondContact OE1-NH2 3.47Å; E78-R81 IonicContact OE2-CZ 3.63Å; E78-R81 IonicContact OE2-NE 2.97Å; E78-R81 PolarHBondContact OE2-NE 3.28Å; E78-R81 IonicContact OE2-NH2 3.4Å; E78-R81 PolarHBondContact OE2-NH2 3.03Å; V79-R81 PolarHBondContact O-N 3.18Å; R81-A84 PolarHBondContact O-N 3.11Å; R81-Q85 WeakPolarHBondContact O-CB 3.42Å; R81-Q85 PolarHBondContact O-N 3.37Å
82	K	82.8	Confident	79.1	Confident	58 Å²	58	68.3 Å²	68.3	25%	0.252	35%	0.347	S	S	.	.	H	α-helix	trans	-65.6	-38.6	177.8	-75.9	-168.4	175.8	-161.4	0	113	E78 V79 R80 Q85 A86 L104	E78-K82 WeakPolarHBondContact O-CB 3.28Å; E78-K82 WeakPolarHBondContact O-CG 3.46Å; E78-K82 PolarHBondContact O-N 2.88Å; E78-K82 WeakPolarHBondContact OE1-CE 3.3Å; V79-K82 PolarHBondContact O-N 3.47Å; R80-K82 PolarHBondContact O-N 2.94Å; K82-Q85 PolarHBondContact O-N 3.26Å; K82-A86 VanDerWaalsContact O-CB 3.23Å; K82-A86 WeakPolarHBondContact O-CB 3.44Å; K82-A86 PolarHBondContact O-N 2.89Å; K82-L104 HydrophobicContact CB-CD2 3.86Å; K82-L104 HydrophobicContact CD-CD2 4.41Å
83	V	82.1	Confident	77.3	Confident	13 Å²	13	70.7 Å²	70.7	8%	0.079	36%	0.362	C	S	.	.	H	α-helix	trans	-67.3	-40.2	175.7	173	0	0	0	0	111.2	V79 R80 A86 R87 L104 I120	V79-V83 HydrophobicContact CG1-CG2 4.33Å; V79-V83 VanDerWaalsContact O-CG2 3.26Å; V79-V83 WeakPolarHBondContact O-CG2 3.49Å; V79-V83 PolarHBondContact O-N 3.47Å; R80-V83 PolarHBondContact O-N 3.27Å; V83-A86 WeakPolarHBondContact O-CB 3.49Å; V83-A86 PolarHBondContact O-N 3.47Å; V83-R87 WeakPolarHBondContact O-CG 3.48Å; V83-R87 PolarHBondContact O-N 2.91Å; V83-L104 HydrophobicContact CG2-CD1 3.92Å; V83-I120 HydrophobicContact CB-CG2 4.28Å; V83-I120 HydrophobicContact CG1-CG2 3.8Å
84	A	80.1	Confident	75.3	Confident	61 Å²	61	74 Å²	74	50%	0.504	38%	0.38	S	S	.	.	H	α-helix	trans	-62.9	-46.6	174.5	0	0	0	0	0	111.4	R80 R81 A86 R87 A88	R80-A84 WeakPolarHBondContact O-CB 3.45Å; R80-A84 PolarHBondContact O-N 3.45Å; R81-A84 PolarHBondContact O-N 3.11Å; A84-A86 VanDerWaalsContact C-N 3.3Å; A84-A86 PolarHBondContact O-N 3.13Å; A84-R87 PolarHBondContact O-N 3.45Å; A84-A88 PolarHBondContact O-N 2.89Å
85	Q	78.9	Confident	73.6	Confident	118 Å²	118	76.2 Å²	76.2	55%	0.551	40%	0.397	S	S	*	.	H	α-helix	trans	-60.7	-39.6	174.9	-173.7	174.9	13.6	0	0	112	R81 K82 R87 A88 A89	R81-Q85 WeakPolarHBondContact O-CB 3.42Å; R81-Q85 PolarHBondContact O-N 3.37Å; K82-Q85 PolarHBondContact O-N 3.26Å; Q85-R87 VanDerWaalsContact C-N 3.34Å; Q85-R87 PolarHBondContact O-N 2.85Å; Q85-A88 PolarHBondContact O-N 3.18Å; Q85-A89 PolarHBondContact O-N 3.4Å; Q85-A89 VanDerWaalsContact O-N 3.12Å
86	A	74.4	Confident	71.3	Confident	12 Å²	12	81.8 Å²	81.8	10%	0.099	43%	0.427	C	S	.	.	H	α-helix	trans	-59.8	-44.7	175.5	0	0	0	0	0	112.1	K82 V83 A84 I90 V102	K82-A86 VanDerWaalsContact O-CB 3.23Å; K82-A86 WeakPolarHBondContact O-CB 3.44Å; K82-A86 PolarHBondContact O-N 2.89Å; V83-A86 WeakPolarHBondContact O-CB 3.49Å; V83-A86 PolarHBondContact O-N 3.47Å; A84-A86 VanDerWaalsContact C-N 3.3Å; A84-A86 PolarHBondContact O-N 3.13Å; A86-I90 WeakPolarHBondContact O-CD1 3.44Å; A86-I90 WeakPolarHBondContact O-CG1 3.5Å; A86-I90 PolarHBondContact O-N 3.15Å; A86-V102 HydrophobicContact CB-CB 3.53Å; A86-V102 HydrophobicContact CB-CG1 3.33Å; A86-V102 HydrophobicContact CB-CG2 3.66Å
87	R	71.3	Confident	69.5	Low	140 Å²	140	85.3 Å²	85.3	53%	0.528	46%	0.457	S	S	.	.	H	α-helix	trans	-69.3	-43.6	179.3	-74	179.7	176.3	-104.9	1.6	112.1	V83 A84 Q85 A89 I90 E91	V83-R87 WeakPolarHBondContact O-CG 3.48Å; V83-R87 PolarHBondContact O-N 2.91Å; A84-R87 PolarHBondContact O-N 3.45Å; Q85-R87 VanDerWaalsContact C-N 3.34Å; Q85-R87 PolarHBondContact O-N 2.85Å; R87-A89 VanDerWaalsContact C-N 3.29Å; R87-A89 PolarHBondContact O-N 2.89Å; R87-I90 WeakPolarHBondContact O-CB 3.4Å; R87-I90 PolarHBondContact O-N 3.33Å; R87-E91 PolarHBondContact O-N 3.32Å
88	A	73.9	Confident	67.3	Low	45 Å²	45	86.9 Å²	86.9	37%	0.372	47%	0.467	S	S	.	.	H	α-helix	trans	-57.8	-42	176.7	0	0	0	0	0	112	A84 Q85 I90 E91 E92	A84-A88 PolarHBondContact O-N 2.89Å; Q85-A88 PolarHBondContact O-N 3.18Å; A88-I90 VanDerWaalsContact C-N 3.27Å; A88-I90 PolarHBondContact O-N 3.23Å; A88-E91 PolarHBondContact O-N 2.94Å; A88-E92 PolarHBondContact O-N 3.15Å; A88-E92 VanDerWaalsContact O-N 3.07Å
89	A	67.1	Low	65.3	Low	43 Å²	43	88.4 Å²	88.4	36%	0.355	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-28.6	176.1	0	0	0	0	0	113.6	Q85 R87 T93	Q85-A89 PolarHBondContact O-N 3.4Å; Q85-A89 VanDerWaalsContact O-N 3.12Å; R87-A89 VanDerWaalsContact C-N 3.29Å; R87-A89 PolarHBondContact O-N 2.89Å; A89-T93 PolarHBondContact O-OG1 3.45Å
90	I	65.5	Low	63.3	Low	88 Å²	88	92 Å²	92	45%	0.451	51%	0.505	S	S	.	.	H	α-helix	trans	-77.2	-38.9	175.5	-66	163.9	0	0	0	110.6	A86 R87 A88 T93 V102	A86-I90 WeakPolarHBondContact O-CD1 3.44Å; A86-I90 WeakPolarHBondContact O-CG1 3.5Å; A86-I90 PolarHBondContact O-N 3.15Å; R87-I90 WeakPolarHBondContact O-CB 3.4Å; R87-I90 PolarHBondContact O-N 3.33Å; A88-I90 VanDerWaalsContact C-N 3.27Å; A88-I90 PolarHBondContact O-N 3.23Å; I90-T93 PolarHBondContact O-N 2.95Å; I90-V102 HydrophobicContact CD1-CG2 4.48Å
91	E	60.5	Low	61.7	Low	143 Å²	143	96 Å²	96	67%	0.668	53%	0.526	S	S	*	.	H	α-helix	trans	-69.8	-30.8	-179.8	-163.1	168.4	-174.2	0	0	112.6	R87 A88 T93 T94	R87-E91 PolarHBondContact O-N 3.32Å; A88-E91 PolarHBondContact O-N 2.94Å; E91-T93 PolarHBondContact O-N 2.92Å; E91-T94 PolarHBondContact O-OG1 2.96Å
92	E	55.2	Low	60.4	Low	168 Å²	168	93.1 Å²	93.1	79%	0.785	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.8	172.5	-71.1	179.1	-177.2	0	0	114	A88	A88-E92 PolarHBondContact O-N 3.15Å; A88-E92 VanDerWaalsContact O-N 3.07Å
93	T	53.4	Low	59.5	Low	58 Å²	58	98 Å²	98	36%	0.356	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	18.4	-177.6	-48.8	0	0	0	0	112.7	A89 I90 E91 T95	A89-T93 PolarHBondContact O-OG1 3.45Å; I90-T93 PolarHBondContact O-N 2.95Å; E91-T93 PolarHBondContact O-N 2.92Å; T93-T95 PolarHBondContact O-N 2.94Å
94	T	47.3	Very low	59	Low	122 Å²	122	98.9 Å²	98.9	75%	0.748	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	15.9	-178.7	47.9	0	0	0	0	116.1	E91	E91-T94 PolarHBondContact O-OG1 2.96Å
95	T	52.3	Low	59	Low	123 Å²	123	99.4 Å²	99.4	76%	0.755	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-22.6	173	-49.2	0	0	0	0	113.9	T93	T93-T95 PolarHBondContact O-N 2.94Å
96	D	39.9	Very low	59.1	Low	135 Å²	135	98 Å²	98	72%	0.722	56%	0.559	S	S	*	*	S	Bend	trans	-148.9	139.5	178.9	-83	-50.8	0	0	0	114.2	T98	D96-T98 PolarHBondContact O-N 3.05Å; D96-T98 VanDerWaalsContact O-N 3.13Å
97	C	48.3	Very low	59.4	Low	126 Å²	126	99.6 Å²	99.6	85%	0.851	56%	0.564	S	S	*	*	S	Bend	trans	-57.1	102.9	-170.1	-165.1	0	0	0	0	113.6
98	T	42	Very low	59.9	Low	105 Å²	105	94.3 Å²	94.3	64%	0.644	55%	0.546	S	S	*	.			trans	-171.9	124	146	10.1	0	0	0	0	110.7	D96 V100	D96-T98 PolarHBondContact O-N 3.05Å; D96-T98 VanDerWaalsContact O-N 3.13Å; T98-V100 PolarHBondContact O-N 3.39Å
99	P	42.9	Very low	60.3	Low	103 Å²	103	96 Å²	96	67%	0.669	55%	0.546	S	S	*	.			trans	-69.8	102.6	174.8	27.5	-30.7	0	0	0	109.2	H101	P99-H101 VanDerWaalsContact C-N 3.32Å; P99-H101 PolarHBondContact O-N 3.04Å
100	V	44.9	Very low	61.1	Low	79 Å²	79	97.8 Å²	97.8	48%	0.479	54%	0.544	S	S	.	.			trans	-69	94.6	169.8	-179.5	0	0	0	0	107.3	T98 V102	T98-V100 PolarHBondContact O-N 3.39Å; V100-V102 PolarHBondContact O-N 3.03Å
101	H	48.6	Very low	62	Low	158 Å²	158	93.8 Å²	93.8	73%	0.731	52%	0.523	S	S	*	.			trans	-64.4	103.8	170.9	-77.1	-80.4	0	0	0	108.7	P99 I103	P99-H101 VanDerWaalsContact C-N 3.32Å; P99-H101 PolarHBondContact O-N 3.04Å; H101-I103 PolarHBondContact O-N 3.31Å
102	V	57.2	Low	63	Low	57 Å²	57	87.8 Å²	87.8	35%	0.345	50%	0.497	S	S	.	.			trans	-66.5	119.5	175	175.6	0	0	0	0	108.7	A86 I90 V100 L104	A86-V102 HydrophobicContact CB-CB 3.53Å; A86-V102 HydrophobicContact CB-CG1 3.33Å; A86-V102 HydrophobicContact CB-CG2 3.66Å; I90-V102 HydrophobicContact CD1-CG2 4.48Å; V100-V102 PolarHBondContact O-N 3.03Å; V102-L104 PolarHBondContact O-N 2.9Å
103	I	63.5	Low	64.4	Low	161 Å²	161	84.8 Å²	84.8	83%	0.826	49%	0.486	S	S	*	.			trans	-77.8	87.5	-175.2	-53.3	172.8	0	0	0	108.6	H101	H101-I103 PolarHBondContact O-N 3.31Å
104	L	71.5	Confident	65.8	Low	32 Å²	32	82.4 Å²	82.4	17%	0.168	47%	0.471	C	S	.	.			trans	-69.9	141.5	159.4	-69	172.8	0	0	0	108.6	K82 V83 V102 Q108	K82-L104 HydrophobicContact CB-CD2 3.86Å; K82-L104 HydrophobicContact CD-CD2 4.41Å; V83-L104 HydrophobicContact CG2-CD1 3.92Å; V102-L104 PolarHBondContact O-N 2.9Å; L104-Q108 HydrophobicContact CB-CB 4.15Å; L104-Q108 HydrophobicContact CD2-CB 4.18Å
105	T	81.1	Confident	67.3	Low	71 Å²	71	77.2 Å²	77.2	44%	0.436	44%	0.438	S	S	.	.			trans	-64.7	153.9	171.2	69.1	0	0	0	0	109.6	M107 Q108 Q109	T105-M107 PolarHBondContact O-N 2.94Å; T105-Q108 WeakPolarHBondContact O-CA 3.32Å; T105-Q108 WeakPolarHBondContact O-CB 3.24Å; T105-Q108 PolarHBondContact O-N 3Å; T105-Q108 VanDerWaalsContact OG1-CG 3.31Å; T105-Q108 WeakPolarHBondContact OG1-CG 3.31Å; T105-Q108 PolarHBondContact OG1-N 3.03Å; T105-Q108 PolarHBondContact OG1-NE2 3.02Å; T105-Q108 PolarHBondContact OG1-OE1 3.05Å; T105-Q109 PolarHBondContact O-N 3.35Å
106	A	79.6	Confident	68.2	Low	90 Å²	90	72.8 Å²	72.8	74%	0.744	42%	0.417	S	S	*	.	H	α-helix	trans	-51	-37.1	178.7	0	0	0	0	0	112.5	R110	A106-R110 WeakPolarHBondContact O-CB 3.42Å; A106-R110 PolarHBondContact O-N 3.44Å
107	M	80.7	Confident	68.9	Low	44 Å²	44	73 Å²	73	22%	0.217	41%	0.414	C	S	.	.	H	α-helix	trans	-68.2	-41.8	175.9	-165.3	60.1	64.4	0	0	113.2	E18 V21 T105 Q109 R110 I111	E18-M107 HydrophobicContact CB-CE 4.22Å; E18-M107 HydrophobicContact CG-CE 3.48Å; E18-M107 VanDerWaalsContact CG-CE 3.48Å; V21-M107 HydrophobicContact CB-SD 3.72Å; V21-M107 HydrophobicContact CG1-SD 3.76Å; V21-M107 HydrophobicContact CG2-CG 4.25Å; V21-M107 HydrophobicContact CG2-SD 3.62Å; T105-M107 PolarHBondContact O-N 2.94Å; M107-Q109 VanDerWaalsContact C-N 3.33Å; M107-R110 PolarHBondContact O-N 3.47Å; M107-I111 HydrophobicContact CG-CD1 4.29Å; M107-I111 WeakPolarHBondContact O-CD1 3.3Å; M107-I111 VanDerWaalsContact O-CG1 3.3Å; M107-I111 WeakPolarHBondContact O-CG1 3.41Å; M107-I111 PolarHBondContact O-N 3Å
108	Q	82.3	Confident	68.8	Low	30 Å²	30	70.5 Å²	70.5	14%	0.14	40%	0.403	C	S	.	.	H	α-helix	trans	-65.4	-39.5	177	-72.8	156	6.6	0	0	111.1	V79 L104 T105 I111 C112	V79-Q108 HydrophobicContact CG2-CB 4.11Å; V79-Q108 HydrophobicContact CG2-CG 4Å; L104-Q108 HydrophobicContact CB-CB 4.15Å; L104-Q108 HydrophobicContact CD2-CB 4.18Å; T105-Q108 WeakPolarHBondContact O-CA 3.32Å; T105-Q108 WeakPolarHBondContact O-CB 3.24Å; T105-Q108 PolarHBondContact O-N 3Å; T105-Q108 VanDerWaalsContact OG1-CG 3.31Å; T105-Q108 WeakPolarHBondContact OG1-CG 3.31Å; T105-Q108 PolarHBondContact OG1-N 3.03Å; T105-Q108 PolarHBondContact OG1-NE2 3.02Å; T105-Q108 PolarHBondContact OG1-OE1 3.05Å; Q108-I111 PolarHBondContact O-N 3.41Å; Q108-C112 WeakPolarHBondContact O-CB 3.5Å; Q108-C112 PolarHBondContact O-N 2.83Å
109	Q	82.8	Confident	69.3	Low	81 Å²	81	68.8 Å²	68.8	38%	0.379	39%	0.392	S	S	.	.	H	α-helix	trans	-62.5	-43	174.3	-166.8	65.8	30.8	0	0	111.5	T105 M107 I111 C112 N113	T105-Q109 PolarHBondContact O-N 3.35Å; M107-Q109 VanDerWaalsContact C-N 3.33Å; Q109-I111 PolarHBondContact O-N 3.31Å; Q109-C112 WeakPolarHBondContact O-CB 3.35Å; Q109-C112 PolarHBondContact O-N 3.33Å; Q109-N113 PolarHBondContact NE2-OD1 2.95Å; Q109-N113 VanDerWaalsContact O-CG 3.27Å; Q109-N113 PolarHBondContact O-N 3.01Å; Q109-N113 PolarHBondContact O-OD1 3.44Å
110	R	83.1	Confident	69.9	Low	80 Å²	80	65.4 Å²	65.4	30%	0.302	37%	0.368	S	S	.	.	H	α-helix	trans	-60.8	-43.5	177.5	-167.2	175.5	175.4	-172.1	3	111.9	V21 E22 E25 A106 M107 L114	V21-R110 HydrophobicContact CG1-CG 4.24Å; E22-R110 IonicContact OE1-NH1 3.36Å; E25-R110 IonicContact OE2-CZ 3.65Å; E25-R110 IonicContact OE2-NE 3.06Å; E25-R110 PolarHBondContact OE2-NE 2.95Å; E25-R110 IonicContact OE2-NH2 2.86Å; E25-R110 PolarHBondContact OE2-NH2 2.89Å; A106-R110 WeakPolarHBondContact O-CB 3.42Å; A106-R110 PolarHBondContact O-N 3.44Å; M107-R110 PolarHBondContact O-N 3.47Å; R110-L114 WeakPolarHBondContact O-CB 3.43Å; R110-L114 PolarHBondContact O-N 3.39Å
111	I	84.6	Confident	70.3	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.021	37%	0.371	C	S	.	.	H	α-helix	trans	-66.7	-39.3	175.6	-63.5	161.7	0	0	0	111.3	V21 W72 M75 V79 M107 Q108 Q109 L114 L115	V21-I111 HydrophobicContact CG1-CG1 4.05Å; V21-I111 HydrophobicContact CG2-CD1 3.91Å; V21-I111 HydrophobicContact CG2-CG1 3.92Å; W72-I111 HydrophobicContact CH2-CG2 4.21Å; W72-I111 HydrophobicContact CZ3-CG1 4.33Å; W72-I111 HydrophobicContact CZ3-CG2 4.49Å; M75-I111 HydrophobicContact CB-CD1 4.42Å; M75-I111 HydrophobicContact CE-CD1 3.42Å; M75-I111 VanDerWaalsContact CE-CD1 3.42Å; M75-I111 HydrophobicContact CE-CG1 4.45Å; V79-I111 HydrophobicContact CB-CG2 4.18Å; V79-I111 HydrophobicContact CG1-CB 4.48Å; V79-I111 HydrophobicContact CG1-CG2 4.23Å; V79-I111 HydrophobicContact CG2-CB 3.99Å; V79-I111 HydrophobicContact CG2-CD1 4.06Å; V79-I111 HydrophobicContact CG2-CG2 3.86Å; M107-I111 HydrophobicContact CG-CD1 4.29Å; M107-I111 WeakPolarHBondContact O-CD1 3.3Å; M107-I111 VanDerWaalsContact O-CG1 3.3Å; M107-I111 WeakPolarHBondContact O-CG1 3.41Å; M107-I111 PolarHBondContact O-N 3Å; Q108-I111 PolarHBondContact O-N 3.41Å; Q109-I111 PolarHBondContact O-N 3.31Å; I111-L114 WeakPolarHBondContact O-CB 3.37Å; I111-L114 PolarHBondContact O-N 3.04Å; I111-L115 HydrophobicContact CG2-CD1 3.76Å; I111-L115 HydrophobicContact CG2-CG 4.45Å; I111-L115 WeakPolarHBondContact O-CD1 3.31Å; I111-L115 WeakPolarHBondContact O-CG 3.31Å; I111-L115 PolarHBondContact O-N 3.19Å
112	C	82.4	Confident	69.8	Low	17 Å²	17	63.8 Å²	63.8	12%	0.115	37%	0.369	C	S	.	.	H	α-helix	trans	-58.8	-51.9	175.9	-173.7	0	0	0	0	111.2	V79 Q108 Q109 L114 L115 G116 I120	V79-C112 HydrophobicContact CG1-CB 4.04Å; Q108-C112 WeakPolarHBondContact O-CB 3.5Å; Q108-C112 PolarHBondContact O-N 2.83Å; Q109-C112 WeakPolarHBondContact O-CB 3.35Å; Q109-C112 PolarHBondContact O-N 3.33Å; C112-L114 PolarHBondContact O-N 3.47Å; C112-L115 PolarHBondContact O-N 3.29Å; C112-G116 PolarHBondContact O-N 3.42Å; C112-G116 VanDerWaalsContact O-N 3.16Å; C112-I120 HydrophobicContact CB-CD1 4.43Å; C112-I120 WeakPolarHBondContact SG-CD1 3.48Å
113	N	83.6	Confident	69.1	Low	104 Å²	104	68.2 Å²	68.2	56%	0.556	39%	0.39	S	S	*	.	H	α-helix	trans	-60.3	-31.3	176.2	-65.7	-6.4	0	0	0	112.3	Q109	Q109-N113 PolarHBondContact NE2-OD1 2.95Å; Q109-N113 VanDerWaalsContact O-CG 3.27Å; Q109-N113 PolarHBondContact O-N 3.01Å; Q109-N113 PolarHBondContact O-OD1 3.44Å
114	L	82.5	Confident	67.8	Low	8 Å²	8	66.3 Å²	66.3	4%	0.042	39%	0.388	C	S	.	.	H	α-helix	trans	-70.7	-41	178.1	-165.9	73.3	0	0	0	112.7	I24 E25 K28 V32 W72 R110 I111 C112 G116	I24-L114 HydrophobicContact CG2-CD2 3.92Å; E25-L114 HydrophobicContact CB-CD1 4.02Å; E25-L114 HydrophobicContact CG-CD1 3.94Å; K28-L114 HydrophobicContact CB-CD1 4.02Å; K28-L114 HydrophobicContact CD-CD1 3.62Å; K28-L114 VanDerWaalsContact CE-O 3.31Å; K28-L114 WeakPolarHBondContact CE-O 3.48Å; K28-L114 HydrophobicContact CG-CD1 3.71Å; K28-L114 HydrophobicContact CG-CG 4.4Å; V32-L114 HydrophobicContact CG1-CG 4.31Å; V32-L114 WeakPolarHBondContact CG1-O 3.43Å; V32-L114 HydrophobicContact CG2-CD2 4.01Å; V32-L114 HydrophobicContact CG2-CG 4.32Å; W72-L114 HydrophobicContact CH2-CD2 3.64Å; W72-L114 HydrophobicContact CZ2-CD2 4.07Å; R110-L114 WeakPolarHBondContact O-CB 3.43Å; R110-L114 PolarHBondContact O-N 3.39Å; I111-L114 WeakPolarHBondContact O-CB 3.37Å; I111-L114 PolarHBondContact O-N 3.04Å; C112-L114 PolarHBondContact O-N 3.47Å; L114-G116 VanDerWaalsContact C-N 3.34Å
115	L	78.9	Confident	66.6	Low	13 Å²	13	72 Å²	72	7%	0.068	42%	0.424	C	S	.	.	H	α-helix	trans	-73.4	-26.4	-179.6	-70.7	160	0	0	0	112.8	K76 I111 C112 T119 I120	K76-L115 HydrophobicContact CB-CD1 4.38Å; K76-L115 HydrophobicContact CD-CD2 3.63Å; K76-L115 HydrophobicContact CG-CD1 4.18Å; K76-L115 HydrophobicContact CG-CD2 3.94Å; I111-L115 HydrophobicContact CG2-CD1 3.76Å; I111-L115 HydrophobicContact CG2-CG 4.45Å; I111-L115 WeakPolarHBondContact O-CD1 3.31Å; I111-L115 WeakPolarHBondContact O-CG 3.31Å; I111-L115 PolarHBondContact O-N 3.19Å; C112-L115 PolarHBondContact O-N 3.29Å; L115-T119 VanDerWaalsContact O-CB 3.24Å; L115-T119 WeakPolarHBondContact O-CB 3.36Å; L115-T119 PolarHBondContact O-OG1 3.18Å; L115-I120 HydrophobicContact CB-CD1 4.38Å; L115-I120 HydrophobicContact CB-CG1 4.39Å
116	G	70.9	Confident	64.5	Low	30 Å²	30	71.8 Å²	71.8	31%	0.309	44%	0.436	S	S	.	.			trans	77.3	147.9	-176.2	0	0	0	0	0	112.4	C112 L114 A118 T119	C112-G116 PolarHBondContact O-N 3.42Å; C112-G116 VanDerWaalsContact O-N 3.16Å; L114-G116 VanDerWaalsContact C-N 3.34Å; G116-A118 VanDerWaalsContact C-N 3.31Å; G116-A118 PolarHBondContact O-N 2.92Å; G116-T119 PolarHBondContact O-N 3.34Å
117	E	54.5	Low	62.2	Low	140 Å²	140	74.6 Å²	74.6	65%	0.654	44%	0.438	S	S	*	.	H	α-helix	trans	-59.2	-40.5	-175.6	-61.9	-171.7	170.3	0	0	112	T119 I120 I121	E117-T119 VanDerWaalsContact C-N 3.34Å; E117-T119 PolarHBondContact O-N 3.45Å; E117-I120 WeakPolarHBondContact O-CB 3.48Å; E117-I120 PolarHBondContact O-N 3.01Å; E117-I121 HydrophobicContact CB-CD1 4.07Å; E117-I121 VanDerWaalsContact O-CD1 3.27Å; E117-I121 WeakPolarHBondContact O-CD1 3.37Å; E117-I121 WeakPolarHBondContact O-CG1 3.38Å; E117-I121 PolarHBondContact O-N 3.44Å
118	A	46.2	Very low	60.4	Low	74 Å²	74	78.4 Å²	78.4	61%	0.612	47%	0.466	S	S	*	.	H	α-helix	trans	-60.1	-36	-179.6	0	0	0	0	0	114.3	G116 I120 I121 S122	G116-A118 VanDerWaalsContact C-N 3.31Å; G116-A118 PolarHBondContact O-N 2.92Å; A118-I120 PolarHBondContact O-N 3.46Å; A118-I121 PolarHBondContact O-N 2.96Å; A118-S122 PolarHBondContact O-OG 3Å
119	T	54.5	Low	58.3	Low	68 Å²	68	84.4 Å²	84.4	42%	0.417	50%	0.499	S	S	.	.	H	α-helix	trans	-74.4	-17.5	177.6	-47.6	0	0	0	0	112.4	L115 G116 E117	L115-T119 VanDerWaalsContact O-CB 3.24Å; L115-T119 WeakPolarHBondContact O-CB 3.36Å; L115-T119 PolarHBondContact O-OG1 3.18Å; G116-T119 PolarHBondContact O-N 3.34Å; E117-T119 VanDerWaalsContact C-N 3.34Å; E117-T119 PolarHBondContact O-N 3.45Å
120	I	53.7	Low	56.1	Low	32 Å²	32	84.5 Å²	84.5	16%	0.164	51%	0.514	C	S	.	.	H	α-helix	trans	-92.6	-25.3	178.5	-59.3	171.1	0	0	0	110.3	R80 V83 C112 L115 E117 A118	R80-I120 HydrophobicContact CG-CG1 4.35Å; V83-I120 HydrophobicContact CB-CG2 4.28Å; V83-I120 HydrophobicContact CG1-CG2 3.8Å; C112-I120 HydrophobicContact CB-CD1 4.43Å; C112-I120 WeakPolarHBondContact SG-CD1 3.48Å; L115-I120 HydrophobicContact CB-CD1 4.38Å; L115-I120 HydrophobicContact CB-CG1 4.39Å; E117-I120 WeakPolarHBondContact O-CB 3.48Å; E117-I120 PolarHBondContact O-N 3.01Å; A118-I120 PolarHBondContact O-N 3.46Å
121	I	53	Low	54.2	Low	106 Å²	106	89.7 Å²	89.7	54%	0.544	54%	0.542	S	S	.	.	H	α-helix	trans	-79.8	-19.5	-176.4	-68.7	161.1	0	0	0	113.5	E117 A118 L123	E117-I121 HydrophobicContact CB-CD1 4.07Å; E117-I121 VanDerWaalsContact O-CD1 3.27Å; E117-I121 WeakPolarHBondContact O-CD1 3.37Å; E117-I121 WeakPolarHBondContact O-CG1 3.38Å; E117-I121 PolarHBondContact O-N 3.44Å; A118-I121 PolarHBondContact O-N 2.96Å; I121-L123 PolarHBondContact O-N 3.11Å
122	S	39.3	Very low	52	Low	98 Å²	98	96.5 Å²	96.5	69%	0.685	58%	0.577	S	S	*	*			trans	-78.6	50.1	-177.1	-46.6	0	0	0	0	115.2	A118	A118-S122 PolarHBondContact O-OG 3Å
123	L	42.2	Very low	49.6	Very low	150 Å²	150	101.5 Å²	101.5	79%	0.785	61%	0.606	S	S	*	*	S	Bend	trans	-126	121.2	160.9	-125.8	80.2	0	0	0	108.7	I121 T125	I121-L123 PolarHBondContact O-N 3.11Å; L123-T125 PolarHBondContact O-N 2.96Å
124	P	35.7	Very low	47.3	Very low	121 Å²	121	103.4 Å²	103.4	79%	0.786	62%	0.616	S	S	*	*			trans	-61.4	124.2	167.6	-13.4	27.3	0	0	0	108.4	G126	P124-G126 PolarHBondContact O-N 2.93Å
125	T	46	Very low	45.1	Very low	151 Å²	151	108.4 Å²	108.4	93%	0.926	65%	0.649	S	S	*	*			trans	-58.5	103.2	161	-61.3	0	0	0	0	107.7	L123	L123-T125 PolarHBondContact O-N 2.96Å
126	G	37.1	Very low	43.1	Very low	66 Å²	66	113.3 Å²	113.3	68%	0.68	68%	0.679	S	S	*	*			trans	-177.1	104	179.4	0	0	0	0	0	114.3	P124	P124-G126 PolarHBondContact O-N 2.93Å
127	D	31	Very low	41.3	Very low	150 Å²	150	118.1 Å²	118.1	80%	0.802	70%	0.703	S	S	*	*			trans	66.3	125.8	157.7	-104.8	-41.6	0	0	0	121.4	D129	D127-D129 VanDerWaalsContact C-N 3.35Å; D127-D129 PolarHBondContact O-N 3.13Å
128	P	44.8	Very low	40.4	Very low	124 Å²	124	119.8 Å²	119.8	81%	0.805	71%	0.713	S	S	*	*	S	Bend	trans	-88	61.5	169.1	38.4	-34.1	0	0	0	111.6
129	D	38.2	Very low	39.8	Very low	156 Å²	156	121.8 Å²	121.8	83%	0.834	72%	0.722	S	S	*	*			trans	-164.1	82.2	160.3	-144.1	19.9	0	0	0	111.6	D127	D127-D129 VanDerWaalsContact C-N 3.35Å; D127-D129 PolarHBondContact O-N 3.13Å
130	A	34.9	Very low	38.8	Very low	83 Å²	83	124.5 Å²	124.5	69%	0.686	74%	0.744	S	S	*	*			trans	-152.2	105.9	163.5	0	0	0	0	0	108.9	I132	A130-I132 PolarHBondContact O-N 3.29Å
131	E	43.1	Very low	37.8	Very low	189 Å²	189	127.3 Å²	127.3	88%	0.883	77%	0.772	S	S	*	*			trans	-53.1	103.1	162.6	-83.5	-174.1	135.6	0	0	109.5	T133	E131-T133 PolarHBondContact O-N 3.2Å
132	I	40.2	Very low	36.9	Very low	147 Å²	147	128.5 Å²	128.5	75%	0.754	78%	0.784	S	S	*	*			trans	-89.3	93.1	164.1	-60.3	173.1	0	0	0	106.7	A130 L134	A130-I132 PolarHBondContact O-N 3.29Å; I132-L134 PolarHBondContact O-N 3.46Å
133	T	31.4	Very low	36.5	Very low	121 Å²	121	130.5 Å²	130.5	74%	0.742	79%	0.792	S	S	*	*			trans	-53.7	115.3	163.7	-46.8	0	0	0	0	109	E131 P135	E131-T133 PolarHBondContact O-N 3.2Å; T133-P135 WeakPolarHBondContact O-CD 3.44Å
134	L	35.4	Very low	36.2	Very low	144 Å²	144	129.3 Å²	129.3	75%	0.754	79%	0.791	S	S	*	*			trans	-71.4	123.9	172	-68.7	166.7	0	0	0	109.7	I132 V136	I132-L134 PolarHBondContact O-N 3.46Å; L134-V136 PolarHBondContact O-N 2.97Å; L134-V136 VanDerWaalsContact O-N 3.11Å
135	P	34.9	Very low	35.8	Very low	114 Å²	114	130.4 Å²	130.4	74%	0.74	80%	0.796	S	S	*	*			trans	-76.9	99.6	161.2	28.8	-28.3	0	0	0	108.8	T133 T137	T133-P135 WeakPolarHBondContact O-CD 3.44Å; P135-T137 PolarHBondContact O-N 3.42Å
136	V	38.3	Very low	35	Very low	116 Å²	116	130.5 Å²	130.5	70%	0.703	79%	0.79	S	S	*	*			trans	-60.5	111.6	158.4	172.3	0	0	0	0	107.4	L134 M138	L134-V136 PolarHBondContact O-N 2.97Å; L134-V136 VanDerWaalsContact O-N 3.11Å; V136-M138 HydrophobicContact CG1-CG 4Å
137	T	32.5	Very low	34.6	Very low	131 Å²	131	133.4 Å²	133.4	80%	0.804	80%	0.795	S	S	*	*			trans	-106.4	92.6	164.2	42.3	0	0	0	0	108.9	P135	P135-T137 PolarHBondContact O-N 3.42Å
138	M	36.5	Very low	34.6	Very low	175 Å²	175	134.7 Å²	134.7	86%	0.862	80%	0.796	S	S	*	*			trans	-72.2	116	158.8	-77	-84.9	177.9	0	0	107.5	V136	V136-M138 HydrophobicContact CG1-CG 4Å
139	S	33.5	Very low	33.9	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	79%	0.788	S	S	*	*			trans	-83.4	122	164.5	-93.6	0	0	0	0	109.6
140	S	33.2	Very low	33.6	Very low	125 Å²	125	133.1 Å²	133.1	87%	0.874	79%	0.787	S	S	*	*			trans	-157.6	135.9	148.9	-88.7	0	0	0	0	112.7
141	A	31.9	Very low	33.5	Very low	91 Å²	91	138.6 Å²	138.6	75%	0.752	80%	0.798	S	S	*	*			trans	82.3	94.8	156.1	0	0	0	0	0	119.5
142	T	35.4	Very low	32.7	Very low	131 Å²	131	135.7 Å²	135.7	80%	0.804	79%	0.794	S	S	*	*				11	120.9	123.4	-36.1	0	0	0	0	118.6
143	T	29.6	Very low	32.1	Very low	139 Å²	139	133.5 Å²	133.5	85%	0.853	80%	0.798	S	S	*	*			trans	-155	140.4	132.8	34.8	0	0	0	0	110.3
144	V	35.9	Very low	32	Very low	126 Å²	126	133.2 Å²	133.2	76%	0.764	80%	0.801	S	S	*	*			trans	-87.1	133.7	-179.3	176	0	0	0	0	109.2
145	T	28.6	Very low	31.7	Very low	144 Å²	144	131.6 Å²	131.6	88%	0.883	81%	0.808	S	S	*	*			trans	-157.3	137.1	150.2	3.7	0	0	0	0	112
146	L	28.5	Very low	31.2	Very low	153 Å²	153	131.2 Å²	131.2	80%	0.801	81%	0.808	S	S	*	*			trans	-80.5	176.9	-177.8	-71.7	158	0	0	0	112.6
147	T	29.3	Very low	30.5	Very low	127 Å²	127	131.2 Å²	131.2	78%	0.779	81%	0.812	S	S	*	*			trans	91.5	104.5	154.9	50.9	0	0	0	0	120.6
148	E	29.9	Very low	30.1	Very low	177 Å²	177	134.3 Å²	134.3	83%	0.827	82%	0.817	S	S	*	*				89.8	138.1	112.3	-151.4	178.1	176.4	0	0	121.6
149	S	30	Very low	29.6	Very low	92 Å²	92	134.3 Å²	134.3	64%	0.643	82%	0.815	S	S	*	*			trans	94.3	98.1	157.1	-75	0	0	0	0	120.5
150	L	33.3	Very low	29.4	Very low	154 Å²	154	135.1 Å²	135.1	81%	0.806	82%	0.815	S	S	*	*				30	120.5	119.9	-67.8	147.5	0	0	0	118.2
151	Q	32	Very low	29.1	Very low	198 Å²	198	136.2 Å²	136.2	93%	0.925	80%	0.804	S	S	*	*				-162.9	131.8	123.7	-109.7	153.2	14.5	0	0	114.6
152	T	25.5	Very low	28.8	Very low	128 Å²	128	139.9 Å²	139.9	79%	0.785	81%	0.81	S	S	*	*			trans	-68	137.5	173.6	-37.5	0	0	0	0	111.8
153	A	29.1	Very low	28.3	Very low	101 Å²	101	139.1 Å²	139.1	84%	0.835	80%	0.801	S	S	*	*			trans	-157.2	104	149.4	0	0	0	0	0	110.3
154	S	29	Very low	28.3	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	80%	0.797	S	S	*	*			trans	-69.2	131.3	163.2	48.2	0	0	0	0	111.1
155	A	28.8	Very low	28	Very low	109 Å²	109	140.5 Å²	140.5	90%	0.901	80%	0.798	S	S	*	*			trans	-145.4	134.7	153.1	0	0	0	0	0	108.9
156	S	25.1	Very low	27.9	Very low	107 Å²	107	139.3 Å²	139.3	75%	0.748	79%	0.791	S	S	*	*			trans	-101.1	153.1	-161	-160.4	0	0	0	0	111.7
157	C	23.9	Very low	27.9	Very low	115 Å²	115	136.1 Å²	136.1	78%	0.777	78%	0.778	S	S	*	*			trans	62	116.9	152	-59.7	0	0	0	0	119.9
158	E	23.3	Very low	27.7	Very low	196 Å²	196	140.2 Å²	140.2	92%	0.916	78%	0.78	S	S	*	*				-145.8	128.7	113.7	-128.1	171.9	161.1	0	0	110.9
159	E	26.5	Very low	27.6	Very low	176 Å²	176	139.8 Å²	139.8	82%	0.822	78%	0.778	S	S	*	*			trans	-88.7	126.5	-176.8	-171	-176.4	142.6	0	0	107.6
160	T	28.2	Very low	27.6	Very low	132 Å²	132	140.9 Å²	140.9	81%	0.81	78%	0.781	S	S	*	*			trans	-133.8	95.8	164.4	-33.5	0	0	0	0	109.4
161	K	27	Very low	27.5	Very low	149 Å²	149	141.3 Å²	141.3	65%	0.648	78%	0.783	S	S	*	*			trans	-49.2	123	165.6	-176.1	179.7	-167.6	-102.3	0	111	D163	K161-D163 VanDerWaalsContact CE-OD2 3.32Å; K161-D163 WeakPolarHBondContact CE-OD2 3.26Å; K161-D163 IonicContact NZ-OD1 3.98Å; K161-D163 IonicContact NZ-OD2 2.65Å; K161-D163 PolarHBondContact NZ-OD2 3.04Å
162	L	25.7	Very low	27.5	Very low	167 Å²	167	139.7 Å²	139.7	87%	0.874	78%	0.776	S	S	*	*			trans	-128.8	100.6	157.7	-87	163.4	0	0	0	107.8	V164	L162-V164 PolarHBondContact O-N 3.19Å
163	D	26	Very low	27.8	Very low	115 Å²	115	142.6 Å²	142.6	62%	0.615	78%	0.78	S	S	*	*			trans	-62.4	122.9	165.6	-68.9	-61.6	0	0	0	109.5	K161	K161-D163 VanDerWaalsContact CE-OD2 3.32Å; K161-D163 WeakPolarHBondContact CE-OD2 3.26Å; K161-D163 IonicContact NZ-OD1 3.98Å; K161-D163 IonicContact NZ-OD2 2.65Å; K161-D163 PolarHBondContact NZ-OD2 3.04Å
164	V	29.7	Very low	28.1	Very low	126 Å²	126	141.7 Å²	141.7	76%	0.764	78%	0.781	S	S	*	*			trans	-132.6	90.8	151.2	172.8	0	0	0	0	107.2	L162 T166	L162-V164 PolarHBondContact O-N 3.19Å; V164-T166 PolarHBondContact O-N 3.23Å
165	E	28.2	Very low	28.1	Very low	169 Å²	169	139.8 Å²	139.8	79%	0.79	78%	0.78	S	S	*	*			trans	-65.8	111.2	166.3	-165.9	175.9	164.1	0	0	107.9	T167	E165-T167 PolarHBondContact O-N 3.2Å
166	T	28	Very low	28.3	Very low	119 Å²	119	141.2 Å²	141.2	73%	0.73	78%	0.777	S	S	*	*			trans	-96.8	87.5	170	-37.6	0	0	0	0	107.7	V164 Y168	V164-T166 PolarHBondContact O-N 3.23Å; T166-Y168 PolarHBondContact O-N 2.93Å
167	T	27.2	Very low	28.7	Very low	86 Å²	86	142.4 Å²	142.4	53%	0.528	78%	0.779	S	S	.	*			trans	-58.1	119.3	172	-65.9	0	0	0	0	110.3	E165 H169	E165-T167 PolarHBondContact O-N 3.2Å; T167-H169 PolarHBondContact O-N 3.16Å
168	Y	26.3	Very low	29.2	Very low	212 Å²	212	145 Å²	145	83%	0.831	78%	0.78	S	S	*	*			trans	-67.1	120.1	166.3	-81.3	-102	0	0	0	109.4	T166	T166-Y168 PolarHBondContact O-N 2.93Å
169	H	27.6	Very low	29.6	Very low	168 Å²	168	145.1 Å²	145.1	78%	0.778	77%	0.774	S	S	*	*			trans	-100.8	96.4	160.3	-84.2	-65.6	0	0	0	109.6	T167	T167-H169 PolarHBondContact O-N 3.16Å
170	T	30.1	Very low	29.8	Very low	116 Å²	116	142.7 Å²	142.7	71%	0.712	77%	0.774	S	S	*	*			trans	-71.7	118.3	154.6	-58.5	0	0	0	0	108
171	L	30.8	Very low	30.1	Very low	162 Å²	162	141.8 Å²	141.8	85%	0.848	77%	0.769	S	S	*	*			trans	-133.3	106.7	156.9	-82.4	172.7	0	0	0	108.3
172	E	31	Very low	30.4	Very low	164 Å²	164	141 Å²	141	77%	0.766	78%	0.777	S	S	*	*			trans	-61	142.5	157.3	-81.7	179.5	133.4	0	0	110.5
173	E	32.6	Very low	30.8	Very low	189 Å²	189	139.1 Å²	139.1	88%	0.883	77%	0.772	S	S	*	*			trans	68.9	121.7	133.8	-158.6	158.3	-152.3	0	0	120.8
174	G	34.6	Very low	31.2	Very low	83 Å²	83	142.6 Å²	142.6	86%	0.856	79%	0.785	S	S	*	*			trans	123.3	92.9	152.3	0	0	0	0	0	115.7
175	G	28.7	Very low	31.4	Very low	75 Å²	75	141.3 Å²	141.3	77%	0.773	79%	0.788	S	S	*	*			trans	171.8	79.4	169.7	0	0	0	0	0	114.1	V177	G175-V177 PolarHBondContact O-N 3.46Å
176	V	34.7	Very low	31.7	Very low	140 Å²	140	139.2 Å²	139.2	85%	0.848	79%	0.786	S	S	*	*			trans	-53.9	125.4	171.2	169.1	0	0	0	0	110.9
177	V	33.5	Very low	32.1	Very low	131 Å²	131	139.7 Å²	139.7	79%	0.794	79%	0.792	S	S	*	*			trans	-130.9	123	152.5	-170	0	0	0	0	108.8	G175	G175-V177 PolarHBondContact O-N 3.46Å
178	E	34	Very low	32.3	Very low	169 Å²	169	141.9 Å²	141.9	79%	0.79	81%	0.805	S	S	*	*			trans	-71.8	123.2	-160.8	-169.2	174.2	-168.6	0	0	112.8
179	Y	30.4	Very low	32.9	Very low	200 Å²	200	137.9 Å²	137.9	78%	0.784	80%	0.803	S	S	*	*			trans	-96.8	109.2	166.1	32.1	-88.7	0	0	0	108.9	T181	Y179-T181 PolarHBondContact O-N 3.42Å; Y179-T181 PolarHBondContact O-OG1 3.21Å
180	C	31.7	Very low	33.1	Very low	124 Å²	124	136.1 Å²	136.1	84%	0.838	80%	0.803	S	S	*	*			trans	-57.5	104.8	170.9	-76.8	0	0	0	0	110.2
181	T	33.5	Very low	33.1	Very low	113 Å²	113	136.6 Å²	136.6	69%	0.693	81%	0.806	S	S	*	*			trans	-109.3	107.2	168.1	-45.2	0	0	0	0	107.1	Y179	Y179-T181 PolarHBondContact O-N 3.42Å; Y179-T181 PolarHBondContact O-OG1 3.21Å
182	T	33.3	Very low	33.3	Very low	134 Å²	134	133.4 Å²	133.4	82%	0.822	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-73.9	130.9	172.5	-54.2	0	0	0	0	109.1
183	T	34.3	Very low	33.2	Very low	126 Å²	126	132.6 Å²	132.6	77%	0.773	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-61.6	147.7	-169.4	34.3	0	0	0	0	116.1
184	E	35.2	Very low	33.3	Very low	188 Å²	188	131.7 Å²	131.7	88%	0.879	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-60.3	142.8	155.9	-73.7	-175.7	123.4	0	0	111.2
185	A	33.5	Very low	33.1	Very low	100 Å²	100	133.1 Å²	133.1	83%	0.826	80%	0.802	S	S	*	*			trans	-135.3	116	154.8	0	0	0	0	0	109
186	T	34	Very low	33.3	Very low	124 Å²	124	137.8 Å²	137.8	76%	0.761	80%	0.803	S	S	*	*			trans	-66.1	150.6	168.7	43	0	0	0	0	111.3
187	P	37.9	Very low	34.3	Very low	130 Å²	130	136.3 Å²	136.3	84%	0.844	80%	0.796	S	S	*	*			trans	-107.3	124.1	166.2	33.6	-22.8	0	0	0	111.6
188	T	30.1	Very low	34.7	Very low	131 Å²	131	135.9 Å²	135.9	80%	0.804	79%	0.794	S	S	*	*			trans	-105.2	121.1	162.4	-64.3	0	0	0	0	109.6
189	V	38.6	Very low	34.7	Very low	129 Å²	129	137 Å²	137	78%	0.782	80%	0.799	S	S	*	*			trans	10	123.1	153.3	-171	0	0	0	0	119.5
190	V	33.3	Very low	35.5	Very low	131 Å²	131	135.1 Å²	135.1	79%	0.794	80%	0.799	S	S	*	*			trans	-156.7	119.6	134.3	-111.4	0	0	0	0	113.2
191	T	30.3	Very low	35.9	Very low	126 Å²	126	137 Å²	137	77%	0.773	80%	0.8	S	S	*	*			trans	48.7	116.4	139	45.8	0	0	0	0	123.5
192	A	34.3	Very low	36.3	Very low	95 Å²	95	137.6 Å²	137.6	79%	0.785	80%	0.804	S	S	*	*			trans	-15.9	138	147.1	0	0	0	0	0	119.6
193	V	29.4	Very low	36.4	Very low	147 Å²	147	137.1 Å²	137.1	89%	0.891	81%	0.806	S	S	*	*				-142.8	131	118	163.2	0	0	0	0	108.8
194	E	34.6	Very low	37	Very low	170 Å²	170	138.3 Å²	138.3	79%	0.794	81%	0.812	S	S	*	*			trans	-84.7	137.9	176	177.9	179.1	176.9	0	0	111
195	S	30.8	Very low	37	Very low	112 Å²	112	134.9 Å²	134.9	78%	0.783	81%	0.81	S	S	*	*			trans	-165.9	106.7	146.2	58.2	0	0	0	0	111.3
196	H	32.3	Very low	37.5	Very low	174 Å²	174	134.9 Å²	134.9	81%	0.806	80%	0.803	S	S	*	*			trans	-76.3	-178.4	160	-80.7	2.7	0	0	0	110.7
197	P	55.5	Low	37.6	Very low	108 Å²	108	134.1 Å²	134.1	70%	0.701	80%	0.803	S	S	*	*			cis	-142.6	-177.8	-45.8	40.2	-22.2	0	0	0	114.4
198	V	41.9	Very low	38.7	Very low	123 Å²	123	134.1 Å²	134.1	75%	0.745	80%	0.803	S	S	*	*			trans	69.2	121.9	156.3	-167.8	0	0	0	0	119.7
199	E	34	Very low	39.3	Very low	193 Å²	193	133.7 Å²	133.7	90%	0.902	80%	0.802	S	S	*	*				-156.1	136.1	126.7	-113.9	176.6	-173.9	0	0	113.3
200	M	46.9	Very low	39.5	Very low	160 Å²	160	135.8 Å²	135.8	79%	0.788	80%	0.803	S	S	*	*			trans	-64.9	158.4	173.6	-59.6	-178.1	-66.3	0	0	110.4
201	L	39.7	Very low	40.3	Very low	162 Å²	162	135.2 Å²	135.2	85%	0.848	81%	0.805	S	S	*	*				-176.2	129.5	115.5	-90.1	178.4	0	0	0	110.1
202	T	42.8	Very low	41.3	Very low	127 Å²	127	138 Å²	138	78%	0.779	81%	0.809	S	S	*	*			trans	-67.5	139	168.8	45.4	0	0	0	0	111.2
203	S	36.2	Very low	42.2	Very low	123 Å²	123	138 Å²	138	86%	0.86	81%	0.809	S	S	*	*			trans	-148.8	111	154.2	-74.1	0	0	0	0	109.6
204	V	45.3	Very low	43.5	Very low	151 Å²	151	138.5 Å²	138.5	92%	0.915	80%	0.8	S	S	*	*			trans	-67.7	128.1	168.2	164.3	0	0	0	0	108.4
205	S	35.8	Very low	45.2	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	80%	0.795	S	S	*	*			trans	-143.7	130.3	157.2	-166.9	0	0	0	0	110.4
206	S	43.1	Very low	47.4	Very low	100 Å²	100	137.7 Å²	137.7	70%	0.699	79%	0.793	S	S	*	*			trans	-75.8	130.1	-171.9	45.2	0	0	0	0	113.9
207	S	36.8	Very low	49.8	Very low	108 Å²	108	135.4 Å²	135.4	76%	0.755	78%	0.783	S	S	*	*			trans	160.8	149.3	137.6	-72.4	0	0	0	0	110.6
208	P	61.2	Low	51.4	Low	130 Å²	130	135.5 Å²	135.5	84%	0.844	78%	0.777	S	S	*	*			trans	-84	144.1	-174.5	34.2	-31.1	0	0	0	111.3
209	P	43.4	Very low	53.6	Low	121 Å²	121	137 Å²	137	79%	0.786	77%	0.773	S	S	*	*			trans	-124.9	138.9	152	30.9	-15.6	0	0	0	112.4
210	H	42.1	Very low	56.3	Low	173 Å²	173	131.7 Å²	131.7	80%	0.801	76%	0.757	S	S	*	*			trans	-35.7	137.3	163.3	-78.4	-104.3	0	0	0	114.9	Q212	H210-Q212 PolarHBondContact O-N 3.46Å
211	S	50.7	Low	58.4	Low	119 Å²	119	132.6 Å²	132.6	83%	0.832	75%	0.752	S	S	*	*			trans	29.5	78.8	135.5	-47.4	0	0	0	0	118
212	Q	51.2	Low	60.9	Low	184 Å²	184	129.9 Å²	129.9	86%	0.86	74%	0.737	S	S	*	*			trans	-120.3	85.9	161.6	-108.9	-175.5	-11.8	0	0	109.9	H210 K214	H210-Q212 PolarHBondContact O-N 3.46Å; Q212-K214 PolarHBondContact O-N 2.92Å
213	A	52.2	Low	63.3	Low	95 Å²	95	126.5 Å²	126.5	79%	0.785	72%	0.722	S	S	*	*			trans	-65.1	113.9	162.3	0	0	0	0	0	107.9
214	K	56.1	Low	66.1	Low	158 Å²	158	125.5 Å²	125.5	69%	0.687	71%	0.706	S	S	*	*			trans	-62	141.5	-172.9	-77.5	167.5	174.5	168.2	0	111.4	Q212 Q216 E217	Q212-K214 PolarHBondContact O-N 2.92Å; K214-Q216 PolarHBondContact O-N 2.97Å; K214-E217 VanDerWaalsContact O-CB 3.25Å; K214-E217 WeakPolarHBondContact O-CB 3.43Å; K214-E217 PolarHBondContact O-N 2.95Å
215	P	70.9	Confident	68.4	Low	107 Å²	107	123.6 Å²	123.6	70%	0.695	69%	0.691	S	S	*	*	H	α-helix	trans	-51.5	-23.9	175	-26.5	32.8	0	0	0	114.8	K219	P215-K219 PolarHBondContact O-N 3.48Å
216	Q	76.2	Confident	71.2	Confident	159 Å²	159	120.7 Å²	120.7	74%	0.743	67%	0.671	S	S	*	*	H	α-helix	trans	-73	-33.8	178.6	-163.6	141.4	-23.3	0	0	113.3	K214 L218 K219 S220	K214-Q216 PolarHBondContact O-N 2.97Å; Q216-L218 VanDerWaalsContact C-N 3.3Å; Q216-L218 PolarHBondContact O-N 3.02Å; Q216-K219 PolarHBondContact O-N 3.17Å; Q216-S220 PolarHBondContact O-N 2.93Å; Q216-S220 VanDerWaalsContact O-N 3.1Å
217	E	84.2	Confident	73.7	Confident	126 Å²	126	118.3 Å²	118.3	59%	0.589	66%	0.657	S	S	*	*	H	α-helix	trans	-61.1	-43.1	173.6	-167.8	87.9	-158.4	0	0	110.2	K214 S220 R221	K214-E217 VanDerWaalsContact O-CB 3.25Å; K214-E217 WeakPolarHBondContact O-CB 3.43Å; K214-E217 PolarHBondContact O-N 2.95Å; E217-S220 PolarHBondContact O-N 3.01Å; E217-R221 WeakPolarHBondContact O-CG 3.43Å; E217-R221 PolarHBondContact O-N 3.38Å
218	L	88	Confident	76.4	Confident	110 Å²	110	121 Å²	121	58%	0.576	65%	0.651	S	S	*	*	H	α-helix	trans	-65.4	-44	-179.2	-163	75	0	0	0	111.6	Q216 S220 R221 I222	Q216-L218 VanDerWaalsContact C-N 3.3Å; Q216-L218 PolarHBondContact O-N 3.02Å; L218-S220 PolarHBondContact O-N 3.44Å; L218-R221 PolarHBondContact O-N 2.96Å; L218-I222 HydrophobicContact CG-CD1 4.22Å; L218-I222 VanDerWaalsContact O-CG1 3.28Å; L218-I222 WeakPolarHBondContact O-CG1 3.46Å; L218-I222 PolarHBondContact O-N 3.4Å
219	K	88.6	Confident	78.1	Confident	155 Å²	155	119.6 Å²	119.6	67%	0.674	64%	0.636	S	S	*	*	H	α-helix	trans	-61.3	-42.4	175.7	-70.2	-178.9	-179	-177.3	0	112	P215 Q216 I222 A223	P215-K219 PolarHBondContact O-N 3.48Å; Q216-K219 PolarHBondContact O-N 3.17Å; K219-I222 PolarHBondContact O-N 3.4Å; K219-A223 WeakPolarHBondContact O-CB 3.28Å; K219-A223 PolarHBondContact O-N 2.97Å
220	S	90.6	Very high	80.6	Confident	81 Å²	81	118.5 Å²	118.5	57%	0.566	62%	0.623	S	S	*	*	H	α-helix	trans	-60.6	-44.6	175.3	-178.7	0	0	0	0	111.8	Q216 E217 L218 I222 A223 L224	Q216-S220 PolarHBondContact O-N 2.93Å; Q216-S220 VanDerWaalsContact O-N 3.1Å; E217-S220 PolarHBondContact O-N 3.01Å; L218-S220 PolarHBondContact O-N 3.44Å; S220-I222 PolarHBondContact O-N 3.47Å; S220-A223 PolarHBondContact O-N 2.89Å; S220-L224 WeakPolarHBondContact O-CB 3.47Å; S220-L224 PolarHBondContact O-N 3.28Å
221	R	92.1	Very high	83.2	Confident	178 Å²	178	117 Å²	117	67%	0.672	62%	0.616	S	S	*	*	H	α-helix	trans	-64.1	-39.5	176.9	-72.7	-174.3	66.8	178.4	0.1	113.2	E217 L218 L224 N225	E217-R221 WeakPolarHBondContact O-CG 3.43Å; E217-R221 PolarHBondContact O-N 3.38Å; L218-R221 PolarHBondContact O-N 2.96Å; R221-L224 PolarHBondContact O-N 2.95Å; R221-N225 WeakPolarHBondContact O-CB 3.4Å; R221-N225 PolarHBondContact O-N 3.24Å
222	I	91.3	Very high	85.2	Confident	106 Å²	106	117.4 Å²	117.4	54%	0.544	61%	0.605	S	S	.	*	H	α-helix	trans	-65.1	-45.6	176.1	-67.3	164.1	0	0	0	110.2	L218 K219 S220 L224 N225 S226	L218-I222 HydrophobicContact CG-CD1 4.22Å; L218-I222 VanDerWaalsContact O-CG1 3.28Å; L218-I222 WeakPolarHBondContact O-CG1 3.46Å; L218-I222 PolarHBondContact O-N 3.4Å; K219-I222 PolarHBondContact O-N 3.4Å; S220-I222 PolarHBondContact O-N 3.47Å; I222-L224 VanDerWaalsContact C-N 3.33Å; I222-L224 PolarHBondContact O-N 2.92Å; I222-N225 PolarHBondContact O-N 3.42Å; I222-S226 PolarHBondContact O-N 3.23Å; I222-S226 PolarHBondContact O-OG 3.46Å
223	A	93.2	Very high	87.4	Confident	55 Å²	55	114 Å²	114	46%	0.455	59%	0.589	S	S	.	*	H	α-helix	trans	-62.3	-38.4	177.4	0	0	0	0	0	112.6	K219 S220 S226 A227	K219-A223 WeakPolarHBondContact O-CB 3.28Å; K219-A223 PolarHBondContact O-N 2.97Å; S220-A223 PolarHBondContact O-N 2.89Å; A223-S226 WeakPolarHBondContact CA-OG 3.36Å; A223-S226 PolarHBondContact O-OG 2.73Å; A223-A227 WeakPolarHBondContact O-CB 2.97Å; A223-A227 PolarHBondContact O-N 3.4Å
224	L	94.2	Very high	89.5	Confident	102 Å²	102	118.2 Å²	118.2	53%	0.534	59%	0.585	S	S	.	*	H	α-helix	trans	-68.9	-38.9	175.8	-173.1	65.8	0	0	0	112.1	S220 R221 I222 R228	S220-L224 WeakPolarHBondContact O-CB 3.47Å; S220-L224 PolarHBondContact O-N 3.28Å; R221-L224 PolarHBondContact O-N 2.95Å; I222-L224 VanDerWaalsContact C-N 3.33Å; I222-L224 PolarHBondContact O-N 2.92Å; L224-R228 WeakPolarHBondContact O-CG 3.49Å; L224-R228 PolarHBondContact O-N 3.47Å
225	N	95.1	Very high	91.4	Very high	111 Å²	111	114.3 Å²	114.3	59%	0.594	57%	0.574	S	S	*	*	H	α-helix	trans	-67.7	-42.9	177.2	-171.7	-90.8	0	0	0	111.6	R221 I222 A227 R228 L229	R221-N225 WeakPolarHBondContact O-CB 3.4Å; R221-N225 PolarHBondContact O-N 3.24Å; I222-N225 PolarHBondContact O-N 3.42Å; N225-A227 VanDerWaalsContact C-N 3.35Å; N225-A227 PolarHBondContact O-N 2.91Å; N225-R228 PolarHBondContact O-N 3.13Å; N225-L229 PolarHBondContact O-N 2.89Å
226	S	94.2	Very high	92.6	Very high	56 Å²	56	113.1 Å²	113.1	39%	0.392	57%	0.565	S	S	.	*	H	α-helix	trans	-64	-39	175.2	63.6	0	0	0	0	112	I222 A223 L229 L230	I222-S226 PolarHBondContact O-N 3.23Å; I222-S226 PolarHBondContact O-OG 3.46Å; A223-S226 WeakPolarHBondContact CA-OG 3.36Å; A223-S226 PolarHBondContact O-OG 2.73Å; S226-L229 PolarHBondContact O-N 3.29Å; S226-L230 WeakPolarHBondContact O-CB 3.48Å; S226-L230 PolarHBondContact O-N 3.48Å
227	A	94.5	Very high	93.6	Very high	51 Å²	51	109 Å²	109	42%	0.421	55%	0.547	S	S	.	.	H	α-helix	trans	-62.3	-42.2	173.6	0	0	0	0	0	112.4	A223 N225 L230 Q231	A223-A227 WeakPolarHBondContact O-CB 2.97Å; A223-A227 PolarHBondContact O-N 3.4Å; N225-A227 VanDerWaalsContact C-N 3.35Å; N225-A227 PolarHBondContact O-N 2.91Å; A227-L230 PolarHBondContact O-N 3.39Å; A227-Q231 PolarHBondContact O-N 2.97Å
228	R	95.4	Very high	94.2	Very high	163 Å²	163	106.7 Å²	106.7	62%	0.615	54%	0.542	S	S	*	.	H	α-helix	trans	-63.5	-44.4	174.6	-77.8	-174.5	-178.4	-177.7	0.6	112.1	L224 N225 L230 Q231 E232	L224-R228 WeakPolarHBondContact O-CG 3.49Å; L224-R228 PolarHBondContact O-N 3.47Å; N225-R228 PolarHBondContact O-N 3.13Å; R228-L230 PolarHBondContact O-N 2.93Å; R228-Q231 WeakPolarHBondContact O-CB 3.46Å; R228-Q231 PolarHBondContact O-N 3.06Å; R228-Q231 VanDerWaalsContact O-N 3.13Å; R228-E232 PolarHBondContact O-N 3.32Å
229	L	96.6	Very high	94.6	Very high	101 Å²	101	106.6 Å²	106.6	53%	0.529	54%	0.539	S	S	.	.	H	α-helix	trans	-61.4	-43.9	178.2	-177.1	66	0	0	0	111.7	N225 S226 Q231 E232 Q233	N225-L229 PolarHBondContact O-N 2.89Å; S226-L229 PolarHBondContact O-N 3.29Å; L229-Q231 VanDerWaalsContact C-N 3.27Å; L229-Q231 PolarHBondContact O-N 3.36Å; L229-E232 PolarHBondContact O-N 2.98Å; L229-Q233 WeakPolarHBondContact O-CB 3.41Å; L229-Q233 PolarHBondContact O-N 3.2Å
230	L	95.8	Very high	95.1	Very high	99 Å²	99	103.3 Å²	103.3	52%	0.518	53%	0.531	S	S	.	.	H	α-helix	trans	-60.4	-38.1	174.5	-85.5	156.3	0	0	0	111.8	S226 A227 R228 Q233 R234	S226-L230 WeakPolarHBondContact O-CB 3.48Å; S226-L230 PolarHBondContact O-N 3.48Å; A227-L230 PolarHBondContact O-N 3.39Å; R228-L230 PolarHBondContact O-N 2.93Å; L230-Q233 PolarHBondContact O-N 3.06Å; L230-R234 WeakPolarHBondContact O-CG 3.42Å; L230-R234 PolarHBondContact O-N 2.93Å
231	Q	96	Very high	95.4	Very high	141 Å²	141	107.2 Å²	107.2	66%	0.659	53%	0.534	S	S	*	.	H	α-helix	trans	-69.4	-43.5	177.1	-174.5	145.6	-4	0	0	112.3	A227 R228 L229 Q233 R234 V235	A227-Q231 PolarHBondContact O-N 2.97Å; R228-Q231 WeakPolarHBondContact O-CB 3.46Å; R228-Q231 PolarHBondContact O-N 3.06Å; R228-Q231 VanDerWaalsContact O-N 3.13Å; L229-Q231 VanDerWaalsContact C-N 3.27Å; L229-Q231 PolarHBondContact O-N 3.36Å; Q231-Q233 VanDerWaalsContact C-N 3.3Å; Q231-Q233 PolarHBondContact O-N 3.37Å; Q231-R234 WeakPolarHBondContact O-CB 3.48Å; Q231-R234 PolarHBondContact O-N 2.8Å; Q231-V235 WeakPolarHBondContact O-CG2 3.31Å; Q231-V235 PolarHBondContact O-N 3.28Å
232	E	93.9	Very high	95.6	Very high	127 Å²	127	104.7 Å²	104.7	59%	0.593	53%	0.529	S	S	*	.	H	α-helix	trans	-59.2	-43.9	172.3	-73.9	-179.5	179.2	0	0	111	R228 L229 R234 V235 T236	R228-E232 PolarHBondContact O-N 3.32Å; L229-E232 PolarHBondContact O-N 2.98Å; E232-R234 VanDerWaalsContact C-N 3.31Å; E232-R234 PolarHBondContact O-N 3.47Å; E232-V235 PolarHBondContact O-N 3.3Å; E232-V235 VanDerWaalsContact O-N 3.15Å; E232-T236 PolarHBondContact O-N 3.29Å; E232-T236 PolarHBondContact O-OG1 3.48Å; E232-T236 VanDerWaalsContact O-OG1 3.13Å
233	Q	96.3	Very high	95.9	Very high	114 Å²	114	104.6 Å²	104.6	53%	0.533	53%	0.529	S	S	.	.	H	α-helix	trans	-63.5	-36	177.1	-170.8	162.6	26.8	0	0	112.5	L229 L230 Q231 T236 N237	L229-Q233 WeakPolarHBondContact O-CB 3.41Å; L229-Q233 PolarHBondContact O-N 3.2Å; L230-Q233 PolarHBondContact O-N 3.06Å; Q231-Q233 VanDerWaalsContact C-N 3.3Å; Q231-Q233 PolarHBondContact O-N 3.37Å; Q233-T236 PolarHBondContact O-N 2.91Å; Q233-N237 WeakPolarHBondContact O-CB 3.41Å; Q233-N237 PolarHBondContact O-N 2.83Å; Q233-N237 PolarHBondContact O-ND2 2.94Å
234	R	95.8	Very high	96	Very high	183 Å²	183	104.5 Å²	104.5	69%	0.691	53%	0.528	S	S	*	.	H	α-helix	trans	-63.3	-44.3	172.7	-76.1	174	-177	-169.4	1.1	111.5	L230 Q231 E232 N237 V238	L230-R234 WeakPolarHBondContact O-CG 3.42Å; L230-R234 PolarHBondContact O-N 2.93Å; Q231-R234 WeakPolarHBondContact O-CB 3.48Å; Q231-R234 PolarHBondContact O-N 2.8Å; E232-R234 VanDerWaalsContact C-N 3.31Å; E232-R234 PolarHBondContact O-N 3.47Å; R234-N237 PolarHBondContact O-N 2.88Å; R234-V238 WeakPolarHBondContact O-CG2 3.26Å; R234-V238 PolarHBondContact O-N 2.91Å
235	V	96.9	Very high	96.2	Very high	75 Å²	75	106.1 Å²	106.1	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-44.3	176.8	173.4	0	0	0	0	110.8	Q231 E232 N237 V238 H239	Q231-V235 WeakPolarHBondContact O-CG2 3.31Å; Q231-V235 PolarHBondContact O-N 3.28Å; E232-V235 PolarHBondContact O-N 3.3Å; E232-V235 VanDerWaalsContact O-N 3.15Å; V235-N237 PolarHBondContact O-N 3.47Å; V235-V238 PolarHBondContact O-N 3.38Å; V235-H239 VanDerWaalsContact CG1-CE1 3.44Å; V235-H239 WeakPolarHBondContact CG1-CE1 3.46Å; V235-H239 PolarHBondContact O-N 3.39Å; V235-H239 VanDerWaalsContact O-N 3.11Å; V235-H239 PolarHBondContact O-ND1 3.47Å
236	T	95.5	Very high	96.3	Very high	83 Å²	83	106.3 Å²	106.3	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-61.1	-43.5	175.4	-58.2	0	0	0	0	111.6	E232 Q233 V238 H239 V240	E232-T236 PolarHBondContact O-N 3.29Å; E232-T236 PolarHBondContact O-OG1 3.48Å; E232-T236 VanDerWaalsContact O-OG1 3.13Å; Q233-T236 PolarHBondContact O-N 2.91Å; T236-V238 VanDerWaalsContact C-N 3.31Å; T236-V238 PolarHBondContact O-N 3.21Å; T236-H239 PolarHBondContact O-N 3.5Å; T236-V240 HydrophobicContact CG2-CG2 4.37Å; T236-V240 WeakPolarHBondContact O-CG2 3.24Å; T236-V240 PolarHBondContact O-N 3.32Å
237	N	97.2	Very high	96.5	Very high	71 Å²	71	108.4 Å²	108.4	38%	0.38	54%	0.536	S	S	.	.	H	α-helix	trans	-61	-38	176.8	-89.4	-79.5	0	0	0	112.7	Q233 R234 V235 V240 R241	Q233-N237 WeakPolarHBondContact O-CB 3.41Å; Q233-N237 PolarHBondContact O-N 2.83Å; Q233-N237 PolarHBondContact O-ND2 2.94Å; R234-N237 PolarHBondContact O-N 2.88Å; V235-N237 PolarHBondContact O-N 3.47Å; N237-V240 PolarHBondContact O-N 3.48Å; N237-R241 WeakPolarHBondContact O-CG 3.41Å; N237-R241 PolarHBondContact O-N 3.18Å
238	V	97.2	Very high	96.6	Very high	79 Å²	79	112 Å²	112	48%	0.479	54%	0.544	S	S	.	.	H	α-helix	trans	-62.4	-47.4	174.3	172.1	0	0	0	0	110.6	R234 V235 T236 V240 R241 Q242	R234-V238 WeakPolarHBondContact O-CG2 3.26Å; R234-V238 PolarHBondContact O-N 2.91Å; V235-V238 PolarHBondContact O-N 3.38Å; T236-V238 VanDerWaalsContact C-N 3.31Å; T236-V238 PolarHBondContact O-N 3.21Å; V238-V240 PolarHBondContact O-N 2.91Å; V238-R241 PolarHBondContact O-N 3.31Å; V238-Q242 PolarHBondContact O-N 3.21Å
239	H	97.3	Very high	96.7	Very high	108 Å²	108	105.9 Å²	105.9	50%	0.5	53%	0.532	S	S	.	.	H	α-helix	trans	-61.4	-42.9	177.3	-68.8	110.1	0	0	0	112.4	V235 T236 R241 Q242 I243	V235-H239 VanDerWaalsContact CG1-CE1 3.44Å; V235-H239 WeakPolarHBondContact CG1-CE1 3.46Å; V235-H239 PolarHBondContact O-N 3.39Å; V235-H239 VanDerWaalsContact O-N 3.11Å; V235-H239 PolarHBondContact O-ND1 3.47Å; T236-H239 PolarHBondContact O-N 3.5Å; H239-R241 VanDerWaalsContact C-N 3.33Å; H239-R241 PolarHBondContact O-N 3.16Å; H239-Q242 PolarHBondContact O-N 2.92Å; H239-I243 VanDerWaalsContact O-CG1 3.28Å; H239-I243 WeakPolarHBondContact O-CG1 3.48Å; H239-I243 PolarHBondContact O-N 2.95Å
240	V	97.4	Very high	96.7	Very high	85 Å²	85	105.8 Å²	105.8	52%	0.515	53%	0.529	S	S	.	.	H	α-helix	trans	-59.9	-44.4	176.9	170.8	0	0	0	0	111	T236 N237 V238 Q242 I243 A244	T236-V240 HydrophobicContact CG2-CG2 4.37Å; T236-V240 WeakPolarHBondContact O-CG2 3.24Å; T236-V240 PolarHBondContact O-N 3.32Å; N237-V240 PolarHBondContact O-N 3.48Å; V238-V240 PolarHBondContact O-N 2.91Å; V240-Q242 VanDerWaalsContact C-N 3.34Å; V240-Q242 PolarHBondContact O-N 2.68Å; V240-I243 PolarHBondContact O-N 3.36Å; V240-A244 WeakPolarHBondContact O-CB 3.23Å; V240-A244 PolarHBondContact O-N 2.91Å
241	R	97.1	Very high	96.8	Very high	164 Å²	164	105.2 Å²	105.2	62%	0.619	53%	0.527	S	S	*	.	H	α-helix	trans	-63.1	-40.6	176	-73.4	177.5	-173.2	157.2	1.7	112.1	N237 V238 H239 I243 A244 Q245	N237-R241 WeakPolarHBondContact O-CG 3.41Å; N237-R241 PolarHBondContact O-N 3.18Å; V238-R241 PolarHBondContact O-N 3.31Å; H239-R241 VanDerWaalsContact C-N 3.33Å; H239-R241 PolarHBondContact O-N 3.16Å; R241-I243 VanDerWaalsContact C-N 3.34Å; R241-A244 PolarHBondContact O-N 3.13Å; R241-Q245 WeakPolarHBondContact O-CG 3.39Å; R241-Q245 PolarHBondContact O-N 3.3Å
242	Q	96.8	Very high	96.9	Very high	125 Å²	125	104.5 Å²	104.5	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-67.8	-36.2	178.9	-167.7	152.5	1.3	0	0	112.2	V238 H239 V240 H246	V238-Q242 PolarHBondContact O-N 3.21Å; H239-Q242 PolarHBondContact O-N 2.92Å; V240-Q242 VanDerWaalsContact C-N 3.34Å; V240-Q242 PolarHBondContact O-N 2.68Å; Q242-H246 PolarHBondContact O-N 2.99Å
243	I	97.6	Very high	97.1	Very high	104 Å²	104	103 Å²	103	53%	0.533	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-46.3	171.6	-67.6	164.1	0	0	0	110.3	H239 V240 R241 Q245 H246 L247	H239-I243 VanDerWaalsContact O-CG1 3.28Å; H239-I243 WeakPolarHBondContact O-CG1 3.48Å; H239-I243 PolarHBondContact O-N 2.95Å; V240-I243 PolarHBondContact O-N 3.36Å; R241-I243 VanDerWaalsContact C-N 3.34Å; I243-Q245 PolarHBondContact O-N 3.32Å; I243-H246 PolarHBondContact O-N 3.03Å; I243-L247 HydrophobicContact CG2-CD1 4.02Å; I243-L247 HydrophobicContact CG2-CG 4.38Å; I243-L247 WeakPolarHBondContact O-CG 3.36Å; I243-L247 PolarHBondContact O-N 3.13Å
244	A	96.3	Very high	97.2	Very high	53 Å²	53	103 Å²	103	44%	0.438	52%	0.522	S	S	.	.	H	α-helix	trans	-58.5	-46.3	178.4	0	0	0	0	0	111.7	V240 R241 H246 L247 E248	V240-A244 WeakPolarHBondContact O-CB 3.23Å; V240-A244 PolarHBondContact O-N 2.91Å; R241-A244 PolarHBondContact O-N 3.13Å; A244-H246 VanDerWaalsContact C-N 3.33Å; A244-H246 PolarHBondContact O-N 3.44Å; A244-L247 PolarHBondContact O-N 2.95Å; A244-E248 WeakPolarHBondContact O-CB 3.4Å; A244-E248 PolarHBondContact O-N 3.4Å
245	Q	97.6	Very high	97.3	Very high	135 Å²	135	98.2 Å²	98.2	63%	0.631	51%	0.508	S	S	*	.	H	α-helix	trans	-60.7	-40.8	175.5	-74.9	179.5	-21.5	0	0	112.6	R241 I243 E248 G249	R241-Q245 WeakPolarHBondContact O-CG 3.39Å; R241-Q245 PolarHBondContact O-N 3.3Å; I243-Q245 PolarHBondContact O-N 3.32Å; Q245-E248 PolarHBondContact O-N 3.4Å; Q245-G249 PolarHBondContact O-N 3.41Å
246	H	97.9	Very high	97.3	Very high	115 Å²	115	100.6 Å²	100.6	53%	0.532	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-42.9	177	-175.3	70	0	0	0	111.9	Q242 I243 A244 G249 Q250	Q242-H246 PolarHBondContact O-N 2.99Å; I243-H246 PolarHBondContact O-N 3.03Å; A244-H246 VanDerWaalsContact C-N 3.33Å; A244-H246 PolarHBondContact O-N 3.44Å; H246-G249 PolarHBondContact O-N 3.01Å; H246-Q250 PolarHBondContact NE2-NE2 3Å; H246-Q250 VanDerWaalsContact NE2-NE2 3.11Å; H246-Q250 WeakPolarHBondContact O-CG 3.41Å; H246-Q250 PolarHBondContact O-N 2.98Å
247	L	97	Very high	97.4	Very high	100 Å²	100	100 Å²	100	52%	0.524	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-39.4	177.6	-69.1	174.9	0	0	0	112	I243 A244 Q250 N251	I243-L247 HydrophobicContact CG2-CD1 4.02Å; I243-L247 HydrophobicContact CG2-CG 4.38Å; I243-L247 WeakPolarHBondContact O-CG 3.36Å; I243-L247 PolarHBondContact O-N 3.13Å; A244-L247 PolarHBondContact O-N 2.95Å; L247-Q250 PolarHBondContact O-N 2.95Å; L247-N251 WeakPolarHBondContact O-CB 3.44Å; L247-N251 PolarHBondContact O-N 3.33Å
248	E	97.1	Very high	97.4	Very high	126 Å²	126	104.6 Å²	104.6	59%	0.589	52%	0.52	S	S	*	.	H	α-helix	trans	-62.2	-48	175.7	-169.8	163.9	-145.4	0	0	111	A244 Q245 Q250 N251 E252	A244-E248 WeakPolarHBondContact O-CB 3.4Å; A244-E248 PolarHBondContact O-N 3.4Å; Q245-E248 PolarHBondContact O-N 3.4Å; E248-Q250 VanDerWaalsContact C-N 3.34Å; E248-Q250 PolarHBondContact O-N 3.2Å; E248-N251 WeakPolarHBondContact O-CB 3.29Å; E248-N251 PolarHBondContact O-N 3.12Å; E248-E252 WeakPolarHBondContact O-CG 3.48Å; E248-E252 PolarHBondContact O-N 3.5Å
249	G	97.6	Very high	97.4	Very high	36 Å²	36	108.2 Å²	108.2	37%	0.371	53%	0.525	S	S	.	.	H	α-helix	trans	-62.3	-36.6	175.8	0	0	0	0	0	113.7	Q245 H246 N251 L253	Q245-G249 PolarHBondContact O-N 3.41Å; H246-G249 PolarHBondContact O-N 3.01Å; G249-N251 VanDerWaalsContact C-N 3.35Å; G249-L253 PolarHBondContact O-N 3.11Å; G249-L253 VanDerWaalsContact O-N 3.13Å
250	Q	97.4	Very high	97.3	Very high	98 Å²	98	105.6 Å²	105.6	46%	0.458	52%	0.519	S	S	.	.	H	α-helix	trans	-64.6	-38.8	172.4	-76.4	-170.4	-23.3	0	0	112.2	H246 L247 E248 L253 L254	H246-Q250 PolarHBondContact NE2-NE2 3Å; H246-Q250 VanDerWaalsContact NE2-NE2 3.11Å; H246-Q250 WeakPolarHBondContact O-CG 3.41Å; H246-Q250 PolarHBondContact O-N 2.98Å; L247-Q250 PolarHBondContact O-N 2.95Å; E248-Q250 VanDerWaalsContact C-N 3.34Å; E248-Q250 PolarHBondContact O-N 3.2Å; Q250-L253 PolarHBondContact O-N 3.18Å; Q250-L254 WeakPolarHBondContact O-CG 3.4Å; Q250-L254 PolarHBondContact O-N 3.4Å
251	N	96.9	Very high	97.3	Very high	88 Å²	88	107.1 Å²	107.1	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-67.5	-44	178.4	-164.5	-24.1	0	0	0	111.4	L247 E248 G249 L253 L254 Q255	L247-N251 WeakPolarHBondContact O-CB 3.44Å; L247-N251 PolarHBondContact O-N 3.33Å; E248-N251 WeakPolarHBondContact O-CB 3.29Å; E248-N251 PolarHBondContact O-N 3.12Å; G249-N251 VanDerWaalsContact C-N 3.35Å; N251-L253 VanDerWaalsContact C-N 3.32Å; N251-L253 PolarHBondContact O-N 3.02Å; N251-L254 PolarHBondContact O-N 3.5Å; N251-L254 VanDerWaalsContact O-N 3.16Å; N251-Q255 WeakPolarHBondContact O-CG 3.48Å; N251-Q255 PolarHBondContact O-N 3.04Å; N251-Q255 PolarHBondContact OD1-NE2 3.47Å
252	E	97.9	Very high	97.3	Very high	125 Å²	125	104.5 Å²	104.5	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-57.2	-44.5	174.4	-71.3	-178.2	162.9	0	0	112.2	E248 L254 Q255 M256	E248-E252 WeakPolarHBondContact O-CG 3.48Å; E248-E252 PolarHBondContact O-N 3.5Å; E252-L254 PolarHBondContact O-N 3.34Å; E252-Q255 PolarHBondContact O-N 3.34Å; E252-M256 WeakPolarHBondContact O-CB 3.44Å; E252-M256 PolarHBondContact O-N 2.95Å
253	L	97.9	Very high	97.3	Very high	97 Å²	97	101.4 Å²	101.4	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-61	-44.8	176.1	178.3	62.8	0	0	0	111.6	G249 Q250 N251 Q255 M256 I257	G249-L253 PolarHBondContact O-N 3.11Å; G249-L253 VanDerWaalsContact O-N 3.13Å; Q250-L253 PolarHBondContact O-N 3.18Å; N251-L253 VanDerWaalsContact C-N 3.32Å; N251-L253 PolarHBondContact O-N 3.02Å; L253-Q255 VanDerWaalsContact C-N 3.33Å; L253-Q255 PolarHBondContact O-N 3.44Å; L253-M256 WeakPolarHBondContact O-CB 3.43Å; L253-M256 PolarHBondContact O-N 3.1Å; L253-I257 HydrophobicContact CD1-CD1 4.2Å; L253-I257 HydrophobicContact CD1-CG1 4.4Å; L253-I257 HydrophobicContact CG-CD1 4.01Å; L253-I257 VanDerWaalsContact O-CG1 3.31Å; L253-I257 WeakPolarHBondContact O-CG1 3.27Å; L253-I257 PolarHBondContact O-N 3.29Å
254	L	97.9	Very high	97.3	Very high	113 Å²	113	102.7 Å²	102.7	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-62.2	-40.9	177.3	-76.5	169.8	0	0	0	111.9	Q250 N251 E252 I257 R258	Q250-L254 WeakPolarHBondContact O-CG 3.4Å; Q250-L254 PolarHBondContact O-N 3.4Å; N251-L254 PolarHBondContact O-N 3.5Å; N251-L254 VanDerWaalsContact O-N 3.16Å; E252-L254 PolarHBondContact O-N 3.34Å; L254-I257 PolarHBondContact O-N 3.36Å; L254-R258 WeakPolarHBondContact O-CB 3.36Å; L254-R258 PolarHBondContact O-N 2.86Å
255	Q	97.9	Very high	97.2	Very high	83 Å²	83	102.7 Å²	102.7	39%	0.388	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-40.6	175	-71.2	-177.6	22.6	0	0	111.9	N251 E252 L253 R258 R259	N251-Q255 WeakPolarHBondContact O-CG 3.48Å; N251-Q255 PolarHBondContact O-N 3.04Å; N251-Q255 PolarHBondContact OD1-NE2 3.47Å; E252-Q255 PolarHBondContact O-N 3.34Å; L253-Q255 VanDerWaalsContact C-N 3.33Å; L253-Q255 PolarHBondContact O-N 3.44Å; Q255-R258 PolarHBondContact O-N 3.45Å; Q255-R259 WeakPolarHBondContact O-CG 3.13Å; Q255-R259 PolarHBondContact O-N 3.47Å
256	M	97.3	Very high	97.2	Very high	125 Å²	125	102.1 Å²	102.1	62%	0.616	51%	0.508	S	S	*	.	H	α-helix	trans	-61.1	-46.3	175.4	-171.5	-163.7	-61.9	0	0	111.1	E252 L253 R258 R259 S260	E252-M256 WeakPolarHBondContact O-CB 3.44Å; E252-M256 PolarHBondContact O-N 2.95Å; L253-M256 WeakPolarHBondContact O-CB 3.43Å; L253-M256 PolarHBondContact O-N 3.1Å; M256-R258 PolarHBondContact O-N 2.93Å; M256-R259 PolarHBondContact O-N 3.26Å; M256-S260 WeakPolarHBondContact O-CB 3.32Å; M256-S260 PolarHBondContact O-N 3.23Å; M256-S260 PolarHBondContact O-OG 2.97Å
257	I	97.3	Very high	97.1	Very high	71 Å²	71	99.1 Å²	99.1	36%	0.364	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-47.2	177.2	-68.4	166.5	0	0	0	110	L253 L254 R259 S260 Q261	L253-I257 HydrophobicContact CD1-CD1 4.2Å; L253-I257 HydrophobicContact CD1-CG1 4.4Å; L253-I257 HydrophobicContact CG-CD1 4.01Å; L253-I257 VanDerWaalsContact O-CG1 3.31Å; L253-I257 WeakPolarHBondContact O-CG1 3.27Å; L253-I257 PolarHBondContact O-N 3.29Å; L254-I257 PolarHBondContact O-N 3.36Å; I257-R259 PolarHBondContact O-N 3.5Å; I257-S260 PolarHBondContact O-N 2.9Å; I257-S260 PolarHBondContact O-OG 3.03Å; I257-Q261 HydrophobicContact CG2-CG 4.43Å; I257-Q261 WeakPolarHBondContact O-CG 3.47Å; I257-Q261 PolarHBondContact O-N 3.2Å
258	R	97.7	Very high	97.1	Very high	166 Å²	166	101 Å²	101	63%	0.626	51%	0.509	S	S	*	.	H	α-helix	trans	-57.4	-51.8	177.5	176.5	179.2	-70	-89.1	1.4	112.1	L254 Q255 M256 S260 Q261 E262	L254-R258 WeakPolarHBondContact O-CB 3.36Å; L254-R258 PolarHBondContact O-N 2.86Å; Q255-R258 PolarHBondContact O-N 3.45Å; M256-R258 PolarHBondContact O-N 2.93Å; R258-S260 VanDerWaalsContact C-N 3.26Å; R258-S260 PolarHBondContact O-N 2.96Å; R258-Q261 PolarHBondContact O-N 3.01Å; R258-Q261 VanDerWaalsContact O-N 3.13Å; R258-E262 WeakPolarHBondContact CG-OE1 3.5Å; R258-E262 WeakPolarHBondContact O-CG 3.48Å; R258-E262 PolarHBondContact O-N 3.04Å
259	R	97.7	Very high	97.1	Very high	155 Å²	155	100.2 Å²	100.2	59%	0.585	51%	0.505	S	S	*	.	H	α-helix	trans	-59.7	-37.9	178.1	-71.1	-178.9	-174.5	117.2	4.2	111.9	Q255 M256 I257 A263	Q255-R259 WeakPolarHBondContact O-CG 3.13Å; Q255-R259 PolarHBondContact O-N 3.47Å; M256-R259 PolarHBondContact O-N 3.26Å; I257-R259 PolarHBondContact O-N 3.5Å; R259-A263 WeakPolarHBondContact O-CB 3.39Å; R259-A263 PolarHBondContact O-N 2.93Å
260	S	95.4	Very high	97.1	Very high	54 Å²	54	105.5 Å²	105.5	38%	0.378	51%	0.514	S	S	.	.	H	α-helix	trans	-66.4	-40.3	176.8	76.9	0	0	0	0	112.3	M256 I257 R258 A263 Q264	M256-S260 WeakPolarHBondContact O-CB 3.32Å; M256-S260 PolarHBondContact O-N 3.23Å; M256-S260 PolarHBondContact O-OG 2.97Å; I257-S260 PolarHBondContact O-N 2.9Å; I257-S260 PolarHBondContact O-OG 3.03Å; R258-S260 VanDerWaalsContact C-N 3.26Å; R258-S260 PolarHBondContact O-N 2.96Å; S260-A263 PolarHBondContact O-N 3.26Å; S260-Q264 VanDerWaalsContact O-CG 3.29Å; S260-Q264 WeakPolarHBondContact O-CG 3.21Å; S260-Q264 PolarHBondContact O-N 3.36Å
261	Q	97.4	Very high	97	Very high	117 Å²	117	107.3 Å²	107.3	55%	0.547	52%	0.523	S	S	.	.	H	α-helix	trans	-67.2	-41.6	176.7	-73.6	178.4	-0.1	0	0	111.4	I257 R258 A263 Q264 A265	I257-Q261 HydrophobicContact CG2-CG 4.43Å; I257-Q261 WeakPolarHBondContact O-CG 3.47Å; I257-Q261 PolarHBondContact O-N 3.2Å; R258-Q261 PolarHBondContact O-N 3.01Å; R258-Q261 VanDerWaalsContact O-N 3.13Å; Q261-A263 PolarHBondContact O-N 3.27Å; Q261-Q264 PolarHBondContact O-N 3.07Å; Q261-A265 WeakPolarHBondContact O-CB 3.45Å; Q261-A265 PolarHBondContact O-N 2.95Å
262	E	96.8	Very high	97	Very high	108 Å²	108	105.2 Å²	105.2	51%	0.505	52%	0.517	S	S	.	.	H	α-helix	trans	-61.2	-44	175.6	-72.7	166.8	-172.1	0	0	111.4	R258 Q264 A265 Y266	R258-E262 WeakPolarHBondContact CG-OE1 3.5Å; R258-E262 WeakPolarHBondContact O-CG 3.48Å; R258-E262 PolarHBondContact O-N 3.04Å; E262-Q264 PolarHBondContact O-N 3.35Å; E262-A265 PolarHBondContact O-N 3.44Å; E262-Y266 WeakPolarHBondContact O-CB 3.44Å; E262-Y266 PolarHBondContact O-N 3.39Å
263	A	96.6	Very high	96.9	Very high	60 Å²	60	104 Å²	104	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-63.7	-39.4	175.8	0	0	0	0	0	112.5	R259 S260 Q261 A267	R259-A263 WeakPolarHBondContact O-CB 3.39Å; R259-A263 PolarHBondContact O-N 2.93Å; S260-A263 PolarHBondContact O-N 3.26Å; Q261-A263 PolarHBondContact O-N 3.27Å; A263-A267 WeakPolarHBondContact O-CB 3.43Å; A263-A267 PolarHBondContact O-N 3.47Å
264	Q	96.9	Very high	96.8	Very high	132 Å²	132	102.3 Å²	102.3	62%	0.617	51%	0.512	S	S	*	.	H	α-helix	trans	-64.9	-45.6	175	-75.6	174	-17.5	0	0	111.8	S260 Q261 E262 Y266 A267 Q268	S260-Q264 VanDerWaalsContact O-CG 3.29Å; S260-Q264 WeakPolarHBondContact O-CG 3.21Å; S260-Q264 PolarHBondContact O-N 3.36Å; Q261-Q264 PolarHBondContact O-N 3.07Å; E262-Q264 PolarHBondContact O-N 3.35Å; Q264-Y266 VanDerWaalsContact C-N 3.34Å; Q264-Y266 PolarHBondContact O-N 3.48Å; Q264-A267 PolarHBondContact O-N 3.03Å; Q264-Q268 WeakPolarHBondContact O-CB 3.42Å; Q264-Q268 PolarHBondContact O-N 3.33Å
265	A	95.6	Very high	96.8	Very high	53 Å²	53	102.9 Å²	102.9	44%	0.438	52%	0.515	S	S	.	.	H	α-helix	trans	-60.5	-44.6	177.1	0	0	0	0	0	111.2	Q261 E262 A267 Q268 E269	Q261-A265 WeakPolarHBondContact O-CB 3.45Å; Q261-A265 PolarHBondContact O-N 2.95Å; E262-A265 PolarHBondContact O-N 3.44Å; A265-A267 PolarHBondContact O-N 3.43Å; A265-Q268 PolarHBondContact O-N 3.36Å; A265-E269 WeakPolarHBondContact O-CB 3.4Å; A265-E269 PolarHBondContact O-N 3.34Å
266	Y	97.1	Very high	96.7	Very high	123 Å²	123	105 Å²	105	48%	0.482	53%	0.525	S	S	.	.	H	α-helix	trans	-61.6	-42.2	176.7	-176.7	-101.6	0	0	0	113	E262 Q264 Q268 E269 R270	E262-Y266 WeakPolarHBondContact O-CB 3.44Å; E262-Y266 PolarHBondContact O-N 3.39Å; Q264-Y266 VanDerWaalsContact C-N 3.34Å; Q264-Y266 PolarHBondContact O-N 3.48Å; Y266-Q268 VanDerWaalsContact C-N 3.34Å; Y266-E269 PolarHBondContact O-N 2.88Å; Y266-R270 HydrophobicContact CE1-CG 4.34Å; Y266-R270 PolarHBondContact O-N 3.18Å; Y266-R270 PolarHBondContact OH-NE 3.21Å; Y266-R270 PolarHBondContact OH-NH1 2.88Å; Y266-R270 PolarHBondContact OH-NH2 3.05Å
267	A	96.7	Very high	96.6	Very high	52 Å²	52	101.2 Å²	101.2	43%	0.43	52%	0.517	S	S	.	.	H	α-helix	trans	-63.6	-41.8	175.9	0	0	0	0	0	111.6	A263 Q264 A265 R270 Q271	A263-A267 WeakPolarHBondContact O-CB 3.43Å; A263-A267 PolarHBondContact O-N 3.47Å; Q264-A267 PolarHBondContact O-N 3.03Å; A265-A267 PolarHBondContact O-N 3.43Å; A267-R270 PolarHBondContact O-N 3.08Å; A267-Q271 WeakPolarHBondContact O-CG 3.45Å; A267-Q271 PolarHBondContact O-N 3.11Å; A267-Q271 VanDerWaalsContact O-N 3.1Å
268	Q	96.9	Very high	96.6	Very high	140 Å²	140	101.8 Å²	101.8	65%	0.654	52%	0.524	S	S	*	.	H	α-helix	trans	-65.8	-42	177.1	-172	177.8	-4.4	0	0	111.8	Q264 A265 Y266 R270 Q271 A272	Q264-Q268 WeakPolarHBondContact O-CB 3.42Å; Q264-Q268 PolarHBondContact O-N 3.33Å; A265-Q268 PolarHBondContact O-N 3.36Å; Y266-Q268 VanDerWaalsContact C-N 3.34Å; Q268-R270 VanDerWaalsContact C-N 3.35Å; Q268-R270 PolarHBondContact O-N 2.92Å; Q268-Q271 PolarHBondContact O-N 2.84Å; Q268-A272 PolarHBondContact O-N 3.21Å
269	E	96.5	Very high	96.6	Very high	108 Å²	108	99.7 Å²	99.7	51%	0.505	52%	0.521	S	S	.	.	H	α-helix	trans	-60.6	-43.9	176	-173.3	-178	172	0	0	111.4	A265 Y266 Q271 A272 Q273	A265-E269 WeakPolarHBondContact O-CB 3.4Å; A265-E269 PolarHBondContact O-N 3.34Å; Y266-E269 PolarHBondContact O-N 2.88Å; E269-Q271 VanDerWaalsContact C-N 3.32Å; E269-Q271 PolarHBondContact O-N 3.21Å; E269-A272 WeakPolarHBondContact O-CB 3.46Å; E269-A272 PolarHBondContact O-N 2.77Å; E269-Q273 WeakPolarHBondContact O-CG 3.48Å; E269-Q273 PolarHBondContact O-N 2.88Å; E269-Q273 PolarHBondContact OE1-NE2 2.99Å
270	R	96.6	Very high	96.5	Very high	148 Å²	148	95 Å²	95	56%	0.558	52%	0.516	S	S	*	.	H	α-helix	trans	-61	-39.9	174.6	-83.5	-146.7	165.4	137.7	-5.5	113.3	Y266 A267 Q268 A274	Y266-R270 HydrophobicContact CE1-CG 4.34Å; Y266-R270 PolarHBondContact O-N 3.18Å; Y266-R270 PolarHBondContact OH-NE 3.21Å; Y266-R270 PolarHBondContact OH-NH1 2.88Å; Y266-R270 PolarHBondContact OH-NH2 3.05Å; A267-R270 PolarHBondContact O-N 3.08Å; Q268-R270 VanDerWaalsContact C-N 3.35Å; Q268-R270 PolarHBondContact O-N 2.92Å; R270-A274 WeakPolarHBondContact O-CB 3.45Å; R270-A274 PolarHBondContact O-N 3.4Å
271	Q	96.1	Very high	96.6	Very high	135 Å²	135	95.4 Å²	95.4	63%	0.631	52%	0.523	S	S	*	.	H	α-helix	trans	-64.5	-42.5	175	-72.7	179.4	-12.2	0	0	111.2	A267 Q268 E269 A274 L275	A267-Q271 WeakPolarHBondContact O-CG 3.45Å; A267-Q271 PolarHBondContact O-N 3.11Å; A267-Q271 VanDerWaalsContact O-N 3.1Å; Q268-Q271 PolarHBondContact O-N 2.84Å; E269-Q271 VanDerWaalsContact C-N 3.32Å; E269-Q271 PolarHBondContact O-N 3.21Å; Q271-A274 PolarHBondContact O-N 3.26Å; Q271-L275 WeakPolarHBondContact O-CG 3.48Å; Q271-L275 PolarHBondContact O-N 3.44Å; Q271-L275 VanDerWaalsContact O-N 3.08Å
272	A	96.3	Very high	96.6	Very high	44 Å²	44	94.9 Å²	94.9	36%	0.364	52%	0.523	S	S	.	.	H	α-helix	trans	-61.6	-47.9	176.4	0	0	0	0	0	111.7	Q268 E269 A274 L275 E276	Q268-A272 PolarHBondContact O-N 3.21Å; E269-A272 WeakPolarHBondContact O-CB 3.46Å; E269-A272 PolarHBondContact O-N 2.77Å; A272-A274 VanDerWaalsContact C-N 3.31Å; A272-A274 PolarHBondContact O-N 3.43Å; A272-L275 WeakPolarHBondContact O-CB 3.49Å; A272-L275 PolarHBondContact O-N 2.87Å; A272-L275 VanDerWaalsContact O-N 3.11Å; A272-E276 WeakPolarHBondContact O-CG 3.38Å; A272-E276 PolarHBondContact O-N 3.23Å
273	Q	96.5	Very high	96.5	Very high	101 Å²	101	94.6 Å²	94.6	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-59.9	-39	176.9	-71.7	174.6	-0.3	0	0	112.5	E269 L275 E276 G277	E269-Q273 WeakPolarHBondContact O-CG 3.48Å; E269-Q273 PolarHBondContact O-N 2.88Å; E269-Q273 PolarHBondContact OE1-NE2 2.99Å; Q273-L275 VanDerWaalsContact C-N 3.35Å; Q273-E276 PolarHBondContact O-N 2.98Å; Q273-G277 PolarHBondContact O-N 3.43Å
274	A	96.4	Very high	96.5	Very high	60 Å²	60	94.2 Å²	94.2	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-65	-39.1	175.9	0	0	0	0	0	112.2	R270 Q271 A272 T278	R270-A274 WeakPolarHBondContact O-CB 3.45Å; R270-A274 PolarHBondContact O-N 3.4Å; Q271-A274 PolarHBondContact O-N 3.26Å; A272-A274 VanDerWaalsContact C-N 3.31Å; A272-A274 PolarHBondContact O-N 3.43Å; A274-T278 WeakPolarHBondContact O-CB 3.46Å; A274-T278 PolarHBondContact O-N 2.85Å; A274-T278 PolarHBondContact O-OG1 3.33Å
275	L	96.9	Very high	96.5	Very high	125 Å²	125	92 Å²	92	65%	0.654	51%	0.514	S	S	*	.	H	α-helix	trans	-67.3	-44.2	175.2	-71.5	171.1	0	0	0	111.5	Q271 A272 Q273 G277 T278 Q279	Q271-L275 WeakPolarHBondContact O-CG 3.48Å; Q271-L275 PolarHBondContact O-N 3.44Å; Q271-L275 VanDerWaalsContact O-N 3.08Å; A272-L275 WeakPolarHBondContact O-CB 3.49Å; A272-L275 PolarHBondContact O-N 2.87Å; A272-L275 VanDerWaalsContact O-N 3.11Å; Q273-L275 VanDerWaalsContact C-N 3.35Å; L275-G277 PolarHBondContact O-N 3.26Å; L275-T278 PolarHBondContact O-N 3.44Å; L275-Q279 WeakPolarHBondContact O-CB 3.4Å; L275-Q279 PolarHBondContact O-N 3.5Å
276	E	95.6	Very high	96.5	Very high	129 Å²	129	93.4 Å²	93.4	60%	0.603	52%	0.516	S	S	*	.	H	α-helix	trans	-60.3	-44.2	174.7	-72.8	-176.3	176	0	0	111.5	A272 Q273 T278 Q279 A280	A272-E276 WeakPolarHBondContact O-CG 3.38Å; A272-E276 PolarHBondContact O-N 3.23Å; Q273-E276 PolarHBondContact O-N 2.98Å; E276-T278 VanDerWaalsContact C-N 3.33Å; E276-T278 PolarHBondContact O-N 3.32Å; E276-Q279 PolarHBondContact O-N 3.48Å; E276-A280 WeakPolarHBondContact O-CB 3.47Å; E276-A280 PolarHBondContact O-N 3.49Å
277	G	96.1	Very high	96.4	Very high	44 Å²	44	92.3 Å²	92.3	45%	0.454	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-40.6	175.3	0	0	0	0	0	112.6	Q273 L275 A280 A281	Q273-G277 PolarHBondContact O-N 3.43Å; L275-G277 PolarHBondContact O-N 3.26Å; G277-A280 PolarHBondContact O-N 2.86Å; G277-A281 WeakPolarHBondContact O-CB 3.4Å; G277-A281 PolarHBondContact O-N 2.98Å
278	T	96.9	Very high	96.3	Very high	83 Å²	83	96.6 Å²	96.6	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-44	175.6	-54.6	0	0	0	0	111.1	A274 L275 E276 A281 L282	A274-T278 WeakPolarHBondContact O-CB 3.46Å; A274-T278 PolarHBondContact O-N 2.85Å; A274-T278 PolarHBondContact O-OG1 3.33Å; L275-T278 PolarHBondContact O-N 3.44Å; E276-T278 VanDerWaalsContact C-N 3.33Å; E276-T278 PolarHBondContact O-N 3.32Å; T278-A281 PolarHBondContact O-N 3.31Å; T278-L282 HydrophobicContact CG2-CD1 4.48Å; T278-L282 WeakPolarHBondContact O-CG 3.47Å; T278-L282 PolarHBondContact O-N 3.47Å
279	Q	97.1	Very high	96.2	Very high	122 Å²	122	94.7 Å²	94.7	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-62.1	-43.7	176.4	-175.5	179.5	4.8	0	0	111.5	L275 E276 A281 L282 L283	L275-Q279 WeakPolarHBondContact O-CB 3.4Å; L275-Q279 PolarHBondContact O-N 3.5Å; E276-Q279 PolarHBondContact O-N 3.48Å; Q279-A281 VanDerWaalsContact C-N 3.35Å; Q279-A281 PolarHBondContact O-N 3.3Å; Q279-L282 PolarHBondContact O-N 2.97Å; Q279-L283 HydrophobicContact CG-CD1 4.33Å; Q279-L283 WeakPolarHBondContact O-CG 3.42Å; Q279-L283 PolarHBondContact O-N 3.46Å
280	A	96.8	Very high	96.1	Very high	58 Å²	58	95.8 Å²	95.8	48%	0.479	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-42	176.2	0	0	0	0	0	111.9	E276 G277 L283 A284	E276-A280 WeakPolarHBondContact O-CB 3.47Å; E276-A280 PolarHBondContact O-N 3.49Å; G277-A280 PolarHBondContact O-N 2.86Å; A280-L283 PolarHBondContact O-N 3.29Å; A280-A284 WeakPolarHBondContact O-CB 3.19Å; A280-A284 PolarHBondContact O-N 3.5Å
281	A	96.9	Very high	95.9	Very high	62 Å²	62	92.3 Å²	92.3	51%	0.512	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-43.1	175.9	0	0	0	0	0	112.3	G277 T278 Q279 A284 L285	G277-A281 WeakPolarHBondContact O-CB 3.4Å; G277-A281 PolarHBondContact O-N 2.98Å; T278-A281 PolarHBondContact O-N 3.31Å; Q279-A281 VanDerWaalsContact C-N 3.35Å; Q279-A281 PolarHBondContact O-N 3.3Å; A281-A284 PolarHBondContact O-N 3.31Å; A281-L285 PolarHBondContact O-N 3.35Å
282	L	96.8	Very high	95.7	Very high	106 Å²	106	89 Å²	89	56%	0.555	51%	0.513	S	S	*	.	H	α-helix	trans	-62.1	-43.7	175	-72.5	173.3	0	0	0	111.7	T278 Q279 A284 L285 V286	T278-L282 HydrophobicContact CG2-CD1 4.48Å; T278-L282 WeakPolarHBondContact O-CG 3.47Å; T278-L282 PolarHBondContact O-N 3.47Å; Q279-L282 PolarHBondContact O-N 2.97Å; L282-A284 PolarHBondContact O-N 2.91Å; L282-L285 PolarHBondContact O-N 2.93Å; L282-V286 WeakPolarHBondContact O-CG2 3.38Å; L282-V286 PolarHBondContact O-N 3.44Å
283	L	96.2	Very high	95.5	Very high	101 Å²	101	91.6 Å²	91.6	53%	0.529	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-43.9	175.7	-74.1	172	0	0	0	111.4	Q279 A280 L285 V286 Q287	Q279-L283 HydrophobicContact CG-CD1 4.33Å; Q279-L283 WeakPolarHBondContact O-CG 3.42Å; Q279-L283 PolarHBondContact O-N 3.46Å; A280-L283 PolarHBondContact O-N 3.29Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 3.31Å; L283-V286 PolarHBondContact O-N 3.19Å; L283-Q287 WeakPolarHBondContact O-CG 3.38Å; L283-Q287 PolarHBondContact O-N 2.94Å
284	A	96.8	Very high	95.3	Very high	53 Å²	53	92.9 Å²	92.9	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-60.4	-42.7	175.9	0	0	0	0	0	111.9	A280 A281 L282 Q287 M288	A280-A284 WeakPolarHBondContact O-CB 3.19Å; A280-A284 PolarHBondContact O-N 3.5Å; A281-A284 PolarHBondContact O-N 3.31Å; L282-A284 PolarHBondContact O-N 2.91Å; A284-Q287 PolarHBondContact O-N 2.93Å; A284-M288 WeakPolarHBondContact O-CG 3.33Å; A284-M288 PolarHBondContact O-N 2.89Å
285	L	96.6	Very high	95	Very high	86 Å²	86	94.3 Å²	94.3	45%	0.45	52%	0.523	S	S	.	.	H	α-helix	trans	-61.2	-46.5	175.8	-178.7	63.6	0	0	0	111.8	A281 L282 L283 Q287 M288 M289	A281-L285 PolarHBondContact O-N 3.35Å; L282-L285 PolarHBondContact O-N 2.93Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 3.31Å; L285-Q287 VanDerWaalsContact C-N 3.28Å; L285-Q287 PolarHBondContact O-N 2.95Å; L285-M288 HydrophobicContact CD1-CE 4.27Å; L285-M288 PolarHBondContact O-N 3.38Å; L285-M289 HydrophobicContact CD1-CG 4.36Å; L285-M289 HydrophobicContact CD1-SD 4.31Å; L285-M289 HydrophobicContact CG-SD 4.31Å; L285-M289 WeakPolarHBondContact O-CG 3.37Å; L285-M289 PolarHBondContact O-N 3.23Å
286	V	95.3	Very high	94.8	Very high	82 Å²	82	93 Å²	93	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-40.9	176	170.2	0	0	0	0	111.1	L282 L283 M289 R290	L282-V286 WeakPolarHBondContact O-CG2 3.38Å; L282-V286 PolarHBondContact O-N 3.44Å; L283-V286 PolarHBondContact O-N 3.19Å; V286-M289 PolarHBondContact O-N 2.96Å; V286-R290 WeakPolarHBondContact O-CB 3.35Å; V286-R290 PolarHBondContact O-N 3.41Å; V286-R290 VanDerWaalsContact O-N 3.08Å
287	Q	94.9	Very high	94.6	Very high	99 Å²	99	95 Å²	95	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-65.4	-41.1	176.8	-67.1	-72.4	-0.6	0	0	111.9	L283 A284 L285 R290 P291	L283-Q287 WeakPolarHBondContact O-CG 3.38Å; L283-Q287 PolarHBondContact O-N 2.94Å; A284-Q287 PolarHBondContact O-N 2.93Å; L285-Q287 VanDerWaalsContact C-N 3.28Å; L285-Q287 PolarHBondContact O-N 2.95Å; Q287-R290 VanDerWaalsContact CD-CZ 3.44Å; Q287-R290 WeakPolarHBondContact O-CB 3.41Å; Q287-R290 PolarHBondContact O-N 2.92Å; Q287-P291 WeakPolarHBondContact O-CD 3.45Å
288	M	94.6	Very high	94.3	Very high	143 Å²	143	98.5 Å²	98.5	70%	0.704	52%	0.521	S	S	*	.	H	α-helix	trans	-65.9	-36.3	176	-73.5	-158	-57	0	0	113	A284 L285 R290 P291	A284-M288 WeakPolarHBondContact O-CG 3.33Å; A284-M288 PolarHBondContact O-N 2.89Å; L285-M288 HydrophobicContact CD1-CE 4.27Å; L285-M288 PolarHBondContact O-N 3.38Å; M288-R290 VanDerWaalsContact C-N 3.35Å; M288-P291 VanDerWaalsContact O-CD 3.3Å; M288-P291 WeakPolarHBondContact O-CD 3.3Å
289	M	94.1	Very high	94	Very high	99 Å²	99	101.5 Å²	101.5	49%	0.488	53%	0.527	S	S	.	.	H	α-helix	trans	-79.1	-18.7	179.1	-67.5	-172.8	74	0	0	113.3	L285 V286 A292 L293	L285-M289 HydrophobicContact CD1-CG 4.36Å; L285-M289 HydrophobicContact CD1-SD 4.31Å; L285-M289 HydrophobicContact CG-SD 4.31Å; L285-M289 WeakPolarHBondContact O-CG 3.37Å; L285-M289 PolarHBondContact O-N 3.23Å; V286-M289 PolarHBondContact O-N 2.96Å; M289-A292 PolarHBondContact O-N 3.36Å; M289-L293 HydrophobicContact CB-CD1 4.2Å; M289-L293 WeakPolarHBondContact O-CG 3.32Å; M289-L293 PolarHBondContact O-N 3.01Å
290	R	94.2	Very high	93.6	Very high	132 Å²	132	100.8 Å²	100.8	50%	0.498	53%	0.527	S	S	.	.	H	α-helix	trans	-56.4	-42.8	-174.8	-167.9	179.5	-68.6	180	-2.6	114.5	V286 Q287 M288 K294	V286-R290 WeakPolarHBondContact O-CB 3.35Å; V286-R290 PolarHBondContact O-N 3.41Å; V286-R290 VanDerWaalsContact O-N 3.08Å; Q287-R290 VanDerWaalsContact CD-CZ 3.44Å; Q287-R290 WeakPolarHBondContact O-CB 3.41Å; Q287-R290 PolarHBondContact O-N 2.92Å; M288-R290 VanDerWaalsContact C-N 3.35Å; R290-K294 WeakPolarHBondContact O-CB 3.47Å; R290-K294 PolarHBondContact O-N 3.28Å
291	P	93.1	Very high	93.1	Very high	74 Å²	74	103.4 Å²	103.4	48%	0.481	53%	0.529	S	S	.	.	H	α-helix	trans	-65.7	-47.4	177.1	-18.3	32.1	0	0	0	111.9	Q287 M288 L293 K294 D295	Q287-P291 WeakPolarHBondContact O-CD 3.45Å; M288-P291 VanDerWaalsContact O-CD 3.3Å; M288-P291 WeakPolarHBondContact O-CD 3.3Å; P291-L293 VanDerWaalsContact C-N 3.32Å; P291-L293 PolarHBondContact O-N 3.32Å; P291-K294 WeakPolarHBondContact O-CA 3.47Å; P291-K294 WeakPolarHBondContact O-CB 3.34Å; P291-K294 PolarHBondContact O-N 3.02Å; P291-D295 PolarHBondContact O-N 3.37Å
292	A	92	Very high	92.3	Very high	67 Å²	67	103.5 Å²	103.5	55%	0.554	53%	0.526	S	S	*	.	H	α-helix	trans	-60.4	-41.4	179.2	0	0	0	0	0	112.1	M289 K294 D295 L296	M289-A292 PolarHBondContact O-N 3.36Å; A292-K294 VanDerWaalsContact C-N 3.35Å; A292-D295 PolarHBondContact O-N 3.08Å; A292-L296 WeakPolarHBondContact O-CB 3.35Å; A292-L296 PolarHBondContact O-N 3.43Å
293	L	91.3	Very high	91	Very high	98 Å²	98	100.3 Å²	100.3	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-66.2	-35.7	174.1	-68.8	172.9	0	0	0	112.3	M289 P291 R297	M289-L293 HydrophobicContact CB-CD1 4.2Å; M289-L293 WeakPolarHBondContact O-CG 3.32Å; M289-L293 PolarHBondContact O-N 3.01Å; P291-L293 VanDerWaalsContact C-N 3.32Å; P291-L293 PolarHBondContact O-N 3.32Å; L293-R297 WeakPolarHBondContact O-CB 3.43Å; L293-R297 PolarHBondContact O-N 2.96Å
294	K	92.3	Very high	89.5	Confident	127 Å²	127	99.8 Å²	99.8	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-67.9	-39.5	176.4	-169.9	175.8	-176.9	178.6	0	111.4	R290 P291 A292 K298	R290-K294 WeakPolarHBondContact O-CB 3.47Å; R290-K294 PolarHBondContact O-N 3.28Å; P291-K294 WeakPolarHBondContact O-CA 3.47Å; P291-K294 WeakPolarHBondContact O-CB 3.34Å; P291-K294 PolarHBondContact O-N 3.02Å; A292-K294 VanDerWaalsContact C-N 3.35Å; K294-K298 WeakPolarHBondContact O-CG 3.38Å; K294-K298 PolarHBondContact O-N 3.01Å
295	D	91.8	Very high	87.7	Confident	91 Å²	91	102.1 Å²	102.1	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-73.8	-39.5	178.6	-66.7	-26.7	0	0	0	112	P291 A292 R297 K298 F299	P291-D295 PolarHBondContact O-N 3.37Å; A292-D295 PolarHBondContact O-N 3.08Å; D295-R297 VanDerWaalsContact C-N 3.32Å; D295-R297 PolarHBondContact O-N 3.04Å; D295-K298 PolarHBondContact O-N 3.31Å; D295-K298 IonicContact OD1-NZ 3.53Å; D295-F299 WeakPolarHBondContact O-CB 3.48Å; D295-F299 PolarHBondContact O-N 3.26Å
296	L	91.1	Very high	85.9	Confident	96 Å²	96	103.9 Å²	103.9	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-59.1	-43.4	170.8	-178.7	62.8	0	0	0	111.7	A292 F299 L300	A292-L296 WeakPolarHBondContact O-CB 3.35Å; A292-L296 PolarHBondContact O-N 3.43Å; L296-F299 PolarHBondContact O-N 3.02Å; L296-L300 HydrophobicContact CG-CD1 4.26Å; L296-L300 WeakPolarHBondContact O-CG 3.42Å; L296-L300 PolarHBondContact O-N 3.31Å
297	R	91.9	Very high	84	Confident	172 Å²	172	103.8 Å²	103.8	65%	0.649	54%	0.538	S	S	*	.	H	α-helix	trans	-59.9	-47.6	175.2	173.8	-179.2	-77.7	151.4	-6.1	111.5	L293 D295 F299 L300 Q301	L293-R297 WeakPolarHBondContact O-CB 3.43Å; L293-R297 PolarHBondContact O-N 2.96Å; D295-R297 VanDerWaalsContact C-N 3.32Å; D295-R297 PolarHBondContact O-N 3.04Å; R297-F299 VanDerWaalsContact C-N 3.32Å; R297-F299 PolarHBondContact O-N 3.5Å; R297-L300 PolarHBondContact O-N 3.29Å; R297-Q301 PolarHBondContact O-N 3.2Å; R297-Q301 PolarHBondContact O-OE1 3.09Å
298	K	90.4	Very high	82	Confident	117 Å²	117	104.8 Å²	104.8	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-59.1	-43.1	176.7	-73.2	172.2	-177.2	170.7	0	111.9	K294 D295 L300 Q301 S302	K294-K298 WeakPolarHBondContact O-CG 3.38Å; K294-K298 PolarHBondContact O-N 3.01Å; D295-K298 PolarHBondContact O-N 3.31Å; D295-K298 IonicContact OD1-NZ 3.53Å; K298-L300 PolarHBondContact O-N 3.21Å; K298-Q301 PolarHBondContact O-N 3.43Å; K298-S302 PolarHBondContact O-N 2.65Å; K298-S302 PolarHBondContact O-OG 3.24Å
299	F	90.1	Very high	80	Confident	146 Å²	146	104.6 Å²	104.6	64%	0.64	55%	0.549	S	S	*	.	H	α-helix	trans	-61.7	-42.3	178	-179.1	-98.9	0	0	0	112.4	D295 L296 R297 S302 G303	D295-F299 WeakPolarHBondContact O-CB 3.48Å; D295-F299 PolarHBondContact O-N 3.26Å; L296-F299 PolarHBondContact O-N 3.02Å; R297-F299 VanDerWaalsContact C-N 3.32Å; R297-F299 PolarHBondContact O-N 3.5Å; F299-S302 WeakPolarHBondContact CA-OG 3.47Å; F299-S302 PolarHBondContact O-N 2.89Å; F299-S302 PolarHBondContact O-OG 3.06Å; F299-G303 PolarHBondContact O-N 3.04Å
300	L	88.9	Confident	77.9	Confident	108 Å²	108	104 Å²	104	57%	0.565	55%	0.554	S	S	*	*	H	α-helix	trans	-67.5	-38.5	175.9	-69	171.2	0	0	0	112.6	L296 R297 K298 T304	L296-L300 HydrophobicContact CG-CD1 4.26Å; L296-L300 WeakPolarHBondContact O-CG 3.42Å; L296-L300 PolarHBondContact O-N 3.31Å; R297-L300 PolarHBondContact O-N 3.29Å; K298-L300 PolarHBondContact O-N 3.21Å; L300-T304 PolarHBondContact O-N 3.29Å; L300-T304 PolarHBondContact O-OG1 3.06Å; L300-T304 VanDerWaalsContact O-OG1 3.04Å
301	Q	86.1	Confident	75.7	Confident	113 Å²	113	102.4 Å²	102.4	53%	0.528	56%	0.563	S	S	.	*	H	α-helix	trans	-61.8	-47.7	172.3	-112	94.2	49.9	0	0	110.8	R297 K298 G303 T304 D305	R297-Q301 PolarHBondContact O-N 3.2Å; R297-Q301 PolarHBondContact O-OE1 3.09Å; K298-Q301 PolarHBondContact O-N 3.43Å; Q301-G303 VanDerWaalsContact C-N 3.33Å; Q301-G303 PolarHBondContact O-N 3.48Å; Q301-T304 WeakPolarHBondContact O-CB 3.39Å; Q301-T304 PolarHBondContact O-N 3.36Å; Q301-T304 VanDerWaalsContact O-N 3.09Å; Q301-D305 PolarHBondContact O-N 2.9Å
302	S	79.4	Confident	73.6	Confident	63 Å²	63	102.3 Å²	102.3	44%	0.441	58%	0.575	S	S	.	*	H	α-helix	trans	-64.3	-34.3	180	59.9	0	0	0	0	113.5	K298 F299 T304 D305 N306	K298-S302 PolarHBondContact O-N 2.65Å; K298-S302 PolarHBondContact O-OG 3.24Å; F299-S302 WeakPolarHBondContact CA-OG 3.47Å; F299-S302 PolarHBondContact O-N 2.89Å; F299-S302 PolarHBondContact O-OG 3.06Å; S302-T304 VanDerWaalsContact C-N 3.29Å; S302-T304 PolarHBondContact O-N 3.02Å; S302-D305 PolarHBondContact O-N 2.92Å; S302-N306 WeakPolarHBondContact O-CB 3.37Å; S302-N306 PolarHBondContact O-N 3.43Å
303	G	70.3	Confident	71.5	Confident	40 Å²	40	103.4 Å²	103.4	41%	0.412	59%	0.585	S	S	.	*	H	α-helix	trans	-68.3	-27.9	174.7	0	0	0	0	0	113.7	F299 Q301 S307	F299-G303 PolarHBondContact O-N 3.04Å; Q301-G303 VanDerWaalsContact C-N 3.33Å; Q301-G303 PolarHBondContact O-N 3.48Å; G303-S307 PolarHBondContact O-N 3.47Å; G303-S307 PolarHBondContact O-OG 3.01Å
304	T	64.9	Low	69.1	Low	90 Å²	90	104 Å²	104	55%	0.552	60%	0.603	S	S	*	*	H	α-helix	trans	-76.2	-43.1	174.8	-58.4	0	0	0	0	111	L300 Q301 S302 N306 S307 N308	L300-T304 PolarHBondContact O-N 3.29Å; L300-T304 PolarHBondContact O-OG1 3.06Å; L300-T304 VanDerWaalsContact O-OG1 3.04Å; Q301-T304 WeakPolarHBondContact O-CB 3.39Å; Q301-T304 PolarHBondContact O-N 3.36Å; Q301-T304 VanDerWaalsContact O-N 3.09Å; S302-T304 VanDerWaalsContact C-N 3.29Å; S302-T304 PolarHBondContact O-N 3.02Å; T304-N306 VanDerWaalsContact C-N 3.32Å; T304-N306 PolarHBondContact O-N 2.83Å; T304-S307 PolarHBondContact O-N 3.28Å; T304-N308 PolarHBondContact O-N 3.39Å
305	D	58.9	Low	66.7	Low	101 Å²	101	102.6 Å²	102.6	54%	0.54	62%	0.616	S	S	.	*	H	α-helix	trans	-64.9	-34.9	176.3	-66.2	-38.1	0	0	0	112.1	Q301 S302 S307 N308 N309	Q301-D305 PolarHBondContact O-N 2.9Å; S302-D305 PolarHBondContact O-N 2.92Å; D305-S307 VanDerWaalsContact C-N 3.34Å; D305-N308 PolarHBondContact O-N 3.05Å; D305-N309 PolarHBondContact O-N 2.83Å
306	N	57.7	Low	64.2	Low	123 Å²	123	107.8 Å²	107.8	66%	0.658	64%	0.637	S	S	*	*	H	α-helix	trans	-72.8	-24.9	176.1	-143.9	69	0	0	0	113.2	S302 T304 S310	S302-N306 WeakPolarHBondContact O-CB 3.37Å; S302-N306 PolarHBondContact O-N 3.43Å; T304-N306 VanDerWaalsContact C-N 3.32Å; T304-N306 PolarHBondContact O-N 2.83Å; N306-S310 WeakPolarHBondContact O-CB 3.49Å; N306-S310 PolarHBondContact O-N 3.4Å; N306-S310 PolarHBondContact O-OG 3.44Å
307	S	55.2	Low	61.7	Low	80 Å²	80	106.4 Å²	106.4	56%	0.559	65%	0.646	S	S	*	*	H	α-helix	trans	-79.8	-29	172.3	-62.4	0	0	0	0	112.4	G303 T304 D305 S310	G303-S307 PolarHBondContact O-N 3.47Å; G303-S307 PolarHBondContact O-OG 3.01Å; T304-S307 PolarHBondContact O-N 3.28Å; D305-S307 VanDerWaalsContact C-N 3.34Å; S307-S310 WeakPolarHBondContact CA-OG 3.47Å; S307-S310 PolarHBondContact O-OG 3.36Å
308	N	52.8	Low	59.1	Low	121 Å²	121	104.3 Å²	104.3	65%	0.647	66%	0.658	S	S	*	*	H	α-helix	trans	-80.3	-24.2	174.2	-104.6	5.3	0	0	0	113.7	T304 D305 S311	T304-N308 PolarHBondContact O-N 3.39Å; D305-N308 PolarHBondContact O-N 3.05Å; N308-S311 PolarHBondContact O-OG 3.12Å; N308-S311 VanDerWaalsContact O-OG 3.12Å
309	N	53.1	Low	57	Low	139 Å²	139	107.5 Å²	107.5	74%	0.743	67%	0.674	S	S	*	*	H	α-helix	trans	-87.7	-14.3	174.5	-91.3	17.6	0	0	0	114.1	D305	D305-N309 PolarHBondContact O-N 2.83Å
310	S	50.8	Low	54.5	Low	85 Å²	85	110 Å²	110	59%	0.594	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-90.1	-6	178.5	48	0	0	0	0	114.1	N306 S307 G312	N306-S310 WeakPolarHBondContact O-CB 3.49Å; N306-S310 PolarHBondContact O-N 3.4Å; N306-S310 PolarHBondContact O-OG 3.44Å; S307-S310 WeakPolarHBondContact CA-OG 3.47Å; S307-S310 PolarHBondContact O-OG 3.36Å; S310-G312 PolarHBondContact O-N 3.03Å
311	S	48.1	Very low	52.2	Low	100 Å²	100	116.2 Å²	116.2	70%	0.699	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-83.7	8.4	170.4	45.1	0	0	0	0	113.8	N308	N308-S311 PolarHBondContact O-OG 3.12Å; N308-S311 VanDerWaalsContact O-OG 3.12Å
312	G	48.8	Very low	50.9	Low	71 Å²	71	115.3 Å²	115.3	73%	0.732	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-118.4	0	-175.1	0	0	0	0	0	117.5	S310	S310-G312 PolarHBondContact O-N 3.03Å
313	A	48	Very low	49	Very low	91 Å²	91	122.1 Å²	122.1	75%	0.752	73%	0.73	S	S	*	*			trans	-152.5	90.7	-176.2	0	0	0	0	0	114
314	A	39.9	Very low	47.8	Very low	109 Å²	109	126.2 Å²	126.2	90%	0.901	75%	0.747	S	S	*	*			trans	-172	87.1	146.1	0	0	0	0	0	111.8
315	A	42	Very low	47.2	Very low	99 Å²	99	127.5 Å²	127.5	82%	0.818	76%	0.757	S	S	*	*			trans	-140.6	131.2	152.7	0	0	0	0	0	104.2
316	E	39.5	Very low	47.2	Very low	199 Å²	199	128 Å²	128	93%	0.93	77%	0.766	S	S	*	*			cis	-142.7	169.7	7.2	-60.9	-178.4	122.4	0	0	105.1
317	G	39	Very low	47.1	Very low	68 Å²	68	128.1 Å²	128.1	70%	0.701	77%	0.773	S	S	*	*			cis	175.9	170.3	10.3	0	0	0	0	0	108
318	S	37.7	Very low	46.8	Very low	127 Å²	127	133 Å²	133	89%	0.888	79%	0.787	S	S	*	*			trans	158.8	124.6	147	-81.7	0	0	0	0	109.5
319	E	45	Very low	47	Very low	184 Å²	184	133.3 Å²	133.3	86%	0.86	80%	0.795	S	S	*	*			trans	-51.5	141.9	-177.6	-72.3	154.7	80.9	0	0	115.7
320	Q	38.6	Very low	46.9	Very low	200 Å²	200	131.1 Å²	131.1	94%	0.935	80%	0.797	S	S	*	*				-172.7	128.2	119.9	-96.9	162.1	33.1	0	0	111
321	R	39.9	Very low	46.8	Very low	237 Å²	237	134.8 Å²	134.8	89%	0.894	81%	0.809	S	S	*	*			trans	-111.8	167.7	176.6	179.6	-178.2	-173.7	-133.8	4	108
322	P	58.9	Low	46.7	Very low	94 Å²	94	139.1 Å²	139.1	61%	0.61	82%	0.819	S	S	*	*			cis	-125.4	174.4	-35.9	32.8	-16.7	0	0	0	112.6
323	K	39	Very low	46.7	Very low	207 Å²	207	143 Å²	143	90%	0.9	86%	0.859	S	S	*	*			trans	-165.5	110.4	132.6	-115	172.4	-178.1	178	0	112.8
324	T	46.6	Very low	46.6	Very low	126 Å²	126	145.7 Å²	145.7	77%	0.773	87%	0.865	S	S	*	*			trans	-74.1	150.8	153.2	-3.9	0	0	0	0	108.7
325	P	51.5	Low	47	Very low	116 Å²	116	147.6 Å²	147.6	75%	0.753	86%	0.863	S	S	*	*				-150.6	-163.7	87.9	42.5	-22	0	0	0	112.9
326	P	60.2	Low	47.3	Very low	113 Å²	113	150.3 Å²	150.3	73%	0.734	87%	0.865	S	S	*	*				-118.3	-170.2	-92.2	41.4	-22	0	0	0	111.6
327	P	55.2	Low	47.7	Very low	124 Å²	124	147.4 Å²	147.4	81%	0.805	86%	0.862	S	S	*	*			trans	-86.7	170	-161.9	36.4	-32.3	0	0	0	114.9
328	Q	48.5	Very low	48.3	Very low	184 Å²	184	152.4 Å²	152.4	86%	0.86	87%	0.872	S	S	*	*			trans	-33	163.7	-178.4	-60.1	-179.6	-49.6	0	0	117.9
329	P	56.4	Low	49	Very low	126 Å²	126	154.1 Å²	154.1	82%	0.818	87%	0.87	S	S	*	*				-136.6	160.2	109.7	36.1	-23.6	0	0	0	114.7
330	A	51	Low	49.3	Very low	93 Å²	93	151.9 Å²	151.9	77%	0.769	87%	0.871	S	S	*	*			trans	-57.1	153.6	163.1	0	0	0	0	0	112
331	D	48.5	Very low	50.1	Low	162 Å²	162	148.2 Å²	148.2	87%	0.866	87%	0.866	S	S	*	*			trans	-146.9	138	145.3	-146.1	-18	0	0	0	110.7
332	E	46.8	Very low	51	Low	191 Å²	191	140.8 Å²	140.8	89%	0.893	86%	0.864	S	S	*	*			trans	-76.5	154.8	171.7	-74.3	174.1	93.9	0	0	109.8
333	G	48.7	Very low	50.2	Low	154 Å²	154	145.1 Å²	145.1	100%	1.588	89%	0.887	S	S	*	*			trans	159.9	0	171	0	0	0	0	0	113.9

Retrieved 333 of 333 residues in 631.6 ms (Link to these results)

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