A0A077ZC51_TRITR Loading...

Transmembrane protein 201

AlphaFold DB , UniProt , Accession A0A077ZC51, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 552 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	42.1	Very low	46.7	Very low	233 Å²	233	139.9 Å²	139.9	100%	1.148	75%	0.75	S	S	*	*				0	105.2	0	-80.5	177.3	172.4	0	0	106
2	N	38.3	Very low	46.8	Very low	158 Å²	158	137.3 Å²	137.3	85%	0.845	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-94.1	117.3	-163.3	-59.8	13.9	0	0	0	108.4	V4	N2-V4 PolarHBondContact O-N 3.15Å
3	I	45.3	Very low	46.8	Very low	165 Å²	165	135.5 Å²	135.5	85%	0.846	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-63.5	122.9	166.5	-65.3	170.3	0	0	0	105.9	D5	I3-D5 PolarHBondContact O-N 2.75Å
4	V	48.4	Very low	47.2	Very low	117 Å²	117	135.4 Å²	135.4	71%	0.709	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-69.2	118.8	174.6	178.2	0	0	0	0	107.3	N2 L6	N2-V4 PolarHBondContact O-N 3.15Å; V4-L6 HydrophobicContact CB-CD1 4.4Å; V4-L6 HydrophobicContact CG1-CD1 4.18Å; V4-L6 WeakPolarHBondContact O-CD1 3.49Å; V4-L6 PolarHBondContact O-N 3.37Å
5	D	43.5	Very low	47.4	Very low	99 Å²	99	137.1 Å²	137.1	53%	0.529	73%	0.734	S	S	.	*			trans	-80.6	99.7	179.1	-166.6	-19.3	0	0	0	109.9	I3 T7 T8	I3-D5 PolarHBondContact O-N 2.75Å; D5-T7 VanDerWaalsContact CG-OG1 3.24Å; D5-T7 PolarHBondContact O-N 3.27Å; D5-T7 VanDerWaalsContact OD1-CB 3.29Å; D5-T7 WeakPolarHBondContact OD1-CB 3.37Å; D5-T7 WeakPolarHBondContact OD1-CG2 3.47Å; D5-T7 PolarHBondContact OD1-N 3.11Å; D5-T7 PolarHBondContact OD1-OG1 2.78Å; D5-T7 PolarHBondContact OD2-OG1 3.3Å; D5-T8 PolarHBondContact O-OG1 2.93Å
6	L	49	Very low	48.1	Very low	136 Å²	136	133.1 Å²	133.1	71%	0.712	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-69.9	-4.3	-179.2	-87.9	80.9	0	0	0	113.6	V4 T8	V4-L6 HydrophobicContact CB-CD1 4.4Å; V4-L6 HydrophobicContact CG1-CD1 4.18Å; V4-L6 WeakPolarHBondContact O-CD1 3.49Å; V4-L6 PolarHBondContact O-N 3.37Å; L6-T8 VanDerWaalsContact C-N 3.25Å; L6-T8 PolarHBondContact O-N 3.5Å
7	T	51.9	Low	49.2	Very low	119 Å²	119	128.8 Å²	128.8	73%	0.73	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-68.8	-18.8	-177.5	60.6	0	0	0	0	114.4	D5	D5-T7 VanDerWaalsContact CG-OG1 3.24Å; D5-T7 PolarHBondContact O-N 3.27Å; D5-T7 VanDerWaalsContact OD1-CB 3.29Å; D5-T7 WeakPolarHBondContact OD1-CB 3.37Å; D5-T7 WeakPolarHBondContact OD1-CG2 3.47Å; D5-T7 PolarHBondContact OD1-N 3.11Å; D5-T7 PolarHBondContact OD1-OG1 2.78Å; D5-T7 PolarHBondContact OD2-OG1 3.3Å
8	T	53.1	Low	49.7	Very low	109 Å²	109	128 Å²	128	67%	0.669	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-92.5	6.7	-174.9	41.3	0	0	0	0	114.9	D5 L6 T10	D5-T8 PolarHBondContact O-OG1 2.93Å; L6-T8 VanDerWaalsContact C-N 3.25Å; L6-T8 PolarHBondContact O-N 3.5Å; T8-T10 VanDerWaalsContact C-N 3.35Å; T8-T10 PolarHBondContact O-N 3.16Å
9	F	45.7	Very low	50.6	Low	182 Å²	182	126.9 Å²	126.9	80%	0.798	69%	0.685	S	S	*	*			trans	-78.8	76.7	-178.5	-124.6	-80.3	0	0	0	112.8	I11	F9-I11 PolarHBondContact O-N 3.39Å
10	T	46.1	Very low	51.4	Low	130 Å²	130	124.1 Å²	124.1	80%	0.798	67%	0.669	S	S	*	*			trans	-71.4	114.8	174.1	45.1	0	0	0	0	111.2	T8	T8-T10 VanDerWaalsContact C-N 3.35Å; T8-T10 PolarHBondContact O-N 3.16Å
11	I	50.3	Low	51.7	Low	91 Å²	91	121.6 Å²	121.6	47%	0.467	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-75.4	131	172.3	-62	166.6	0	0	0	108.1	F9 K13 L333	F9-I11 PolarHBondContact O-N 3.39Å; I11-K13 PolarHBondContact O-N 2.92Å; I11-L333 HydrophobicContact CB-CD2 4.49Å; I11-L333 HydrophobicContact CD1-CD2 4.36Å; I11-L333 HydrophobicContact CG2-CD2 3.77Å
12	P	48.2	Very low	53	Low	109 Å²	109	114.6 Å²	114.6	71%	0.708	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-63.9	118.7	175.8	25.5	-33.6	0	0	0	110.2	L14	P12-L14 PolarHBondContact O-N 3.46Å
13	K	46.6	Very low	54.6	Low	114 Å²	114	115 Å²	115	50%	0.496	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-66.6	123.8	179.4	-62.2	-162.7	174.3	-167.6	0	110	I11 L333 L334 T335	I11-K13 PolarHBondContact O-N 2.92Å; K13-L333 WeakPolarHBondContact CB-O 3.21Å; K13-L333 WeakPolarHBondContact CG-O 3.19Å; K13-L334 PolarHBondContact NZ-O 2.92Å; K13-T335 HydrophobicContact CD-CG2 3.93Å
14	L	52.4	Low	56	Low	133 Å²	133	111.1 Å²	111.1	70%	0.696	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-90.6	126.2	177.4	-77.1	166.4	0	0	0	109.4	P12 L16 Y21	P12-L14 PolarHBondContact O-N 3.46Å; L14-L16 HydrophobicContact CB-CD1 3.85Å; L14-L16 PolarHBondContact O-N 2.67Å; L14-Y21 PolarHBondContact O-OH 2.91Å
15	N	50.8	Low	57.1	Low	162 Å²	162	107.3 Å²	107.3	87%	0.866	58%	0.575	S	S	*	*			trans	-98.8	87.1	-174.8	-159.4	11.6	0	0	0	110.3
16	L	58.4	Low	58.7	Low	72 Å²	72	106.7 Å²	106.7	38%	0.377	57%	0.571	S	S	.	*			trans	-104.8	165.9	169.5	-60.6	89	0	0	0	110.7	L14 D20 Y21	L14-L16 HydrophobicContact CB-CD1 3.85Å; L14-L16 PolarHBondContact O-N 2.67Å; L16-D20 HydrophobicContact CB-CB 4.08Å; L16-D20 HydrophobicContact CD2-CB 4.14Å; L16-Y21 HydrophobicContact CB-CE1 4.33Å; L16-Y21 HydrophobicContact CB-CE2 3.98Å; L16-Y21 HydrophobicContact CD1-CE1 4.21Å; L16-Y21 PolarHBondContact N-OH 3.45Å; L16-Y21 WeakPolarHBondContact O-CE2 3.23Å
17	S	66.2	Low	60.1	Low	61 Å²	61	104 Å²	104	43%	0.427	56%	0.56	S	S	.	*			trans	-71.1	153.7	176.6	-171.6	0	0	0	0	111.7	D19 D20 Y21	S17-D19 PolarHBondContact O-N 3Å; S17-D20 VanDerWaalsContact CB-OD2 3.29Å; S17-D20 WeakPolarHBondContact CB-OD2 3.44Å; S17-D20 PolarHBondContact N-OD2 3.32Å; S17-D20 WeakPolarHBondContact O-CB 3.44Å; S17-D20 PolarHBondContact O-N 3.42Å; S17-Y21 WeakPolarHBondContact O-CD2 3.32Å; S17-Y21 WeakPolarHBondContact O-CE2 3.48Å
18	N	58.9	Low	61.4	Low	114 Å²	114	104 Å²	104	61%	0.61	56%	0.555	S	S	*	*	H	α-helix	trans	-55.1	-36.6	174.4	-81.2	-30.6	0	0	0	112.4	D20	N18-D20 VanDerWaalsContact C-N 3.34Å; N18-D20 PolarHBondContact O-N 3.04Å
19	D	65.7	Low	62.5	Low	108 Å²	108	103 Å²	103	58%	0.578	55%	0.545	S	S	*	.	H	α-helix	trans	-61.7	-39.8	176.4	-64.3	-51.4	0	0	0	112.3	S17 Y21 V22 W23	S17-D19 PolarHBondContact O-N 3Å; D19-Y21 VanDerWaalsContact C-N 3.33Å; D19-Y21 PolarHBondContact O-N 3.25Å; D19-V22 PolarHBondContact O-N 2.9Å; D19-W23 PolarHBondContact O-N 3.47Å
20	D	66.6	Low	64	Low	70 Å²	70	96.5 Å²	96.5	37%	0.374	52%	0.522	S	S	.	.	H	α-helix	trans	-61.6	-41.2	-175.6	-63.5	-46.3	0	0	0	111.3	L16 S17 N18 W23 I24	L16-D20 HydrophobicContact CB-CB 4.08Å; L16-D20 HydrophobicContact CD2-CB 4.14Å; S17-D20 VanDerWaalsContact CB-OD2 3.29Å; S17-D20 WeakPolarHBondContact CB-OD2 3.44Å; S17-D20 PolarHBondContact N-OD2 3.32Å; S17-D20 WeakPolarHBondContact O-CB 3.44Å; S17-D20 PolarHBondContact O-N 3.42Å; N18-D20 VanDerWaalsContact C-N 3.34Å; N18-D20 PolarHBondContact O-N 3.04Å; D20-W23 PolarHBondContact O-N 3.47Å; D20-I24 WeakPolarHBondContact O-CB 3.42Å; D20-I24 WeakPolarHBondContact O-CD1 3.38Å; D20-I24 WeakPolarHBondContact O-CG1 3.47Å; D20-I24 PolarHBondContact O-N 3.49Å
21	Y	59.3	Low	65.6	Low	72 Å²	72	94.3 Å²	94.3	28%	0.282	51%	0.508	S	S	.	.	H	α-helix	trans	-67.2	-39.6	178.5	-58.7	-72.6	0	0	0	112.4	L14 L16 S17 D19 I24 G25 L334	L14-Y21 PolarHBondContact O-OH 2.91Å; L16-Y21 HydrophobicContact CB-CE1 4.33Å; L16-Y21 HydrophobicContact CB-CE2 3.98Å; L16-Y21 HydrophobicContact CD1-CE1 4.21Å; L16-Y21 PolarHBondContact N-OH 3.45Å; L16-Y21 WeakPolarHBondContact O-CE2 3.23Å; S17-Y21 WeakPolarHBondContact O-CD2 3.32Å; S17-Y21 WeakPolarHBondContact O-CE2 3.48Å; D19-Y21 VanDerWaalsContact C-N 3.33Å; D19-Y21 PolarHBondContact O-N 3.25Å; Y21-I24 PolarHBondContact O-N 3.09Å; Y21-G25 PolarHBondContact O-N 2.9Å; Y21-L334 HydrophobicContact CE1-CD2 3.92Å; Y21-L334 HydrophobicContact CE2-CD1 4.3Å; Y21-L334 HydrophobicContact CE2-CD2 4.1Å; Y21-L334 VanDerWaalsContact CZ-CD2 3.5Å; Y21-L334 VanDerWaalsContact OH-CD2 3.23Å; Y21-L334 WeakPolarHBondContact OH-CD2 3.39Å
22	V	67.7	Low	66.9	Low	86 Å²	86	94.1 Å²	94.1	52%	0.521	50%	0.504	S	S	.	.	H	α-helix	trans	-64.3	-45.1	175.8	176.9	0	0	0	0	109.8	D19 G25 I26	D19-V22 PolarHBondContact O-N 2.9Å; V22-G25 PolarHBondContact O-N 3.22Å; V22-I26 HydrophobicContact CG1-CD1 3.75Å; V22-I26 WeakPolarHBondContact O-CB 3.47Å; V22-I26 VanDerWaalsContact O-CG1 3.26Å; V22-I26 WeakPolarHBondContact O-CG1 3.48Å; V22-I26 PolarHBondContact O-N 2.88Å
23	W	73.2	Confident	68.4	Low	165 Å²	165	93.3 Å²	93.3	63%	0.625	49%	0.493	S	S	*	.	H	α-helix	trans	-63.4	-45.1	175.3	-75.3	116.1	0	0	0	112.9	D19 D20 G25 I26 V27	D19-W23 PolarHBondContact O-N 3.47Å; D20-W23 PolarHBondContact O-N 3.47Å; W23-G25 VanDerWaalsContact C-N 3.34Å; W23-G25 PolarHBondContact O-N 2.92Å; W23-I26 PolarHBondContact O-N 3.29Å; W23-V27 WeakPolarHBondContact O-CB 3.45Å; W23-V27 VanDerWaalsContact O-CG2 3.25Å; W23-V27 WeakPolarHBondContact O-CG2 3.37Å; W23-V27 PolarHBondContact O-N 3.36Å
24	I	73.8	Confident	70	Confident	85 Å²	85	93.6 Å²	93.6	44%	0.436	50%	0.5	S	S	.	.	H	α-helix	trans	-61.4	-43.3	176.3	-70.4	163.4	0	0	0	110.7	D20 Y21 V27 L28	D20-I24 WeakPolarHBondContact O-CB 3.42Å; D20-I24 WeakPolarHBondContact O-CD1 3.38Å; D20-I24 WeakPolarHBondContact O-CG1 3.47Å; D20-I24 PolarHBondContact O-N 3.49Å; Y21-I24 PolarHBondContact O-N 3.09Å; I24-V27 PolarHBondContact O-N 3Å; I24-L28 HydrophobicContact CG2-CD1 3.94Å; I24-L28 HydrophobicContact CG2-CG 4.41Å; I24-L28 WeakPolarHBondContact O-CB 3.5Å; I24-L28 WeakPolarHBondContact O-CG 3.32Å; I24-L28 PolarHBondContact O-N 3.25Å
25	G	71.9	Confident	71.1	Confident	37 Å²	37	95.6 Å²	95.6	38%	0.381	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-47.3	175.3	0	0	0	0	0	112.6	Y21 V22 W23 L28 L29	Y21-G25 PolarHBondContact O-N 2.9Å; V22-G25 PolarHBondContact O-N 3.22Å; W23-G25 VanDerWaalsContact C-N 3.34Å; W23-G25 PolarHBondContact O-N 2.92Å; G25-L28 PolarHBondContact O-N 3.16Å; G25-L29 VanDerWaalsContact O-CB 3.23Å; G25-L29 WeakPolarHBondContact O-CB 3.27Å; G25-L29 PolarHBondContact O-N 3.42Å
26	I	76.5	Confident	72.2	Confident	85 Å²	85	89.6 Å²	89.6	44%	0.436	47%	0.469	S	S	.	.	H	α-helix	trans	-64.6	-39	176.4	-70.4	169.7	0	0	0	111.5	V22 W23 S30	V22-I26 HydrophobicContact CG1-CD1 3.75Å; V22-I26 WeakPolarHBondContact O-CB 3.47Å; V22-I26 VanDerWaalsContact O-CG1 3.26Å; V22-I26 WeakPolarHBondContact O-CG1 3.48Å; V22-I26 PolarHBondContact O-N 2.88Å; W23-I26 PolarHBondContact O-N 3.29Å; I26-S30 WeakPolarHBondContact O-CB 3.25Å; I26-S30 PolarHBondContact O-N 3.09Å; I26-S30 PolarHBondContact O-OG 3.26Å
27	V	78.6	Confident	73	Confident	80 Å²	80	90.5 Å²	90.5	49%	0.485	48%	0.477	S	S	.	.	H	α-helix	trans	-66.4	-46.4	176.4	167.5	0	0	0	0	110.9	W23 I24 S30 V31	W23-V27 WeakPolarHBondContact O-CB 3.45Å; W23-V27 VanDerWaalsContact O-CG2 3.25Å; W23-V27 WeakPolarHBondContact O-CG2 3.37Å; W23-V27 PolarHBondContact O-N 3.36Å; I24-V27 PolarHBondContact O-N 3Å; V27-S30 WeakPolarHBondContact CA-OG 3.36Å; V27-S30 PolarHBondContact O-N 2.87Å; V27-S30 PolarHBondContact O-OG 2.76Å; V27-S30 VanDerWaalsContact O-OG 3.06Å; V27-V31 HydrophobicContact CG1-CG2 4.48Å; V27-V31 VanDerWaalsContact O-CB 3.32Å; V27-V31 WeakPolarHBondContact O-CB 3.46Å; V27-V31 VanDerWaalsContact O-CG2 3.23Å; V27-V31 WeakPolarHBondContact O-CG2 3.28Å; V27-V31 PolarHBondContact O-N 3.17Å
28	L	78.6	Confident	73.2	Confident	118 Å²	118	93.5 Å²	93.5	62%	0.618	48%	0.479	S	S	*	.	H	α-helix	trans	-65.2	-42	177.2	-69.9	174.4	0	0	0	112	I24 G25 F32	I24-L28 HydrophobicContact CG2-CD1 3.94Å; I24-L28 HydrophobicContact CG2-CG 4.41Å; I24-L28 WeakPolarHBondContact O-CB 3.5Å; I24-L28 WeakPolarHBondContact O-CG 3.32Å; I24-L28 PolarHBondContact O-N 3.25Å; G25-L28 PolarHBondContact O-N 3.16Å; L28-F32 VanDerWaalsContact O-CB 3.31Å; L28-F32 WeakPolarHBondContact O-CB 3.2Å; L28-F32 PolarHBondContact O-N 3.38Å
29	L	77.6	Confident	73.7	Confident	89 Å²	89	90.4 Å²	90.4	47%	0.466	46%	0.462	S	S	.	.	H	α-helix	trans	-65.4	-45.9	176.5	-179.8	61.1	0	0	0	111.6	G25 F32 L33	G25-L29 VanDerWaalsContact O-CB 3.23Å; G25-L29 WeakPolarHBondContact O-CB 3.27Å; G25-L29 PolarHBondContact O-N 3.42Å; L29-F32 PolarHBondContact O-N 3.28Å; L29-L33 HydrophobicContact CD1-CD1 4.11Å; L29-L33 HydrophobicContact CD1-CG 4.17Å; L29-L33 HydrophobicContact CG-CD1 3.96Å; L29-L33 HydrophobicContact CG-CG 4.42Å; L29-L33 WeakPolarHBondContact O-CB 3.24Å; L29-L33 VanDerWaalsContact O-CG 3.28Å; L29-L33 WeakPolarHBondContact O-CG 3.4Å; L29-L33 PolarHBondContact O-N 3.48Å
30	S	77.4	Confident	73.8	Confident	46 Å²	46	92.1 Å²	92.1	32%	0.322	46%	0.461	S	S	.	.	H	α-helix	trans	-66.4	-40.8	178.2	60.2	0	0	0	0	111.9	I26 V27 F32 L33 L34	I26-S30 WeakPolarHBondContact O-CB 3.25Å; I26-S30 PolarHBondContact O-N 3.09Å; I26-S30 PolarHBondContact O-OG 3.26Å; V27-S30 WeakPolarHBondContact CA-OG 3.36Å; V27-S30 PolarHBondContact O-N 2.87Å; V27-S30 PolarHBondContact O-OG 2.76Å; V27-S30 VanDerWaalsContact O-OG 3.06Å; S30-F32 VanDerWaalsContact C-N 3.34Å; S30-F32 PolarHBondContact O-N 3.29Å; S30-L33 PolarHBondContact O-N 3.1Å; S30-L34 VanDerWaalsContact O-CB 3.23Å; S30-L34 WeakPolarHBondContact O-CB 3.46Å; S30-L34 WeakPolarHBondContact O-CG 3.45Å; S30-L34 PolarHBondContact O-N 3.37Å
31	V	78.5	Confident	74	Confident	83 Å²	83	91.6 Å²	91.6	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-61.5	-41.3	171.6	168.8	0	0	0	0	111.3	V27 R35	V27-V31 HydrophobicContact CG1-CG2 4.48Å; V27-V31 VanDerWaalsContact O-CB 3.32Å; V27-V31 WeakPolarHBondContact O-CB 3.46Å; V27-V31 VanDerWaalsContact O-CG2 3.23Å; V27-V31 WeakPolarHBondContact O-CG2 3.28Å; V27-V31 PolarHBondContact O-N 3.17Å; V31-R35 WeakPolarHBondContact O-CB 3.5Å; V31-R35 PolarHBondContact O-N 3.5Å
32	F	77.9	Confident	75	Confident	88 Å²	88	91.9 Å²	91.9	39%	0.386	47%	0.471	S	S	.	.	H	α-helix	trans	-64.5	-44.5	175.2	176.7	-93.2	0	0	0	112.3	L28 L29 S30 S36 V319	L28-F32 VanDerWaalsContact O-CB 3.31Å; L28-F32 WeakPolarHBondContact O-CB 3.2Å; L28-F32 PolarHBondContact O-N 3.38Å; L29-F32 PolarHBondContact O-N 3.28Å; S30-F32 VanDerWaalsContact C-N 3.34Å; S30-F32 PolarHBondContact O-N 3.29Å; F32-S36 VanDerWaalsContact O-CB 3.24Å; F32-S36 WeakPolarHBondContact O-CB 2.97Å; F32-S36 PolarHBondContact O-N 2.79Å; F32-S36 PolarHBondContact O-OG 3.49Å; F32-V319 HydrophobicContact CE1-CG2 3.57Å; F32-V319 HydrophobicContact CZ-CG2 3.81Å
33	L	79.4	Confident	75.6	Confident	91 Å²	91	92 Å²	92	48%	0.476	46%	0.462	S	S	.	.	H	α-helix	trans	-66.7	-48.4	178.3	-72.4	173.1	0	0	0	111.4	L29 S30 R35 S36 V37	L29-L33 HydrophobicContact CD1-CD1 4.11Å; L29-L33 HydrophobicContact CD1-CG 4.17Å; L29-L33 HydrophobicContact CG-CD1 3.96Å; L29-L33 HydrophobicContact CG-CG 4.42Å; L29-L33 WeakPolarHBondContact O-CB 3.24Å; L29-L33 VanDerWaalsContact O-CG 3.28Å; L29-L33 WeakPolarHBondContact O-CG 3.4Å; L29-L33 PolarHBondContact O-N 3.48Å; S30-L33 PolarHBondContact O-N 3.1Å; L33-R35 PolarHBondContact O-N 3.34Å; L33-S36 PolarHBondContact O-N 3Å; L33-S36 VanDerWaalsContact O-N 3.13Å; L33-V37 WeakPolarHBondContact O-CB 3.43Å; L33-V37 WeakPolarHBondContact O-CG2 3.49Å; L33-V37 PolarHBondContact O-N 3.46Å
34	L	80.2	Confident	76.5	Confident	120 Å²	120	90.4 Å²	90.4	63%	0.628	46%	0.46	S	S	*	.	H	α-helix	trans	-57.1	-48.3	175.1	-73.6	168.2	0	0	0	111	S30 S36 V37 W38	S30-L34 VanDerWaalsContact O-CB 3.23Å; S30-L34 WeakPolarHBondContact O-CB 3.46Å; S30-L34 WeakPolarHBondContact O-CG 3.45Å; S30-L34 PolarHBondContact O-N 3.37Å; L34-S36 VanDerWaalsContact C-N 3.31Å; L34-S36 PolarHBondContact O-N 2.99Å; L34-V37 PolarHBondContact O-N 2.73Å; L34-W38 WeakPolarHBondContact O-CB 3.35Å; L34-W38 PolarHBondContact O-N 2.85Å
35	R	76.1	Confident	77.3	Confident	175 Å²	175	87.1 Å²	87.1	66%	0.66	44%	0.443	S	S	*	.	H	α-helix	trans	-61.6	-38.6	176	-173.7	179.9	-177.5	96.7	-8.4	111.9	V31 L33 L39	V31-R35 WeakPolarHBondContact O-CB 3.5Å; V31-R35 PolarHBondContact O-N 3.5Å; L33-R35 PolarHBondContact O-N 3.34Å; R35-L39 HydrophobicContact CG-CD1 4.09Å; R35-L39 VanDerWaalsContact O-CB 3.29Å; R35-L39 WeakPolarHBondContact O-CB 3.47Å; R35-L39 WeakPolarHBondContact O-CD1 3.26Å; R35-L39 WeakPolarHBondContact O-CG 3.37Å; R35-L39 PolarHBondContact O-N 3.05Å; R35-L39 VanDerWaalsContact O-N 3.1Å
36	S	74.5	Confident	78.3	Confident	37 Å²	37	90.1 Å²	90.1	26%	0.259	45%	0.448	S	S	.	.	H	α-helix	trans	-69	-49.4	178.5	-63.5	0	0	0	0	111.7	F32 L33 L34 L39 W40	F32-S36 VanDerWaalsContact O-CB 3.24Å; F32-S36 WeakPolarHBondContact O-CB 2.97Å; F32-S36 PolarHBondContact O-N 2.79Å; F32-S36 PolarHBondContact O-OG 3.49Å; L33-S36 PolarHBondContact O-N 3Å; L33-S36 VanDerWaalsContact O-N 3.13Å; L34-S36 VanDerWaalsContact C-N 3.31Å; L34-S36 PolarHBondContact O-N 2.99Å; S36-L39 PolarHBondContact O-N 3.12Å; S36-W40 PolarHBondContact O-N 3.23Å
37	V	75.3	Confident	79.2	Confident	91 Å²	91	86.1 Å²	86.1	55%	0.552	43%	0.427	S	S	*	.	H	α-helix	trans	-58.1	-52.8	175.2	170.8	0	0	0	0	110.1	L33 L34 L39 W40 T41	L33-V37 WeakPolarHBondContact O-CB 3.43Å; L33-V37 WeakPolarHBondContact O-CG2 3.49Å; L33-V37 PolarHBondContact O-N 3.46Å; L34-V37 PolarHBondContact O-N 2.73Å; V37-L39 VanDerWaalsContact C-N 3.31Å; V37-L39 PolarHBondContact O-N 2.89Å; V37-W40 CarbonylContact O-C 3.58Å; V37-W40 PolarHBondContact O-N 3.08Å; V37-T41 HydrophobicContact CG1-CG2 3.86Å; V37-T41 WeakPolarHBondContact O-CG2 3.42Å; V37-T41 PolarHBondContact O-N 2.95Å; V37-T41 PolarHBondContact O-OG1 2.89Å
38	W	70.6	Confident	79.8	Confident	123 Å²	123	90.8 Å²	90.8	47%	0.466	44%	0.436	S	S	.	.	H	α-helix	trans	-62.3	-33.7	-176.5	-168.2	79.2	0	0	0	113.5	L34 W40 T41 W43 W58	L34-W38 WeakPolarHBondContact O-CB 3.35Å; L34-W38 PolarHBondContact O-N 2.85Å; W38-W40 VanDerWaalsContact C-N 3.32Å; W38-W40 PolarHBondContact O-N 3.44Å; W38-T41 WeakPolarHBondContact CA-OG1 3.43Å; W38-T41 PolarHBondContact O-OG1 3.32Å; W38-W43 AromaticContact NE1-CZ3 3.89Å; W38-W58 HydrophobicContact CH2-CD2 4.21Å; W38-W58 AromaticContact CH2-CE2 3.36Å; W38-W58 AromaticContact CH2-CH2 3.94Å; W38-W58 HydrophobicContact CH2-CH2 3.94Å; W38-W58 AromaticContact CH2-CZ2 3.22Å; W38-W58 HydrophobicContact CH2-CZ2 3.22Å; W38-W58 AromaticContact CH2-NE1 3.56Å; W38-W58 HydrophobicContact CZ2-CD2 4.36Å; W38-W58 AromaticContact CZ2-CE2 3.88Å; W38-W58 AromaticContact CZ2-CH2 3.9Å; W38-W58 HydrophobicContact CZ2-CH2 3.9Å; W38-W58 AromaticContact CZ2-CZ2 3.66Å; W38-W58 HydrophobicContact CZ2-CZ2 3.66Å; W38-W58 HydrophobicContact CZ2-CZ3 4.34Å; W38-W58 HydrophobicContact CZ3-CD2 4.44Å; W38-W58 AromaticContact CZ3-CE2 3.68Å; W38-W58 HydrophobicContact CZ3-CZ2 4.01Å; W38-W58 AromaticContact CZ3-NE1 3.36Å
39	L	69	Low	80.5	Confident	49 Å²	49	87.4 Å²	87.4	26%	0.257	42%	0.417	S	S	.	.	H	α-helix	trans	-71.7	-22.4	173.4	-75.7	174.2	0	0	0	113.9	R35 S36 V37	R35-L39 HydrophobicContact CG-CD1 4.09Å; R35-L39 VanDerWaalsContact O-CB 3.29Å; R35-L39 WeakPolarHBondContact O-CB 3.47Å; R35-L39 WeakPolarHBondContact O-CD1 3.26Å; R35-L39 WeakPolarHBondContact O-CG 3.37Å; R35-L39 PolarHBondContact O-N 3.05Å; R35-L39 VanDerWaalsContact O-N 3.1Å; S36-L39 PolarHBondContact O-N 3.12Å; V37-L39 VanDerWaalsContact C-N 3.31Å; V37-L39 PolarHBondContact O-N 2.89Å
40	W	66.6	Low	81.2	Confident	145 Å²	145	85.4 Å²	85.4	55%	0.549	41%	0.409	S	S	.	.	H	α-helix	trans	-99.4	-28	179.7	-79.5	68	0	0	0	113.4	S36 V37 W38	S36-W40 PolarHBondContact O-N 3.23Å; V37-W40 CarbonylContact O-C 3.58Å; V37-W40 PolarHBondContact O-N 3.08Å; W38-W40 VanDerWaalsContact C-N 3.32Å; W38-W40 PolarHBondContact O-N 3.44Å
41	T	72.5	Confident	81.9	Confident	58 Å²	58	89.3 Å²	89.3	36%	0.356	42%	0.422	S	S	.	.	S	Bend	trans	-59.2	135	178.3	42.8	0	0	0	0	111.8	V37 W38 W43	V37-T41 HydrophobicContact CG1-CG2 3.86Å; V37-T41 WeakPolarHBondContact O-CG2 3.42Å; V37-T41 PolarHBondContact O-N 2.95Å; V37-T41 PolarHBondContact O-OG1 2.89Å; W38-T41 WeakPolarHBondContact CA-OG1 3.43Å; W38-T41 PolarHBondContact O-OG1 3.32Å; T41-W43 PolarHBondContact O-N 2.99Å
42	P	78.8	Confident	82.5	Confident	79 Å²	79	86 Å²	86	51%	0.513	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	117.6	177.2	29.8	-33	0	0	0	110.8	R55 V56	P42-R55 HydrophobicContact CB-CB 4.16Å; P42-V56 CarbonylContact C-O 3.59Å; P42-V56 WeakPolarHBondContact CA-O 3.38Å
43	W	81.7	Confident	83.2	Confident	87 Å²	87	87.1 Å²	87.1	33%	0.33	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	140.9	176.9	-163.4	-92.2	0	0	0	111.4	W38 T41 R55 V56 W58	W38-W43 AromaticContact NE1-CZ3 3.89Å; T41-W43 PolarHBondContact O-N 2.99Å; W43-R55 WeakPolarHBondContact O-CA 3.47Å; W43-V56 PolarHBondContact N-O 3.08Å; W43-V56 PolarHBondContact O-N 3.22Å; W43-W58 HydrophobicContact CB-CE3 4.27Å; W43-W58 AromaticContact CD2-CE3 3.57Å; W43-W58 HydrophobicContact CD2-CE3 3.57Å; W43-W58 AromaticContact CD2-CZ3 3.57Å; W43-W58 HydrophobicContact CD2-CZ3 3.57Å; W43-W58 AromaticContact CE2-CZ3 3.69Å; W43-W58 AromaticContact CE3-CE3 3.55Å; W43-W58 HydrophobicContact CE3-CE3 3.55Å; W43-W58 AromaticContact CE3-CZ3 3.66Å; W43-W58 HydrophobicContact CE3-CZ3 3.66Å; W43-W58 AromaticContact CG-CE3 3.89Å; W43-W58 HydrophobicContact CG-CE3 3.89Å; W43-W58 HydrophobicContact CG-CZ3 4.16Å; W43-W58 AromaticContact CH2-CZ3 3.99Å; W43-W58 HydrophobicContact CH2-CZ3 3.99Å; W43-W58 AromaticContact CZ2-CZ3 3.92Å; W43-W58 HydrophobicContact CZ2-CZ3 3.92Å; W43-W58 HydrophobicContact CZ3-CE3 4.13Å; W43-W58 AromaticContact CZ3-CZ3 3.87Å; W43-W58 HydrophobicContact CZ3-CZ3 3.87Å
44	K	90.4	Very high	83.7	Confident	132 Å²	132	83.5 Å²	83.5	57%	0.574	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	114.3	173.3	-175.4	-178.2	174.1	-172.5	0	108.9	F53 S54	K44-F53 HydrophobicContact CD-CD1 4.22Å; K44-F53 HydrophobicContact CD-CG 4.43Å; K44-F53 HydrophobicContact CG-CB 4.25Å; K44-F53 HydrophobicContact CG-CD1 3.97Å; K44-F53 HydrophobicContact CG-CG 4.35Å; K44-S54 WeakPolarHBondContact CA-O 3.39Å
45	V	90.5	Very high	84.3	Confident	16 Å²	16	87.8 Å²	87.8	10%	0.097	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	153.6	174.5	-68.7	0	0	0	0	110	F53 S54 V56 R61 W64	V45-F53 CarbonylContact O-C 3.42Å; V45-F53 VanDerWaalsContact O-CA 3.26Å; V45-F53 WeakPolarHBondContact O-CA 3.31Å; V45-S54 WeakPolarHBondContact CG2-O 3.19Å; V45-S54 PolarHBondContact N-O 2.94Å; V45-S54 PolarHBondContact O-N 2.75Å; V45-V56 HydrophobicContact CB-CG2 4.31Å; V45-V56 HydrophobicContact CG1-CG2 3.69Å; V45-V56 HydrophobicContact CG2-CB 4.32Å; V45-V56 HydrophobicContact CG2-CG1 3.81Å; V45-V56 HydrophobicContact CG2-CG2 3.57Å; V45-R61 HydrophobicContact CG1-CB 3.88Å; V45-W64 HydrophobicContact CB-CZ2 3.92Å; V45-W64 HydrophobicContact CG2-CD2 3.95Å; V45-W64 VanDerWaalsContact CG2-CE2 3.45Å; V45-W64 HydrophobicContact CG2-CE3 4.29Å; V45-W64 HydrophobicContact CG2-CH2 3.8Å; V45-W64 HydrophobicContact CG2-CZ2 3.41Å; V45-W64 VanDerWaalsContact CG2-CZ2 3.41Å; V45-W64 HydrophobicContact CG2-CZ3 4.22Å
46	Q	93.5	Very high	84.8	Confident	100 Å²	100	80.5 Å²	80.5	47%	0.467	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	138.5	173.9	-162.1	175.6	4.7	0	0	109.8	H51 F53 W64	Q46-H51 WeakPolarHBondContact CG-O 3.48Å; Q46-H51 PolarHBondContact NE2-O 3.31Å; Q46-F53 HydrophobicContact CB-CD1 3.86Å; Q46-F53 HydrophobicContact CB-CE1 3.72Å; Q46-F53 HydrophobicContact CG-CD1 4.02Å; Q46-F53 HydrophobicContact CG-CE1 3.77Å; Q46-F53 HydrophobicContact CG-CZ 4.21Å; Q46-W64 WeakPolarHBondContact O-CZ2 3.37Å
47	C	94.7	Very high	85.2	Confident	1 Å²	1	85.5 Å²	85.5	1%	0.007	39%	0.391	C	S	.	.			trans	-74.4	134.5	172.5	-175.9	0	0	0	0	110.8	F49 C50 H51 A52 W64 C66 C69 N73	C47-F49 PolarHBondContact SG-N 3.27Å; C47-C50 VanDerWaalsContact SG-SG 3.62Å; C47-H51 WeakPolarHBondContact O-CA 3.48Å; C47-H51 PolarHBondContact O-N 3.45Å; C47-A52 WeakPolarHBondContact CB-O 3.39Å; C47-A52 PolarHBondContact N-O 2.67Å; C47-W64 HydrophobicContact CB-CH2 3.82Å; C47-W64 HydrophobicContact CB-CZ2 4.47Å; C47-C66 HydrophobicContact CB-CB 4.22Å; C47-C69 VanDerWaalsContact SG-SG 3.7Å; C47-N73 VanDerWaalsContact CA-OD1 3.29Å; C47-N73 WeakPolarHBondContact CA-OD1 3.19Å; C47-N73 PolarHBondContact SG-ND2 2.67Å; C47-N73 VanDerWaalsContact SG-ND2 3.41Å; C47-N73 PolarHBondContact SG-OD1 3.16Å
48	W	92.7	Very high	85.5	Confident	179 Å²	179	83.1 Å²	83.1	68%	0.678	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-48.7	173.9	-172.5	-99.6	0	0	0	112.1	N73 F75	W48-N73 PolarHBondContact N-OD1 3.48Å; W48-F75 HydrophobicContact CB-CE2 4.17Å; W48-F75 HydrophobicContact CB-CZ 4.2Å; W48-F75 HydrophobicContact CD2-CE2 4.44Å; W48-F75 HydrophobicContact CD2-CZ 4.46Å; W48-F75 HydrophobicContact CG-CE2 4.23Å; W48-F75 HydrophobicContact CG-CZ 4.04Å
49	F	92.5	Very high	86	Confident	46 Å²	46	86.5 Å²	86.5	20%	0.202	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-23.1	-169.2	-60.7	-85.4	0	0	0	116.2	C47 Q71 Y72 F75 Y81 L452	C47-F49 PolarHBondContact SG-N 3.27Å; F49-Q71 HydrophobicContact CB-CB 4.37Å; F49-Q71 HydrophobicContact CB-CG 4.23Å; F49-Q71 HydrophobicContact CD1-CG 4.37Å; F49-Q71 HydrophobicContact CD2-CB 3.47Å; F49-Q71 VanDerWaalsContact CD2-CB 3.47Å; F49-Q71 HydrophobicContact CD2-CG 4.03Å; F49-Q71 HydrophobicContact CE2-CB 3.92Å; F49-Q71 HydrophobicContact CG-CB 3.91Å; F49-Q71 HydrophobicContact CG-CG 3.93Å; F49-Y72 WeakPolarHBondContact CE2-O 3.31Å; F49-F75 HydrophobicContact CE2-CZ 4.36Å; F49-Y81 WeakPolarHBondContact CZ-OH 3.2Å; F49-L452 HydrophobicContact CE1-CD2 4.29Å
50	C	92.9	Very high	86.8	Confident	47 Å²	47	86.4 Å²	86.4	32%	0.318	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135	10	-175.8	68	0	0	0	0	113.5	C47 A52 C69	C47-C50 VanDerWaalsContact SG-SG 3.62Å; C50-A52 PolarHBondContact O-N 3.39Å; C50-C69 HydrophobicContact CB-CB 4.2Å
51	H	92.6	Very high	87.8	Confident	128 Å²	128	84.5 Å²	84.5	59%	0.593	38%	0.381	S	S	*	.			trans	51.4	5	-177.3	-64	-66.8	0	0	0	116.7	Q46 C47	Q46-H51 WeakPolarHBondContact CG-O 3.48Å; Q46-H51 PolarHBondContact NE2-O 3.31Å; C47-H51 WeakPolarHBondContact O-CA 3.48Å; C47-H51 PolarHBondContact O-N 3.45Å
52	A	90.6	Very high	88.7	Confident	13 Å²	13	85.2 Å²	85.2	11%	0.107	38%	0.382	C	S	.	.			trans	-75.1	133	-176.8	0	0	0	0	0	111.5	C47 C50 K68	C47-A52 WeakPolarHBondContact CB-O 3.39Å; C47-A52 PolarHBondContact N-O 2.67Å; C50-A52 PolarHBondContact O-N 3.39Å; A52-K68 HydrophobicContact CB-CD 3.65Å; A52-K68 HydrophobicContact CB-CG 4.21Å
53	F	92.8	Very high	89.3	Confident	113 Å²	113	84.1 Å²	84.1	50%	0.496	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	146.8	174	-64.8	-72.6	0	0	0	112.2	K44 V45 Q46	K44-F53 HydrophobicContact CD-CD1 4.22Å; K44-F53 HydrophobicContact CD-CG 4.43Å; K44-F53 HydrophobicContact CG-CB 4.25Å; K44-F53 HydrophobicContact CG-CD1 3.97Å; K44-F53 HydrophobicContact CG-CG 4.35Å; V45-F53 CarbonylContact O-C 3.42Å; V45-F53 VanDerWaalsContact O-CA 3.26Å; V45-F53 WeakPolarHBondContact O-CA 3.31Å; Q46-F53 HydrophobicContact CB-CD1 3.86Å; Q46-F53 HydrophobicContact CB-CE1 3.72Å; Q46-F53 HydrophobicContact CG-CD1 4.02Å; Q46-F53 HydrophobicContact CG-CE1 3.77Å; Q46-F53 HydrophobicContact CG-CZ 4.21Å
54	S	90.5	Very high	89.9	Confident	15 Å²	15	81 Å²	81	11%	0.105	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	155.5	175.1	-72.2	0	0	0	0	110.5	K44 V45 W64 P67	K44-S54 WeakPolarHBondContact CA-O 3.39Å; V45-S54 WeakPolarHBondContact CG2-O 3.19Å; V45-S54 PolarHBondContact N-O 2.94Å; V45-S54 PolarHBondContact O-N 2.75Å; S54-W64 VanDerWaalsContact CB-CZ3 3.4Å; S54-P67 WeakPolarHBondContact OG-CD 3.24Å
55	R	91.4	Very high	90	Very high	210 Å²	210	78.6 Å²	78.6	79%	0.792	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	115.9	177.2	-80.1	-176.6	-179.7	172.4	0.5	109.4	P42 W43	P42-R55 HydrophobicContact CB-CB 4.16Å; W43-R55 WeakPolarHBondContact O-CA 3.47Å
56	V	87.1	Confident	90.2	Very high	21 Å²	21	77.9 Å²	77.9	13%	0.127	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	156.7	-178.1	-55.9	0	0	0	0	110.9	P42 W43 V45 R61 W64	P42-V56 CarbonylContact C-O 3.59Å; P42-V56 WeakPolarHBondContact CA-O 3.38Å; W43-V56 PolarHBondContact N-O 3.08Å; W43-V56 PolarHBondContact O-N 3.22Å; V45-V56 HydrophobicContact CB-CG2 4.31Å; V45-V56 HydrophobicContact CG1-CG2 3.69Å; V45-V56 HydrophobicContact CG2-CB 4.32Å; V45-V56 HydrophobicContact CG2-CG1 3.81Å; V45-V56 HydrophobicContact CG2-CG2 3.57Å; V56-R61 HydrophobicContact CG2-CB 4.39Å; V56-W64 HydrophobicContact CG1-CB 3.98Å; V56-W64 HydrophobicContact CG1-CD2 3.95Å; V56-W64 HydrophobicContact CG1-CE3 3.98Å; V56-W64 HydrophobicContact CG1-CG 3.95Å
57	K	83.3	Confident	90.1	Very high	143 Å²	143	78 Å²	78	62%	0.622	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	143.3	175.2	-62.9	-171.4	177	-169.4	0	110	R59 S60 R61	K57-R59 PolarHBondContact O-N 3.35Å; K57-S60 WeakPolarHBondContact O-CA 3.24Å; K57-S60 PolarHBondContact O-N 3.32Å; K57-R61 PolarHBondContact O-N 3.23Å
58	W	80.4	Confident	89.9	Confident	40 Å²	40	85.3 Å²	85.3	15%	0.152	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-50.3	-36.4	-178	174.6	-111.7	0	0	0	114.5	W38 W43 S60 R61	W38-W58 HydrophobicContact CH2-CD2 4.21Å; W38-W58 AromaticContact CH2-CE2 3.36Å; W38-W58 AromaticContact CH2-CH2 3.94Å; W38-W58 HydrophobicContact CH2-CH2 3.94Å; W38-W58 AromaticContact CH2-CZ2 3.22Å; W38-W58 HydrophobicContact CH2-CZ2 3.22Å; W38-W58 AromaticContact CH2-NE1 3.56Å; W38-W58 HydrophobicContact CZ2-CD2 4.36Å; W38-W58 AromaticContact CZ2-CE2 3.88Å; W38-W58 AromaticContact CZ2-CH2 3.9Å; W38-W58 HydrophobicContact CZ2-CH2 3.9Å; W38-W58 AromaticContact CZ2-CZ2 3.66Å; W38-W58 HydrophobicContact CZ2-CZ2 3.66Å; W38-W58 HydrophobicContact CZ2-CZ3 4.34Å; W38-W58 HydrophobicContact CZ3-CD2 4.44Å; W38-W58 AromaticContact CZ3-CE2 3.68Å; W38-W58 HydrophobicContact CZ3-CZ2 4.01Å; W38-W58 AromaticContact CZ3-NE1 3.36Å; W43-W58 HydrophobicContact CB-CE3 4.27Å; W43-W58 AromaticContact CD2-CE3 3.57Å; W43-W58 HydrophobicContact CD2-CE3 3.57Å; W43-W58 AromaticContact CD2-CZ3 3.57Å; W43-W58 HydrophobicContact CD2-CZ3 3.57Å; W43-W58 AromaticContact CE2-CZ3 3.69Å; W43-W58 AromaticContact CE3-CE3 3.55Å; W43-W58 HydrophobicContact CE3-CE3 3.55Å; W43-W58 AromaticContact CE3-CZ3 3.66Å; W43-W58 HydrophobicContact CE3-CZ3 3.66Å; W43-W58 AromaticContact CG-CE3 3.89Å; W43-W58 HydrophobicContact CG-CE3 3.89Å; W43-W58 HydrophobicContact CG-CZ3 4.16Å; W43-W58 AromaticContact CH2-CZ3 3.99Å; W43-W58 HydrophobicContact CH2-CZ3 3.99Å; W43-W58 AromaticContact CZ2-CZ3 3.92Å; W43-W58 HydrophobicContact CZ2-CZ3 3.92Å; W43-W58 HydrophobicContact CZ3-CE3 4.13Å; W43-W58 AromaticContact CZ3-CZ3 3.87Å; W43-W58 HydrophobicContact CZ3-CZ3 3.87Å; W58-S60 VanDerWaalsContact C-N 3.25Å; W58-S60 PolarHBondContact O-N 2.93Å; W58-R61 VanDerWaalsContact CZ3-CD 3.46Å; W58-R61 WeakPolarHBondContact O-CG 3.47Å; W58-R61 PolarHBondContact O-NH1 2.69Å
59	R	81.1	Confident	89.9	Confident	195 Å²	195	77.7 Å²	77.7	74%	0.736	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-69.4	-14.6	176.3	-64.8	-174.1	-178.7	-177.7	0.8	114.8	K57	K57-R59 PolarHBondContact O-N 3.35Å
60	S	86.4	Confident	89.8	Confident	47 Å²	47	83 Å²	83	33%	0.329	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-114.8	10.5	-178.2	-58.5	0	0	0	0	113.1	K57 W58 N62 S63	K57-S60 WeakPolarHBondContact O-CA 3.24Å; K57-S60 PolarHBondContact O-N 3.32Å; W58-S60 VanDerWaalsContact C-N 3.25Å; W58-S60 PolarHBondContact O-N 2.93Å; S60-N62 PolarHBondContact O-N 2.89Å; S60-N62 VanDerWaalsContact O-N 3.12Å; S60-S63 CarbonylContact O-C 3.51Å; S60-S63 PolarHBondContact O-N 3.19Å
61	R	88	Confident	89.7	Confident	104 Å²	104	83.9 Å²	83.9	39%	0.392	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.5	-178.2	73	-175.5	-177.8	-83.8	6.3	114.4	V45 V56 K57 W58 W64	V45-R61 HydrophobicContact CG1-CB 3.88Å; V56-R61 HydrophobicContact CG2-CB 4.39Å; K57-R61 PolarHBondContact O-N 3.23Å; W58-R61 VanDerWaalsContact CZ3-CD 3.46Å; W58-R61 WeakPolarHBondContact O-CG 3.47Å; W58-R61 PolarHBondContact O-NH1 2.69Å; R61-W64 PolarHBondContact O-NE1 2.82Å
62	N	90.6	Very high	89.7	Confident	74 Å²	74	78.9 Å²	78.9	40%	0.396	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	26.2	175.1	-165.9	23	0	0	0	111.7	S60 G74 F75 N82	S60-N62 PolarHBondContact O-N 2.89Å; S60-N62 VanDerWaalsContact O-N 3.12Å; N62-G74 WeakPolarHBondContact O-CA 3.43Å; N62-G74 WeakPolarHBondContact OD1-CA 3.44Å; N62-F75 PolarHBondContact ND2-O 3.12Å; N62-F75 PolarHBondContact OD1-N 2.75Å; N62-F75 PolarHBondContact OD1-O 3.34Å; N62-N82 PolarHBondContact ND2-ND2 2.83Å; N62-N82 PolarHBondContact O-ND2 3.29Å
63	S	91.9	Very high	89.8	Confident	56 Å²	56	78.5 Å²	78.5	39%	0.392	37%	0.369	S	S	.	.	S	Bend	trans	-159.5	65.3	178.9	47.3	0	0	0	0	111.9	S60 Y72 N73	S60-S63 CarbonylContact O-C 3.51Å; S60-S63 PolarHBondContact O-N 3.19Å; S63-Y72 WeakPolarHBondContact CA-OH 3.26Å; S63-Y72 WeakPolarHBondContact CB-OH 3.38Å; S63-N73 PolarHBondContact N-O 2.62Å
64	W	93.4	Very high	89.8	Confident	20 Å²	20	73.1 Å²	73.1	8%	0.076	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	165.5	-176.8	62.6	-71.7	0	0	0	112.2	V45 Q46 C47 S54 V56 R61 C66 Y72 N73	V45-W64 HydrophobicContact CB-CZ2 3.92Å; V45-W64 HydrophobicContact CG2-CD2 3.95Å; V45-W64 VanDerWaalsContact CG2-CE2 3.45Å; V45-W64 HydrophobicContact CG2-CE3 4.29Å; V45-W64 HydrophobicContact CG2-CH2 3.8Å; V45-W64 HydrophobicContact CG2-CZ2 3.41Å; V45-W64 VanDerWaalsContact CG2-CZ2 3.41Å; V45-W64 HydrophobicContact CG2-CZ3 4.22Å; Q46-W64 WeakPolarHBondContact O-CZ2 3.37Å; C47-W64 HydrophobicContact CB-CH2 3.82Å; C47-W64 HydrophobicContact CB-CZ2 4.47Å; S54-W64 VanDerWaalsContact CB-CZ3 3.4Å; V56-W64 HydrophobicContact CG1-CB 3.98Å; V56-W64 HydrophobicContact CG1-CD2 3.95Å; V56-W64 HydrophobicContact CG1-CE3 3.98Å; V56-W64 HydrophobicContact CG1-CG 3.95Å; R61-W64 PolarHBondContact O-NE1 2.82Å; W64-C66 HydrophobicContact CH2-CB 4.46Å; W64-C66 HydrophobicContact CZ3-CB 3.97Å; W64-Y72 WeakPolarHBondContact O-CD2 3.39Å; W64-N73 HydrophobicContact CD2-CB 3.96Å; W64-N73 VanDerWaalsContact CE2-CB 3.43Å; W64-N73 HydrophobicContact CG-CB 4.25Å; W64-N73 HydrophobicContact CZ2-CB 3.74Å; W64-N73 PolarHBondContact N-O 2.78Å; W64-N73 VanDerWaalsContact N-O 3.09Å; W64-N73 PolarHBondContact O-N 3.12Å
65	V	93.2	Very high	89.9	Confident	82 Å²	82	74.7 Å²	74.7	50%	0.497	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.6	173.6	174.9	0	0	0	0	107.8	E70 Q71 Y72	V65-E70 VanDerWaalsContact CG1-O 3.24Å; V65-E70 WeakPolarHBondContact CG1-O 3.41Å; V65-Q71 WeakPolarHBondContact CA-O 3.25Å; V65-Y72 HydrophobicContact CG2-CD2 4.02Å
66	C	93.8	Very high	89.8	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.007	33%	0.33	C	S	.	.			trans	-72.7	126.7	-177.8	-175.8	0	0	0	0	111.3	C47 W64 K68 E70 Q71	C47-C66 HydrophobicContact CB-CB 4.22Å; W64-C66 HydrophobicContact CH2-CB 4.46Å; W64-C66 HydrophobicContact CZ3-CB 3.97Å; C66-K68 PolarHBondContact O-N 3.16Å; C66-K68 PolarHBondContact SG-N 3.3Å; C66-E70 VanDerWaalsContact O-CA 3.24Å; C66-E70 WeakPolarHBondContact O-CA 3.45Å; C66-E70 PolarHBondContact O-N 3.18Å; C66-Q71 PolarHBondContact N-O 3.13Å
67	P	93	Very high	89.9	Confident	104 Å²	104	78 Å²	78	68%	0.675	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-3.9	178.5	31.6	-36.6	0	0	0	114.3	S54	S54-P67 WeakPolarHBondContact OG-CD 3.24Å
68	K	89.9	Confident	90.1	Very high	153 Å²	153	78.6 Å²	78.6	67%	0.665	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-40.6	175.7	-68.8	-151.1	-173.6	-174.2	0	114.3	A52 C66	A52-K68 HydrophobicContact CB-CD 3.65Å; A52-K68 HydrophobicContact CB-CG 4.21Å; C66-K68 PolarHBondContact O-N 3.16Å; C66-K68 PolarHBondContact SG-N 3.3Å
69	C	92	Very high	90.3	Very high	19 Å²	19	79.1 Å²	79.1	13%	0.128	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	3.1	-175.6	67.2	0	0	0	0	114.3	C47 C50 Q71	C47-C69 VanDerWaalsContact SG-SG 3.7Å; C50-C69 HydrophobicContact CB-CB 4.2Å; C69-Q71 PolarHBondContact O-N 3.34Å
70	E	90.7	Very high	90.7	Very high	159 Å²	159	74.4 Å²	74.4	74%	0.743	38%	0.383	S	S	*	.			trans	56.9	4.8	-177.6	-54.6	-153.5	147.1	0	0	116.7	V65 C66	V65-E70 VanDerWaalsContact CG1-O 3.24Å; V65-E70 WeakPolarHBondContact CG1-O 3.41Å; C66-E70 VanDerWaalsContact O-CA 3.24Å; C66-E70 WeakPolarHBondContact O-CA 3.45Å; C66-E70 PolarHBondContact O-N 3.18Å
71	Q	90.7	Very high	90.9	Very high	64 Å²	64	73.9 Å²	73.9	30%	0.299	37%	0.374	S	S	.	.			trans	-74.3	147.6	178	-63.2	-61.9	-0.9	0	0	112.9	F49 V65 C66 C69 N73	F49-Q71 HydrophobicContact CB-CB 4.37Å; F49-Q71 HydrophobicContact CB-CG 4.23Å; F49-Q71 HydrophobicContact CD1-CG 4.37Å; F49-Q71 HydrophobicContact CD2-CB 3.47Å; F49-Q71 VanDerWaalsContact CD2-CB 3.47Å; F49-Q71 HydrophobicContact CD2-CG 4.03Å; F49-Q71 HydrophobicContact CE2-CB 3.92Å; F49-Q71 HydrophobicContact CG-CB 3.91Å; F49-Q71 HydrophobicContact CG-CG 3.93Å; V65-Q71 WeakPolarHBondContact CA-O 3.25Å; C66-Q71 PolarHBondContact N-O 3.13Å; C69-Q71 PolarHBondContact O-N 3.34Å; Q71-N73 PolarHBondContact O-ND2 3.14Å
72	Y	93.6	Very high	91.1	Very high	23 Å²	23	72 Å²	72	9%	0.09	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	135	174.9	-177.2	-117.1	0	0	0	111	F49 S63 W64 V65 G74 Y81 N82 K83 I85	F49-Y72 WeakPolarHBondContact CE2-O 3.31Å; S63-Y72 WeakPolarHBondContact CA-OH 3.26Å; S63-Y72 WeakPolarHBondContact CB-OH 3.38Å; W64-Y72 WeakPolarHBondContact O-CD2 3.39Å; V65-Y72 HydrophobicContact CG2-CD2 4.02Å; Y72-G74 VanDerWaalsContact CE1-O 3.27Å; Y72-G74 WeakPolarHBondContact CE1-O 3.43Å; Y72-Y81 AromaticContact CD1-CD1 3.87Å; Y72-Y81 HydrophobicContact CD1-CD1 3.87Å; Y72-Y81 HydrophobicContact CD1-CE1 4.49Å; Y72-Y81 HydrophobicContact CE1-CD1 4.49Å; Y72-N82 PolarHBondContact OH-OD1 2.98Å; Y72-K83 HydrophobicContact CD1-CD 4.2Å; Y72-K83 VanDerWaalsContact CD1-CE 3.48Å; Y72-K83 HydrophobicContact CD1-CG 4.37Å; Y72-K83 HydrophobicContact CE1-CD 3.68Å; Y72-K83 VanDerWaalsContact CE1-CE 3.5Å; Y72-K83 HydrophobicContact CE1-CG 3.79Å; Y72-K83 HydrophobicContact CE2-CD 4.03Å; Y72-I85 HydrophobicContact CD1-CD1 4.12Å
73	N	92.8	Very high	91.1	Very high	6 Å²	6	72.5 Å²	72.5	3%	0.032	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	95.5	-179	-71.7	-109	0	0	0	106.8	C47 W48 S63 W64 Q71	C47-N73 VanDerWaalsContact CA-OD1 3.29Å; C47-N73 WeakPolarHBondContact CA-OD1 3.19Å; C47-N73 PolarHBondContact SG-ND2 2.67Å; C47-N73 VanDerWaalsContact SG-ND2 3.41Å; C47-N73 PolarHBondContact SG-OD1 3.16Å; W48-N73 PolarHBondContact N-OD1 3.48Å; S63-N73 PolarHBondContact N-O 2.62Å; W64-N73 HydrophobicContact CD2-CB 3.96Å; W64-N73 VanDerWaalsContact CE2-CB 3.43Å; W64-N73 HydrophobicContact CG-CB 4.25Å; W64-N73 HydrophobicContact CZ2-CB 3.74Å; W64-N73 PolarHBondContact N-O 2.78Å; W64-N73 VanDerWaalsContact N-O 3.09Å; W64-N73 PolarHBondContact O-N 3.12Å; Q71-N73 PolarHBondContact O-ND2 3.14Å
74	G	92.7	Very high	90.8	Very high	0 Å²	0	74.8 Å²	74.8	0%	0	38%	0.384	C	S	.	.			trans	-178.1	101.8	-176.2	0	0	0	0	0	111	N62 Y72 Y81 N82	N62-G74 WeakPolarHBondContact O-CA 3.43Å; N62-G74 WeakPolarHBondContact OD1-CA 3.44Å; Y72-G74 VanDerWaalsContact CE1-O 3.27Å; Y72-G74 WeakPolarHBondContact CE1-O 3.43Å; G74-Y81 WeakPolarHBondContact O-CA 3.43Å; G74-N82 VanDerWaalsContact C-CG 3.46Å; G74-N82 PolarHBondContact O-N 3.1Å; G74-N82 PolarHBondContact O-OD1 3.19Å
75	F	92.8	Very high	90.4	Very high	47 Å²	47	75.1 Å²	75.1	21%	0.206	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-113.2	162.7	-175.8	-51.6	-78.8	0	0	0	110.2	W48 F49 N62 G79 D80 Y81 N82	W48-F75 HydrophobicContact CB-CE2 4.17Å; W48-F75 HydrophobicContact CB-CZ 4.2Å; W48-F75 HydrophobicContact CD2-CE2 4.44Å; W48-F75 HydrophobicContact CD2-CZ 4.46Å; W48-F75 HydrophobicContact CG-CE2 4.23Å; W48-F75 HydrophobicContact CG-CZ 4.04Å; F49-F75 HydrophobicContact CE2-CZ 4.36Å; N62-F75 PolarHBondContact ND2-O 3.12Å; N62-F75 PolarHBondContact OD1-N 2.75Å; N62-F75 PolarHBondContact OD1-O 3.34Å; F75-G79 WeakPolarHBondContact CD1-O 3.5Å; F75-D80 CarbonylContact C-O 3.6Å; F75-D80 WeakPolarHBondContact CA-O 3.33Å; F75-Y81 HydrophobicContact CD1-CD1 4.14Å; F75-Y81 HydrophobicContact CD1-CE1 4.34Å; F75-Y81 AromaticContact CE1-CD1 3.9Å; F75-Y81 HydrophobicContact CE1-CD1 3.9Å; F75-Y81 AromaticContact CE1-CE1 3.64Å; F75-Y81 HydrophobicContact CE1-CE1 3.64Å; F75-Y81 HydrophobicContact CZ-CE1 4.31Å; F75-N82 PolarHBondContact N-ND2 3.04Å; F75-N82 PolarHBondContact O-ND2 2.85Å
76	D	89.1	Confident	89.9	Confident	67 Å²	67	76.9 Å²	76.9	36%	0.358	39%	0.39	S	S	.	.			trans	-86.8	-132.6	174.4	56.2	34.9	0	0	0	112	D78 G79 D80 N82	D76-D78 PolarHBondContact OD1-N 3.45Å; D76-G79 PolarHBondContact OD1-N 3.38Å; D76-D80 PolarHBondContact N-O 3.18Å; D76-D80 PolarHBondContact OD1-N 3.49Å; D76-N82 HydrophobicContact CB-CB 4.33Å
77	R	87.7	Confident	89.2	Confident	235 Å²	235	81.8 Å²	81.8	89%	0.887	41%	0.411	S	S	*	.	S	Bend	trans	-107.6	-19.6	174.9	-68.4	-174.3	177.6	-167.7	0.5	112.8
78	D	87.6	Confident	88.6	Confident	154 Å²	154	80.7 Å²	80.7	82%	0.824	40%	0.398	S	S	*	.	S	Bend	trans	-101	-22.4	-170.3	-48.7	-52.7	0	0	0	109.8	D76	D76-D78 PolarHBondContact OD1-N 3.45Å
79	G	86.1	Confident	88	Confident	52 Å²	52	81.6 Å²	81.6	54%	0.536	40%	0.398	S	S	.	.	S	Bend	trans	128.5	-14.1	166.4	0	0	0	0	0	113.9	F75 D76	F75-G79 WeakPolarHBondContact CD1-O 3.5Å; D76-G79 PolarHBondContact OD1-N 3.38Å
80	D	88.1	Confident	87.2	Confident	95 Å²	95	82.9 Å²	82.9	51%	0.508	40%	0.404	S	S	.	.	S	Bend	trans	-76.3	167.8	179.4	-168.4	20.1	0	0	0	111.5	F75 D76 N82	F75-D80 CarbonylContact C-O 3.6Å; F75-D80 WeakPolarHBondContact CA-O 3.33Å; D76-D80 PolarHBondContact N-O 3.18Å; D76-D80 PolarHBondContact OD1-N 3.49Å; D80-N82 PolarHBondContact O-N 2.96Å
81	Y	91.6	Very high	86.3	Confident	37 Å²	37	78.1 Å²	78.1	15%	0.145	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-68.6	126.4	178.2	-64	-76.4	0	0	0	111.5	F49 Y72 G74 F75 K83 I85 M88	F49-Y81 WeakPolarHBondContact CZ-OH 3.2Å; Y72-Y81 AromaticContact CD1-CD1 3.87Å; Y72-Y81 HydrophobicContact CD1-CD1 3.87Å; Y72-Y81 HydrophobicContact CD1-CE1 4.49Å; Y72-Y81 HydrophobicContact CE1-CD1 4.49Å; G74-Y81 WeakPolarHBondContact O-CA 3.43Å; F75-Y81 HydrophobicContact CD1-CD1 4.14Å; F75-Y81 HydrophobicContact CD1-CE1 4.34Å; F75-Y81 AromaticContact CE1-CD1 3.9Å; F75-Y81 HydrophobicContact CE1-CD1 3.9Å; F75-Y81 AromaticContact CE1-CE1 3.64Å; F75-Y81 HydrophobicContact CE1-CE1 3.64Å; F75-Y81 HydrophobicContact CZ-CE1 4.31Å; Y81-K83 WeakPolarHBondContact CB-O 3.18Å; Y81-K83 PolarHBondContact O-N 3.3Å; Y81-I85 HydrophobicContact CD1-CD1 3.54Å; Y81-I85 HydrophobicContact CD1-CG1 4.48Å; Y81-I85 HydrophobicContact CD2-CD1 3.79Å; Y81-I85 HydrophobicContact CD2-CG1 4.43Å; Y81-I85 HydrophobicContact CE1-CD1 3.63Å; Y81-I85 HydrophobicContact CE2-CD1 3.9Å; Y81-I85 HydrophobicContact CG-CD1 3.58Å; Y81-I85 HydrophobicContact CG-CG1 4.18Å; Y81-M88 HydrophobicContact CD2-SD 4.29Å; Y81-M88 HydrophobicContact CE2-CE 3.68Å; Y81-M88 HydrophobicContact CE2-SD 3.87Å
82	N	91.4	Very high	85.6	Confident	64 Å²	64	86.2 Å²	86.2	34%	0.342	41%	0.409	S	S	.	.	S	Bend	trans	-69.8	17.8	178.3	64.6	30.8	0	0	0	115.4	N62 Y72 G74 F75 D76 D80	N62-N82 PolarHBondContact ND2-ND2 2.83Å; N62-N82 PolarHBondContact O-ND2 3.29Å; Y72-N82 PolarHBondContact OH-OD1 2.98Å; G74-N82 VanDerWaalsContact C-CG 3.46Å; G74-N82 PolarHBondContact O-N 3.1Å; G74-N82 PolarHBondContact O-OD1 3.19Å; F75-N82 PolarHBondContact N-ND2 3.04Å; F75-N82 PolarHBondContact O-ND2 2.85Å; D76-N82 HydrophobicContact CB-CB 4.33Å; D80-N82 PolarHBondContact O-N 2.96Å
83	K	90.2	Very high	84.5	Confident	85 Å²	85	88.8 Å²	88.8	37%	0.37	42%	0.421	S	S	.	.	S	Bend	trans	-155.3	150.9	166.5	76	-174.3	-171.9	-166.4	0	108.3	Y72 Y81 I85	Y72-K83 HydrophobicContact CD1-CD 4.2Å; Y72-K83 VanDerWaalsContact CD1-CE 3.48Å; Y72-K83 HydrophobicContact CD1-CG 4.37Å; Y72-K83 HydrophobicContact CE1-CD 3.68Å; Y72-K83 VanDerWaalsContact CE1-CE 3.5Å; Y72-K83 HydrophobicContact CE1-CG 3.79Å; Y72-K83 HydrophobicContact CE2-CD 4.03Å; Y81-K83 WeakPolarHBondContact CB-O 3.18Å; Y81-K83 PolarHBondContact O-N 3.3Å; K83-I85 PolarHBondContact O-N 2.97Å
84	P	86.6	Confident	83.5	Confident	104 Å²	104	90.9 Å²	90.9	68%	0.675	43%	0.432	S	S	*	.			trans	-62.4	125.6	167.4	26.7	-34.2	0	0	0	110.6	E86	P84-E86 PolarHBondContact O-N 3.46Å
85	I	84.7	Confident	82.1	Confident	26 Å²	26	97.3 Å²	97.3	13%	0.133	47%	0.467	C	S	.	.			trans	-88.9	99.2	171.7	-62.3	-176.1	0	0	0	108.1	Y72 Y81 K83 K87 M88 Y89	Y72-I85 HydrophobicContact CD1-CD1 4.12Å; Y81-I85 HydrophobicContact CD1-CD1 3.54Å; Y81-I85 HydrophobicContact CD1-CG1 4.48Å; Y81-I85 HydrophobicContact CD2-CD1 3.79Å; Y81-I85 HydrophobicContact CD2-CG1 4.43Å; Y81-I85 HydrophobicContact CE1-CD1 3.63Å; Y81-I85 HydrophobicContact CE2-CD1 3.9Å; Y81-I85 HydrophobicContact CG-CD1 3.58Å; Y81-I85 HydrophobicContact CG-CG1 4.18Å; K83-I85 PolarHBondContact O-N 2.97Å; I85-K87 HydrophobicContact CG2-CB 4.23Å; I85-K87 PolarHBondContact O-N 3.48Å; I85-M88 HydrophobicContact CB-CG 4.17Å; I85-M88 HydrophobicContact CB-SD 3.79Å; I85-M88 HydrophobicContact CD1-CE 4.09Å; I85-M88 HydrophobicContact CD1-SD 4.04Å; I85-M88 HydrophobicContact CG1-SD 4.39Å; I85-M88 HydrophobicContact CG2-CE 4.48Å; I85-M88 HydrophobicContact CG2-CG 3.92Å; I85-M88 HydrophobicContact CG2-SD 4Å; I85-M88 WeakPolarHBondContact O-CB 3.24Å; I85-M88 PolarHBondContact O-N 2.97Å; I85-Y89 WeakPolarHBondContact O-CD2 3.39Å
86	E	83.4	Confident	80.3	Confident	120 Å²	120	101 Å²	101	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-54.6	-28.7	-175.3	-58.8	-173.4	-145.1	0	0	114	P84 M88 Y89 D90 K93	P84-E86 PolarHBondContact O-N 3.46Å; E86-M88 VanDerWaalsContact C-N 3.26Å; E86-M88 PolarHBondContact O-N 2.97Å; E86-Y89 PolarHBondContact O-N 3.29Å; E86-D90 PolarHBondContact O-N 3.39Å; E86-K93 HydrophobicContact CB-CD 3.74Å; E86-K93 WeakPolarHBondContact OE2-CD 3.45Å; E86-K93 VanDerWaalsContact OE2-CE 3.22Å; E86-K93 WeakPolarHBondContact OE2-CE 3.49Å; E86-K93 IonicContact OE2-NZ 2.81Å; E86-K93 PolarHBondContact OE2-NZ 3.45Å
87	K	78.1	Confident	78.1	Confident	103 Å²	103	106.4 Å²	106.4	45%	0.448	50%	0.5	S	S	.	.	H	α-helix	trans	-67.7	-18.3	177.1	-62.2	-164.2	174.9	-177.4	0	114.9	I85 K93	I85-K87 HydrophobicContact CG2-CB 4.23Å; I85-K87 PolarHBondContact O-N 3.48Å; K87-K93 WeakPolarHBondContact CE-O 3.42Å; K87-K93 HydrophobicContact CG-CB 4.4Å; K87-K93 WeakPolarHBondContact CG-O 3.24Å
88	M	81.5	Confident	75.8	Confident	82 Å²	82	99.3 Å²	99.3	40%	0.404	47%	0.473	S	S	.	.	H	α-helix	trans	-85.9	-20.5	-179.9	-70.6	172.6	166.3	0	0	112.6	Y81 I85 E86	Y81-M88 HydrophobicContact CD2-SD 4.29Å; Y81-M88 HydrophobicContact CE2-CE 3.68Å; Y81-M88 HydrophobicContact CE2-SD 3.87Å; I85-M88 HydrophobicContact CB-CG 4.17Å; I85-M88 HydrophobicContact CB-SD 3.79Å; I85-M88 HydrophobicContact CD1-CE 4.09Å; I85-M88 HydrophobicContact CD1-SD 4.04Å; I85-M88 HydrophobicContact CG1-SD 4.39Å; I85-M88 HydrophobicContact CG2-CE 4.48Å; I85-M88 HydrophobicContact CG2-CG 3.92Å; I85-M88 HydrophobicContact CG2-SD 4Å; I85-M88 WeakPolarHBondContact O-CB 3.24Å; I85-M88 PolarHBondContact O-N 2.97Å; E86-M88 VanDerWaalsContact C-N 3.26Å; E86-M88 PolarHBondContact O-N 2.97Å
89	Y	75.8	Confident	73.3	Confident	172 Å²	172	95.6 Å²	95.6	68%	0.675	46%	0.459	S	S	*	.	H	α-helix	trans	-115	-21.1	-178.6	-47.9	-79.9	0	0	0	113.4	I85 E86	I85-Y89 WeakPolarHBondContact O-CD2 3.39Å; E86-Y89 PolarHBondContact O-N 3.29Å
90	D	75.1	Confident	71	Confident	45 Å²	45	96.5 Å²	96.5	24%	0.241	45%	0.454	C	S	.	.			trans	-126.1	97.4	178.3	-178.4	1.8	0	0	0	110.2	E86 R92 K93	E86-D90 PolarHBondContact O-N 3.39Å; D90-R92 PolarHBondContact O-N 2.94Å; D90-R92 VanDerWaalsContact O-N 3.14Å; D90-R92 VanDerWaalsContact OD1-CB 3.23Å; D90-R92 WeakPolarHBondContact OD1-CB 3.19Å; D90-R92 VanDerWaalsContact OD1-CG 3.31Å; D90-R92 WeakPolarHBondContact OD1-CG 3.4Å; D90-R92 PolarHBondContact OD1-N 2.95Å; D90-R92 VanDerWaalsContact OD1-N 3.13Å; D90-K93 HydrophobicContact CB-CD 4.04Å; D90-K93 HydrophobicContact CB-CG 4.4Å; D90-K93 WeakPolarHBondContact O-CB 3.33Å; D90-K93 PolarHBondContact O-N 3.07Å; D90-K93 WeakPolarHBondContact OD2-CD 3.28Å; D90-K93 WeakPolarHBondContact OD2-CE 3.35Å; D90-K93 IonicContact OD2-NZ 3.52Å; D90-K93 PolarHBondContact OD2-NZ 2.92Å
91	E	72.9	Confident	68.4	Low	60 Å²	60	101.3 Å²	101.3	28%	0.28	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-55.2	-29.7	-179.1	-44	-178.8	148.2	0	0	112.7	K93 N94 F532 R536	E91-K93 PolarHBondContact O-N 2.96Å; E91-K93 VanDerWaalsContact O-N 3.16Å; E91-N94 VanDerWaalsContact O-CB 3.28Å; E91-N94 WeakPolarHBondContact O-CB 3.38Å; E91-N94 PolarHBondContact O-N 3.29Å; E91-F532 WeakPolarHBondContact OE2-CD1 3.36Å; E91-F532 WeakPolarHBondContact OE2-CE1 3.26Å; E91-R536 WeakPolarHBondContact OE1-CD 3.36Å; E91-R536 IonicContact OE1-CZ 3.66Å; E91-R536 IonicContact OE1-NE 2.69Å; E91-R536 PolarHBondContact OE1-NE 2.62Å; E91-R536 VanDerWaalsContact OE1-NE 3.13Å; E91-R536 IonicContact OE1-NH1 3.07Å; E91-R536 PolarHBondContact OE1-NH1 3.07Å; E91-R536 IonicContact OE1-NH2 2.67Å; E91-R536 IonicContact OE2-CZ 2.78Å; E91-R536 IonicContact OE2-NE 2.98Å; E91-R536 IonicContact OE2-NH1 3.53Å; E91-R536 PolarHBondContact OE2-NH1 3.18Å; E91-R536 IonicContact OE2-NH2 3.5Å; E91-R536 PolarHBondContact OE2-NH2 3.21Å
92	R	74.7	Confident	65.9	Low	234 Å²	234	107 Å²	107	88%	0.883	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-68.1	-14.6	-179.1	-47.8	170.5	-166.2	-179.7	5.5	111.8	D90	D90-R92 PolarHBondContact O-N 2.94Å; D90-R92 VanDerWaalsContact O-N 3.14Å; D90-R92 VanDerWaalsContact OD1-CB 3.23Å; D90-R92 WeakPolarHBondContact OD1-CB 3.19Å; D90-R92 VanDerWaalsContact OD1-CG 3.31Å; D90-R92 WeakPolarHBondContact OD1-CG 3.4Å; D90-R92 PolarHBondContact OD1-N 2.95Å; D90-R92 VanDerWaalsContact OD1-N 3.13Å
93	K	71.4	Confident	63.3	Low	77 Å²	77	108.8 Å²	108.8	34%	0.335	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-97.9	1.6	174.4	-60.9	172.5	-175.3	152.5	0	112.8	E86 K87 D90 E91 N95	E86-K93 HydrophobicContact CB-CD 3.74Å; E86-K93 WeakPolarHBondContact OE2-CD 3.45Å; E86-K93 VanDerWaalsContact OE2-CE 3.22Å; E86-K93 WeakPolarHBondContact OE2-CE 3.49Å; E86-K93 IonicContact OE2-NZ 2.81Å; E86-K93 PolarHBondContact OE2-NZ 3.45Å; K87-K93 WeakPolarHBondContact CE-O 3.42Å; K87-K93 HydrophobicContact CG-CB 4.4Å; K87-K93 WeakPolarHBondContact CG-O 3.24Å; D90-K93 HydrophobicContact CB-CD 4.04Å; D90-K93 HydrophobicContact CB-CG 4.4Å; D90-K93 WeakPolarHBondContact O-CB 3.33Å; D90-K93 PolarHBondContact O-N 3.07Å; D90-K93 WeakPolarHBondContact OD2-CD 3.28Å; D90-K93 WeakPolarHBondContact OD2-CE 3.35Å; D90-K93 IonicContact OD2-NZ 3.52Å; D90-K93 PolarHBondContact OD2-NZ 2.92Å; E91-K93 PolarHBondContact O-N 2.96Å; E91-K93 VanDerWaalsContact O-N 3.16Å; K93-N95 VanDerWaalsContact C-N 3.3Å; K93-N95 PolarHBondContact O-N 3.5Å; K93-N95 PolarHBondContact O-OD1 2.89Å
94	N	71.5	Confident	60.7	Low	50 Å²	50	114.3 Å²	114.3	27%	0.267	53%	0.525	S	S	.	.			trans	-81	77.5	175	-162.5	30.2	0	0	0	110.5	E91 W96	E91-N94 VanDerWaalsContact O-CB 3.28Å; E91-N94 WeakPolarHBondContact O-CB 3.38Å; E91-N94 PolarHBondContact O-N 3.29Å; N94-W96 WeakPolarHBondContact ND2-CZ2 3.31Å; N94-W96 PolarHBondContact O-N 3.27Å; N94-W96 PolarHBondContact OD1-NE1 3.05Å
95	N	62.9	Low	58.3	Low	135 Å²	135	116.2 Å²	116.2	72%	0.722	53%	0.525	S	S	*	.			trans	-59.1	-5	-171.3	-70.2	36.4	0	0	0	117.6	K93	K93-N95 VanDerWaalsContact C-N 3.3Å; K93-N95 PolarHBondContact O-N 3.5Å; K93-N95 PolarHBondContact O-OD1 2.89Å
96	W	56.3	Low	56.1	Low	124 Å²	124	120.1 Å²	120.1	47%	0.47	55%	0.552	S	S	.	*	S	Bend	trans	-101.1	143.7	176.4	68.6	-93.2	0	0	0	109.4	N94 W98	N94-W96 WeakPolarHBondContact ND2-CZ2 3.31Å; N94-W96 PolarHBondContact O-N 3.27Å; N94-W96 PolarHBondContact OD1-NE1 3.05Å; W96-W98 AromaticContact CD2-CD1 2.44Å; W96-W98 AromaticContact CD2-CG 3.95Å; W96-W98 HydrophobicContact CD2-CG 3.95Å; W96-W98 AromaticContact CD2-NE1 2.47Å; W96-W98 AromaticContact CE2-CD1 2.43Å; W96-W98 AromaticContact CE2-CG 3.94Å; W96-W98 AromaticContact CE2-NE1 2.44Å; W96-W98 HydrophobicContact CE3-CB 4.45Å; W96-W98 AromaticContact CE3-CD1 2.39Å; W96-W98 AromaticContact CE3-CD2 3.82Å; W96-W98 HydrophobicContact CE3-CD2 3.82Å; W96-W98 AromaticContact CE3-CE2 3.45Å; W96-W98 VanDerWaalsContact CE3-CE2 3.45Å; W96-W98 AromaticContact CE3-CG 3.38Å; W96-W98 HydrophobicContact CE3-CG 3.38Å; W96-W98 AromaticContact CE3-NE1 2.39Å; W96-W98 AromaticContact CG-CD1 3.66Å; W96-W98 AromaticContact CG-NE1 3.83Å; W96-W98 HydrophobicContact CH2-CB 3.62Å; W96-W98 AromaticContact CH2-CD1 2.09Å; W96-W98 AromaticContact CH2-CD2 2.28Å; W96-W98 HydrophobicContact CH2-CD2 2.28Å; W96-W98 AromaticContact CH2-CE2 2.28Å; W96-W98 AromaticContact CH2-CE3 3.5Å; W96-W98 HydrophobicContact CH2-CE3 3.5Å; W96-W98 AromaticContact CH2-CG 2.27Å; W96-W98 HydrophobicContact CH2-CG 2.27Å; W96-W98 HydrophobicContact CH2-CH2 4.3Å; W96-W98 AromaticContact CH2-CZ2 3.49Å; W96-W98 HydrophobicContact CH2-CZ2 3.49Å; W96-W98 VanDerWaalsContact CH2-CZ2 3.49Å; W96-W98 HydrophobicContact CH2-CZ3 4.3Å; W96-W98 AromaticContact CH2-NE1 2.1Å; W96-W98 AromaticContact CZ2-CD1 2.39Å; W96-W98 AromaticContact CZ2-CD2 3.83Å; W96-W98 HydrophobicContact CZ2-CD2 3.83Å; W96-W98 AromaticContact CZ2-CE2 3.45Å; W96-W98 VanDerWaalsContact CZ2-CE2 3.45Å; W96-W98 AromaticContact CZ2-CG 3.39Å; W96-W98 HydrophobicContact CZ2-CG 3.39Å; W96-W98 AromaticContact CZ2-NE1 2.4Å; W96-W98 HydrophobicContact CZ3-CB 3.47Å; W96-W98 VanDerWaalsContact CZ3-CB 3.47Å; W96-W98 AromaticContact CZ3-CD1 2.09Å; W96-W98 AromaticContact CZ3-CD2 2.28Å; W96-W98 HydrophobicContact CZ3-CD2 2.28Å; W96-W98 AromaticContact CZ3-CE2 2.28Å; W96-W98 AromaticContact CZ3-CE3 3.47Å; W96-W98 HydrophobicContact CZ3-CE3 3.47Å; W96-W98 VanDerWaalsContact CZ3-CE3 3.47Å; W96-W98 AromaticContact CZ3-CG 2.27Å; W96-W98 HydrophobicContact CZ3-CG 2.27Å; W96-W98 HydrophobicContact CZ3-CH2 4.28Å; W96-W98 AromaticContact CZ3-CZ2 3.47Å; W96-W98 HydrophobicContact CZ3-CZ2 3.47Å; W96-W98 VanDerWaalsContact CZ3-CZ2 3.47Å; W96-W98 HydrophobicContact CZ3-CZ3 4.27Å; W96-W98 AromaticContact CZ3-NE1 2.1Å; W96-W98 AromaticContact NE1-CD1 3.64Å; W96-W98 AromaticContact NE1-NE1 3.67Å; W96-W98 PolarHBondContact O-N 3.34Å
97	F	41.4	Very low	53.7	Low	180 Å²	180	121.1 Å²	121.1	79%	0.789	57%	0.566	S	S	*	*			trans	-74.6	87.6	-165.3	-84.5	-120.9	0	0	0	112.9	S99	F97-S99 VanDerWaalsContact C-N 3.26Å; F97-S99 WeakPolarHBondContact CD1-OG 3.23Å
98	W	40.4	Very low	51.9	Low	87 Å²	87	121.1 Å²	121.1	33%	0.33	58%	0.579	S	S	.	*			trans	-92.2	19.9	159.8	-63.7	86.3	0	0	0	112.7	W96 V100 Q446 S449	W96-W98 AromaticContact CD2-CD1 2.44Å; W96-W98 AromaticContact CD2-CG 3.95Å; W96-W98 HydrophobicContact CD2-CG 3.95Å; W96-W98 AromaticContact CD2-NE1 2.47Å; W96-W98 AromaticContact CE2-CD1 2.43Å; W96-W98 AromaticContact CE2-CG 3.94Å; W96-W98 AromaticContact CE2-NE1 2.44Å; W96-W98 HydrophobicContact CE3-CB 4.45Å; W96-W98 AromaticContact CE3-CD1 2.39Å; W96-W98 AromaticContact CE3-CD2 3.82Å; W96-W98 HydrophobicContact CE3-CD2 3.82Å; W96-W98 AromaticContact CE3-CE2 3.45Å; W96-W98 VanDerWaalsContact CE3-CE2 3.45Å; W96-W98 AromaticContact CE3-CG 3.38Å; W96-W98 HydrophobicContact CE3-CG 3.38Å; W96-W98 AromaticContact CE3-NE1 2.39Å; W96-W98 AromaticContact CG-CD1 3.66Å; W96-W98 AromaticContact CG-NE1 3.83Å; W96-W98 HydrophobicContact CH2-CB 3.62Å; W96-W98 AromaticContact CH2-CD1 2.09Å; W96-W98 AromaticContact CH2-CD2 2.28Å; W96-W98 HydrophobicContact CH2-CD2 2.28Å; W96-W98 AromaticContact CH2-CE2 2.28Å; W96-W98 AromaticContact CH2-CE3 3.5Å; W96-W98 HydrophobicContact CH2-CE3 3.5Å; W96-W98 AromaticContact CH2-CG 2.27Å; W96-W98 HydrophobicContact CH2-CG 2.27Å; W96-W98 HydrophobicContact CH2-CH2 4.3Å; W96-W98 AromaticContact CH2-CZ2 3.49Å; W96-W98 HydrophobicContact CH2-CZ2 3.49Å; W96-W98 VanDerWaalsContact CH2-CZ2 3.49Å; W96-W98 HydrophobicContact CH2-CZ3 4.3Å; W96-W98 AromaticContact CH2-NE1 2.1Å; W96-W98 AromaticContact CZ2-CD1 2.39Å; W96-W98 AromaticContact CZ2-CD2 3.83Å; W96-W98 HydrophobicContact CZ2-CD2 3.83Å; W96-W98 AromaticContact CZ2-CE2 3.45Å; W96-W98 VanDerWaalsContact CZ2-CE2 3.45Å; W96-W98 AromaticContact CZ2-CG 3.39Å; W96-W98 HydrophobicContact CZ2-CG 3.39Å; W96-W98 AromaticContact CZ2-NE1 2.4Å; W96-W98 HydrophobicContact CZ3-CB 3.47Å; W96-W98 VanDerWaalsContact CZ3-CB 3.47Å; W96-W98 AromaticContact CZ3-CD1 2.09Å; W96-W98 AromaticContact CZ3-CD2 2.28Å; W96-W98 HydrophobicContact CZ3-CD2 2.28Å; W96-W98 AromaticContact CZ3-CE2 2.28Å; W96-W98 AromaticContact CZ3-CE3 3.47Å; W96-W98 HydrophobicContact CZ3-CE3 3.47Å; W96-W98 VanDerWaalsContact CZ3-CE3 3.47Å; W96-W98 AromaticContact CZ3-CG 2.27Å; W96-W98 HydrophobicContact CZ3-CG 2.27Å; W96-W98 HydrophobicContact CZ3-CH2 4.28Å; W96-W98 AromaticContact CZ3-CZ2 3.47Å; W96-W98 HydrophobicContact CZ3-CZ2 3.47Å; W96-W98 VanDerWaalsContact CZ3-CZ2 3.47Å; W96-W98 HydrophobicContact CZ3-CZ3 4.27Å; W96-W98 AromaticContact CZ3-NE1 2.1Å; W96-W98 AromaticContact NE1-CD1 3.64Å; W96-W98 AromaticContact NE1-NE1 3.67Å; W96-W98 PolarHBondContact O-N 3.34Å; W98-V100 PolarHBondContact O-N 2.78Å; W98-Q446 HydrophobicContact CH2-CG 4.43Å; W98-S449 WeakPolarHBondContact CZ2-OG 3.48Å
99	S	34.4	Very low	49.6	Very low	75 Å²	75	125.2 Å²	125.2	52%	0.524	60%	0.603	S	S	.	*			trans	-68.2	79	151.1	42	0	0	0	0	109.3	F97 R101	F97-S99 VanDerWaalsContact C-N 3.26Å; F97-S99 WeakPolarHBondContact CD1-OG 3.23Å; S99-R101 PolarHBondContact O-N 3.22Å; S99-R101 VanDerWaalsContact O-N 3.12Å
100	V	37.6	Very low	47.9	Very low	71 Å²	71	121.3 Å²	121.3	43%	0.43	61%	0.606	S	S	.	*			trans	-40.8	120.6	136	173.6	0	0	0	0	104.9	W98 M102 T543	W98-V100 PolarHBondContact O-N 2.78Å; V100-M102 PolarHBondContact O-N 3.48Å; V100-T543 HydrophobicContact CG1-CG2 3.86Å; V100-T543 WeakPolarHBondContact CG1-OG1 3.29Å
101	R	34.9	Very low	46	Very low	196 Å²	196	125.1 Å²	125.1	74%	0.74	64%	0.635	S	S	*	*			trans	-67.4	106.7	-167.7	-58.3	-175.4	-169.4	161.9	5.1	108	S99 Q103	S99-R101 PolarHBondContact O-N 3.22Å; S99-R101 VanDerWaalsContact O-N 3.12Å; R101-Q103 HydrophobicContact CB-CB 3.82Å; R101-Q103 VanDerWaalsContact CD-OE1 3.27Å; R101-Q103 VanDerWaalsContact NH1-OE1 3.12Å; R101-Q103 PolarHBondContact O-N 2.9Å
102	M	38.1	Very low	44.2	Very low	158 Å²	158	127.6 Å²	127.6	78%	0.778	67%	0.665	S	S	*	*			trans	-67.2	54.8	149.7	-68.4	-66.5	178.5	0	0	108.6	V100 K104	V100-M102 PolarHBondContact O-N 3.48Å; M102-K104 VanDerWaalsContact C-N 3.28Å; M102-K104 PolarHBondContact O-N 2.9Å
103	Q	37.6	Very low	42.8	Very low	100 Å²	100	124.5 Å²	124.5	47%	0.467	66%	0.661	S	S	.	*			trans	-68	95.8	167.5	-178.3	165.4	-31.4	0	0	103.6	R101 H105	R101-Q103 HydrophobicContact CB-CB 3.82Å; R101-Q103 VanDerWaalsContact CD-OE1 3.27Å; R101-Q103 VanDerWaalsContact NH1-OE1 3.12Å; R101-Q103 PolarHBondContact O-N 2.9Å; Q103-H105 PolarHBondContact NE2-NE2 3.48Å; Q103-H105 PolarHBondContact O-CD2 3.4Å; Q103-H105 PolarHBondContact O-N 3.13Å
104	K	34.6	Very low	41.6	Very low	201 Å²	201	129.3 Å²	129.3	87%	0.874	69%	0.687	S	S	*	*			trans	-53.7	93	171.5	-72.5	-174.7	174	-172.4	0	107.5	M102 P106	M102-K104 VanDerWaalsContact C-N 3.28Å; M102-K104 PolarHBondContact O-N 2.9Å; K104-P106 WeakPolarHBondContact O-CD 3.43Å
105	H	36.1	Very low	40.6	Very low	145 Å²	145	135 Å²	135	67%	0.671	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-67	122.6	172.9	-98.9	-96.4	0	0	0	106.4	Q103	Q103-H105 PolarHBondContact NE2-NE2 3.48Å; Q103-H105 PolarHBondContact O-CD2 3.4Å; Q103-H105 PolarHBondContact O-N 3.13Å
106	P	38.9	Very low	40.5	Very low	107 Å²	107	137.5 Å²	137.5	70%	0.695	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-63.3	143.2	-179	26.8	-33.6	0	0	0	109.2	K104 S108	K104-P106 WeakPolarHBondContact O-CD 3.43Å; P106-S108 PolarHBondContact O-N 3.39Å
107	T	34	Very low	40.8	Very low	141 Å²	141	133.9 Å²	133.9	87%	0.865	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-54.8	120.3	178.8	46.7	0	0	0	0	111.6
108	S	40.6	Very low	42.1	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	71%	0.707	S	S	*	*			trans	-144.2	78.6	170	65.8	0	0	0	0	111.6	P106 A110	P106-S108 PolarHBondContact O-N 3.39Å; S108-A110 PolarHBondContact O-N 3.27Å
109	N	32.9	Very low	43.8	Very low	168 Å²	168	127.2 Å²	127.2	90%	0.898	70%	0.697	S	S	*	*			trans	29.8	83.6	149.1	-53.8	-0.5	0	0	0	116.9
110	A	38.9	Very low	46.1	Very low	90 Å²	90	125 Å²	125	74%	0.744	69%	0.685	S	S	*	*			trans	-113.3	141	155.4	0	0	0	0	0	108.6	S108	S108-A110 PolarHBondContact O-N 3.27Å
111	C	36.2	Very low	48.4	Very low	124 Å²	124	121.8 Å²	121.8	84%	0.838	67%	0.666	S	S	*	*			trans	-87.3	116.9	-169.2	-66.5	0	0	0	0	112.6	E113	C111-E113 PolarHBondContact O-N 3.48Å
112	A	35.5	Very low	51	Low	112 Å²	112	114.3 Å²	114.3	93%	0.926	64%	0.644	S	S	*	*			trans	44.8	25.6	131	0	0	0	0	0	120.3
113	E	43.9	Very low	53.4	Low	170 Å²	170	110 Å²	110	79%	0.794	63%	0.626	S	S	*	*			trans	-94.8	142.1	161.4	-167.4	168.5	-171.8	0	0	108.8	C111 E115	C111-E113 PolarHBondContact O-N 3.48Å; E113-E115 PolarHBondContact O-N 3.35Å
114	M	46.8	Very low	55.9	Low	178 Å²	178	109.5 Å²	109.5	88%	0.877	63%	0.627	S	S	*	*			trans	-69.5	85.6	-165	-170.1	169.6	70.2	0	0	112.1	R116	M114-R116 PolarHBondContact O-N 2.88Å; M114-R116 VanDerWaalsContact O-N 3.11Å
115	E	51.2	Low	58.6	Low	169 Å²	169	100.1 Å²	100.1	79%	0.79	59%	0.586	S	S	*	*			trans	-54.9	114.6	-169.8	-66.2	-167.4	134.9	0	0	112.1	E113	E113-E115 PolarHBondContact O-N 3.35Å
116	R	59.9	Low	61.1	Low	188 Å²	188	95.1 Å²	95.1	71%	0.709	56%	0.564	S	S	*	*			trans	-63.1	132.2	165.8	-73.1	-176.3	174.3	87.6	-4.3	108.2	M114	M114-R116 PolarHBondContact O-N 2.88Å; M114-R116 VanDerWaalsContact O-N 3.11Å
117	P	62.1	Low	63.5	Low	47 Å²	47	95.1 Å²	95.1	31%	0.305	55%	0.553	S	S	.	*			trans	-47.4	150	170	-31.5	36.9	0	0	0	112.6	N119 G120 L121 V123	P117-N119 PolarHBondContact O-N 2.96Å; P117-G120 PolarHBondContact O-N 3.27Å; P117-L121 WeakPolarHBondContact CD-O 3.18Å; P117-V123 HydrophobicContact CG-CG2 4.2Å
118	A	69.7	Low	66.2	Low	104 Å²	104	91.2 Å²	91.2	86%	0.86	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-0.5	-169.6	0	0	0	0	0	116.1
119	N	76.1	Confident	68.4	Low	24 Å²	24	88.1 Å²	88.1	13%	0.128	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-1.4	171.9	66.4	5.2	0	0	0	114.7	P117 L121 N126 F542	P117-N119 PolarHBondContact O-N 2.96Å; N119-L121 PolarHBondContact O-N 3.39Å; N119-L121 WeakPolarHBondContact OD1-CB 3.43Å; N119-L121 PolarHBondContact OD1-N 3.37Å; N119-L121 VanDerWaalsContact OD1-N 3.1Å; N119-N126 PolarHBondContact ND2-OD1 3.45Å; N119-N126 PolarHBondContact OD1-ND2 2.86Å; N119-F542 HydrophobicContact CB-CB 4.03Å; N119-F542 HydrophobicContact CB-CD1 3.36Å; N119-F542 HydrophobicContact CB-CD2 3.38Å; N119-F542 HydrophobicContact CB-CE1 3.5Å; N119-F542 VanDerWaalsContact CB-CE1 3.5Å; N119-F542 HydrophobicContact CB-CE2 3.51Å; N119-F542 HydrophobicContact CB-CG 3.3Å; N119-F542 HydrophobicContact CB-CZ 3.57Å
120	G	83	Confident	70.9	Confident	27 Å²	27	85.4 Å²	85.4	28%	0.278	48%	0.484	S	S	.	.	S	Bend	trans	79.7	-12.9	-179.5	0	0	0	0	0	114.9	P117 I171	P117-G120 PolarHBondContact O-N 3.27Å; G120-I171 WeakPolarHBondContact O-CD1 3.38Å
121	L	86.1	Confident	73.2	Confident	4 Å²	4	83.9 Å²	83.9	2%	0.021	47%	0.465	C	S	.	.			trans	-75.3	149.6	178.6	-47.7	-178.9	0	0	0	110.2	P117 N119 N126 L129 C168 I171 V172	P117-L121 WeakPolarHBondContact CD-O 3.18Å; N119-L121 PolarHBondContact O-N 3.39Å; N119-L121 WeakPolarHBondContact OD1-CB 3.43Å; N119-L121 PolarHBondContact OD1-N 3.37Å; N119-L121 VanDerWaalsContact OD1-N 3.1Å; L121-N126 PolarHBondContact O-ND2 2.88Å; L121-L129 HydrophobicContact CD1-CD1 3.51Å; L121-C168 HydrophobicContact CD2-CB 4.02Å; L121-I171 HydrophobicContact CD2-CB 4.02Å; L121-I171 HydrophobicContact CD2-CG2 3.79Å; L121-V172 HydrophobicContact CD1-CG2 4.29Å; L121-V172 HydrophobicContact CD2-CG2 3.79Å
122	C	89.2	Confident	75.8	Confident	40 Å²	40	79 Å²	79	27%	0.27	43%	0.43	S	S	.	.			trans	-67.3	160.7	176.3	77	0	0	0	0	111.7	D124 C125 N126 C168	C122-D124 PolarHBondContact O-N 2.92Å; C122-C125 PolarHBondContact O-N 3.24Å; C122-C125 PolarHBondContact SG-N 2.92Å; C122-C125 VanDerWaalsContact SG-N 3.37Å; C122-C125 PolarHBondContact SG-SG 3.05Å; C122-N126 PolarHBondContact O-N 3.13Å; C122-N126 VanDerWaalsContact O-N 3.08Å; C122-N126 PolarHBondContact O-ND2 3.13Å; C122-C168 PolarHBondContact N-SG 3Å
123	V	88	Confident	78	Confident	67 Å²	67	76.7 Å²	76.7	41%	0.406	40%	0.401	S	S	.	.	H	α-helix	trans	-57.3	-36.8	-176.7	174.5	0	0	0	0	111.8	P117 N126 K127	P117-V123 HydrophobicContact CG-CG2 4.2Å; V123-N126 WeakPolarHBondContact O-CB 3.24Å; V123-K127 WeakPolarHBondContact O-CG 3.24Å; V123-K127 PolarHBondContact O-N 3.15Å
124	D	90.9	Very high	80	Confident	90 Å²	90	69.6 Å²	69.6	48%	0.481	37%	0.37	S	S	.	.	H	α-helix	trans	-81.5	-35.7	-177.6	-56.1	-55.5	0	0	0	113.1	C122 N126 K127 L128	C122-D124 PolarHBondContact O-N 2.92Å; D124-N126 PolarHBondContact O-N 3.35Å; D124-K127 PolarHBondContact O-N 3.01Å; D124-K127 IonicContact OD1-NZ 2.69Å; D124-K127 PolarHBondContact OD1-NZ 3.17Å; D124-L128 VanDerWaalsContact O-CG 3.28Å; D124-L128 WeakPolarHBondContact O-CG 3.17Å; D124-L128 PolarHBondContact O-N 2.69Å
125	C	90.6	Very high	82.1	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.027	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-34.7	169.9	-74.4	0	0	0	0	111.9	C122 L128 L129 I164 C165 C168	C122-C125 PolarHBondContact O-N 3.24Å; C122-C125 PolarHBondContact SG-N 2.92Å; C122-C125 VanDerWaalsContact SG-N 3.37Å; C122-C125 PolarHBondContact SG-SG 3.05Å; C125-L128 PolarHBondContact O-N 3.46Å; C125-L129 WeakPolarHBondContact O-CB 3.45Å; C125-L129 VanDerWaalsContact O-CG 3.26Å; C125-L129 WeakPolarHBondContact O-CG 3.46Å; C125-L129 PolarHBondContact O-N 3.11Å; C125-I164 HydrophobicContact CB-CB 4.32Å; C125-I164 HydrophobicContact CB-CG2 3.98Å; C125-C165 PolarHBondContact SG-N 2.92Å; C125-C168 HydrophobicContact CB-CB 4.22Å; C125-C168 VanDerWaalsContact SG-SG 3.69Å
126	N	88.4	Confident	83.8	Confident	39 Å²	39	58.1 Å²	58.1	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-48	172.3	-83.5	-68.8	0	0	0	112.3	N119 L121 C122 V123 D124 L128 L129 E130	N119-N126 PolarHBondContact ND2-OD1 3.45Å; N119-N126 PolarHBondContact OD1-ND2 2.86Å; L121-N126 PolarHBondContact O-ND2 2.88Å; C122-N126 PolarHBondContact O-N 3.13Å; C122-N126 VanDerWaalsContact O-N 3.08Å; C122-N126 PolarHBondContact O-ND2 3.13Å; V123-N126 WeakPolarHBondContact O-CB 3.24Å; D124-N126 PolarHBondContact O-N 3.35Å; N126-L128 PolarHBondContact O-N 3.49Å; N126-L129 PolarHBondContact O-N 3.3Å; N126-E130 PolarHBondContact O-N 3.37Å
127	K	90	Very high	85	Confident	107 Å²	107	53.3 Å²	53.3	47%	0.465	32%	0.317	S	S	.	.	H	α-helix	trans	-60.4	-43.4	175.4	-62.7	166.1	-166.9	159.1	0	112.1	V123 D124 L129 E130 V131	V123-K127 WeakPolarHBondContact O-CG 3.24Å; V123-K127 PolarHBondContact O-N 3.15Å; D124-K127 PolarHBondContact O-N 3.01Å; D124-K127 IonicContact OD1-NZ 2.69Å; D124-K127 PolarHBondContact OD1-NZ 3.17Å; K127-L129 VanDerWaalsContact C-N 3.34Å; K127-L129 PolarHBondContact O-N 2.87Å; K127-E130 PolarHBondContact O-N 3.48Å; K127-V131 WeakPolarHBondContact O-CG2 3.26Å; K127-V131 PolarHBondContact O-N 3.33Å
128	L	90.4	Very high	86	Confident	59 Å²	59	59.3 Å²	59.3	31%	0.309	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-40.9	178.5	-67.3	168.6	0	0	0	111.4	D124 C125 N126 K132 Y162	D124-L128 VanDerWaalsContact O-CG 3.28Å; D124-L128 WeakPolarHBondContact O-CG 3.17Å; D124-L128 PolarHBondContact O-N 2.69Å; C125-L128 PolarHBondContact O-N 3.46Å; N126-L128 PolarHBondContact O-N 3.49Å; L128-K132 WeakPolarHBondContact O-CB 3.43Å; L128-K132 PolarHBondContact O-N 3.43Å; L128-Y162 HydrophobicContact CD2-CD1 3.78Å; L128-Y162 HydrophobicContact CD2-CE1 4.48Å
129	L	87.3	Confident	87	Confident	40 Å²	40	56.5 Å²	56.5	21%	0.209	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-41.1	174.5	-73.1	168.5	0	0	0	112.4	L121 C125 N126 K127 K132 I133 I164	L121-L129 HydrophobicContact CD1-CD1 3.51Å; C125-L129 WeakPolarHBondContact O-CB 3.45Å; C125-L129 VanDerWaalsContact O-CG 3.26Å; C125-L129 WeakPolarHBondContact O-CG 3.46Å; C125-L129 PolarHBondContact O-N 3.11Å; N126-L129 PolarHBondContact O-N 3.3Å; K127-L129 VanDerWaalsContact C-N 3.34Å; K127-L129 PolarHBondContact O-N 2.87Å; L129-K132 PolarHBondContact O-N 3.3Å; L129-I133 WeakPolarHBondContact O-CB 3.47Å; L129-I133 WeakPolarHBondContact O-CD1 3.41Å; L129-I133 VanDerWaalsContact O-CG1 3.25Å; L129-I133 WeakPolarHBondContact O-CG1 3.49Å; L129-I133 PolarHBondContact O-N 2.9Å; L129-I164 HydrophobicContact CD1-CG2 4.24Å; L129-I164 HydrophobicContact CD2-CG2 4.21Å; L129-I164 HydrophobicContact CG-CG2 4.06Å
130	E	84.8	Confident	87.5	Confident	110 Å²	110	59.9 Å²	59.9	51%	0.514	33%	0.328	S	S	.	.	H	α-helix	trans	-60.6	-48.6	175.1	-170.5	-167.3	159.8	0	0	111.5	N126 K127 K132 I133 S134	N126-E130 PolarHBondContact O-N 3.37Å; K127-E130 PolarHBondContact O-N 3.48Å; E130-K132 VanDerWaalsContact C-N 3.34Å; E130-K132 PolarHBondContact O-N 3.4Å; E130-I133 PolarHBondContact O-N 3.47Å; E130-S134 VanDerWaalsContact O-CB 3.26Å; E130-S134 WeakPolarHBondContact O-CB 3.29Å; E130-S134 PolarHBondContact O-N 2.95Å
131	V	88.1	Confident	87.8	Confident	58 Å²	58	60.6 Å²	60.6	35%	0.352	33%	0.327	S	S	.	.	H	α-helix	trans	-59.6	-45.2	176.4	172	0	0	0	0	110.9	K127 S134 M135 Y162	K127-V131 WeakPolarHBondContact O-CG2 3.26Å; K127-V131 PolarHBondContact O-N 3.33Å; V131-S134 WeakPolarHBondContact O-CB 3.35Å; V131-S134 PolarHBondContact O-N 3.48Å; V131-M135 HydrophobicContact CG1-CE 4.03Å; V131-M135 HydrophobicContact CG1-SD 4.42Å; V131-M135 WeakPolarHBondContact O-CG 3.4Å; V131-M135 PolarHBondContact O-N 2.92Å; V131-Y162 HydrophobicContact CB-CE1 4.33Å; V131-Y162 HydrophobicContact CG1-CD1 4.16Å; V131-Y162 HydrophobicContact CG1-CE1 3.56Å; V131-Y162 HydrophobicContact CG1-CE2 4.39Å
132	K	89.5	Confident	87.8	Confident	21 Å²	21	66.8 Å²	66.8	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-62.6	-42.7	178.2	174.6	177.3	165.7	-166.4	0	112.8	L128 L129 E130 M135 L136 L158 E159 Y162	L128-K132 WeakPolarHBondContact O-CB 3.43Å; L128-K132 PolarHBondContact O-N 3.43Å; L129-K132 PolarHBondContact O-N 3.3Å; E130-K132 VanDerWaalsContact C-N 3.34Å; E130-K132 PolarHBondContact O-N 3.4Å; K132-M135 PolarHBondContact O-N 2.75Å; K132-L136 HydrophobicContact CG-CD1 4.46Å; K132-L136 WeakPolarHBondContact O-CG 3.45Å; K132-L136 PolarHBondContact O-N 3.07Å; K132-L158 HydrophobicContact CG-CB 4.32Å; K132-E159 VanDerWaalsContact CE-CD 3.48Å; K132-E159 WeakPolarHBondContact CE-OE1 3.44Å; K132-E159 IonicContact NZ-OE1 2.62Å; K132-E159 PolarHBondContact NZ-OE1 2.81Å; K132-E159 IonicContact NZ-OE2 3.02Å; K132-E159 PolarHBondContact NZ-OE2 3.41Å; K132-Y162 HydrophobicContact CB-CG 4.36Å
133	I	82.7	Confident	87.6	Confident	64 Å²	64	68.3 Å²	68.3	33%	0.328	37%	0.371	S	S	.	.	H	α-helix	trans	-64.2	-44.4	173.7	-70.1	163.2	0	0	0	110.4	L129 E130 M135 L136 A137 V537	L129-I133 WeakPolarHBondContact O-CB 3.47Å; L129-I133 WeakPolarHBondContact O-CD1 3.41Å; L129-I133 VanDerWaalsContact O-CG1 3.25Å; L129-I133 WeakPolarHBondContact O-CG1 3.49Å; L129-I133 PolarHBondContact O-N 2.9Å; E130-I133 PolarHBondContact O-N 3.47Å; I133-M135 VanDerWaalsContact C-N 3.29Å; I133-M135 PolarHBondContact O-N 3.34Å; I133-L136 PolarHBondContact O-N 3.45Å; I133-A137 WeakPolarHBondContact O-CB 3.22Å; I133-A137 PolarHBondContact O-N 3.39Å; I133-V537 HydrophobicContact CD1-CG1 4.32Å; I133-V537 HydrophobicContact CG2-CB 4.17Å; I133-V537 HydrophobicContact CG2-CG1 3.82Å
134	S	85.7	Confident	87.4	Confident	21 Å²	21	73 Å²	73	15%	0.147	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-35.7	177	-172.4	0	0	0	0	112.5	E130 V131 R138 Q534	E130-S134 VanDerWaalsContact O-CB 3.26Å; E130-S134 WeakPolarHBondContact O-CB 3.29Å; E130-S134 PolarHBondContact O-N 2.95Å; V131-S134 WeakPolarHBondContact O-CB 3.35Å; V131-S134 PolarHBondContact O-N 3.48Å; S134-R138 VanDerWaalsContact O-CD 3.26Å; S134-R138 WeakPolarHBondContact O-CD 3.45Å; S134-R138 WeakPolarHBondContact O-CG 2.92Å; S134-R138 PolarHBondContact O-N 3.23Å; S134-Q534 PolarHBondContact OG-NE2 2.93Å
135	M	89.5	Confident	87	Confident	59 Å²	59	79.4 Å²	79.4	29%	0.291	41%	0.406	S	S	.	.	H	α-helix	trans	-73.5	-45.7	174.1	-74.4	-167.4	178.4	0	0	112.7	V131 K132 I133 A137 R138 F139 Y154 L158 Y162	V131-M135 HydrophobicContact CG1-CE 4.03Å; V131-M135 HydrophobicContact CG1-SD 4.42Å; V131-M135 WeakPolarHBondContact O-CG 3.4Å; V131-M135 PolarHBondContact O-N 2.92Å; K132-M135 PolarHBondContact O-N 2.75Å; I133-M135 VanDerWaalsContact C-N 3.29Å; I133-M135 PolarHBondContact O-N 3.34Å; M135-A137 VanDerWaalsContact C-N 3.28Å; M135-A137 PolarHBondContact O-N 3.35Å; M135-R138 CarbonylContact O-C 3.56Å; M135-R138 WeakPolarHBondContact O-CA 3.43Å; M135-R138 PolarHBondContact O-N 3.34Å; M135-F139 PolarHBondContact O-N 3.23Å; M135-Y154 PolarHBondContact O-OH 2.96Å; M135-L158 HydrophobicContact CB-CD1 3.73Å; M135-L158 HydrophobicContact CB-CD2 3.95Å; M135-L158 HydrophobicContact CG-CD2 4.4Å; M135-L158 HydrophobicContact SD-CD2 3.55Å; M135-L158 VanDerWaalsContact SD-CD2 3.55Å; M135-Y162 HydrophobicContact CE-CE2 4.28Å; M135-Y162 VanDerWaalsContact CE-OH 3.24Å; M135-Y162 WeakPolarHBondContact CE-OH 3.45Å; M135-Y162 HydrophobicContact SD-CE2 3.65Å
136	L	88.4	Confident	86.7	Confident	47 Å²	47	82.1 Å²	82.1	25%	0.246	42%	0.42	C	S	.	.	H	α-helix	trans	-56.8	-41.4	173.8	-73.9	169.2	0	0	0	112	K132 I133 R138 F139 M151 Y154 R155 L158	K132-L136 HydrophobicContact CG-CD1 4.46Å; K132-L136 WeakPolarHBondContact O-CG 3.45Å; K132-L136 PolarHBondContact O-N 3.07Å; I133-L136 PolarHBondContact O-N 3.45Å; L136-R138 PolarHBondContact O-N 2.95Å; L136-F139 WeakPolarHBondContact O-CB 3.35Å; L136-F139 PolarHBondContact O-N 2.93Å; L136-M151 HydrophobicContact CD2-SD 4.47Å; L136-Y154 HydrophobicContact CD2-CD1 4.32Å; L136-R155 HydrophobicContact CD2-CB 4.2Å; L136-R155 HydrophobicContact CD2-CG 4.38Å; L136-L158 HydrophobicContact CD2-CD1 3.82Å; L136-L158 HydrophobicContact CG-CD1 3.76Å
137	A	83.6	Confident	86.5	Confident	87 Å²	87	81.6 Å²	81.6	72%	0.719	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-8	176.2	0	0	0	0	0	114.5	I133 M135	I133-A137 WeakPolarHBondContact O-CB 3.22Å; I133-A137 PolarHBondContact O-N 3.39Å; M135-A137 VanDerWaalsContact C-N 3.28Å; M135-A137 PolarHBondContact O-N 3.35Å
138	R	84.2	Confident	86.1	Confident	173 Å²	173	82.4 Å²	82.4	65%	0.653	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	1.1	176.5	-70.6	169.8	-175.4	-177.5	1.2	113.1	S134 M135 L136 S140	S134-R138 VanDerWaalsContact O-CD 3.26Å; S134-R138 WeakPolarHBondContact O-CD 3.45Å; S134-R138 WeakPolarHBondContact O-CG 2.92Å; S134-R138 PolarHBondContact O-N 3.23Å; M135-R138 CarbonylContact O-C 3.56Å; M135-R138 WeakPolarHBondContact O-CA 3.43Å; M135-R138 PolarHBondContact O-N 3.34Å; L136-R138 PolarHBondContact O-N 2.95Å; R138-S140 PolarHBondContact O-N 3.44Å
139	F	89.7	Confident	86.1	Confident	45 Å²	45	85.9 Å²	85.9	20%	0.197	44%	0.437	C	S	.	.			trans	-61.2	135.5	175.7	176.6	-95.6	0	0	0	110.9	M135 L136 P141 E150 M151 Y154	M135-F139 PolarHBondContact O-N 3.23Å; L136-F139 WeakPolarHBondContact O-CB 3.35Å; L136-F139 PolarHBondContact O-N 2.93Å; F139-P141 HydrophobicContact CE1-CB 4.02Å; F139-P141 HydrophobicContact CE1-CG 4.46Å; F139-P141 HydrophobicContact CZ-CB 4.13Å; F139-E150 HydrophobicContact CE2-CB 4.23Å; F139-E150 HydrophobicContact CZ-CB 3.69Å; F139-M151 HydrophobicContact CB-CE 4.25Å; F139-M151 HydrophobicContact CD1-CE 3.33Å; F139-M151 HydrophobicContact CD1-SD 4.17Å; F139-M151 HydrophobicContact CE1-CB 4.22Å; F139-M151 HydrophobicContact CE1-CE 3.89Å; F139-M151 HydrophobicContact CG-CE 3.95Å; F139-M151 HydrophobicContact CG-SD 4.34Å; F139-M151 HydrophobicContact CZ-CB 4.42Å; F139-Y154 HydrophobicContact CB-CD1 3.91Å; F139-Y154 HydrophobicContact CB-CE1 3.83Å; F139-Y154 AromaticContact CD2-CD1 3.4Å; F139-Y154 HydrophobicContact CD2-CD1 3.4Å; F139-Y154 HydrophobicContact CD2-CD2 4.32Å; F139-Y154 AromaticContact CD2-CE1 3.94Å; F139-Y154 HydrophobicContact CD2-CE1 3.94Å; F139-Y154 AromaticContact CD2-CG 3.61Å; F139-Y154 HydrophobicContact CD2-CG 3.61Å; F139-Y154 HydrophobicContact CE2-CD1 4.29Å; F139-Y154 HydrophobicContact CE2-CG 4.11Å; F139-Y154 AromaticContact CG-CD1 3.98Å; F139-Y154 HydrophobicContact CG-CD1 3.98Å; F139-Y154 HydrophobicContact CG-CE1 4.34Å
140	S	88.5	Confident	86.2	Confident	96 Å²	96	85.2 Å²	85.2	67%	0.671	43%	0.433	S	S	*	.			trans	-132.7	128.7	167.6	-178.4	0	0	0	0	107.2	R138	R138-S140 PolarHBondContact O-N 3.44Å
141	P	88	Confident	86.4	Confident	41 Å²	41	83.3 Å²	83.3	27%	0.266	43%	0.425	S	S	.	.			trans	-66.3	152.8	177.2	29.6	-35.6	0	0	0	111.2	F139 C147 E150	F139-P141 HydrophobicContact CE1-CB 4.02Å; F139-P141 HydrophobicContact CE1-CG 4.46Å; F139-P141 HydrophobicContact CZ-CB 4.13Å; P141-C147 HydrophobicContact CB-CB 3.97Å; P141-C147 HydrophobicContact CG-CB 4.31Å; P141-E150 VanDerWaalsContact CA-OE2 3.22Å; P141-E150 WeakPolarHBondContact CA-OE2 3.37Å; P141-E150 WeakPolarHBondContact CB-OE2 3.05Å
142	T	86.1	Confident	86.5	Confident	135 Å²	135	85.5 Å²	85.5	83%	0.828	44%	0.435	S	S	*	.	S	Bend	trans	-88.9	-32.4	169.2	37.4	0	0	0	0	112.6	E150	T142-E150 PolarHBondContact N-OE2 3.31Å; T142-E150 PolarHBondContact OG1-OE1 3.16Å; T142-E150 PolarHBondContact OG1-OE2 3.22Å
143	D	84.6	Confident	86.5	Confident	72 Å²	72	89.2 Å²	89.2	39%	0.385	46%	0.456	S	S	.	.			trans	-129.1	119.3	168.4	-179.1	5.8	0	0	0	110.6	R145 N146 C147 E150	D143-R145 PolarHBondContact O-N 3.3Å; D143-R145 VanDerWaalsContact O-N 3.1Å; D143-R145 WeakPolarHBondContact OD1-CB 3.28Å; D143-R145 WeakPolarHBondContact OD1-CG 3.48Å; D143-R145 PolarHBondContact OD1-N 2.94Å; D143-N146 HydrophobicContact CB-CB 4.06Å; D143-N146 CarbonylContact O-C 3.43Å; D143-N146 PolarHBondContact O-N 2.96Å; D143-C147 PolarHBondContact O-N 3Å; D143-E150 PolarHBondContact N-OE1 2.8Å; D143-E150 PolarHBondContact N-OE2 3.13Å
144	E	84.2	Confident	87	Confident	164 Å²	164	89.7 Å²	89.7	77%	0.766	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-48.2	-36.3	173.2	-161.3	88	-138.4	0	0	112.1	N146 C147	E144-N146 VanDerWaalsContact C-N 3.3Å; E144-N146 PolarHBondContact O-N 3.16Å; E144-C147 WeakPolarHBondContact O-CB 3.43Å
145	R	82.9	Confident	87.1	Confident	225 Å²	225	95.1 Å²	95.1	85%	0.849	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-74.6	-19.1	-178.9	-57.2	173.7	174.1	-171.8	-1.1	113.8	D143	D143-R145 PolarHBondContact O-N 3.3Å; D143-R145 VanDerWaalsContact O-N 3.1Å; D143-R145 WeakPolarHBondContact OD1-CB 3.28Å; D143-R145 WeakPolarHBondContact OD1-CG 3.48Å; D143-R145 PolarHBondContact OD1-N 2.94Å
146	N	83.5	Confident	87.2	Confident	61 Å²	61	95 Å²	95	33%	0.326	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-114.4	2.5	-175.3	-167.1	48.4	0	0	0	111.6	D143 E144 E148 K149 E150	D143-N146 HydrophobicContact CB-CB 4.06Å; D143-N146 CarbonylContact O-C 3.43Å; D143-N146 PolarHBondContact O-N 2.96Å; E144-N146 VanDerWaalsContact C-N 3.3Å; E144-N146 PolarHBondContact O-N 3.16Å; N146-E148 VanDerWaalsContact C-N 3.32Å; N146-E148 PolarHBondContact O-N 3.2Å; N146-E148 VanDerWaalsContact O-N 3.16Å; N146-K149 PolarHBondContact O-N 3.43Å; N146-K149 WeakPolarHBondContact OD1-CD 3.14Å; N146-E150 HydrophobicContact CB-CG 4.33Å; N146-E150 VanDerWaalsContact ND2-CG 3.28Å; N146-E150 WeakPolarHBondContact ND2-CG 3.38Å; N146-E150 PolarHBondContact ND2-OE1 3.37Å; N146-E150 PolarHBondContact O-N 3.45Å
147	C	85.6	Confident	87.4	Confident	29 Å²	29	95.6 Å²	95.6	20%	0.196	49%	0.488	C	S	.	.	H	α-helix	trans	-48.4	-43.8	-172.5	-178.6	0	0	0	0	114.1	P141 D143 E144 K149 E150 M151	P141-C147 HydrophobicContact CB-CB 3.97Å; P141-C147 HydrophobicContact CG-CB 4.31Å; D143-C147 PolarHBondContact O-N 3Å; E144-C147 WeakPolarHBondContact O-CB 3.43Å; C147-K149 PolarHBondContact O-N 3.18Å; C147-E150 PolarHBondContact O-N 3.14Å; C147-M151 VanDerWaalsContact O-CB 3.24Å; C147-M151 WeakPolarHBondContact O-CB 3.42Å; C147-M151 PolarHBondContact O-N 3.37Å
148	E	82	Confident	87.7	Confident	124 Å²	124	91.7 Å²	91.7	58%	0.579	46%	0.455	S	S	*	.	H	α-helix	trans	-59.1	-47.2	176.2	-62.5	-170.2	147.3	0	0	112.2	N146 M151 D152 L457	N146-E148 VanDerWaalsContact C-N 3.32Å; N146-E148 PolarHBondContact O-N 3.2Å; N146-E148 VanDerWaalsContact O-N 3.16Å; E148-M151 PolarHBondContact O-N 2.88Å; E148-D152 WeakPolarHBondContact O-CB 3.44Å; E148-D152 PolarHBondContact O-N 3.13Å; E148-L457 HydrophobicContact CG-CD1 4.11Å
149	K	89.1	Confident	88	Confident	131 Å²	131	87.1 Å²	87.1	57%	0.57	44%	0.441	S	S	*	.	H	α-helix	trans	-72.2	-35.4	-178.2	-171.9	-176.3	-178.8	-175.3	0	111.8	N146 C147 N153	N146-K149 PolarHBondContact O-N 3.43Å; N146-K149 WeakPolarHBondContact OD1-CD 3.14Å; C147-K149 PolarHBondContact O-N 3.18Å; K149-N153 VanDerWaalsContact O-CB 3.24Å; K149-N153 WeakPolarHBondContact O-CB 3.36Å; K149-N153 PolarHBondContact O-N 3.04Å; K149-N153 PolarHBondContact O-ND2 3.05Å
150	E	90.3	Very high	88	Confident	27 Å²	27	89.8 Å²	89.8	13%	0.126	46%	0.457	C	S	.	.	H	α-helix	trans	-66.6	-42.6	173.2	-65.8	179.3	179.1	0	0	111.3	F139 P141 T142 D143 N146 C147 N153 Y154	F139-E150 HydrophobicContact CE2-CB 4.23Å; F139-E150 HydrophobicContact CZ-CB 3.69Å; P141-E150 VanDerWaalsContact CA-OE2 3.22Å; P141-E150 WeakPolarHBondContact CA-OE2 3.37Å; P141-E150 WeakPolarHBondContact CB-OE2 3.05Å; T142-E150 PolarHBondContact N-OE2 3.31Å; T142-E150 PolarHBondContact OG1-OE1 3.16Å; T142-E150 PolarHBondContact OG1-OE2 3.22Å; D143-E150 PolarHBondContact N-OE1 2.8Å; D143-E150 PolarHBondContact N-OE2 3.13Å; N146-E150 HydrophobicContact CB-CG 4.33Å; N146-E150 VanDerWaalsContact ND2-CG 3.28Å; N146-E150 WeakPolarHBondContact ND2-CG 3.38Å; N146-E150 PolarHBondContact ND2-OE1 3.37Å; N146-E150 PolarHBondContact O-N 3.45Å; C147-E150 PolarHBondContact O-N 3.14Å; E150-N153 PolarHBondContact O-N 3.22Å; E150-Y154 WeakPolarHBondContact O-CB 3.46Å; E150-Y154 PolarHBondContact O-N 3.47Å
151	M	89.2	Confident	88.2	Confident	69 Å²	69	90.1 Å²	90.1	34%	0.34	45%	0.451	S	S	.	.	H	α-helix	trans	-61.9	-47.5	174.1	177.5	63.8	76.6	0	0	111.7	L136 F139 C147 E148 Y154 R155	L136-M151 HydrophobicContact CD2-SD 4.47Å; F139-M151 HydrophobicContact CB-CE 4.25Å; F139-M151 HydrophobicContact CD1-CE 3.33Å; F139-M151 HydrophobicContact CD1-SD 4.17Å; F139-M151 HydrophobicContact CE1-CB 4.22Å; F139-M151 HydrophobicContact CE1-CE 3.89Å; F139-M151 HydrophobicContact CG-CE 3.95Å; F139-M151 HydrophobicContact CG-SD 4.34Å; F139-M151 HydrophobicContact CZ-CB 4.42Å; C147-M151 VanDerWaalsContact O-CB 3.24Å; C147-M151 WeakPolarHBondContact O-CB 3.42Å; C147-M151 PolarHBondContact O-N 3.37Å; E148-M151 PolarHBondContact O-N 2.88Å; M151-Y154 PolarHBondContact O-N 2.94Å; M151-R155 WeakPolarHBondContact O-CB 3.22Å; M151-R155 PolarHBondContact O-N 2.9Å
152	D	88.8	Confident	88.3	Confident	104 Å²	104	90.5 Å²	90.5	56%	0.556	45%	0.447	S	S	*	.	H	α-helix	trans	-63.9	-42.6	177.9	-88.4	-11.6	0	0	0	111.9	E148 R155 A156	E148-D152 WeakPolarHBondContact O-CB 3.44Å; E148-D152 PolarHBondContact O-N 3.13Å; D152-R155 PolarHBondContact O-N 3.21Å; D152-A156 WeakPolarHBondContact O-CB 3.44Å; D152-A156 PolarHBondContact O-N 3.43Å
153	N	90.2	Very high	88.4	Confident	99 Å²	99	92.1 Å²	92.1	53%	0.529	44%	0.438	S	S	.	.	H	α-helix	trans	-63.4	-44.6	174.5	-75.4	-20.4	0	0	0	112	K149 E150 A156 S157	K149-N153 VanDerWaalsContact O-CB 3.24Å; K149-N153 WeakPolarHBondContact O-CB 3.36Å; K149-N153 PolarHBondContact O-N 3.04Å; K149-N153 PolarHBondContact O-ND2 3.05Å; E150-N153 PolarHBondContact O-N 3.22Å; N153-A156 PolarHBondContact O-N 2.83Å; N153-S157 WeakPolarHBondContact O-CB 3.27Å; N153-S157 PolarHBondContact O-N 2.95Å
154	Y	92.1	Very high	88.7	Confident	75 Å²	75	90.4 Å²	90.4	29%	0.294	43%	0.428	S	S	.	.	H	α-helix	trans	-64.8	-43.4	178.7	-175.4	-114.8	0	0	0	111	M135 L136 F139 E150 M151 S157 L158	M135-Y154 PolarHBondContact O-OH 2.96Å; L136-Y154 HydrophobicContact CD2-CD1 4.32Å; F139-Y154 HydrophobicContact CB-CD1 3.91Å; F139-Y154 HydrophobicContact CB-CE1 3.83Å; F139-Y154 AromaticContact CD2-CD1 3.4Å; F139-Y154 HydrophobicContact CD2-CD1 3.4Å; F139-Y154 HydrophobicContact CD2-CD2 4.32Å; F139-Y154 AromaticContact CD2-CE1 3.94Å; F139-Y154 HydrophobicContact CD2-CE1 3.94Å; F139-Y154 AromaticContact CD2-CG 3.61Å; F139-Y154 HydrophobicContact CD2-CG 3.61Å; F139-Y154 HydrophobicContact CE2-CD1 4.29Å; F139-Y154 HydrophobicContact CE2-CG 4.11Å; F139-Y154 AromaticContact CG-CD1 3.98Å; F139-Y154 HydrophobicContact CG-CD1 3.98Å; F139-Y154 HydrophobicContact CG-CE1 4.34Å; E150-Y154 WeakPolarHBondContact O-CB 3.46Å; E150-Y154 PolarHBondContact O-N 3.47Å; M151-Y154 PolarHBondContact O-N 2.94Å; Y154-S157 WeakPolarHBondContact O-CB 3.43Å; Y154-S157 PolarHBondContact O-N 2.84Å; Y154-L158 HydrophobicContact CD1-CD1 3.89Å; Y154-L158 HydrophobicContact CE1-CD1 3.47Å; Y154-L158 VanDerWaalsContact CE1-CD1 3.47Å; Y154-L158 HydrophobicContact CE1-CG 4.26Å; Y154-L158 HydrophobicContact CE2-CD1 4.48Å; Y154-L158 HydrophobicContact CE2-CG 4.46Å; Y154-L158 WeakPolarHBondContact O-CG 3.42Å; Y154-L158 PolarHBondContact O-N 2.87Å
155	R	89.7	Confident	89.1	Confident	134 Å²	134	84.5 Å²	84.5	51%	0.506	41%	0.405	S	S	.	.	H	α-helix	trans	-59.4	-48.7	172.9	-176.2	177.8	-174.6	149.8	4.7	111.5	L136 M151 D152 S157 L158 E159	L136-R155 HydrophobicContact CD2-CB 4.2Å; L136-R155 HydrophobicContact CD2-CG 4.38Å; M151-R155 WeakPolarHBondContact O-CB 3.22Å; M151-R155 PolarHBondContact O-N 2.9Å; D152-R155 PolarHBondContact O-N 3.21Å; R155-S157 VanDerWaalsContact C-N 3.3Å; R155-S157 PolarHBondContact O-N 2.92Å; R155-L158 PolarHBondContact O-N 3.41Å; R155-E159 HydrophobicContact CG-CG 4.4Å; R155-E159 WeakPolarHBondContact O-CB 3.45Å; R155-E159 VanDerWaalsContact O-CG 3.31Å; R155-E159 WeakPolarHBondContact O-CG 3.35Å; R155-E159 PolarHBondContact O-N 2.86Å
156	A	89.9	Confident	89.5	Confident	57 Å²	57	77.8 Å²	77.8	47%	0.471	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-37.2	177.8	0	0	0	0	0	112.5	D152 N153 N160	D152-A156 WeakPolarHBondContact O-CB 3.44Å; D152-A156 PolarHBondContact O-N 3.43Å; N153-A156 PolarHBondContact O-N 2.83Å; A156-N160 PolarHBondContact O-N 3.37Å
157	S	92.6	Very high	89.9	Confident	59 Å²	59	80.7 Å²	80.7	41%	0.413	40%	0.402	S	S	.	.	H	α-helix	trans	-63.1	-48.5	172.7	-172.2	0	0	0	0	111.6	N153 Y154 R155 E159 N160 I161	N153-S157 WeakPolarHBondContact O-CB 3.27Å; N153-S157 PolarHBondContact O-N 2.95Å; Y154-S157 WeakPolarHBondContact O-CB 3.43Å; Y154-S157 PolarHBondContact O-N 2.84Å; R155-S157 VanDerWaalsContact C-N 3.3Å; R155-S157 PolarHBondContact O-N 2.92Å; S157-E159 PolarHBondContact O-N 3.21Å; S157-N160 PolarHBondContact O-N 2.93Å; S157-N160 VanDerWaalsContact O-N 3.13Å; S157-I161 VanDerWaalsContact O-CG1 3.31Å; S157-I161 WeakPolarHBondContact O-CG1 3.13Å; S157-I161 PolarHBondContact O-N 3.5Å
158	L	91.1	Very high	90.1	Very high	5 Å²	5	79.5 Å²	79.5	3%	0.026	39%	0.394	C	S	.	.	H	α-helix	trans	-65.6	-36.1	176.4	-68.7	179.6	0	0	0	113.1	K132 M135 L136 Y154 R155 N160 Y162	K132-L158 HydrophobicContact CG-CB 4.32Å; M135-L158 HydrophobicContact CB-CD1 3.73Å; M135-L158 HydrophobicContact CB-CD2 3.95Å; M135-L158 HydrophobicContact CG-CD2 4.4Å; M135-L158 HydrophobicContact SD-CD2 3.55Å; M135-L158 VanDerWaalsContact SD-CD2 3.55Å; L136-L158 HydrophobicContact CD2-CD1 3.82Å; L136-L158 HydrophobicContact CG-CD1 3.76Å; Y154-L158 HydrophobicContact CD1-CD1 3.89Å; Y154-L158 HydrophobicContact CE1-CD1 3.47Å; Y154-L158 VanDerWaalsContact CE1-CD1 3.47Å; Y154-L158 HydrophobicContact CE1-CG 4.26Å; Y154-L158 HydrophobicContact CE2-CD1 4.48Å; Y154-L158 HydrophobicContact CE2-CG 4.46Å; Y154-L158 WeakPolarHBondContact O-CG 3.42Å; Y154-L158 PolarHBondContact O-N 2.87Å; R155-L158 PolarHBondContact O-N 3.41Å; L158-N160 VanDerWaalsContact C-N 3.3Å; L158-N160 PolarHBondContact O-N 3.22Å; L158-Y162 HydrophobicContact CB-CD2 4.48Å; L158-Y162 HydrophobicContact CD2-CD2 3.82Å; L158-Y162 HydrophobicContact CD2-CE2 3.69Å; L158-Y162 WeakPolarHBondContact O-CB 3.37Å; L158-Y162 PolarHBondContact O-N 3.27Å
159	E	89.8	Confident	90.5	Very high	77 Å²	77	77.8 Å²	77.8	36%	0.36	39%	0.386	S	S	.	.	H	α-helix	trans	-59.1	-41.2	170.7	-73.2	-64.3	161.1	0	0	110.9	K132 R155 S157 R163	K132-E159 VanDerWaalsContact CE-CD 3.48Å; K132-E159 WeakPolarHBondContact CE-OE1 3.44Å; K132-E159 IonicContact NZ-OE1 2.62Å; K132-E159 PolarHBondContact NZ-OE1 2.81Å; K132-E159 IonicContact NZ-OE2 3.02Å; K132-E159 PolarHBondContact NZ-OE2 3.41Å; R155-E159 HydrophobicContact CG-CG 4.4Å; R155-E159 WeakPolarHBondContact O-CB 3.45Å; R155-E159 VanDerWaalsContact O-CG 3.31Å; R155-E159 WeakPolarHBondContact O-CG 3.35Å; R155-E159 PolarHBondContact O-N 2.86Å; S157-E159 PolarHBondContact O-N 3.21Å; E159-R163 WeakPolarHBondContact O-CG 3.43Å
160	N	90.4	Very high	90.5	Very high	102 Å²	102	76.4 Å²	76.4	55%	0.545	38%	0.384	S	S	.	.	H	α-helix	trans	-79.7	-29.9	-178.6	-172	61.5	0	0	0	114.2	A156 S157 L158 R163	A156-N160 PolarHBondContact O-N 3.37Å; S157-N160 PolarHBondContact O-N 2.93Å; S157-N160 VanDerWaalsContact O-N 3.13Å; L158-N160 VanDerWaalsContact C-N 3.3Å; L158-N160 PolarHBondContact O-N 3.22Å; N160-R163 WeakPolarHBondContact O-CD 3.43Å; N160-R163 WeakPolarHBondContact O-CG 3.16Å; N160-R163 PolarHBondContact OD1-NH1 3.48Å; N160-R163 VanDerWaalsContact OD1-NH1 3.12Å
161	I	91.8	Very high	90.5	Very high	103 Å²	103	78.2 Å²	78.2	53%	0.528	39%	0.393	S	S	.	.	H	α-helix	trans	-80.7	-44	177.4	-65.1	164.4	0	0	0	111	S157	S157-I161 VanDerWaalsContact O-CG1 3.31Å; S157-I161 WeakPolarHBondContact O-CG1 3.13Å; S157-I161 PolarHBondContact O-N 3.5Å
162	Y	89.7	Confident	90.3	Very high	49 Å²	49	77.1 Å²	77.1	19%	0.192	39%	0.391	C	S	.	.	S	Bend	trans	-104.9	50.3	-176.1	-60.4	-78.1	0	0	0	111.4	L128 V131 K132 M135 L158	L128-Y162 HydrophobicContact CD2-CD1 3.78Å; L128-Y162 HydrophobicContact CD2-CE1 4.48Å; V131-Y162 HydrophobicContact CB-CE1 4.33Å; V131-Y162 HydrophobicContact CG1-CD1 4.16Å; V131-Y162 HydrophobicContact CG1-CE1 3.56Å; V131-Y162 HydrophobicContact CG1-CE2 4.39Å; K132-Y162 HydrophobicContact CB-CG 4.36Å; M135-Y162 HydrophobicContact CE-CE2 4.28Å; M135-Y162 VanDerWaalsContact CE-OH 3.24Å; M135-Y162 WeakPolarHBondContact CE-OH 3.45Å; M135-Y162 HydrophobicContact SD-CE2 3.65Å; L158-Y162 HydrophobicContact CB-CD2 4.48Å; L158-Y162 HydrophobicContact CD2-CD2 3.82Å; L158-Y162 HydrophobicContact CD2-CE2 3.69Å; L158-Y162 WeakPolarHBondContact O-CB 3.37Å; L158-Y162 PolarHBondContact O-N 3.27Å
163	R	89.6	Confident	90.3	Very high	168 Å²	168	78.6 Å²	78.6	63%	0.634	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-66.9	135	176.9	-67.2	-180	94.1	147.7	-0.9	110.6	E159 N160	E159-R163 WeakPolarHBondContact O-CG 3.43Å; N160-R163 WeakPolarHBondContact O-CD 3.43Å; N160-R163 WeakPolarHBondContact O-CG 3.16Å; N160-R163 PolarHBondContact OD1-NH1 3.48Å; N160-R163 VanDerWaalsContact OD1-NH1 3.12Å
164	I	89.9	Confident	90.1	Very high	36 Å²	36	78.5 Å²	78.5	19%	0.185	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-76.6	155.8	167.4	58.5	-178.1	0	0	0	110.3	C125 L129 C168 E169 V172	C125-I164 HydrophobicContact CB-CB 4.32Å; C125-I164 HydrophobicContact CB-CG2 3.98Å; L129-I164 HydrophobicContact CD1-CG2 4.24Å; L129-I164 HydrophobicContact CD2-CG2 4.21Å; L129-I164 HydrophobicContact CG-CG2 4.06Å; I164-C168 HydrophobicContact CB-CB 4.12Å; I164-C168 HydrophobicContact CD1-CB 4.47Å; I164-E169 HydrophobicContact CD1-CB 4.12Å; I164-E169 HydrophobicContact CD1-CG 4.2Å; I164-E169 HydrophobicContact CG1-CB 4.16Å; I164-E169 HydrophobicContact CG1-CG 4.36Å; I164-V172 HydrophobicContact CD1-CB 4.15Å; I164-V172 HydrophobicContact CD1-CG2 3.77Å
165	C	92.7	Very high	89.6	Confident	41 Å²	41	79.2 Å²	79.2	28%	0.277	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-69.5	157.2	177.2	73.6	0	0	0	0	111.6	C125 E167 C168 E169	C125-C165 PolarHBondContact SG-N 2.92Å; C165-E167 WeakPolarHBondContact CB-OE2 3.34Å; C165-E167 PolarHBondContact O-N 3.35Å; C165-E167 VanDerWaalsContact O-N 3.16Å; C165-E167 PolarHBondContact SG-OE2 3.43Å; C165-C168 WeakPolarHBondContact O-CB 3.34Å; C165-C168 PolarHBondContact O-N 2.93Å; C165-C168 PolarHBondContact SG-SG 3.42Å; C165-E169 PolarHBondContact O-N 3.26Å
166	P	92.3	Very high	89.2	Confident	84 Å²	84	77.3 Å²	77.3	55%	0.545	39%	0.389	S	S	.	.	H	α-helix	trans	-55.4	-36.5	-174.4	-26.9	36.2	0	0	0	114.1	E169 I170	P166-E169 PolarHBondContact O-N 2.93Å; P166-I170 WeakPolarHBondContact O-CG1 3.29Å; P166-I170 PolarHBondContact O-N 3.09Å; P166-I170 VanDerWaalsContact O-N 3.09Å
167	E	90.6	Very high	88.9	Confident	122 Å²	122	77.7 Å²	77.7	57%	0.57	39%	0.389	S	S	*	.	H	α-helix	trans	-66.6	-41.1	178.8	-53.8	69.1	-147.4	0	0	110.9	C165 I171	C165-E167 WeakPolarHBondContact CB-OE2 3.34Å; C165-E167 PolarHBondContact O-N 3.35Å; C165-E167 VanDerWaalsContact O-N 3.16Å; C165-E167 PolarHBondContact SG-OE2 3.43Å; E167-I171 WeakPolarHBondContact O-CG1 3.13Å; E167-I171 PolarHBondContact O-N 3.19Å
168	C	90.4	Very high	88.3	Confident	4 Å²	4	78.1 Å²	78.1	3%	0.027	39%	0.385	C	S	.	.	H	α-helix	trans	-71	-32.6	174.2	-70.9	0	0	0	0	111.8	L121 C122 C125 I164 C165 I170 I171 V172	L121-C168 HydrophobicContact CD2-CB 4.02Å; C122-C168 PolarHBondContact N-SG 3Å; C125-C168 HydrophobicContact CB-CB 4.22Å; C125-C168 VanDerWaalsContact SG-SG 3.69Å; I164-C168 HydrophobicContact CB-CB 4.12Å; I164-C168 HydrophobicContact CD1-CB 4.47Å; C165-C168 WeakPolarHBondContact O-CB 3.34Å; C165-C168 PolarHBondContact O-N 2.93Å; C165-C168 PolarHBondContact SG-SG 3.42Å; C168-I170 VanDerWaalsContact C-N 3.33Å; C168-I170 PolarHBondContact O-N 3.02Å; C168-I171 PolarHBondContact O-N 3.5Å; C168-V172 WeakPolarHBondContact O-CG2 3.45Å; C168-V172 PolarHBondContact O-N 3.27Å
169	E	90.7	Very high	87.5	Confident	87 Å²	87	81 Å²	81	41%	0.407	40%	0.4	S	S	.	.	H	α-helix	trans	-64.6	-37.6	175.8	-153.3	-161.5	150.2	0	0	111.8	I164 C165 P166 V172 R173	I164-E169 HydrophobicContact CD1-CB 4.12Å; I164-E169 HydrophobicContact CD1-CG 4.2Å; I164-E169 HydrophobicContact CG1-CB 4.16Å; I164-E169 HydrophobicContact CG1-CG 4.36Å; C165-E169 PolarHBondContact O-N 3.26Å; P166-E169 PolarHBondContact O-N 2.93Å; E169-V172 PolarHBondContact O-N 3.21Å; E169-R173 WeakPolarHBondContact O-CB 3.3Å; E169-R173 PolarHBondContact O-N 3.38Å; E169-R173 IonicContact OE1-CZ 3.72Å; E169-R173 IonicContact OE1-NH2 2.67Å; E169-R173 PolarHBondContact OE1-NH2 3.41Å; E169-R173 IonicContact OE2-NH2 3.54Å
170	I	89.6	Confident	86.9	Confident	103 Å²	103	80.5 Å²	80.5	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-47.9	172.8	-65.8	164.2	0	0	0	110.6	P166 C168 V172 R173 D174	P166-I170 WeakPolarHBondContact O-CG1 3.29Å; P166-I170 PolarHBondContact O-N 3.09Å; P166-I170 VanDerWaalsContact O-N 3.09Å; C168-I170 VanDerWaalsContact C-N 3.33Å; C168-I170 PolarHBondContact O-N 3.02Å; I170-V172 PolarHBondContact O-N 3.2Å; I170-R173 PolarHBondContact O-N 3.34Å; I170-D174 WeakPolarHBondContact O-CB 3.44Å; I170-D174 PolarHBondContact O-N 2.74Å
171	I	88.8	Confident	86.4	Confident	64 Å²	64	82.2 Å²	82.2	33%	0.328	40%	0.404	S	S	.	.	H	α-helix	trans	-61.8	-43.7	179.4	-63.7	169.1	0	0	0	111.3	G120 L121 E167 C168 R175	G120-I171 WeakPolarHBondContact O-CD1 3.38Å; L121-I171 HydrophobicContact CD2-CB 4.02Å; L121-I171 HydrophobicContact CD2-CG2 3.79Å; E167-I171 WeakPolarHBondContact O-CG1 3.13Å; E167-I171 PolarHBondContact O-N 3.19Å; C168-I171 PolarHBondContact O-N 3.5Å; I171-R175 WeakPolarHBondContact O-CB 3.18Å; I171-R175 PolarHBondContact O-N 3.17Å
172	V	86.1	Confident	85.7	Confident	46 Å²	46	82 Å²	82	28%	0.279	40%	0.404	S	S	.	.	H	α-helix	trans	-64.3	-42	175.8	171.2	0	0	0	0	111.1	L121 I164 C168 E169 I170 R175 L176	L121-V172 HydrophobicContact CD1-CG2 4.29Å; L121-V172 HydrophobicContact CD2-CG2 3.79Å; I164-V172 HydrophobicContact CD1-CB 4.15Å; I164-V172 HydrophobicContact CD1-CG2 3.77Å; C168-V172 WeakPolarHBondContact O-CG2 3.45Å; C168-V172 PolarHBondContact O-N 3.27Å; E169-V172 PolarHBondContact O-N 3.21Å; I170-V172 PolarHBondContact O-N 3.2Å; V172-R175 PolarHBondContact O-N 3.27Å; V172-L176 HydrophobicContact CG1-CD1 3.78Å; V172-L176 HydrophobicContact CG1-CG 4.29Å; V172-L176 WeakPolarHBondContact O-CB 3.23Å; V172-L176 VanDerWaalsContact O-CG 3.25Å; V172-L176 WeakPolarHBondContact O-CG 3.24Å; V172-L176 PolarHBondContact O-N 2.89Å
173	R	88	Confident	85.1	Confident	135 Å²	135	83.2 Å²	83.2	51%	0.509	41%	0.413	S	S	.	.	H	α-helix	trans	-67.6	-42.9	-178.5	-164.7	-176.8	-56.8	122.6	-3.9	112.2	E169 I170 L176 S177	E169-R173 WeakPolarHBondContact O-CB 3.3Å; E169-R173 PolarHBondContact O-N 3.38Å; E169-R173 IonicContact OE1-CZ 3.72Å; E169-R173 IonicContact OE1-NH2 2.67Å; E169-R173 PolarHBondContact OE1-NH2 3.41Å; E169-R173 IonicContact OE2-NH2 3.54Å; I170-R173 PolarHBondContact O-N 3.34Å; R173-L176 PolarHBondContact O-N 3.16Å; R173-S177 WeakPolarHBondContact O-CB 3.43Å; R173-S177 PolarHBondContact O-N 3.05Å
174	D	86.3	Confident	84.5	Confident	98 Å²	98	78 Å²	78	52%	0.524	41%	0.412	S	S	.	.	H	α-helix	trans	-59.3	-50.7	172.3	177.4	75.9	0	0	0	111.1	I170 L176 S177 M178	I170-D174 WeakPolarHBondContact O-CB 3.44Å; I170-D174 PolarHBondContact O-N 2.74Å; D174-L176 VanDerWaalsContact C-N 3.31Å; D174-L176 PolarHBondContact O-N 3.16Å; D174-S177 WeakPolarHBondContact O-CB 3.14Å; D174-S177 PolarHBondContact O-N 2.95Å; D174-M178 PolarHBondContact O-N 2.81Å
175	R	82.4	Confident	83.4	Confident	90 Å²	90	80.4 Å²	80.4	34%	0.34	43%	0.425	S	S	.	.	H	α-helix	trans	-62.9	-36.7	-179.7	-167.4	59.3	168.1	-171.5	-3.1	112.7	I171 V172 M178 L179	I171-R175 WeakPolarHBondContact O-CB 3.18Å; I171-R175 PolarHBondContact O-N 3.17Å; V172-R175 PolarHBondContact O-N 3.27Å; R175-M178 PolarHBondContact NH1-SD 2.7Å; R175-L179 HydrophobicContact CG-CD1 4.38Å; R175-L179 WeakPolarHBondContact O-CB 3.37Å; R175-L179 VanDerWaalsContact O-CG 3.24Å; R175-L179 WeakPolarHBondContact O-CG 3.41Å; R175-L179 PolarHBondContact O-N 3.35Å
176	L	80.8	Confident	81.8	Confident	93 Å²	93	82.9 Å²	82.9	49%	0.487	44%	0.438	S	S	.	.	H	α-helix	trans	-69.1	-37.1	172.8	-73.9	172.9	0	0	0	112.3	V172 R173 D174 L179 N180	V172-L176 HydrophobicContact CG1-CD1 3.78Å; V172-L176 HydrophobicContact CG1-CG 4.29Å; V172-L176 WeakPolarHBondContact O-CB 3.23Å; V172-L176 VanDerWaalsContact O-CG 3.25Å; V172-L176 WeakPolarHBondContact O-CG 3.24Å; V172-L176 PolarHBondContact O-N 2.89Å; R173-L176 PolarHBondContact O-N 3.16Å; D174-L176 VanDerWaalsContact C-N 3.31Å; D174-L176 PolarHBondContact O-N 3.16Å; L176-L179 PolarHBondContact O-N 2.9Å; L176-N180 WeakPolarHBondContact O-CB 3.39Å; L176-N180 PolarHBondContact O-N 3.05Å; L176-N180 PolarHBondContact O-ND2 3.27Å; L176-N180 VanDerWaalsContact O-ND2 3.08Å
177	S	83.3	Confident	79.9	Confident	65 Å²	65	80.5 Å²	80.5	46%	0.455	43%	0.43	S	S	.	.	H	α-helix	trans	-62	-50.6	174.1	-165.9	0	0	0	0	110.9	R173 D174 L179 N180 E181	R173-S177 WeakPolarHBondContact O-CB 3.43Å; R173-S177 PolarHBondContact O-N 3.05Å; D174-S177 WeakPolarHBondContact O-CB 3.14Å; D174-S177 PolarHBondContact O-N 2.95Å; S177-L179 VanDerWaalsContact C-N 3.33Å; S177-L179 PolarHBondContact O-N 3.3Å; S177-N180 PolarHBondContact O-N 3.45Å; S177-N180 VanDerWaalsContact O-N 3.16Å; S177-E181 PolarHBondContact O-N 3.09Å
178	M	80.1	Confident	77.9	Confident	69 Å²	69	80.7 Å²	80.7	34%	0.34	44%	0.439	S	S	.	.	H	α-helix	trans	-56.8	-43.2	175.4	-176.9	-168.8	-61.2	0	0	112.3	D174 R175 E181 I182	D174-M178 PolarHBondContact O-N 2.81Å; R175-M178 PolarHBondContact NH1-SD 2.7Å; M178-E181 PolarHBondContact O-N 2.82Å; M178-I182 HydrophobicContact CG-CD1 3.92Å; M178-I182 WeakPolarHBondContact O-CB 3.43Å; M178-I182 WeakPolarHBondContact O-CD1 3.32Å; M178-I182 VanDerWaalsContact O-CG1 3.23Å; M178-I182 WeakPolarHBondContact O-CG1 3.47Å; M178-I182 PolarHBondContact O-N 2.94Å
179	L	74.1	Confident	75.7	Confident	66 Å²	66	87.4 Å²	87.4	35%	0.346	47%	0.47	S	S	.	.	H	α-helix	trans	-67.9	-39.6	176.3	-75	169.6	0	0	0	112.4	R175 L176 S177 E181 I182 L183	R175-L179 HydrophobicContact CG-CD1 4.38Å; R175-L179 WeakPolarHBondContact O-CB 3.37Å; R175-L179 VanDerWaalsContact O-CG 3.24Å; R175-L179 WeakPolarHBondContact O-CG 3.41Å; R175-L179 PolarHBondContact O-N 3.35Å; L176-L179 PolarHBondContact O-N 2.9Å; S177-L179 VanDerWaalsContact C-N 3.33Å; S177-L179 PolarHBondContact O-N 3.3Å; L179-E181 VanDerWaalsContact C-N 3.32Å; L179-E181 PolarHBondContact O-N 2.73Å; L179-I182 PolarHBondContact O-N 2.95Å; L179-L183 VanDerWaalsContact O-CB 3.27Å; L179-L183 WeakPolarHBondContact O-CB 3.49Å; L179-L183 WeakPolarHBondContact O-CG 3.22Å; L179-L183 PolarHBondContact O-N 3.49Å
180	N	77.1	Confident	73.7	Confident	65 Å²	65	86.8 Å²	86.8	35%	0.348	47%	0.472	S	S	.	.	H	α-helix	trans	-64.6	-37.1	175.8	-74.1	-34.1	0	0	0	111.9	L176 S177 G184 L185 T186	L176-N180 WeakPolarHBondContact O-CB 3.39Å; L176-N180 PolarHBondContact O-N 3.05Å; L176-N180 PolarHBondContact O-ND2 3.27Å; L176-N180 VanDerWaalsContact O-ND2 3.08Å; S177-N180 PolarHBondContact O-N 3.45Å; S177-N180 VanDerWaalsContact O-N 3.16Å; N180-G184 PolarHBondContact O-N 3.16Å; N180-G184 VanDerWaalsContact O-N 3.12Å; N180-L185 HydrophobicContact CB-CB 4.18Å; N180-L185 PolarHBondContact O-N 2.57Å; N180-T186 HydrophobicContact CB-CG2 3.93Å; N180-T186 PolarHBondContact O-N 3.05Å
181	E	79.2	Confident	71.6	Confident	138 Å²	138	84.5 Å²	84.5	65%	0.645	47%	0.465	S	S	*	.	H	α-helix	trans	-65.8	-50.9	174.5	-173.2	-178.6	171.1	0	0	111.1	S177 M178 L179 L183 G184 T186	S177-E181 PolarHBondContact O-N 3.09Å; M178-E181 PolarHBondContact O-N 2.82Å; L179-E181 VanDerWaalsContact C-N 3.32Å; L179-E181 PolarHBondContact O-N 2.73Å; E181-L183 PolarHBondContact O-N 2.99Å; E181-G184 PolarHBondContact O-N 3.45Å; E181-T186 HydrophobicContact CB-CG2 4.32Å
182	I	78.7	Confident	69.4	Low	100 Å²	100	84.3 Å²	84.3	51%	0.513	47%	0.47	S	S	.	.	H	α-helix	trans	-59.2	-32.8	177.5	-70.3	166.6	0	0	0	112.3	M178 L179	M178-I182 HydrophobicContact CG-CD1 3.92Å; M178-I182 WeakPolarHBondContact O-CB 3.43Å; M178-I182 WeakPolarHBondContact O-CD1 3.32Å; M178-I182 VanDerWaalsContact O-CG1 3.23Å; M178-I182 WeakPolarHBondContact O-CG1 3.47Å; M178-I182 PolarHBondContact O-N 2.94Å; L179-I182 PolarHBondContact O-N 2.95Å
183	L	77.5	Confident	67.5	Low	73 Å²	73	87.6 Å²	87.6	38%	0.382	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-1	177.9	-66.3	171.2	0	0	0	113.8	L179 E181 L185 L447 L450	L179-L183 VanDerWaalsContact O-CB 3.27Å; L179-L183 WeakPolarHBondContact O-CB 3.49Å; L179-L183 WeakPolarHBondContact O-CG 3.22Å; L179-L183 PolarHBondContact O-N 3.49Å; E181-L183 PolarHBondContact O-N 2.99Å; L183-L185 HydrophobicContact CB-CD1 3.92Å; L183-L185 HydrophobicContact CB-CG 3.83Å; L183-L185 HydrophobicContact CD1-CD1 4.1Å; L183-L185 PolarHBondContact O-N 3.37Å; L183-L447 HydrophobicContact CD2-CD2 3.86Å; L183-L450 HydrophobicContact CD2-CD1 4.12Å
184	G	76.4	Confident	65.4	Low	60 Å²	60	89.6 Å²	89.6	62%	0.619	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	19.2	-177.9	0	0	0	0	0	114.7	N180 E181 T186	N180-G184 PolarHBondContact O-N 3.16Å; N180-G184 VanDerWaalsContact O-N 3.12Å; E181-G184 PolarHBondContact O-N 3.45Å; G184-T186 VanDerWaalsContact C-N 3.34Å
185	L	67	Low	63.5	Low	86 Å²	86	92.3 Å²	92.3	45%	0.45	50%	0.495	S	S	.	.			trans	-82.9	-10.9	-178.9	-59.3	176.8	0	0	0	113	N180 L183 G187	N180-L185 HydrophobicContact CB-CB 4.18Å; N180-L185 PolarHBondContact O-N 2.57Å; L183-L185 HydrophobicContact CB-CD1 3.92Å; L183-L185 HydrophobicContact CB-CG 3.83Å; L183-L185 HydrophobicContact CD1-CD1 4.1Å; L183-L185 PolarHBondContact O-N 3.37Å; L185-G187 PolarHBondContact O-N 3.45Å
186	T	59.1	Low	61.6	Low	92 Å²	92	97.3 Å²	97.3	56%	0.564	51%	0.514	S	S	*	.			trans	-72.8	58.4	173.6	48.2	0	0	0	0	112.2	N180 E181 G184	N180-T186 HydrophobicContact CB-CG2 3.93Å; N180-T186 PolarHBondContact O-N 3.05Å; E181-T186 HydrophobicContact CB-CG2 4.32Å; G184-T186 VanDerWaalsContact C-N 3.34Å
187	G	51	Low	60	Low	35 Å²	35	96.6 Å²	96.6	36%	0.361	51%	0.514	S	S	.	.	S	Bend	trans	-146.1	144	-178.9	0	0	0	0	0	113	L185 E189 T190	L185-G187 PolarHBondContact O-N 3.45Å; G187-E189 PolarHBondContact O-N 2.9Å; G187-E189 VanDerWaalsContact O-N 3.13Å; G187-T190 PolarHBondContact O-N 3.04Å; G187-T190 PolarHBondContact O-OG1 2.93Å
188	T	49.7	Very low	58.5	Low	125 Å²	125	98.7 Å²	98.7	77%	0.767	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.3	179.5	47.6	0	0	0	0	113.6	T190 S191	T188-T190 VanDerWaalsContact C-N 3.25Å; T188-T190 PolarHBondContact O-N 3.28Å; T188-S191 PolarHBondContact O-N 3.35Å; T188-S191 PolarHBondContact O-OG 3.05Å
189	E	44.4	Very low	56.8	Low	145 Å²	145	100.9 Å²	100.9	68%	0.678	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.6	178	-57.3	-151	129.8	0	0	114.2	G187 S191 S192 L193	G187-E189 PolarHBondContact O-N 2.9Å; G187-E189 VanDerWaalsContact O-N 3.13Å; E189-S191 PolarHBondContact O-N 2.8Å; E189-S191 VanDerWaalsContact O-N 3.16Å; E189-S192 PolarHBondContact O-N 3.1Å; E189-S192 PolarHBondContact O-OG 2.96Å; E189-L193 PolarHBondContact O-N 3.34Å; E189-L193 VanDerWaalsContact O-N 3.07Å
190	T	48.5	Very low	55.6	Low	75 Å²	75	101.7 Å²	101.7	46%	0.46	54%	0.537	S	S	.	.	H	α-helix	trans	-55	-34.3	173.9	53.7	0	0	0	0	112	G187 T188 S192 R194	G187-T190 PolarHBondContact O-N 3.04Å; G187-T190 PolarHBondContact O-OG1 2.93Å; T188-T190 VanDerWaalsContact C-N 3.25Å; T188-T190 PolarHBondContact O-N 3.28Å; T190-S192 VanDerWaalsContact C-N 3.35Å; T190-R194 PolarHBondContact O-N 2.87Å
191	S	44.3	Very low	54.1	Low	54 Å²	54	103.7 Å²	103.7	38%	0.378	55%	0.548	S	S	.	.	H	α-helix	trans	-76.8	-15.9	176.2	81.6	0	0	0	0	114.5	T188 E189 R195	T188-S191 PolarHBondContact O-N 3.35Å; T188-S191 PolarHBondContact O-OG 3.05Å; E189-S191 PolarHBondContact O-N 2.8Å; E189-S191 VanDerWaalsContact O-N 3.16Å; S191-R195 PolarHBondContact O-NE 3.34Å; S191-R195 PolarHBondContact OG-NH2 2.8Å
192	S	44	Very low	52.5	Low	60 Å²	60	100.7 Å²	100.7	42%	0.42	54%	0.542	S	S	.	.	H	α-helix	trans	-87.4	-43.6	175.7	87	0	0	0	0	110.3	E189 T190 R194 R195 R196	E189-S192 PolarHBondContact O-N 3.1Å; E189-S192 PolarHBondContact O-OG 2.96Å; T190-S192 VanDerWaalsContact C-N 3.35Å; S192-R194 PolarHBondContact O-N 3.42Å; S192-R195 PolarHBondContact O-N 2.76Å; S192-R196 WeakPolarHBondContact O-CB 3.36Å; S192-R196 PolarHBondContact O-N 3.12Å
193	L	45.8	Very low	50.9	Low	115 Å²	115	100.4 Å²	100.4	60%	0.602	55%	0.545	S	S	*	.	H	α-helix	trans	-59.3	-47.1	175.6	-77	162.4	0	0	0	111.9	E189 R195 R196 T197	E189-L193 PolarHBondContact O-N 3.34Å; E189-L193 VanDerWaalsContact O-N 3.07Å; L193-R195 PolarHBondContact O-N 2.98Å; L193-R196 PolarHBondContact O-N 3.46Å; L193-R196 VanDerWaalsContact O-N 3.17Å; L193-T197 PolarHBondContact O-N 2.83Å; L193-T197 VanDerWaalsContact O-N 3.15Å; L193-T197 PolarHBondContact O-OG1 2.74Å
194	R	44.2	Very low	49.4	Very low	178 Å²	178	101.5 Å²	101.5	67%	0.672	55%	0.55	S	S	*	*	H	α-helix	trans	-63.3	-36.8	177.8	-168.2	175.9	-174.6	179.5	3.3	113.2	T190 S192 T197 Q198	T190-R194 PolarHBondContact O-N 2.87Å; S192-R194 PolarHBondContact O-N 3.42Å; R194-T197 PolarHBondContact O-OG1 2.76Å; R194-T197 VanDerWaalsContact O-OG1 3.11Å; R194-Q198 WeakPolarHBondContact O-CG 3.43Å; R194-Q198 PolarHBondContact O-N 2.86Å
195	R	45.1	Very low	47.7	Very low	154 Å²	154	103.2 Å²	103.2	58%	0.581	55%	0.553	S	S	*	*	H	α-helix	trans	-71.9	-32.4	174.3	-83.3	-176.3	-85.6	-162.3	-5.9	112.5	S191 S192 L193 N199	S191-R195 PolarHBondContact O-NE 3.34Å; S191-R195 PolarHBondContact OG-NH2 2.8Å; S192-R195 PolarHBondContact O-N 2.76Å; L193-R195 PolarHBondContact O-N 2.98Å; R195-N199 WeakPolarHBondContact O-CB 3.48Å; R195-N199 PolarHBondContact O-N 3.29Å; R195-N199 VanDerWaalsContact O-N 3.13Å; R195-N199 PolarHBondContact O-OD1 3.43Å
196	R	43.2	Very low	46.5	Very low	195 Å²	195	103.2 Å²	103.2	74%	0.736	56%	0.56	S	S	*	*	H	α-helix	trans	-68.5	-40.3	178.8	-135.6	172.1	-170.4	160.5	3	112.2	S192 L193 T200	S192-R196 WeakPolarHBondContact O-CB 3.36Å; S192-R196 PolarHBondContact O-N 3.12Å; L193-R196 PolarHBondContact O-N 3.46Å; L193-R196 VanDerWaalsContact O-N 3.17Å; R196-T200 PolarHBondContact O-N 2.91Å; R196-T200 PolarHBondContact O-OG1 2.89Å
197	T	47.9	Very low	45.9	Very low	78 Å²	78	107 Å²	107	48%	0.479	57%	0.569	S	S	.	*	H	α-helix	trans	-69.7	-44.3	175.6	44.8	0	0	0	0	112.6	L193 R194 N199 T200 L201	L193-T197 PolarHBondContact O-N 2.83Å; L193-T197 VanDerWaalsContact O-N 3.15Å; L193-T197 PolarHBondContact O-OG1 2.74Å; R194-T197 PolarHBondContact O-OG1 2.76Å; R194-T197 VanDerWaalsContact O-OG1 3.11Å; T197-N199 PolarHBondContact O-N 3.07Å; T197-T200 WeakPolarHBondContact CA-OG1 3.41Å; T197-T200 PolarHBondContact O-N 3.2Å; T197-T200 PolarHBondContact O-OG1 2.95Å; T197-L201 WeakPolarHBondContact O-CG 3.46Å; T197-L201 PolarHBondContact O-N 2.79Å
198	Q	50.5	Low	45.2	Very low	110 Å²	110	111.1 Å²	111.1	51%	0.514	59%	0.587	S	S	.	*	H	α-helix	trans	-60.1	-45.2	178.1	-74.3	-177.3	-51.7	0	0	112.2	R194 T200 L201 S202	R194-Q198 WeakPolarHBondContact O-CG 3.43Å; R194-Q198 PolarHBondContact O-N 2.86Å; Q198-T200 VanDerWaalsContact C-N 3.28Å; Q198-T200 PolarHBondContact O-N 3.29Å; Q198-L201 PolarHBondContact O-N 3.22Å; Q198-S202 PolarHBondContact O-N 2.75Å; Q198-S202 VanDerWaalsContact O-N 3.13Å; Q198-S202 PolarHBondContact O-OG 3.44Å
199	N	44.9	Very low	44.7	Very low	114 Å²	114	110.6 Å²	110.6	61%	0.61	59%	0.588	S	S	*	*	H	α-helix	trans	-66.8	-25	179.1	-72.1	8.1	0	0	0	113.6	R195 T197 S202 T203	R195-N199 WeakPolarHBondContact O-CB 3.48Å; R195-N199 PolarHBondContact O-N 3.29Å; R195-N199 VanDerWaalsContact O-N 3.13Å; R195-N199 PolarHBondContact O-OD1 3.43Å; T197-N199 PolarHBondContact O-N 3.07Å; N199-S202 PolarHBondContact O-OG 3.48Å; N199-T203 PolarHBondContact O-OG1 3.41Å
200	T	48.6	Very low	44.6	Very low	83 Å²	83	108.6 Å²	108.6	51%	0.509	59%	0.587	S	S	.	*	H	α-helix	trans	-79.7	-35.6	172.2	45.6	0	0	0	0	113	R196 T197 Q198 T203	R196-T200 PolarHBondContact O-N 2.91Å; R196-T200 PolarHBondContact O-OG1 2.89Å; T197-T200 WeakPolarHBondContact CA-OG1 3.41Å; T197-T200 PolarHBondContact O-N 3.2Å; T197-T200 PolarHBondContact O-OG1 2.95Å; Q198-T200 VanDerWaalsContact C-N 3.28Å; Q198-T200 PolarHBondContact O-N 3.29Å; T200-T203 PolarHBondContact O-N 3.5Å
201	L	45.5	Very low	44.1	Very low	108 Å²	108	111.1 Å²	111.1	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-69.8	-38.1	-179.2	-75.4	162.6	0	0	0	112	T197 Q198 T203 I204 S205	T197-L201 WeakPolarHBondContact O-CG 3.46Å; T197-L201 PolarHBondContact O-N 2.79Å; Q198-L201 PolarHBondContact O-N 3.22Å; L201-T203 PolarHBondContact O-N 3.1Å; L201-I204 PolarHBondContact O-N 3.29Å; L201-S205 PolarHBondContact O-N 2.8Å; L201-S205 PolarHBondContact O-OG 3.27Å
202	S	46.1	Very low	43.7	Very low	74 Å²	74	115.8 Å²	115.8	52%	0.517	63%	0.629	S	S	.	*	H	α-helix	trans	-64.3	-18.4	178.6	53.5	0	0	0	0	115.1	Q198 N199	Q198-S202 PolarHBondContact O-N 2.75Å; Q198-S202 VanDerWaalsContact O-N 3.13Å; Q198-S202 PolarHBondContact O-OG 3.44Å; N199-S202 PolarHBondContact O-OG 3.48Å
203	T	45.3	Very low	43.4	Very low	95 Å²	95	118.8 Å²	118.8	58%	0.583	65%	0.65	S	S	*	*	H	α-helix	trans	-93.2	-17.4	178.8	-51.9	0	0	0	0	112.6	N199 T200 L201 S206	N199-T203 PolarHBondContact O-OG1 3.41Å; T200-T203 PolarHBondContact O-N 3.5Å; L201-T203 PolarHBondContact O-N 3.1Å; T203-S206 PolarHBondContact O-OG 3.22Å
204	I	44.9	Very low	42.9	Very low	96 Å²	96	116.6 Å²	116.6	49%	0.492	66%	0.655	S	S	.	*	H	α-helix	trans	-98.3	-32.1	-176.1	-62.2	173.1	0	0	0	111.2	L201 S206 F207	L201-I204 PolarHBondContact O-N 3.29Å; I204-S206 PolarHBondContact O-N 3.35Å; I204-S206 VanDerWaalsContact O-N 3.16Å; I204-F207 PolarHBondContact O-N 2.99Å
205	S	42.7	Very low	42.3	Very low	96 Å²	96	120.5 Å²	120.5	67%	0.671	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-15.2	-178	57.7	0	0	0	0	115.3	L201	L201-S205 PolarHBondContact O-N 2.8Å; L201-S205 PolarHBondContact O-OG 3.27Å
206	S	41.3	Very low	42	Very low	85 Å²	85	118.3 Å²	118.3	59%	0.594	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-5.6	-178	52.3	0	0	0	0	115.2	T203 I204	T203-S206 PolarHBondContact O-OG 3.22Å; I204-S206 PolarHBondContact O-N 3.35Å; I204-S206 VanDerWaalsContact O-N 3.16Å
207	F	45	Very low	41.4	Very low	173 Å²	173	114.5 Å²	114.5	76%	0.759	68%	0.682	S	S	*	*	S	Bend	trans	-116.6	-5	-167.9	-80	-76.9	0	0	0	116.9	I204	I204-F207 PolarHBondContact O-N 2.99Å
208	V	38.3	Very low	41	Very low	121 Å²	121	116.8 Å²	116.8	73%	0.733	70%	0.695	S	S	*	*			trans	-136.4	102.6	-174.7	-171.1	0	0	0	0	113.5
209	S	37.6	Very low	40.1	Very low	113 Å²	113	123.4 Å²	123.4	79%	0.79	72%	0.715	S	S	*	*			trans	-168.5	153.9	160	-88.6	0	0	0	0	109.8
210	P	42.8	Very low	39.7	Very low	103 Å²	103	122.4 Å²	122.4	67%	0.669	72%	0.717	S	S	*	*			cis	-130.6	-147.8	-9.6	36	-14.5	0	0	0	111.5
211	T	38.3	Very low	39	Very low	129 Å²	129	121.8 Å²	121.8	79%	0.791	73%	0.728	S	S	*	*			trans	83.6	101.6	167.7	69.7	0	0	0	0	118.2
212	V	35.3	Very low	38.6	Very low	151 Å²	151	121.8 Å²	121.8	92%	0.915	74%	0.737	S	S	*	*			trans	-129.9	115.8	152.8	175.2	0	0	0	0	107.9
213	S	39.1	Very low	38.2	Very low	124 Å²	124	123.1 Å²	123.1	87%	0.867	74%	0.744	S	S	*	*			trans	-129.8	133.4	161	63.1	0	0	0	0	107.5
214	G	34.8	Very low	37.8	Very low	69 Å²	69	128.8 Å²	128.8	71%	0.711	76%	0.76	S	S	*	*			trans	168.7	38.5	-166.3	0	0	0	0	0	115.4	S216	G214-S216 PolarHBondContact O-N 3.21Å; G214-S216 VanDerWaalsContact O-N 3.13Å
215	R	31.5	Very low	37.7	Very low	259 Å²	259	129.3 Å²	129.3	98%	0.977	76%	0.763	S	S	*	*			trans	-61.7	110.2	-179	-177.8	-170	-167.4	-179.1	5.9	111.2
216	S	37.9	Very low	37.5	Very low	109 Å²	109	128.8 Å²	128.8	76%	0.762	76%	0.758	S	S	*	*			trans	-148.6	130.3	162	54.4	0	0	0	0	110.9	G214	G214-S216 PolarHBondContact O-N 3.21Å; G214-S216 VanDerWaalsContact O-N 3.13Å
217	S	31.6	Very low	37.9	Very low	115 Å²	115	130.5 Å²	130.5	80%	0.804	77%	0.77	S	S	*	*			trans	-100	130.6	-176.6	54	0	0	0	0	111.1
218	V	39.3	Very low	38.2	Very low	126 Å²	126	130.3 Å²	130.3	76%	0.764	77%	0.769	S	S	*	*			trans	-120.3	90.4	169.9	-176.3	0	0	0	0	109.4	S220	V218-S220 VanDerWaalsContact C-N 3.25Å; V218-S220 PolarHBondContact O-N 2.83Å
219	R	31.4	Very low	39.1	Very low	248 Å²	248	131.6 Å²	131.6	94%	0.936	76%	0.76	S	S	*	*			trans	-74.5	66.8	-179.3	-165.7	-172.9	-161.7	-179.8	6.6	111.5	G221	R219-G221 PolarHBondContact O-N 3.35Å; R219-G221 VanDerWaalsContact O-N 3.14Å
220	S	36.6	Very low	40.4	Very low	93 Å²	93	128.2 Å²	128.2	65%	0.65	74%	0.743	S	S	*	*			trans	-88.2	69.8	-177.8	66.7	0	0	0	0	113.3	V218 S222	V218-S220 VanDerWaalsContact C-N 3.25Å; V218-S220 PolarHBondContact O-N 2.83Å; S220-S222 PolarHBondContact O-N 2.92Å
221	G	34.2	Very low	41.7	Very low	71 Å²	71	130.4 Å²	130.4	73%	0.732	74%	0.742	S	S	*	*			trans	-60.2	109.5	168.1	0	0	0	0	0	110.3	R219 P223	R219-G221 PolarHBondContact O-N 3.35Å; R219-G221 VanDerWaalsContact O-N 3.14Å; G221-P223 VanDerWaalsContact O-CD 3.22Å; G221-P223 WeakPolarHBondContact O-CD 3.46Å
222	S	36.3	Very low	43.5	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	73%	0.731	S	S	*	*			trans	-70.7	113.1	-173.2	-74.9	0	0	0	0	111.8	S220 K224	S220-S222 PolarHBondContact O-N 2.92Å; S222-K224 PolarHBondContact O-N 3.09Å
223	P	39.1	Very low	45.2	Very low	102 Å²	102	124 Å²	124	66%	0.662	70%	0.695	S	S	*	*			trans	-67.7	130.5	177.6	28	-33.8	0	0	0	110	G221 L225	G221-P223 VanDerWaalsContact O-CD 3.22Å; G221-P223 WeakPolarHBondContact O-CD 3.46Å; P223-L225 PolarHBondContact O-N 3.45Å
224	K	36.9	Very low	47	Very low	214 Å²	214	126.1 Å²	126.1	93%	0.93	68%	0.684	S	S	*	*			trans	-70.4	74.7	174.9	-70.6	178.5	179.5	172.7	0	110.2	S222	S222-K224 PolarHBondContact O-N 3.09Å
225	L	41.5	Very low	49.2	Very low	106 Å²	106	128.4 Å²	128.4	56%	0.555	68%	0.679	S	S	*	*			trans	-53.3	128.7	-178.5	-83.9	164	0	0	0	111.3	P223	P223-L225 PolarHBondContact O-N 3.45Å
226	P	39.9	Very low	51.5	Low	86 Å²	86	119.2 Å²	119.2	56%	0.558	65%	0.649	S	S	*	*			trans	-68.6	157.7	-167.9	25.9	-34.9	0	0	0	113.6	K228 R229	P226-K228 PolarHBondContact O-N 3.05Å; P226-R229 PolarHBondContact O-N 2.89Å
227	S	49.6	Very low	53.5	Low	120 Å²	120	115.6 Å²	115.6	84%	0.839	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-14.6	-174.3	58.6	0	0	0	0	115.5	R229 G230	S227-R229 PolarHBondContact O-N 3.42Å; S227-G230 PolarHBondContact O-N 3.5Å
228	K	51	Low	55.9	Low	170 Å²	170	112.8 Å²	112.8	74%	0.739	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	-26.9	174.1	-70.4	-173.7	177.2	-179.1	0	113.7	P226 G230 K231	P226-K228 PolarHBondContact O-N 3.05Å; K228-G230 PolarHBondContact O-N 2.78Å; K228-K231 PolarHBondContact O-N 3.37Å
229	R	56.1	Low	58.1	Low	148 Å²	148	108.4 Å²	108.4	56%	0.558	58%	0.582	S	S	*	*	H	α-helix	trans	-51.5	-30.5	179.4	-139	175.4	-166.5	175.2	4.8	113.6	P226 S227 A233	P226-R229 PolarHBondContact O-N 2.89Å; S227-R229 PolarHBondContact O-N 3.42Å; R229-A233 WeakPolarHBondContact O-CB 3.45Å; R229-A233 PolarHBondContact O-N 2.93Å; R229-A233 VanDerWaalsContact O-N 3.13Å
230	G	65.9	Low	60.7	Low	42 Å²	42	97.3 Å²	97.3	43%	0.433	54%	0.542	S	S	.	.	H	α-helix	trans	-78.4	-9	177.9	0	0	0	0	0	116.5	S227 K228 R234	S227-G230 PolarHBondContact O-N 3.5Å; K228-G230 PolarHBondContact O-N 2.78Å; G230-R234 PolarHBondContact O-NE 3.41Å
231	K	70.5	Confident	62.9	Low	148 Å²	148	93.2 Å²	93.2	64%	0.643	51%	0.513	S	S	*	.	H	α-helix	trans	-85.8	-52.5	165.8	-72.4	-168.8	177.2	-172.1	0	110	K228 A233 R234 I235	K228-K231 PolarHBondContact O-N 3.37Å; K231-A233 PolarHBondContact O-N 3.02Å; K231-R234 WeakPolarHBondContact O-CB 3.18Å; K231-R234 PolarHBondContact O-N 3.26Å; K231-I235 PolarHBondContact O-N 2.97Å; K231-I235 VanDerWaalsContact O-N 3.11Å
232	F	76.1	Confident	65.5	Low	127 Å²	127	94.7 Å²	94.7	56%	0.557	50%	0.504	S	S	*	.	H	α-helix	trans	-56.5	-45.3	-179.4	-173	-114.8	0	0	0	113	R234 I235 L236	F232-R234 PolarHBondContact O-N 2.94Å; F232-R234 VanDerWaalsContact O-N 3.17Å; F232-I235 PolarHBondContact O-N 3.46Å; F232-I235 VanDerWaalsContact O-N 3.14Å; F232-L236 HydrophobicContact CD1-CD1 3.89Å; F232-L236 HydrophobicContact CD1-CG 4.35Å; F232-L236 HydrophobicContact CE1-CD1 3.44Å; F232-L236 VanDerWaalsContact CE1-CD1 3.44Å; F232-L236 HydrophobicContact CE1-CG 4.04Å; F232-L236 HydrophobicContact CE2-CD2 4.41Å; F232-L236 HydrophobicContact CE2-CG 4.3Å; F232-L236 HydrophobicContact CZ-CD1 3.82Å; F232-L236 HydrophobicContact CZ-CD2 4.12Å; F232-L236 HydrophobicContact CZ-CG 4.01Å; F232-L236 PolarHBondContact O-N 2.85Å
233	A	70.8	Confident	68	Low	20 Å²	20	92.5 Å²	92.5	17%	0.165	49%	0.486	C	S	.	.	H	α-helix	trans	-67.3	-13.2	177.1	0	0	0	0	0	114.9	R229 K231 R237	R229-A233 WeakPolarHBondContact O-CB 3.45Å; R229-A233 PolarHBondContact O-N 2.93Å; R229-A233 VanDerWaalsContact O-N 3.13Å; K231-A233 PolarHBondContact O-N 3.02Å; A233-R237 WeakPolarHBondContact O-CB 3.4Å
234	R	75.4	Confident	70.3	Confident	167 Å²	167	87.7 Å²	87.7	63%	0.63	46%	0.455	S	S	*	.	H	α-helix	trans	-88.1	-38.9	169.3	-76.5	-173.4	-72.9	154.1	-6.4	111.9	G230 K231 F232 R237 A238	G230-R234 PolarHBondContact O-NE 3.41Å; K231-R234 WeakPolarHBondContact O-CB 3.18Å; K231-R234 PolarHBondContact O-N 3.26Å; F232-R234 PolarHBondContact O-N 2.94Å; F232-R234 VanDerWaalsContact O-N 3.17Å; R234-R237 WeakPolarHBondContact O-CB 3.23Å; R234-R237 PolarHBondContact O-N 2.73Å; R234-A238 PolarHBondContact O-N 3.45Å
235	I	81.2	Confident	72.8	Confident	118 Å²	118	79.5 Å²	79.5	61%	0.605	42%	0.421	S	S	*	.	H	α-helix	trans	-63.2	-48.9	175.3	-62.6	168.9	0	0	0	109.9	K231 F232 R237 A238 G239	K231-I235 PolarHBondContact O-N 2.97Å; K231-I235 VanDerWaalsContact O-N 3.11Å; F232-I235 PolarHBondContact O-N 3.46Å; F232-I235 VanDerWaalsContact O-N 3.14Å; I235-R237 PolarHBondContact O-N 3.13Å; I235-A238 PolarHBondContact O-N 3.33Å; I235-G239 PolarHBondContact O-N 3.04Å
236	L	80.1	Confident	75.2	Confident	65 Å²	65	77.9 Å²	77.9	34%	0.34	42%	0.415	S	S	.	.	H	α-helix	trans	-58.4	-33.3	174.1	-72.6	-176.8	0	0	0	113.3	F232 S240	F232-L236 HydrophobicContact CD1-CD1 3.89Å; F232-L236 HydrophobicContact CD1-CG 4.35Å; F232-L236 HydrophobicContact CE1-CD1 3.44Å; F232-L236 VanDerWaalsContact CE1-CD1 3.44Å; F232-L236 HydrophobicContact CE1-CG 4.04Å; F232-L236 HydrophobicContact CE2-CD2 4.41Å; F232-L236 HydrophobicContact CE2-CG 4.3Å; F232-L236 HydrophobicContact CZ-CD1 3.82Å; F232-L236 HydrophobicContact CZ-CD2 4.12Å; F232-L236 HydrophobicContact CZ-CG 4.01Å; F232-L236 PolarHBondContact O-N 2.85Å; L236-S240 WeakPolarHBondContact O-CB 3.28Å; L236-S240 PolarHBondContact O-N 2.78Å; L236-S240 PolarHBondContact O-OG 3.13Å; L236-S240 VanDerWaalsContact O-OG 3.08Å
237	R	80	Confident	77.6	Confident	34 Å²	34	74.4 Å²	74.4	13%	0.128	39%	0.392	C	S	.	.	H	α-helix	trans	-70.3	-48.1	176.1	-171.5	-172.4	-62	-151.6	-2.7	111.3	A233 R234 I235 G239 S240 I241 F303 S307 T309	A233-R237 WeakPolarHBondContact O-CB 3.4Å; R234-R237 WeakPolarHBondContact O-CB 3.23Å; R234-R237 PolarHBondContact O-N 2.73Å; I235-R237 PolarHBondContact O-N 3.13Å; R237-G239 VanDerWaalsContact C-N 3.34Å; R237-S240 PolarHBondContact O-N 2.88Å; R237-S240 PolarHBondContact O-OG 3.44Å; R237-I241 HydrophobicContact CG-CD1 3.85Å; R237-I241 WeakPolarHBondContact O-CB 3.12Å; R237-I241 WeakPolarHBondContact O-CD1 3.43Å; R237-I241 WeakPolarHBondContact O-CG1 3.32Å; R237-I241 PolarHBondContact O-N 3.35Å; R237-I241 VanDerWaalsContact O-N 3.09Å; R237-F303 HydrophobicContact CB-CD2 3.98Å; R237-F303 HydrophobicContact CB-CE2 3.56Å; R237-F303 HydrophobicContact CB-CZ 4.19Å; R237-F303 HydrophobicContact CG-CD2 4.32Å; R237-F303 HydrophobicContact CG-CE1 4.42Å; R237-F303 HydrophobicContact CG-CE2 3.64Å; R237-F303 HydrophobicContact CG-CZ 3.71Å; R237-F303 VanDerWaalsContact NE-CZ 3.28Å; R237-S307 PolarHBondContact NH2-OG 2.89Å; R237-T309 PolarHBondContact NH2-O 3.36Å; R237-T309 VanDerWaalsContact NH2-O 3.09Å; R237-T309 PolarHBondContact NH2-OG1 2.83Å
238	A	82.3	Confident	79.6	Confident	56 Å²	56	68.7 Å²	68.7	46%	0.463	35%	0.352	S	S	.	.	H	α-helix	trans	-62.1	-44.8	178.1	0	0	0	0	0	110.8	R234 I235 I241 L242	R234-A238 PolarHBondContact O-N 3.45Å; I235-A238 PolarHBondContact O-N 3.33Å; A238-I241 PolarHBondContact O-N 3.11Å; A238-L242 WeakPolarHBondContact O-CB 3.23Å; A238-L242 PolarHBondContact O-N 2.91Å
239	G	85.7	Confident	81.5	Confident	33 Å²	33	63.3 Å²	63.3	34%	0.34	33%	0.333	S	S	.	.	H	α-helix	trans	-59.7	-48.5	175.5	0	0	0	0	0	113.3	I235 R237 I241 L242 V243	I235-G239 PolarHBondContact O-N 3.04Å; R237-G239 VanDerWaalsContact C-N 3.34Å; G239-I241 VanDerWaalsContact C-N 3.29Å; G239-I241 PolarHBondContact O-N 3Å; G239-L242 PolarHBondContact O-N 2.95Å; G239-V243 WeakPolarHBondContact O-CB 3.45Å; G239-V243 VanDerWaalsContact O-CG2 3.31Å; G239-V243 WeakPolarHBondContact O-CG2 3.27Å; G239-V243 PolarHBondContact O-N 3.27Å
240	S	85.4	Confident	83.3	Confident	15 Å²	15	57.8 Å²	57.8	11%	0.105	32%	0.315	C	S	.	.	H	α-helix	trans	-71.2	-20.8	-180	67.9	0	0	0	0	114.3	L236 R237 G244	L236-S240 WeakPolarHBondContact O-CB 3.28Å; L236-S240 PolarHBondContact O-N 2.78Å; L236-S240 PolarHBondContact O-OG 3.13Å; L236-S240 VanDerWaalsContact O-OG 3.08Å; R237-S240 PolarHBondContact O-N 2.88Å; R237-S240 PolarHBondContact O-OG 3.44Å; S240-G244 PolarHBondContact O-N 2.88Å
241	I	83.8	Confident	84.4	Confident	7 Å²	7	55.8 Å²	55.8	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-80.4	-41.2	170.8	-64.3	169.3	0	0	0	110.6	R237 A238 G239 G244 L245 V359 T362 L363	R237-I241 HydrophobicContact CG-CD1 3.85Å; R237-I241 WeakPolarHBondContact O-CB 3.12Å; R237-I241 WeakPolarHBondContact O-CD1 3.43Å; R237-I241 WeakPolarHBondContact O-CG1 3.32Å; R237-I241 PolarHBondContact O-N 3.35Å; R237-I241 VanDerWaalsContact O-N 3.09Å; A238-I241 PolarHBondContact O-N 3.11Å; G239-I241 VanDerWaalsContact C-N 3.29Å; G239-I241 PolarHBondContact O-N 3Å; I241-G244 PolarHBondContact O-N 2.81Å; I241-L245 PolarHBondContact O-N 3.07Å; I241-V359 HydrophobicContact CG2-CG1 3.85Å; I241-V359 WeakPolarHBondContact O-CG1 3.16Å; I241-T362 WeakPolarHBondContact CG2-OG1 3.41Å; I241-L363 HydrophobicContact CB-CD2 4.23Å; I241-L363 HydrophobicContact CG2-CD1 4.3Å; I241-L363 HydrophobicContact CG2-CD2 3.45Å; I241-L363 VanDerWaalsContact CG2-CD2 3.45Å; I241-L363 HydrophobicContact CG2-CG 3.62Å
242	L	87.7	Confident	85.5	Confident	103 Å²	103	52.9 Å²	52.9	54%	0.539	28%	0.279	S	S	.	.	H	α-helix	trans	-66.9	-47.3	177.7	-179.5	63.2	0	0	0	112.4	A238 G239 G244 L245 V246	A238-L242 WeakPolarHBondContact O-CB 3.23Å; A238-L242 PolarHBondContact O-N 2.91Å; G239-L242 PolarHBondContact O-N 2.95Å; L242-G244 PolarHBondContact O-N 2.74Å; L242-L245 PolarHBondContact O-N 3.14Å; L242-L245 VanDerWaalsContact O-N 3.12Å; L242-V246 WeakPolarHBondContact O-CG2 3.29Å; L242-V246 PolarHBondContact O-N 3.05Å
243	V	88.7	Confident	86.3	Confident	61 Å²	61	48.8 Å²	48.8	37%	0.37	26%	0.263	S	S	.	.	H	α-helix	trans	-58.9	-39.8	173.9	169.3	0	0	0	0	110.5	G239 I247 L299	G239-V243 WeakPolarHBondContact O-CB 3.45Å; G239-V243 VanDerWaalsContact O-CG2 3.31Å; G239-V243 WeakPolarHBondContact O-CG2 3.27Å; G239-V243 PolarHBondContact O-N 3.27Å; V243-I247 HydrophobicContact CG1-CD1 3.76Å; V243-I247 VanDerWaalsContact O-CG1 3.32Å; V243-I247 WeakPolarHBondContact O-CG1 3.42Å; V243-I247 PolarHBondContact O-N 3.41Å; V243-L299 HydrophobicContact CG1-CD1 4.24Å
244	G	87.6	Confident	87.2	Confident	2 Å²	2	47.8 Å²	47.8	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-58.1	-53.8	170.7	0	0	0	0	0	112	S240 I241 L242 V246 I247 S248 W321	S240-G244 PolarHBondContact O-N 2.88Å; I241-G244 PolarHBondContact O-N 2.81Å; L242-G244 PolarHBondContact O-N 2.74Å; G244-V246 VanDerWaalsContact C-N 3.3Å; G244-V246 PolarHBondContact O-N 3.44Å; G244-I247 PolarHBondContact O-N 2.82Å; G244-I247 VanDerWaalsContact O-N 3.13Å; G244-S248 PolarHBondContact O-N 2.99Å; G244-S248 PolarHBondContact O-OG 3.14Å; G244-W321 WeakPolarHBondContact O-CH2 3.33Å; G244-W321 WeakPolarHBondContact O-CZ2 3.37Å
245	L	90.2	Very high	87.9	Confident	42 Å²	42	39.9 Å²	39.9	22%	0.22	23%	0.225	C	C	.	.	H	α-helix	trans	-56.6	-44.1	-178.4	-170.1	146.6	0	0	0	112	I241 L242 S248 V249 V359 L363	I241-L245 PolarHBondContact O-N 3.07Å; L242-L245 PolarHBondContact O-N 3.14Å; L242-L245 VanDerWaalsContact O-N 3.12Å; L245-S248 PolarHBondContact O-N 3.1Å; L245-V249 HydrophobicContact CD2-CG2 4.1Å; L245-V249 WeakPolarHBondContact O-CG2 3.43Å; L245-V249 PolarHBondContact O-N 3.31Å; L245-V359 HydrophobicContact CB-CG1 3.73Å; L245-V359 HydrophobicContact CD1-CG1 4.34Å; L245-V359 HydrophobicContact CG-CG1 4.41Å; L245-L363 HydrophobicContact CD1-CD1 3.81Å
246	V	91.5	Very high	88.3	Confident	71 Å²	71	35.2 Å²	35.2	43%	0.43	20%	0.201	S	C	.	.	H	α-helix	trans	-61.3	-48.3	176.5	173.5	0	0	0	0	111.1	L242 G244 S248 V249 L250	L242-V246 WeakPolarHBondContact O-CG2 3.29Å; L242-V246 PolarHBondContact O-N 3.05Å; G244-V246 VanDerWaalsContact C-N 3.3Å; G244-V246 PolarHBondContact O-N 3.44Å; V246-S248 VanDerWaalsContact C-N 3.32Å; V246-S248 PolarHBondContact O-N 3.03Å; V246-V249 PolarHBondContact O-N 3.44Å; V246-L250 HydrophobicContact CG1-CD1 3.83Å; V246-L250 HydrophobicContact CG1-CG 4.33Å; V246-L250 WeakPolarHBondContact O-CB 3.45Å; V246-L250 VanDerWaalsContact O-CG 3.3Å; V246-L250 WeakPolarHBondContact O-CG 3.45Å; V246-L250 PolarHBondContact O-N 2.92Å
247	I	89.8	Confident	88.7	Confident	14 Å²	14	32.2 Å²	32.2	7%	0.072	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-34.1	179.2	-64.2	165.2	0	0	0	111.3	V243 G244 T251 F285 L292 T293 A296 W321	V243-I247 HydrophobicContact CG1-CD1 3.76Å; V243-I247 VanDerWaalsContact O-CG1 3.32Å; V243-I247 WeakPolarHBondContact O-CG1 3.42Å; V243-I247 PolarHBondContact O-N 3.41Å; G244-I247 PolarHBondContact O-N 2.82Å; G244-I247 VanDerWaalsContact O-N 3.13Å; I247-T251 HydrophobicContact CG2-CG2 4.36Å; I247-T251 WeakPolarHBondContact O-CB 3.24Å; I247-T251 WeakPolarHBondContact O-CG2 3.23Å; I247-T251 PolarHBondContact O-N 3.17Å; I247-T251 PolarHBondContact O-OG1 3.13Å; I247-F285 HydrophobicContact CG2-CZ 4.49Å; I247-L292 HydrophobicContact CD1-CB 4.3Å; I247-L292 HydrophobicContact CG2-CB 4.25Å; I247-T293 HydrophobicContact CG2-CG2 4.26Å; I247-A296 HydrophobicContact CD1-CB 4.18Å; I247-W321 HydrophobicContact CB-CH2 3.76Å; I247-W321 HydrophobicContact CB-CZ3 4.13Å; I247-W321 HydrophobicContact CG2-CH2 3.77Å; I247-W321 HydrophobicContact CG2-CZ3 3.66Å
248	S	91.3	Very high	88.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-49.8	172.8	-57	0	0	0	0	111.4	G244 L245 V246 L250 T251 W252 W321 S352 C356	G244-S248 PolarHBondContact O-N 2.99Å; G244-S248 PolarHBondContact O-OG 3.14Å; L245-S248 PolarHBondContact O-N 3.1Å; V246-S248 VanDerWaalsContact C-N 3.32Å; V246-S248 PolarHBondContact O-N 3.03Å; S248-L250 VanDerWaalsContact C-N 3.31Å; S248-L250 PolarHBondContact O-N 3.31Å; S248-T251 WeakPolarHBondContact CA-OG1 3.44Å; S248-T251 PolarHBondContact O-N 2.66Å; S248-T251 PolarHBondContact O-OG1 3.11Å; S248-W252 WeakPolarHBondContact O-CB 3.49Å; S248-W252 PolarHBondContact O-N 2.94Å; S248-W321 VanDerWaalsContact OG-CH2 3.3Å; S248-W321 WeakPolarHBondContact OG-CH2 3.21Å; S248-W321 WeakPolarHBondContact OG-CZ2 3.16Å; S248-S352 PolarHBondContact O-OG 3.37Å; S248-C356 VanDerWaalsContact C-SG 3.59Å; S248-C356 WeakPolarHBondContact CB-SG 3.43Å
249	V	92.4	Very high	89.1	Confident	56 Å²	56	31 Å²	31	34%	0.339	17%	0.173	S	C	.	.	H	α-helix	trans	-60.5	-41.9	178.4	172.6	0	0	0	0	111.3	L245 V246 W252 L253	L245-V249 HydrophobicContact CD2-CG2 4.1Å; L245-V249 WeakPolarHBondContact O-CG2 3.43Å; L245-V249 PolarHBondContact O-N 3.31Å; V246-V249 PolarHBondContact O-N 3.44Å; V249-W252 PolarHBondContact O-N 3.03Å; V249-L253 HydrophobicContact CG1-CD1 3.94Å; V249-L253 HydrophobicContact CG1-CG 4.43Å; V249-L253 WeakPolarHBondContact O-CB 3.48Å; V249-L253 VanDerWaalsContact O-CG 3.28Å; V249-L253 WeakPolarHBondContact O-CG 3.4Å; V249-L253 PolarHBondContact O-N 2.82Å
250	L	92	Very high	89.2	Confident	32 Å²	32	31.1 Å²	31.1	17%	0.168	16%	0.163	C	C	.	.	H	α-helix	trans	-71.1	-36.8	179.2	-66	179.2	0	0	0	113.5	V246 S248 L253 S254 W281 F285	V246-L250 HydrophobicContact CG1-CD1 3.83Å; V246-L250 HydrophobicContact CG1-CG 4.33Å; V246-L250 WeakPolarHBondContact O-CB 3.45Å; V246-L250 VanDerWaalsContact O-CG 3.3Å; V246-L250 WeakPolarHBondContact O-CG 3.45Å; V246-L250 PolarHBondContact O-N 2.92Å; S248-L250 VanDerWaalsContact C-N 3.31Å; S248-L250 PolarHBondContact O-N 3.31Å; L250-L253 HydrophobicContact CD2-CD1 4.32Å; L250-S254 WeakPolarHBondContact O-CB 3.35Å; L250-S254 PolarHBondContact O-N 3.48Å; L250-S254 PolarHBondContact O-OG 3.25Å; L250-W281 HydrophobicContact CD1-CH2 4.13Å; L250-W281 HydrophobicContact CD2-CH2 3.58Å; L250-W281 HydrophobicContact CD2-CZ3 3.79Å; L250-W281 HydrophobicContact CG-CH2 4.49Å; L250-F285 HydrophobicContact CB-CD1 4.06Å; L250-F285 HydrophobicContact CB-CD2 4.24Å; L250-F285 HydrophobicContact CB-CE1 3.52Å; L250-F285 HydrophobicContact CB-CE2 3.72Å; L250-F285 HydrophobicContact CB-CG 4.41Å; L250-F285 HydrophobicContact CB-CZ 3.33Å; L250-F285 HydrophobicContact CD1-CD2 4.08Å; L250-F285 HydrophobicContact CD1-CE2 3.48Å; L250-F285 VanDerWaalsContact CD1-CE2 3.48Å; L250-F285 HydrophobicContact CD1-CZ 3.91Å; L250-F285 HydrophobicContact CG-CE2 4.24Å; L250-F285 HydrophobicContact CG-CZ 4.27Å
251	T	90.9	Very high	89	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.2	-40.1	171.7	44.2	0	0	0	0	111.6	I247 S248 S254 S255 F285 A289 T293 Y328 S352	I247-T251 HydrophobicContact CG2-CG2 4.36Å; I247-T251 WeakPolarHBondContact O-CB 3.24Å; I247-T251 WeakPolarHBondContact O-CG2 3.23Å; I247-T251 PolarHBondContact O-N 3.17Å; I247-T251 PolarHBondContact O-OG1 3.13Å; S248-T251 WeakPolarHBondContact CA-OG1 3.44Å; S248-T251 PolarHBondContact O-N 2.66Å; S248-T251 PolarHBondContact O-OG1 3.11Å; T251-S254 PolarHBondContact O-N 2.97Å; T251-S255 PolarHBondContact O-N 3.32Å; T251-S255 PolarHBondContact O-OG 3.13Å; T251-F285 HydrophobicContact CG2-CE1 3.86Å; T251-A289 HydrophobicContact CG2-CB 3.97Å; T251-T293 HydrophobicContact CG2-CG2 4.45Å; T251-Y328 VanDerWaalsContact CB-OH 3.29Å; T251-Y328 WeakPolarHBondContact CB-OH 3.39Å; T251-Y328 HydrophobicContact CG2-CE2 3.55Å; T251-Y328 PolarHBondContact O-OH 3.35Å; T251-S352 PolarHBondContact OG1-OG 2.89Å
252	W	93.4	Very high	89	Confident	87 Å²	87	37.2 Å²	37.2	33%	0.33	20%	0.204	S	C	.	.	H	α-helix	trans	-62.4	-47.7	174.7	-178.5	79.4	0	0	0	112	S248 V249 S254 S255 L256 S352 T353	S248-W252 WeakPolarHBondContact O-CB 3.49Å; S248-W252 PolarHBondContact O-N 2.94Å; V249-W252 PolarHBondContact O-N 3.03Å; W252-S254 VanDerWaalsContact C-N 3.3Å; W252-S254 PolarHBondContact O-N 3.37Å; W252-S255 PolarHBondContact O-N 2.75Å; W252-L256 HydrophobicContact CH2-CD2 3.6Å; W252-L256 HydrophobicContact CZ2-CD2 3.97Å; W252-L256 HydrophobicContact CZ3-CD2 3.91Å; W252-L256 VanDerWaalsContact O-CB 3.26Å; W252-L256 WeakPolarHBondContact O-CB 3.47Å; W252-L256 PolarHBondContact O-N 3.06Å; W252-S352 PolarHBondContact N-OG 3.42Å; W252-T353 PolarHBondContact NE1-OG1 3.41Å; W252-T353 VanDerWaalsContact NE1-OG1 3.17Å
253	L	92.5	Very high	88.7	Confident	41 Å²	41	33.8 Å²	33.8	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-38.6	175	-71.7	169.1	0	0	0	112.1	V249 L250 L256 D257 L275 L282	V249-L253 HydrophobicContact CG1-CD1 3.94Å; V249-L253 HydrophobicContact CG1-CG 4.43Å; V249-L253 WeakPolarHBondContact O-CB 3.48Å; V249-L253 VanDerWaalsContact O-CG 3.28Å; V249-L253 WeakPolarHBondContact O-CG 3.4Å; V249-L253 PolarHBondContact O-N 2.82Å; L250-L253 HydrophobicContact CD2-CD1 4.32Å; L253-L256 PolarHBondContact O-N 3.05Å; L253-D257 WeakPolarHBondContact O-CB 3.21Å; L253-D257 PolarHBondContact O-N 3.32Å; L253-L275 HydrophobicContact CD2-CD2 3.85Å; L253-L282 HydrophobicContact CB-CD2 3.93Å
254	S	90.3	Very high	88.4	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-47.8	178.9	-56.1	0	0	0	0	111.9	L250 T251 W252 L256 D257 M258 L282 F285	L250-S254 WeakPolarHBondContact O-CB 3.35Å; L250-S254 PolarHBondContact O-N 3.48Å; L250-S254 PolarHBondContact O-OG 3.25Å; T251-S254 PolarHBondContact O-N 2.97Å; W252-S254 VanDerWaalsContact C-N 3.3Å; W252-S254 PolarHBondContact O-N 3.37Å; S254-L256 VanDerWaalsContact C-N 3.29Å; S254-L256 PolarHBondContact O-N 3.32Å; S254-D257 PolarHBondContact O-N 3.04Å; S254-M258 VanDerWaalsContact O-CG 3.26Å; S254-M258 WeakPolarHBondContact O-CG 3.25Å; S254-M258 PolarHBondContact O-N 2.81Å; S254-L282 PolarHBondContact OG-O 2.89Å; S254-F285 WeakPolarHBondContact OG-CD1 3.41Å
255	S	88.8	Confident	88.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-32.3	175.8	-64.1	0	0	0	0	112.2	T251 W252 L259 Y328 Q348	T251-S255 PolarHBondContact O-N 3.32Å; T251-S255 PolarHBondContact O-OG 3.13Å; W252-S255 PolarHBondContact O-N 2.75Å; S255-L259 WeakPolarHBondContact O-CB 3.31Å; S255-L259 VanDerWaalsContact O-CG 3.28Å; S255-L259 WeakPolarHBondContact O-CG 3.24Å; S255-L259 PolarHBondContact O-N 3.46Å; S255-Y328 PolarHBondContact OG-OH 3.08Å; S255-Q348 WeakPolarHBondContact OG-CB 3.15Å; S255-Q348 PolarHBondContact OG-OE1 2.98Å
256	L	89	Confident	88.1	Confident	20 Å²	20	49.3 Å²	49.3	11%	0.105	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-40.8	174.3	-178.2	62.6	0	0	0	112.5	W252 L253 S254 L259 R260 F268 T272 L275 M349	W252-L256 HydrophobicContact CH2-CD2 3.6Å; W252-L256 HydrophobicContact CZ2-CD2 3.97Å; W252-L256 HydrophobicContact CZ3-CD2 3.91Å; W252-L256 VanDerWaalsContact O-CB 3.26Å; W252-L256 WeakPolarHBondContact O-CB 3.47Å; W252-L256 PolarHBondContact O-N 3.06Å; L253-L256 PolarHBondContact O-N 3.05Å; S254-L256 VanDerWaalsContact C-N 3.29Å; S254-L256 PolarHBondContact O-N 3.32Å; L256-L259 PolarHBondContact O-N 3.1Å; L256-R260 WeakPolarHBondContact O-CB 3.37Å; L256-R260 PolarHBondContact O-N 2.98Å; L256-F268 HydrophobicContact CD1-CE2 4.15Å; L256-F268 HydrophobicContact CD1-CZ 3.71Å; L256-T272 HydrophobicContact CD1-CG2 4.18Å; L256-T272 HydrophobicContact CG-CG2 4.38Å; L256-L275 HydrophobicContact CB-CD1 4.5Å; L256-L275 HydrophobicContact CD2-CD1 3.88Å; L256-L275 HydrophobicContact CG-CD1 3.91Å; L256-M349 HydrophobicContact CD1-SD 4.05Å
257	D	88.4	Confident	87.9	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.011	27%	0.273	C	S	.	.	H	α-helix	trans	-70.7	-34.8	177	-170.1	64.8	0	0	0	112.4	L253 S254 R260 A261 L275 N279 L282	L253-D257 WeakPolarHBondContact O-CB 3.21Å; L253-D257 PolarHBondContact O-N 3.32Å; S254-D257 PolarHBondContact O-N 3.04Å; D257-R260 WeakPolarHBondContact O-CB 3.46Å; D257-R260 PolarHBondContact O-N 3.23Å; D257-A261 WeakPolarHBondContact O-CB 3.26Å; D257-A261 PolarHBondContact O-N 2.81Å; D257-L275 HydrophobicContact CB-CD1 4.4Å; D257-N279 VanDerWaalsContact OD2-CA 3.32Å; D257-N279 WeakPolarHBondContact OD2-CA 3.33Å; D257-L282 HydrophobicContact CB-CB 4.32Å; D257-L282 HydrophobicContact CB-CD1 3.69Å
258	M	86.2	Confident	87.8	Confident	37 Å²	37	54.5 Å²	54.5	18%	0.182	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-45.3	170.1	-62.7	-68.4	89.6	0	0	112.2	S254 R260 A261 D262 T283 L345	S254-M258 VanDerWaalsContact O-CG 3.26Å; S254-M258 WeakPolarHBondContact O-CG 3.25Å; S254-M258 PolarHBondContact O-N 2.81Å; M258-R260 PolarHBondContact O-N 2.89Å; M258-A261 PolarHBondContact O-N 3.03Å; M258-D262 PolarHBondContact O-N 2.91Å; M258-T283 WeakPolarHBondContact CE-OG1 3.45Å; M258-L345 HydrophobicContact CB-CD1 4.05Å; M258-L345 HydrophobicContact CB-CD2 3.91Å; M258-L345 HydrophobicContact CG-CD2 4.36Å
259	L	86	Confident	87.5	Confident	27 Å²	27	56.8 Å²	56.8	14%	0.141	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-29.1	174.3	-73.7	168.5	0	0	0	112.4	S255 L256 S263 F268 L345 V346 M349	S255-L259 WeakPolarHBondContact O-CB 3.31Å; S255-L259 VanDerWaalsContact O-CG 3.28Å; S255-L259 WeakPolarHBondContact O-CG 3.24Å; S255-L259 PolarHBondContact O-N 3.46Å; L256-L259 PolarHBondContact O-N 3.1Å; L259-S263 WeakPolarHBondContact O-CB 3.34Å; L259-S263 PolarHBondContact O-N 3.03Å; L259-F268 HydrophobicContact CB-CE1 4.49Å; L259-L345 HydrophobicContact CD2-CB 3.76Å; L259-L345 HydrophobicContact CD2-CD1 4.39Å; L259-L345 HydrophobicContact CG-CB 4Å; L259-V346 HydrophobicContact CD1-CG2 4.38Å; L259-V346 HydrophobicContact CD2-CG2 3.93Å; L259-M349 HydrophobicContact CD1-CB 4.27Å; L259-M349 HydrophobicContact CD1-CE 3.64Å; L259-M349 HydrophobicContact CD1-SD 3.81Å
260	R	86.6	Confident	87.3	Confident	37 Å²	37	60.9 Å²	60.9	14%	0.14	31%	0.31	C	S	.	.	H	α-helix	trans	-69.1	-44.9	171.8	179.9	-166.8	175.5	-176.3	-6.8	111.7	L256 D257 M258 D262 S263 F268 V269 T272 R273 A276	L256-R260 WeakPolarHBondContact O-CB 3.37Å; L256-R260 PolarHBondContact O-N 2.98Å; D257-R260 WeakPolarHBondContact O-CB 3.46Å; D257-R260 PolarHBondContact O-N 3.23Å; M258-R260 PolarHBondContact O-N 2.89Å; R260-D262 PolarHBondContact O-N 2.79Å; R260-S263 PolarHBondContact O-N 3.21Å; R260-F268 HydrophobicContact CB-CE1 4.23Å; R260-V269 HydrophobicContact CG-CG2 4.31Å; R260-T272 WeakPolarHBondContact CD-OG1 3.13Å; R260-T272 VanDerWaalsContact CG-OG1 3.25Å; R260-T272 WeakPolarHBondContact CG-OG1 3.38Å; R260-T272 PolarHBondContact NH1-O 2.92Å; R260-R273 VanDerWaalsContact NH1-C 3.31Å; R260-R273 PolarHBondContact NH1-O 3.44Å; R260-A276 VanDerWaalsContact NH1-N 3.12Å
261	A	82.3	Confident	87	Confident	72 Å²	72	65.5 Å²	65.5	60%	0.595	33%	0.334	S	S	*	.	H	α-helix	trans	-64.8	-25.8	-177.2	0	0	0	0	0	113.2	D257 M258	D257-A261 WeakPolarHBondContact O-CB 3.26Å; D257-A261 PolarHBondContact O-N 2.81Å; M258-A261 PolarHBondContact O-N 3.03Å
262	D	82.7	Confident	86.8	Confident	78 Å²	78	66.2 Å²	66.2	42%	0.417	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	10.4	179.5	-164.8	58.5	0	0	0	113.3	M258 R260 R342	M258-D262 PolarHBondContact O-N 2.91Å; R260-D262 PolarHBondContact O-N 2.79Å; D262-R342 VanDerWaalsContact CG-NH1 3.27Å; D262-R342 IonicContact OD1-NH1 3.05Å; D262-R342 PolarHBondContact OD1-NH1 3.27Å; D262-R342 WeakPolarHBondContact OD2-CD 3.45Å; D262-R342 WeakPolarHBondContact OD2-CG 3.37Å; D262-R342 IonicContact OD2-CZ 3.46Å; D262-R342 IonicContact OD2-NE 3.13Å; D262-R342 IonicContact OD2-NH1 3.7Å; D262-R342 PolarHBondContact OD2-NH1 3.26Å
263	S	82.6	Confident	86.6	Confident	31 Å²	31	69.9 Å²	69.9	22%	0.217	35%	0.352	C	S	.	.			trans	-105.4	111.8	-173.5	160.5	0	0	0	0	113.5	L259 R260 N265 F268 V269	L259-S263 WeakPolarHBondContact O-CB 3.34Å; L259-S263 PolarHBondContact O-N 3.03Å; R260-S263 PolarHBondContact O-N 3.21Å; S263-N265 PolarHBondContact O-N 2.99Å; S263-N265 PolarHBondContact OG-N 3.42Å; S263-F268 WeakPolarHBondContact OG-CD1 3.33Å; S263-V269 WeakPolarHBondContact O-CG2 3.38Å
264	D	81.1	Confident	86.4	Confident	170 Å²	170	74.8 Å²	74.8	91%	0.909	38%	0.379	S	S	*	.			trans	-64.3	-13.6	168.9	-64.1	-40.9	0	0	0	114.3	E266	D264-E266 PolarHBondContact O-N 3.48Å
265	N	87.2	Confident	86.2	Confident	90 Å²	90	76 Å²	76	48%	0.481	39%	0.385	S	S	.	.			trans	-77.2	103.9	-178.4	-175.7	-10.8	0	0	0	112.1	S263 E267 F268 V269	S263-N265 PolarHBondContact O-N 2.99Å; S263-N265 PolarHBondContact OG-N 3.42Å; N265-E267 VanDerWaalsContact C-N 3.27Å; N265-E267 PolarHBondContact O-N 3.22Å; N265-E267 WeakPolarHBondContact OD1-CB 3.35Å; N265-E267 PolarHBondContact OD1-N 2.91Å; N265-F268 HydrophobicContact CB-CB 4.17Å; N265-F268 PolarHBondContact O-N 3.42Å; N265-F268 VanDerWaalsContact O-N 3.11Å; N265-V269 WeakPolarHBondContact O-CG2 3.4Å; N265-V269 PolarHBondContact O-N 2.84Å
266	E	85.5	Confident	86	Confident	170 Å²	170	78.4 Å²	78.4	79%	0.794	41%	0.405	S	S	*	.	H	α-helix	trans	-53.7	-36.9	177.5	-62.6	-168.6	159.2	0	0	113.9	D264 V269 F270	D264-E266 PolarHBondContact O-N 3.48Å; E266-V269 PolarHBondContact O-N 2.96Å; E266-F270 VanDerWaalsContact O-CB 3.26Å; E266-F270 WeakPolarHBondContact O-CB 3.41Å; E266-F270 PolarHBondContact O-N 3.38Å
267	E	87.5	Confident	85.9	Confident	134 Å²	134	82.6 Å²	82.6	63%	0.626	43%	0.433	S	S	*	.	H	α-helix	trans	-65.4	-42.5	179.1	-172.9	-176.8	-171.4	0	0	110.8	N265 F270 L271	N265-E267 VanDerWaalsContact C-N 3.27Å; N265-E267 PolarHBondContact O-N 3.22Å; N265-E267 WeakPolarHBondContact OD1-CB 3.35Å; N265-E267 PolarHBondContact OD1-N 2.91Å; E267-F270 PolarHBondContact O-N 3.17Å; E267-L271 HydrophobicContact CG-CD1 4.15Å; E267-L271 WeakPolarHBondContact O-CB 3.07Å; E267-L271 VanDerWaalsContact O-CG 3.3Å; E267-L271 WeakPolarHBondContact O-CG 3.3Å; E267-L271 PolarHBondContact O-N 2.97Å
268	F	86.8	Confident	85.9	Confident	61 Å²	61	87.9 Å²	87.9	27%	0.268	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-42	177.2	-178.2	-109.8	0	0	0	111.7	L256 L259 R260 S263 N265 F270 L271 T272	L256-F268 HydrophobicContact CD1-CE2 4.15Å; L256-F268 HydrophobicContact CD1-CZ 3.71Å; L259-F268 HydrophobicContact CB-CE1 4.49Å; R260-F268 HydrophobicContact CB-CE1 4.23Å; S263-F268 WeakPolarHBondContact OG-CD1 3.33Å; N265-F268 HydrophobicContact CB-CB 4.17Å; N265-F268 PolarHBondContact O-N 3.42Å; N265-F268 VanDerWaalsContact O-N 3.11Å; F268-F270 VanDerWaalsContact C-N 3.28Å; F268-F270 PolarHBondContact O-N 3.39Å; F268-L271 PolarHBondContact O-N 3.35Å; F268-T272 HydrophobicContact CD2-CG2 4.31Å; F268-T272 HydrophobicContact CE1-CG2 4.45Å; F268-T272 HydrophobicContact CE2-CG2 3.97Å; F268-T272 HydrophobicContact CZ-CG2 4.07Å; F268-T272 WeakPolarHBondContact O-CB 3.27Å; F268-T272 WeakPolarHBondContact O-CG2 3.49Å; F268-T272 PolarHBondContact O-N 3.36Å; F268-T272 PolarHBondContact O-OG1 2.97Å
269	V	86.2	Confident	85.8	Confident	47 Å²	47	89.1 Å²	89.1	29%	0.285	46%	0.464	S	S	.	.	H	α-helix	trans	-65.5	-31.1	176	175.5	0	0	0	0	112	R260 S263 N265 E266 R273	R260-V269 HydrophobicContact CG-CG2 4.31Å; S263-V269 WeakPolarHBondContact O-CG2 3.38Å; N265-V269 WeakPolarHBondContact O-CG2 3.4Å; N265-V269 PolarHBondContact O-N 2.84Å; E266-V269 PolarHBondContact O-N 2.96Å; V269-R273 PolarHBondContact O-N 2.86Å
270	F	86.8	Confident	85.8	Confident	143 Å²	143	95.8 Å²	95.8	63%	0.627	49%	0.494	S	S	*	.	H	α-helix	trans	-72.4	-48.7	172.5	-179.2	-92.5	0	0	0	112	E266 E267 F268 T272 R273	E266-F270 VanDerWaalsContact O-CB 3.26Å; E266-F270 WeakPolarHBondContact O-CB 3.41Å; E266-F270 PolarHBondContact O-N 3.38Å; E267-F270 PolarHBondContact O-N 3.17Å; F268-F270 VanDerWaalsContact C-N 3.28Å; F268-F270 PolarHBondContact O-N 3.39Å; F270-T272 PolarHBondContact O-N 3.14Å; F270-R273 WeakPolarHBondContact O-CB 3.47Å; F270-R273 PolarHBondContact O-N 3.29Å; F270-R273 VanDerWaalsContact O-N 3.11Å
271	L	87.1	Confident	85.9	Confident	128 Å²	128	100.8 Å²	100.8	67%	0.67	51%	0.513	S	S	*	.	H	α-helix	trans	-62.7	-29.3	178.7	-73.9	170.4	0	0	0	113.2	E267 F268	E267-L271 HydrophobicContact CG-CD1 4.15Å; E267-L271 WeakPolarHBondContact O-CB 3.07Å; E267-L271 VanDerWaalsContact O-CG 3.3Å; E267-L271 WeakPolarHBondContact O-CG 3.3Å; E267-L271 PolarHBondContact O-N 2.97Å; F268-L271 PolarHBondContact O-N 3.35Å
272	T	87	Confident	86.2	Confident	16 Å²	16	97.5 Å²	97.5	10%	0.098	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	9.2	178	56.2	0	0	0	0	113.5	L256 R260 F268 F270 D274 L275	L256-T272 HydrophobicContact CD1-CG2 4.18Å; L256-T272 HydrophobicContact CG-CG2 4.38Å; R260-T272 WeakPolarHBondContact CD-OG1 3.13Å; R260-T272 VanDerWaalsContact CG-OG1 3.25Å; R260-T272 WeakPolarHBondContact CG-OG1 3.38Å; R260-T272 PolarHBondContact NH1-O 2.92Å; F268-T272 HydrophobicContact CD2-CG2 4.31Å; F268-T272 HydrophobicContact CE1-CG2 4.45Å; F268-T272 HydrophobicContact CE2-CG2 3.97Å; F268-T272 HydrophobicContact CZ-CG2 4.07Å; F268-T272 WeakPolarHBondContact O-CB 3.27Å; F268-T272 WeakPolarHBondContact O-CG2 3.49Å; F268-T272 PolarHBondContact O-N 3.36Å; F268-T272 PolarHBondContact O-OG1 2.97Å; F270-T272 PolarHBondContact O-N 3.14Å; T272-D274 VanDerWaalsContact C-N 3.26Å; T272-D274 PolarHBondContact O-N 3.09Å; T272-D274 VanDerWaalsContact O-N 3.07Å; T272-L275 PolarHBondContact O-N 3.36Å; T272-L275 VanDerWaalsContact O-N 3.09Å
273	R	87.7	Confident	86.3	Confident	164 Å²	164	95.3 Å²	95.3	62%	0.619	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-50.9	-41	-167.8	-178.2	171.6	179.7	161.8	1.3	114.3	R260 V269 F270 L275 A276	R260-R273 VanDerWaalsContact NH1-C 3.31Å; R260-R273 PolarHBondContact NH1-O 3.44Å; V269-R273 PolarHBondContact O-N 2.86Å; F270-R273 WeakPolarHBondContact O-CB 3.47Å; F270-R273 PolarHBondContact O-N 3.29Å; F270-R273 VanDerWaalsContact O-N 3.11Å; R273-L275 PolarHBondContact O-N 3.36Å; R273-L275 VanDerWaalsContact O-N 3.11Å; R273-A276 WeakPolarHBondContact O-CB 3.39Å; R273-A276 PolarHBondContact O-N 3.34Å; R273-A276 VanDerWaalsContact O-N 3.13Å
274	D	88.2	Confident	86.4	Confident	143 Å²	143	96.9 Å²	96.9	77%	0.765	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-66.5	-10.7	-174.6	-62.5	-23.1	0	0	0	114.7	T272 P277	T272-D274 VanDerWaalsContact C-N 3.26Å; T272-D274 PolarHBondContact O-N 3.09Å; T272-D274 VanDerWaalsContact O-N 3.07Å; D274-P277 WeakPolarHBondContact O-CD 3.19Å
275	L	86.5	Confident	86.7	Confident	27 Å²	27	89.7 Å²	89.7	14%	0.141	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-75.7	-22.3	173.1	-61.4	177.3	0	0	0	113.5	L253 L256 D257 T272 R273 P277 F278 L282	L253-L275 HydrophobicContact CD2-CD2 3.85Å; L256-L275 HydrophobicContact CB-CD1 4.5Å; L256-L275 HydrophobicContact CD2-CD1 3.88Å; L256-L275 HydrophobicContact CG-CD1 3.91Å; D257-L275 HydrophobicContact CB-CD1 4.4Å; T272-L275 PolarHBondContact O-N 3.36Å; T272-L275 VanDerWaalsContact O-N 3.09Å; R273-L275 PolarHBondContact O-N 3.36Å; R273-L275 VanDerWaalsContact O-N 3.11Å; L275-P277 VanDerWaalsContact C-CD 3.43Å; L275-F278 WeakPolarHBondContact O-CA 3.46Å; L275-F278 WeakPolarHBondContact O-CB 3.38Å; L275-F278 PolarHBondContact O-N 3.08Å; L275-L282 HydrophobicContact CD2-CD1 4.46Å
276	A	83.9	Confident	86.6	Confident	50 Å²	50	86.8 Å²	86.8	41%	0.413	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-55.9	-39.7	-170.8	0	0	0	0	0	114.9	R260 R273 F278 N279	R260-A276 VanDerWaalsContact NH1-N 3.12Å; R273-A276 WeakPolarHBondContact O-CB 3.39Å; R273-A276 PolarHBondContact O-N 3.34Å; R273-A276 VanDerWaalsContact O-N 3.13Å; A276-F278 PolarHBondContact O-N 3.48Å; A276-F278 VanDerWaalsContact O-N 3.08Å; A276-N279 PolarHBondContact O-N 3.24Å
277	P	87.9	Confident	86.5	Confident	107 Å²	107	87.8 Å²	87.8	70%	0.695	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-63.5	-11.8	176.1	-21.8	35	0	0	0	114.5	D274 L275	D274-P277 WeakPolarHBondContact O-CD 3.19Å; L275-P277 VanDerWaalsContact C-CD 3.43Å
278	F	87.9	Confident	86.4	Confident	113 Å²	113	85.9 Å²	85.9	50%	0.496	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-110.8	0.4	-175.6	-54.7	-76.9	0	0	0	113.6	L275 A276 E280 W281 L282	L275-F278 WeakPolarHBondContact O-CA 3.46Å; L275-F278 WeakPolarHBondContact O-CB 3.38Å; L275-F278 PolarHBondContact O-N 3.08Å; A276-F278 PolarHBondContact O-N 3.48Å; A276-F278 VanDerWaalsContact O-N 3.08Å; F278-E280 PolarHBondContact O-N 3.24Å; F278-W281 CarbonylContact O-C 3.59Å; F278-W281 WeakPolarHBondContact O-CA 3.38Å; F278-W281 WeakPolarHBondContact O-CB 3.46Å; F278-W281 PolarHBondContact O-N 3.21Å; F278-L282 HydrophobicContact CB-CD1 4.03Å; F278-L282 HydrophobicContact CB-CG 4.16Å; F278-L282 PolarHBondContact O-N 3.46Å
279	N	84.4	Confident	86.4	Confident	63 Å²	63	83 Å²	83	34%	0.337	41%	0.408	S	S	.	.	H	α-helix	trans	-54	-50.4	-171.8	177.5	-39.4	0	0	0	113.3	D257 A276 W281 L282 T283	D257-N279 VanDerWaalsContact OD2-CA 3.32Å; D257-N279 WeakPolarHBondContact OD2-CA 3.33Å; A276-N279 PolarHBondContact O-N 3.24Å; N279-W281 PolarHBondContact O-N 2.92Å; N279-L282 PolarHBondContact O-N 2.81Å; N279-T283 VanDerWaalsContact O-CB 3.24Å; N279-T283 WeakPolarHBondContact O-CB 3.19Å; N279-T283 PolarHBondContact O-N 2.91Å; N279-T283 PolarHBondContact O-OG1 2.89Å; N279-T283 PolarHBondContact OD1-OG1 3.34Å; N279-T283 VanDerWaalsContact OD1-OG1 3.1Å
280	E	85.3	Confident	86.4	Confident	167 Å²	167	81.2 Å²	81.2	78%	0.78	40%	0.398	S	S	*	.	H	α-helix	trans	-58.2	-35.8	178.4	-66.1	-167.3	159.4	0	0	112.5	F278 S284	F278-E280 PolarHBondContact O-N 3.24Å; E280-S284 VanDerWaalsContact O-CB 3.23Å; E280-S284 WeakPolarHBondContact O-CB 3.31Å; E280-S284 PolarHBondContact O-N 3.02Å; E280-S284 PolarHBondContact O-OG 2.87Å
281	W	89.3	Confident	86.3	Confident	142 Å²	142	79.5 Å²	79.5	54%	0.538	40%	0.395	S	S	.	.	H	α-helix	trans	-76.3	-41.1	179.9	-175	78.6	0	0	0	112.3	L250 F278 N279 S284 F285	L250-W281 HydrophobicContact CD1-CH2 4.13Å; L250-W281 HydrophobicContact CD2-CH2 3.58Å; L250-W281 HydrophobicContact CD2-CZ3 3.79Å; L250-W281 HydrophobicContact CG-CH2 4.49Å; F278-W281 CarbonylContact O-C 3.59Å; F278-W281 WeakPolarHBondContact O-CA 3.38Å; F278-W281 WeakPolarHBondContact O-CB 3.46Å; F278-W281 PolarHBondContact O-N 3.21Å; N279-W281 PolarHBondContact O-N 2.92Å; W281-S284 PolarHBondContact O-N 3.14Å; W281-F285 WeakPolarHBondContact O-CB 3.44Å; W281-F285 PolarHBondContact O-N 2.88Å
282	L	89.1	Confident	86.3	Confident	4 Å²	4	75.3 Å²	75.3	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-67.9	-43	175.1	-69.5	175.4	0	0	0	111.2	L253 S254 D257 L275 F278 N279 S284 F285 N286	L253-L282 HydrophobicContact CB-CD2 3.93Å; S254-L282 PolarHBondContact OG-O 2.89Å; D257-L282 HydrophobicContact CB-CB 4.32Å; D257-L282 HydrophobicContact CB-CD1 3.69Å; L275-L282 HydrophobicContact CD2-CD1 4.46Å; F278-L282 HydrophobicContact CB-CD1 4.03Å; F278-L282 HydrophobicContact CB-CG 4.16Å; F278-L282 PolarHBondContact O-N 3.46Å; N279-L282 PolarHBondContact O-N 2.81Å; L282-S284 VanDerWaalsContact C-N 3.33Å; L282-S284 PolarHBondContact O-N 3.32Å; L282-F285 PolarHBondContact O-N 3.39Å; L282-N286 WeakPolarHBondContact O-CB 3.47Å; L282-N286 PolarHBondContact O-N 3.46Å
283	T	83.6	Confident	86.2	Confident	32 Å²	32	74.5 Å²	74.5	20%	0.196	37%	0.368	C	S	.	.	H	α-helix	trans	-56.9	-45.3	170.2	-63.6	0	0	0	0	111.5	M258 N279 N286 R287	M258-T283 WeakPolarHBondContact CE-OG1 3.45Å; N279-T283 VanDerWaalsContact O-CB 3.24Å; N279-T283 WeakPolarHBondContact O-CB 3.19Å; N279-T283 PolarHBondContact O-N 2.91Å; N279-T283 PolarHBondContact O-OG1 2.89Å; N279-T283 PolarHBondContact OD1-OG1 3.34Å; N279-T283 VanDerWaalsContact OD1-OG1 3.1Å; T283-N286 WeakPolarHBondContact O-CB 3.42Å; T283-N286 PolarHBondContact O-N 3.04Å; T283-R287 PolarHBondContact O-N 3.36Å
284	S	85.3	Confident	86.1	Confident	63 Å²	63	71.5 Å²	71.5	44%	0.441	36%	0.359	S	S	.	.	H	α-helix	trans	-65.9	-39.4	176.6	-64	0	0	0	0	112.3	E280 W281 L282 R287 L288	E280-S284 VanDerWaalsContact O-CB 3.23Å; E280-S284 WeakPolarHBondContact O-CB 3.31Å; E280-S284 PolarHBondContact O-N 3.02Å; E280-S284 PolarHBondContact O-OG 2.87Å; W281-S284 PolarHBondContact O-N 3.14Å; L282-S284 VanDerWaalsContact C-N 3.33Å; L282-S284 PolarHBondContact O-N 3.32Å; S284-R287 PolarHBondContact O-N 2.85Å; S284-L288 PolarHBondContact O-N 3.44Å
285	F	87.3	Confident	86	Confident	20 Å²	20	68.6 Å²	68.6	9%	0.088	34%	0.344	C	S	.	.	H	α-helix	trans	-64.5	-40.3	174	-174	-83	0	0	0	111.6	I247 L250 T251 S254 W281 L282 R287 L288 A289 L292	I247-F285 HydrophobicContact CG2-CZ 4.49Å; L250-F285 HydrophobicContact CB-CD1 4.06Å; L250-F285 HydrophobicContact CB-CD2 4.24Å; L250-F285 HydrophobicContact CB-CE1 3.52Å; L250-F285 HydrophobicContact CB-CE2 3.72Å; L250-F285 HydrophobicContact CB-CG 4.41Å; L250-F285 HydrophobicContact CB-CZ 3.33Å; L250-F285 HydrophobicContact CD1-CD2 4.08Å; L250-F285 HydrophobicContact CD1-CE2 3.48Å; L250-F285 VanDerWaalsContact CD1-CE2 3.48Å; L250-F285 HydrophobicContact CD1-CZ 3.91Å; L250-F285 HydrophobicContact CG-CE2 4.24Å; L250-F285 HydrophobicContact CG-CZ 4.27Å; T251-F285 HydrophobicContact CG2-CE1 3.86Å; S254-F285 WeakPolarHBondContact OG-CD1 3.41Å; W281-F285 WeakPolarHBondContact O-CB 3.44Å; W281-F285 PolarHBondContact O-N 2.88Å; L282-F285 PolarHBondContact O-N 3.39Å; F285-R287 VanDerWaalsContact C-N 3.3Å; F285-R287 PolarHBondContact O-N 2.97Å; F285-L288 CarbonylContact O-C 3.55Å; F285-L288 WeakPolarHBondContact O-CA 3.38Å; F285-L288 PolarHBondContact O-N 2.92Å; F285-A289 PolarHBondContact O-N 2.95Å; F285-L292 HydrophobicContact CD2-CD1 3.96Å; F285-L292 HydrophobicContact CE1-CD1 4.33Å; F285-L292 HydrophobicContact CE2-CD1 3.33Å; F285-L292 HydrophobicContact CZ-CD1 3.54Å
286	N	84.8	Confident	85.9	Confident	29 Å²	29	67.6 Å²	67.6	16%	0.155	34%	0.339	C	S	.	.	H	α-helix	trans	-58.2	-42.3	179	-157.5	32.4	0	0	0	111.6	L282 T283 L288 A289 Y328	L282-N286 WeakPolarHBondContact O-CB 3.47Å; L282-N286 PolarHBondContact O-N 3.46Å; T283-N286 WeakPolarHBondContact O-CB 3.42Å; T283-N286 PolarHBondContact O-N 3.04Å; N286-L288 VanDerWaalsContact C-N 3.25Å; N286-L288 PolarHBondContact O-N 3.29Å; N286-A289 VanDerWaalsContact O-CB 3.26Å; N286-A289 WeakPolarHBondContact O-CB 3.45Å; N286-A289 PolarHBondContact O-N 3.38Å; N286-Y328 WeakPolarHBondContact OD1-CE1 3.3Å
287	R	84.3	Confident	86	Confident	190 Å²	190	66.6 Å²	66.6	72%	0.717	33%	0.327	S	S	*	.	H	α-helix	trans	-62.3	-30.5	174.1	-65	176.7	-175.4	-168.7	1.7	113	T283 S284 F285	T283-R287 PolarHBondContact O-N 3.36Å; S284-R287 PolarHBondContact O-N 2.85Å; F285-R287 VanDerWaalsContact C-N 3.3Å; F285-R287 PolarHBondContact O-N 2.97Å
288	L	86.1	Confident	85.8	Confident	94 Å²	94	65.1 Å²	65.1	49%	0.492	31%	0.313	S	S	.	.	H	α-helix	trans	-90	-10.8	178	-63.3	174.5	0	0	0	113.9	S284 F285 N286 L291 L292	S284-L288 PolarHBondContact O-N 3.44Å; F285-L288 CarbonylContact O-C 3.55Å; F285-L288 WeakPolarHBondContact O-CA 3.38Å; F285-L288 PolarHBondContact O-N 2.92Å; N286-L288 VanDerWaalsContact C-N 3.25Å; N286-L288 PolarHBondContact O-N 3.29Å; L288-L291 PolarHBondContact O-N 2.88Å; L288-L292 HydrophobicContact CB-CD1 4.11Å; L288-L292 HydrophobicContact CB-CG 4.41Å; L288-L292 WeakPolarHBondContact O-CG 3.5Å; L288-L292 PolarHBondContact O-N 2.82Å
289	A	86.1	Confident	85.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-53.1	-42.3	-175.8	0	0	0	0	0	115	T251 F285 N286 L291 L292 T293 Y328	T251-A289 HydrophobicContact CG2-CB 3.97Å; F285-A289 PolarHBondContact O-N 2.95Å; N286-A289 VanDerWaalsContact O-CB 3.26Å; N286-A289 WeakPolarHBondContact O-CB 3.45Å; N286-A289 PolarHBondContact O-N 3.38Å; A289-L291 PolarHBondContact O-N 3Å; A289-L292 PolarHBondContact O-N 3.48Å; A289-T293 WeakPolarHBondContact O-CB 3.31Å; A289-T293 VanDerWaalsContact O-CG2 3.27Å; A289-T293 WeakPolarHBondContact O-CG2 3.39Å; A289-T293 PolarHBondContact O-N 3.25Å; A289-T293 PolarHBondContact O-OG1 2.96Å; A289-Y328 HydrophobicContact CB-CD1 3.93Å; A289-Y328 HydrophobicContact CB-CD2 3.82Å; A289-Y328 HydrophobicContact CB-CE1 3.98Å; A289-Y328 HydrophobicContact CB-CE2 3.86Å; A289-Y328 HydrophobicContact CB-CG 3.87Å
290	P	85	Confident	85.4	Confident	10 Å²	10	60.1 Å²	60.1	7%	0.065	29%	0.29	C	S	.	.	H	α-helix	trans	-65.8	-35.5	176.7	13.8	-17.5	0	0	0	113	T293 F294 F325	P290-T293 WeakPolarHBondContact CA-OG1 3.37Å; P290-T293 PolarHBondContact O-OG1 3.4Å; P290-T293 VanDerWaalsContact O-OG1 3.1Å; P290-F294 WeakPolarHBondContact O-CB 3.33Å; P290-F294 PolarHBondContact O-N 2.89Å; P290-F325 HydrophobicContact CB-CD2 4.29Å; P290-F325 HydrophobicContact CB-CE2 4.18Å; P290-F325 VanDerWaalsContact O-CD2 3.3Å; P290-F325 WeakPolarHBondContact O-CD2 3.28Å; P290-F325 WeakPolarHBondContact O-CE2 3.42Å
291	L	85	Confident	85.2	Confident	107 Å²	107	56.1 Å²	56.1	56%	0.56	28%	0.277	S	S	*	.	H	α-helix	trans	-69.1	-42.2	175.9	-174.1	157.5	0	0	0	111.3	L288 A289 F294 L295	L288-L291 PolarHBondContact O-N 2.88Å; A289-L291 PolarHBondContact O-N 3Å; L291-F294 PolarHBondContact O-N 3.19Å; L291-L295 WeakPolarHBondContact O-CB 3.44Å; L291-L295 PolarHBondContact O-N 3.3Å
292	L	86.6	Confident	84.6	Confident	40 Å²	40	53.7 Å²	53.7	21%	0.209	27%	0.274	C	S	.	.	H	α-helix	trans	-70	-42.1	-179.9	-65.2	174.8	0	0	0	112.4	I247 F285 L288 A289 L295 A296	I247-L292 HydrophobicContact CD1-CB 4.3Å; I247-L292 HydrophobicContact CG2-CB 4.25Å; F285-L292 HydrophobicContact CD2-CD1 3.96Å; F285-L292 HydrophobicContact CE1-CD1 4.33Å; F285-L292 HydrophobicContact CE2-CD1 3.33Å; F285-L292 HydrophobicContact CZ-CD1 3.54Å; L288-L292 HydrophobicContact CB-CD1 4.11Å; L288-L292 HydrophobicContact CB-CG 4.41Å; L288-L292 WeakPolarHBondContact O-CG 3.5Å; L288-L292 PolarHBondContact O-N 2.82Å; A289-L292 PolarHBondContact O-N 3.48Å; L292-L295 PolarHBondContact O-N 3.45Å; L292-A296 PolarHBondContact O-N 2.8Å
293	T	86.1	Confident	84	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-40.4	173.4	52.2	0	0	0	0	111.3	I247 T251 A289 P290 A296 I297 W321 L324 F325 Y328	I247-T293 HydrophobicContact CG2-CG2 4.26Å; T251-T293 HydrophobicContact CG2-CG2 4.45Å; A289-T293 WeakPolarHBondContact O-CB 3.31Å; A289-T293 VanDerWaalsContact O-CG2 3.27Å; A289-T293 WeakPolarHBondContact O-CG2 3.39Å; A289-T293 PolarHBondContact O-N 3.25Å; A289-T293 PolarHBondContact O-OG1 2.96Å; P290-T293 WeakPolarHBondContact CA-OG1 3.37Å; P290-T293 PolarHBondContact O-OG1 3.4Å; P290-T293 VanDerWaalsContact O-OG1 3.1Å; T293-A296 WeakPolarHBondContact O-CB 3.21Å; T293-A296 PolarHBondContact O-N 3.29Å; T293-I297 WeakPolarHBondContact O-CG1 3.38Å; T293-I297 PolarHBondContact O-N 2.95Å; T293-W321 HydrophobicContact CG2-CE3 4.15Å; T293-W321 HydrophobicContact CG2-CZ3 3.85Å; T293-L324 HydrophobicContact CG2-CD2 4.09Å; T293-L324 HydrophobicContact CG2-CG 4.17Å; T293-F325 WeakPolarHBondContact OG1-CD2 3.43Å; T293-Y328 HydrophobicContact CG2-CD2 4.45Å
294	F	86.2	Confident	83.8	Confident	100 Å²	100	55.2 Å²	55.2	44%	0.439	28%	0.277	S	S	.	.	H	α-helix	trans	-60.5	-44.4	171.9	-179.5	-110	0	0	0	112.5	P290 L291 A296 I297 L298 F325	P290-F294 WeakPolarHBondContact O-CB 3.33Å; P290-F294 PolarHBondContact O-N 2.89Å; L291-F294 PolarHBondContact O-N 3.19Å; F294-A296 VanDerWaalsContact C-N 3.33Å; F294-A296 PolarHBondContact O-N 3.48Å; F294-I297 WeakPolarHBondContact O-CB 3.26Å; F294-I297 PolarHBondContact O-N 3.17Å; F294-I297 VanDerWaalsContact O-N 3.16Å; F294-L298 HydrophobicContact CD1-CD1 4.02Å; F294-L298 HydrophobicContact CD1-CG 4.44Å; F294-L298 HydrophobicContact CE1-CD1 3.55Å; F294-L298 HydrophobicContact CE1-CG 4.12Å; F294-L298 HydrophobicContact CZ-CD1 3.96Å; F294-L298 HydrophobicContact CZ-CD2 4.2Å; F294-L298 HydrophobicContact CZ-CG 4.15Å; F294-L298 PolarHBondContact O-N 3.44Å; F294-F325 HydrophobicContact CB-CD2 4.05Å; F294-F325 HydrophobicContact CB-CE2 3.82Å; F294-F325 HydrophobicContact CD2-CE2 4.41Å; F294-F325 HydrophobicContact CD2-CZ 4.3Å; F294-F325 HydrophobicContact CG-CE2 4.47Å
295	L	85	Confident	83.3	Confident	83 Å²	83	60 Å²	60	44%	0.435	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-39.7	175.4	-177.6	60.2	0	0	0	111.9	L291 L292 L298 L299	L291-L295 WeakPolarHBondContact O-CB 3.44Å; L291-L295 PolarHBondContact O-N 3.3Å; L292-L295 PolarHBondContact O-N 3.45Å; L295-L298 PolarHBondContact O-N 3.18Å; L295-L299 HydrophobicContact CG-CD1 4.36Å; L295-L299 WeakPolarHBondContact O-CG 3.47Å; L295-L299 PolarHBondContact O-N 3.42Å
296	A	84.9	Confident	82.4	Confident	6 Å²	6	64.8 Å²	64.8	5%	0.05	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-39.9	173.4	0	0	0	0	0	112.4	I247 L292 T293 F294 L299 R300 W321	I247-A296 HydrophobicContact CD1-CB 4.18Å; L292-A296 PolarHBondContact O-N 2.8Å; T293-A296 WeakPolarHBondContact O-CB 3.21Å; T293-A296 PolarHBondContact O-N 3.29Å; F294-A296 VanDerWaalsContact C-N 3.33Å; F294-A296 PolarHBondContact O-N 3.48Å; A296-L299 PolarHBondContact O-N 3.14Å; A296-R300 WeakPolarHBondContact O-CG 3.4Å; A296-R300 PolarHBondContact O-N 3.15Å; A296-W321 HydrophobicContact CB-CD2 4.27Å; A296-W321 HydrophobicContact CB-CE3 3.83Å; A296-W321 HydrophobicContact CB-CH2 4.44Å; A296-W321 HydrophobicContact CB-CZ3 3.9Å
297	I	85.9	Confident	81.6	Confident	29 Å²	29	64.2 Å²	64.2	15%	0.149	31%	0.306	C	S	.	.	H	α-helix	trans	-62.4	-45.8	173	-66.8	162.6	0	0	0	110.7	T293 F294 L299 R300 V301 W321 V322 F325	T293-I297 WeakPolarHBondContact O-CG1 3.38Å; T293-I297 PolarHBondContact O-N 2.95Å; F294-I297 WeakPolarHBondContact O-CB 3.26Å; F294-I297 PolarHBondContact O-N 3.17Å; F294-I297 VanDerWaalsContact O-N 3.16Å; I297-L299 PolarHBondContact O-N 2.95Å; I297-R300 WeakPolarHBondContact O-CB 3.39Å; I297-R300 PolarHBondContact O-N 3.43Å; I297-V301 HydrophobicContact CG2-CG2 4.49Å; I297-V301 WeakPolarHBondContact O-CG2 3.27Å; I297-V301 PolarHBondContact O-N 2.88Å; I297-W321 HydrophobicContact CG1-CB 3.88Å; I297-V322 HydrophobicContact CD1-CG2 4.08Å; I297-V322 HydrophobicContact CG1-CG2 4.44Å; I297-F325 HydrophobicContact CD1-CB 3.77Å; I297-F325 HydrophobicContact CD1-CD1 4.42Å; I297-F325 HydrophobicContact CD1-CG 4.13Å
298	L	83.8	Confident	80.6	Confident	76 Å²	76	67 Å²	67	40%	0.398	32%	0.317	S	S	.	.	H	α-helix	trans	-60.9	-44.4	176.6	-70.6	-179.4	0	0	0	112	F294 L295 R300 V301 L302	F294-L298 HydrophobicContact CD1-CD1 4.02Å; F294-L298 HydrophobicContact CD1-CG 4.44Å; F294-L298 HydrophobicContact CE1-CD1 3.55Å; F294-L298 HydrophobicContact CE1-CG 4.12Å; F294-L298 HydrophobicContact CZ-CD1 3.96Å; F294-L298 HydrophobicContact CZ-CD2 4.2Å; F294-L298 HydrophobicContact CZ-CG 4.15Å; F294-L298 PolarHBondContact O-N 3.44Å; L295-L298 PolarHBondContact O-N 3.18Å; L298-R300 VanDerWaalsContact C-N 3.31Å; L298-R300 PolarHBondContact O-N 2.93Å; L298-V301 PolarHBondContact O-N 2.93Å; L298-L302 WeakPolarHBondContact O-CG 3.29Å; L298-L302 PolarHBondContact O-N 2.97Å
299	L	82.3	Confident	79.6	Confident	65 Å²	65	66.7 Å²	66.7	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-61.7	-37.8	175.2	-70.8	170.6	0	0	0	112	V243 L295 A296 I297 F303	V243-L299 HydrophobicContact CG1-CD1 4.24Å; L295-L299 HydrophobicContact CG-CD1 4.36Å; L295-L299 WeakPolarHBondContact O-CG 3.47Å; L295-L299 PolarHBondContact O-N 3.42Å; A296-L299 PolarHBondContact O-N 3.14Å; I297-L299 PolarHBondContact O-N 2.95Å; L299-F303 WeakPolarHBondContact O-CB 3.32Å; L299-F303 PolarHBondContact O-N 2.88Å
300	R	81.6	Confident	78.8	Confident	5 Å²	5	69 Å²	69	2%	0.019	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-44.3	171.2	-79.8	-66.6	-163.2	108.4	-10.9	112.4	A296 I297 L298 F303 Y304 D314 C317 S318	A296-R300 WeakPolarHBondContact O-CG 3.4Å; A296-R300 PolarHBondContact O-N 3.15Å; I297-R300 WeakPolarHBondContact O-CB 3.39Å; I297-R300 PolarHBondContact O-N 3.43Å; L298-R300 VanDerWaalsContact C-N 3.31Å; L298-R300 PolarHBondContact O-N 2.93Å; R300-F303 WeakPolarHBondContact O-CB 3.3Å; R300-F303 PolarHBondContact O-N 3.12Å; R300-Y304 VanDerWaalsContact O-CG 3.26Å; R300-Y304 PolarHBondContact O-N 3.37Å; R300-D314 PolarHBondContact NH1-O 3.44Å; R300-C317 VanDerWaalsContact NH2-CB 3.28Å; R300-S318 PolarHBondContact NH1-OG 3.16Å
301	V	81	Confident	78.2	Confident	83 Å²	83	71.4 Å²	71.4	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-64.7	-40.3	177.6	171.6	0	0	0	0	111.7	I297 L298 Y304 K305	I297-V301 HydrophobicContact CG2-CG2 4.49Å; I297-V301 WeakPolarHBondContact O-CG2 3.27Å; I297-V301 PolarHBondContact O-N 2.88Å; L298-V301 PolarHBondContact O-N 2.93Å; V301-Y304 WeakPolarHBondContact O-CB 3.44Å; V301-Y304 PolarHBondContact O-N 3.34Å; V301-K305 PolarHBondContact O-N 3.3Å
302	L	77.6	Confident	77.9	Confident	92 Å²	92	72 Å²	72	48%	0.482	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-45.2	172.9	-70.7	172.8	0	0	0	111.4	L298 Y304 K305 Y306	L298-L302 WeakPolarHBondContact O-CG 3.29Å; L298-L302 PolarHBondContact O-N 2.97Å; L302-Y304 VanDerWaalsContact C-N 3.29Å; L302-Y304 PolarHBondContact O-N 3.38Å; L302-K305 WeakPolarHBondContact O-CB 3.47Å; L302-K305 PolarHBondContact O-N 3.37Å; L302-K305 VanDerWaalsContact O-N 3.14Å; L302-Y306 VanDerWaalsContact O-CD2 3.24Å; L302-Y306 WeakPolarHBondContact O-CD2 3.3Å; L302-Y306 PolarHBondContact O-N 2.86Å
303	F	76.2	Confident	77.7	Confident	8 Å²	8	71.3 Å²	71.3	4%	0.035	34%	0.34	C	S	.	.	H	α-helix	trans	-57.9	-40.8	172.1	164.2	-105.4	0	0	0	112	R237 L299 R300 K305 Y306 S307 M310	R237-F303 HydrophobicContact CB-CD2 3.98Å; R237-F303 HydrophobicContact CB-CE2 3.56Å; R237-F303 HydrophobicContact CB-CZ 4.19Å; R237-F303 HydrophobicContact CG-CD2 4.32Å; R237-F303 HydrophobicContact CG-CE1 4.42Å; R237-F303 HydrophobicContact CG-CE2 3.64Å; R237-F303 HydrophobicContact CG-CZ 3.71Å; R237-F303 VanDerWaalsContact NE-CZ 3.28Å; L299-F303 WeakPolarHBondContact O-CB 3.32Å; L299-F303 PolarHBondContact O-N 2.88Å; R300-F303 WeakPolarHBondContact O-CB 3.3Å; R300-F303 PolarHBondContact O-N 3.12Å; F303-K305 VanDerWaalsContact C-N 3.3Å; F303-K305 PolarHBondContact O-N 3.13Å; F303-Y306 PolarHBondContact O-N 2.85Å; F303-S307 WeakPolarHBondContact O-CB 3.45Å; F303-S307 PolarHBondContact O-N 3.28Å; F303-M310 HydrophobicContact CE1-CE 4Å; F303-M310 HydrophobicContact CE1-SD 3.65Å; F303-M310 HydrophobicContact CZ-CE 4.18Å; F303-M310 HydrophobicContact CZ-SD 4.04Å
304	Y	79.1	Confident	77.5	Confident	60 Å²	60	71.3 Å²	71.3	24%	0.235	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-32.4	175.5	-69.1	-17.2	0	0	0	114	R300 V301 L302 M310 D314 S318	R300-Y304 VanDerWaalsContact O-CG 3.26Å; R300-Y304 PolarHBondContact O-N 3.37Å; V301-Y304 WeakPolarHBondContact O-CB 3.44Å; V301-Y304 PolarHBondContact O-N 3.34Å; L302-Y304 VanDerWaalsContact C-N 3.29Å; L302-Y304 PolarHBondContact O-N 3.38Å; Y304-M310 HydrophobicContact CD1-CE 3.57Å; Y304-M310 HydrophobicContact CD1-CG 4.41Å; Y304-M310 HydrophobicContact CD1-SD 3.45Å; Y304-M310 WeakPolarHBondContact CD1-SD 3.28Å; Y304-M310 HydrophobicContact CE1-CE 4.35Å; Y304-M310 HydrophobicContact CE1-SD 3.62Å; Y304-M310 HydrophobicContact CG-CE 4.34Å; Y304-D314 HydrophobicContact CE1-CB 4.43Å; Y304-D314 VanDerWaalsContact OH-C 3.29Å; Y304-D314 PolarHBondContact OH-O 3.12Å; Y304-S318 VanDerWaalsContact OH-CB 3.27Å; Y304-S318 WeakPolarHBondContact OH-CB 3.41Å; Y304-S318 PolarHBondContact OH-OG 3.43Å
305	K	74.3	Confident	77.3	Confident	164 Å²	164	69.2 Å²	69.2	71%	0.713	33%	0.332	S	S	*	.	H	α-helix	trans	-68.3	-31.4	174.4	-166.9	176.5	-177.3	176.4	0	113	V301 L302 F303	V301-K305 PolarHBondContact O-N 3.3Å; L302-K305 WeakPolarHBondContact O-CB 3.47Å; L302-K305 PolarHBondContact O-N 3.37Å; L302-K305 VanDerWaalsContact O-N 3.14Å; F303-K305 VanDerWaalsContact C-N 3.3Å; F303-K305 PolarHBondContact O-N 3.13Å
306	Y	68.3	Low	77.3	Confident	120 Å²	120	69.3 Å²	69.3	47%	0.471	33%	0.332	S	S	.	.	H	α-helix	trans	-101.8	-24.2	-172.8	-72.5	-65.4	0	0	0	115.7	L302 F303	L302-Y306 VanDerWaalsContact O-CD2 3.24Å; L302-Y306 WeakPolarHBondContact O-CD2 3.3Å; L302-Y306 PolarHBondContact O-N 2.86Å; F303-Y306 PolarHBondContact O-N 2.85Å
307	S	69.3	Low	77.3	Confident	16 Å²	16	69 Å²	69	11%	0.112	33%	0.33	C	S	.	.			trans	-91.5	127.9	-175.8	171.5	0	0	0	0	113	R237 F303 T309 M310	R237-S307 PolarHBondContact NH2-OG 2.89Å; F303-S307 WeakPolarHBondContact O-CB 3.45Å; F303-S307 PolarHBondContact O-N 3.28Å; S307-T309 VanDerWaalsContact C-N 3.29Å; S307-T309 PolarHBondContact O-N 2.94Å; S307-T309 PolarHBondContact OG-N 3.4Å; S307-T309 PolarHBondContact OG-O 3.22Å; S307-M310 WeakPolarHBondContact O-CE 3.32Å
308	R	61.3	Low	77.3	Confident	250 Å²	250	68.7 Å²	68.7	94%	0.943	33%	0.33	S	S	*	.	S	Bend	trans	-76.7	-9.5	178	-73	-177.6	171.8	176.8	-4.1	114.4
309	T	65.4	Low	77.5	Confident	87 Å²	87	67.1 Å²	67.1	53%	0.534	32%	0.323	S	S	.	.			trans	-132.2	125.8	179.8	53.6	0	0	0	0	111	R237 S307	R237-T309 PolarHBondContact NH2-O 3.36Å; R237-T309 VanDerWaalsContact NH2-O 3.09Å; R237-T309 PolarHBondContact NH2-OG1 2.83Å; S307-T309 VanDerWaalsContact C-N 3.29Å; S307-T309 PolarHBondContact O-N 2.94Å; S307-T309 PolarHBondContact OG-N 3.4Å; S307-T309 PolarHBondContact OG-O 3.22Å
310	M	70.2	Confident	77.8	Confident	48 Å²	48	64.6 Å²	64.6	24%	0.236	31%	0.313	C	S	.	.			trans	-117.3	143.6	166.9	-57.6	-52.9	156.2	0	0	108.5	F303 Y304 S307	F303-M310 HydrophobicContact CE1-CE 4Å; F303-M310 HydrophobicContact CE1-SD 3.65Å; F303-M310 HydrophobicContact CZ-CE 4.18Å; F303-M310 HydrophobicContact CZ-SD 4.04Å; Y304-M310 HydrophobicContact CD1-CE 3.57Å; Y304-M310 HydrophobicContact CD1-CG 4.41Å; Y304-M310 HydrophobicContact CD1-SD 3.45Å; Y304-M310 WeakPolarHBondContact CD1-SD 3.28Å; Y304-M310 HydrophobicContact CE1-CE 4.35Å; Y304-M310 HydrophobicContact CE1-SD 3.62Å; Y304-M310 HydrophobicContact CG-CE 4.34Å; S307-M310 WeakPolarHBondContact O-CE 3.32Å
311	M	73.1	Confident	78.1	Confident	61 Å²	61	64.5 Å²	64.5	30%	0.3	31%	0.312	S	S	.	.			trans	-102.5	159.7	167.8	-49.9	-162.3	-42.5	0	0	109	I313 D314 L365 R367	M311-I313 HydrophobicContact CB-CG2 4.08Å; M311-I313 HydrophobicContact CE-CG2 3.76Å; M311-I313 PolarHBondContact O-N 3.37Å; M311-D314 PolarHBondContact N-OD2 3.47Å; M311-D314 WeakPolarHBondContact O-CB 3.29Å; M311-D314 PolarHBondContact O-N 2.88Å; M311-L365 HydrophobicContact CE-CB 4.42Å; M311-L365 HydrophobicContact CE-CD1 4.4Å; M311-R367 HydrophobicContact CE-CG 3.95Å; M311-R367 HydrophobicContact SD-CG 4.16Å
312	L	78.4	Confident	78.5	Confident	120 Å²	120	64.3 Å²	64.3	63%	0.628	31%	0.311	S	S	*	.	H	α-helix	trans	-53.8	-41.1	177.8	-179.3	62.3	0	0	0	111.8	D314 H315 I316	L312-D314 VanDerWaalsContact C-N 3.3Å; L312-D314 PolarHBondContact O-N 2.92Å; L312-H315 WeakPolarHBondContact O-CB 3.44Å; L312-H315 PolarHBondContact O-N 3.35Å; L312-H315 VanDerWaalsContact O-N 3.11Å; L312-I316 HydrophobicContact CG-CD1 4.19Å; L312-I316 PolarHBondContact O-N 3.27Å
313	I	81.4	Confident	79.2	Confident	24 Å²	24	64.3 Å²	64.3	12%	0.123	31%	0.311	C	S	.	.	H	α-helix	trans	-64.8	-28.1	178.1	-163.6	175.8	0	0	0	114.2	M311 H315 I316 C317 W361 T362 L365	M311-I313 HydrophobicContact CB-CG2 4.08Å; M311-I313 HydrophobicContact CE-CG2 3.76Å; M311-I313 PolarHBondContact O-N 3.37Å; I313-H315 VanDerWaalsContact C-N 3.28Å; I313-H315 PolarHBondContact O-N 2.93Å; I313-I316 PolarHBondContact O-N 3.47Å; I313-C317 PolarHBondContact O-N 2.93Å; I313-C317 VanDerWaalsContact O-N 3.13Å; I313-W361 HydrophobicContact CD1-CB 4Å; I313-W361 HydrophobicContact CD1-CG 4.17Å; I313-T362 HydrophobicContact CB-CG2 4.32Å; I313-T362 HydrophobicContact CD1-CG2 3.78Å; I313-T362 HydrophobicContact CG1-CG2 3.63Å; I313-T362 HydrophobicContact CG2-CG2 4.02Å; I313-L365 HydrophobicContact CD1-CD1 3.74Å; I313-L365 HydrophobicContact CG2-CD1 4.03Å
314	D	81.6	Confident	79.9	Confident	1 Å²	1	64 Å²	64	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-43.6	173.5	-64.3	-54.5	0	0	0	109.3	R300 Y304 M311 L312 S318 R367	R300-D314 PolarHBondContact NH1-O 3.44Å; Y304-D314 HydrophobicContact CE1-CB 4.43Å; Y304-D314 VanDerWaalsContact OH-C 3.29Å; Y304-D314 PolarHBondContact OH-O 3.12Å; M311-D314 PolarHBondContact N-OD2 3.47Å; M311-D314 WeakPolarHBondContact O-CB 3.29Å; M311-D314 PolarHBondContact O-N 2.88Å; L312-D314 VanDerWaalsContact C-N 3.3Å; L312-D314 PolarHBondContact O-N 2.92Å; D314-S318 PolarHBondContact O-N 2.97Å; D314-R367 IonicContact OD1-CZ 3.04Å; D314-R367 IonicContact OD1-NH1 3.8Å; D314-R367 PolarHBondContact OD1-NH1 2.98Å; D314-R367 IonicContact OD1-NH2 2.75Å; D314-R367 PolarHBondContact OD1-NH2 2.94Å; D314-R367 IonicContact OD2-CZ 2.74Å; D314-R367 IonicContact OD2-NH1 3.67Å; D314-R367 PolarHBondContact OD2-NH1 3.46Å
315	H	81.9	Confident	80.4	Confident	55 Å²	55	63.4 Å²	63.4	26%	0.255	31%	0.309	S	S	.	.	H	α-helix	trans	-64.7	-44.2	174.8	-66.9	-73.7	0	0	0	112.8	L312 I313 C317 S318 V319	L312-H315 WeakPolarHBondContact O-CB 3.44Å; L312-H315 PolarHBondContact O-N 3.35Å; L312-H315 VanDerWaalsContact O-N 3.11Å; I313-H315 VanDerWaalsContact C-N 3.28Å; I313-H315 PolarHBondContact O-N 2.93Å; H315-C317 PolarHBondContact O-N 2.9Å; H315-S318 PolarHBondContact O-N 3.4Å; H315-V319 PolarHBondContact O-N 2.91Å
316	I	86.2	Confident	81.1	Confident	86 Å²	86	56.9 Å²	56.9	44%	0.441	29%	0.288	S	S	.	.	H	α-helix	trans	-55	-51.9	178.8	-66.8	171.5	0	0	0	110.7	L312 I313 S318 V319 G320 T358	L312-I316 HydrophobicContact CG-CD1 4.19Å; L312-I316 PolarHBondContact O-N 3.27Å; I313-I316 PolarHBondContact O-N 3.47Å; I316-S318 VanDerWaalsContact C-N 3.29Å; I316-S318 PolarHBondContact O-N 2.97Å; I316-V319 PolarHBondContact O-N 3Å; I316-V319 VanDerWaalsContact O-N 3.1Å; I316-G320 PolarHBondContact O-N 3.3Å; I316-T358 HydrophobicContact CG2-CG2 4.21Å
317	C	85.1	Confident	82.1	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-57.3	-43.1	175.6	-66.5	0	0	0	0	111.8	R300 I313 H315 V319 G320 W321 T358 V359 T362	R300-C317 VanDerWaalsContact NH2-CB 3.28Å; I313-C317 PolarHBondContact O-N 2.93Å; I313-C317 VanDerWaalsContact O-N 3.13Å; H315-C317 PolarHBondContact O-N 2.9Å; C317-V319 VanDerWaalsContact C-N 3.26Å; C317-V319 PolarHBondContact O-N 3.47Å; C317-G320 CarbonylContact O-C 3.53Å; C317-G320 WeakPolarHBondContact O-CA 3.17Å; C317-G320 PolarHBondContact O-N 3.41Å; C317-G320 VanDerWaalsContact O-N 3.08Å; C317-W321 PolarHBondContact O-N 2.81Å; C317-T358 VanDerWaalsContact SG-C 3.52Å; C317-T358 VanDerWaalsContact SG-CB 3.55Å; C317-T358 PolarHBondContact SG-OG1 3.11Å; C317-T358 VanDerWaalsContact SG-OG1 3.42Å; C317-V359 HydrophobicContact CB-CG2 4.43Å; C317-T362 WeakPolarHBondContact SG-CG2 3.44Å
318	S	85.2	Confident	82.9	Confident	21 Å²	21	51.3 Å²	51.3	15%	0.147	27%	0.265	C	S	.	.	H	α-helix	trans	-66.3	-24.4	179.5	-82.9	0	0	0	0	114.1	R300 Y304 D314 H315 I316 V322	R300-S318 PolarHBondContact NH1-OG 3.16Å; Y304-S318 VanDerWaalsContact OH-CB 3.27Å; Y304-S318 WeakPolarHBondContact OH-CB 3.41Å; Y304-S318 PolarHBondContact OH-OG 3.43Å; D314-S318 PolarHBondContact O-N 2.97Å; H315-S318 PolarHBondContact O-N 3.4Å; I316-S318 VanDerWaalsContact C-N 3.29Å; I316-S318 PolarHBondContact O-N 2.97Å; S318-V322 WeakPolarHBondContact O-CG2 3.46Å; S318-V322 PolarHBondContact O-N 2.8Å
319	V	88.6	Confident	84.1	Confident	44 Å²	44	41.6 Å²	41.6	27%	0.267	23%	0.232	S	C	.	.	H	α-helix	trans	-71.7	-45.5	167.9	176.2	0	0	0	0	109.7	F32 H315 I316 C317 W321 V322 L323	F32-V319 HydrophobicContact CE1-CG2 3.57Å; F32-V319 HydrophobicContact CZ-CG2 3.81Å; H315-V319 PolarHBondContact O-N 2.91Å; I316-V319 PolarHBondContact O-N 3Å; I316-V319 VanDerWaalsContact O-N 3.1Å; C317-V319 VanDerWaalsContact C-N 3.26Å; C317-V319 PolarHBondContact O-N 3.47Å; V319-W321 VanDerWaalsContact C-N 3.28Å; V319-W321 PolarHBondContact O-N 2.97Å; V319-V322 PolarHBondContact O-N 3.26Å; V319-L323 HydrophobicContact CG1-CD1 4.16Å; V319-L323 HydrophobicContact CG1-CG 4.38Å; V319-L323 WeakPolarHBondContact O-CG 3.46Å; V319-L323 PolarHBondContact O-N 3.45Å
320	G	88.9	Confident	85	Confident	11 Å²	11	39.9 Å²	39.9	11%	0.113	22%	0.221	C	C	.	.	H	α-helix	trans	-55.1	-38.9	174.5	0	0	0	0	0	113.8	I316 C317 L323 L324 N355	I316-G320 PolarHBondContact O-N 3.3Å; C317-G320 CarbonylContact O-C 3.53Å; C317-G320 WeakPolarHBondContact O-CA 3.17Å; C317-G320 PolarHBondContact O-N 3.41Å; C317-G320 VanDerWaalsContact O-N 3.08Å; G320-L323 PolarHBondContact O-N 3.41Å; G320-L324 WeakPolarHBondContact O-CB 3.48Å; G320-L324 PolarHBondContact O-N 2.86Å; G320-N355 VanDerWaalsContact C-ND2 3.32Å; G320-N355 WeakPolarHBondContact CA-OD1 3.11Å; G320-N355 PolarHBondContact O-ND2 3Å
321	W	87.7	Confident	85.3	Confident	3 Å²	3	39.1 Å²	39.1	1%	0.011	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-39.9	173.8	-80.7	100.9	0	0	0	113.3	G244 I247 S248 T293 A296 I297 C317 V319 L324 F325 N355	G244-W321 WeakPolarHBondContact O-CH2 3.33Å; G244-W321 WeakPolarHBondContact O-CZ2 3.37Å; I247-W321 HydrophobicContact CB-CH2 3.76Å; I247-W321 HydrophobicContact CB-CZ3 4.13Å; I247-W321 HydrophobicContact CG2-CH2 3.77Å; I247-W321 HydrophobicContact CG2-CZ3 3.66Å; S248-W321 VanDerWaalsContact OG-CH2 3.3Å; S248-W321 WeakPolarHBondContact OG-CH2 3.21Å; S248-W321 WeakPolarHBondContact OG-CZ2 3.16Å; T293-W321 HydrophobicContact CG2-CE3 4.15Å; T293-W321 HydrophobicContact CG2-CZ3 3.85Å; A296-W321 HydrophobicContact CB-CD2 4.27Å; A296-W321 HydrophobicContact CB-CE3 3.83Å; A296-W321 HydrophobicContact CB-CH2 4.44Å; A296-W321 HydrophobicContact CB-CZ3 3.9Å; I297-W321 HydrophobicContact CG1-CB 3.88Å; C317-W321 PolarHBondContact O-N 2.81Å; V319-W321 VanDerWaalsContact C-N 3.28Å; V319-W321 PolarHBondContact O-N 2.97Å; W321-L324 HydrophobicContact CZ3-CD2 4.34Å; W321-F325 WeakPolarHBondContact O-CB 3.37Å; W321-F325 PolarHBondContact O-N 3.41Å; W321-N355 PolarHBondContact N-OD1 2.91Å
322	V	89.4	Confident	85.4	Confident	80 Å²	80	40.2 Å²	40.2	49%	0.485	22%	0.224	S	C	.	.	H	α-helix	trans	-69.5	-38.7	177.6	172	0	0	0	0	111	I297 S318 V319 G326	I297-V322 HydrophobicContact CD1-CG2 4.08Å; I297-V322 HydrophobicContact CG1-CG2 4.44Å; S318-V322 WeakPolarHBondContact O-CG2 3.46Å; S318-V322 PolarHBondContact O-N 2.8Å; V319-V322 PolarHBondContact O-N 3.26Å; V322-G326 PolarHBondContact O-N 2.9Å
323	L	91.6	Very high	85.1	Confident	92 Å²	92	37.4 Å²	37.4	48%	0.482	21%	0.209	S	C	.	.	H	α-helix	trans	-64.2	-46	174.3	-66.3	173.9	0	0	0	111.5	V319 G320 G326 S327 L351	V319-L323 HydrophobicContact CG1-CD1 4.16Å; V319-L323 HydrophobicContact CG1-CG 4.38Å; V319-L323 WeakPolarHBondContact O-CG 3.46Å; V319-L323 PolarHBondContact O-N 3.45Å; G320-L323 PolarHBondContact O-N 3.41Å; L323-G326 WeakPolarHBondContact O-CA 3.22Å; L323-G326 PolarHBondContact O-N 2.93Å; L323-G326 VanDerWaalsContact O-N 3.12Å; L323-S327 PolarHBondContact O-N 2.72Å; L323-S327 PolarHBondContact O-OG 2.96Å; L323-L351 HydrophobicContact CB-CD1 4.33Å; L323-L351 HydrophobicContact CB-CD2 3.88Å; L323-L351 HydrophobicContact CD1-CD2 4.19Å
324	L	90.2	Very high	84.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.6	-40.2	178.5	-173.3	64.7	0	0	0	112.4	T293 G320 W321 G326 S327 Y328 L351	T293-L324 HydrophobicContact CG2-CD2 4.09Å; T293-L324 HydrophobicContact CG2-CG 4.17Å; G320-L324 WeakPolarHBondContact O-CB 3.48Å; G320-L324 PolarHBondContact O-N 2.86Å; W321-L324 HydrophobicContact CZ3-CD2 4.34Å; L324-G326 VanDerWaalsContact C-N 3.33Å; L324-S327 WeakPolarHBondContact CA-OG 3.48Å; L324-S327 PolarHBondContact O-N 3.32Å; L324-S327 PolarHBondContact O-OG 3.33Å; L324-Y328 HydrophobicContact CD1-CD2 4.24Å; L324-Y328 HydrophobicContact CD1-CE2 3.67Å; L324-Y328 HydrophobicContact CG-CD2 4.21Å; L324-Y328 HydrophobicContact CG-CE2 3.93Å; L324-Y328 WeakPolarHBondContact O-CD2 3.34Å; L324-Y328 PolarHBondContact O-N 2.92Å; L324-L351 HydrophobicContact CD1-CB 4.05Å
325	F	90.4	Very high	84.5	Confident	49 Å²	49	43 Å²	43	22%	0.215	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-43.7	170.4	171.1	-108.8	0	0	0	111.4	P290 T293 F294 I297 W321 Y328 L329	P290-F325 HydrophobicContact CB-CD2 4.29Å; P290-F325 HydrophobicContact CB-CE2 4.18Å; P290-F325 VanDerWaalsContact O-CD2 3.3Å; P290-F325 WeakPolarHBondContact O-CD2 3.28Å; P290-F325 WeakPolarHBondContact O-CE2 3.42Å; T293-F325 WeakPolarHBondContact OG1-CD2 3.43Å; F294-F325 HydrophobicContact CB-CD2 4.05Å; F294-F325 HydrophobicContact CB-CE2 3.82Å; F294-F325 HydrophobicContact CD2-CE2 4.41Å; F294-F325 HydrophobicContact CD2-CZ 4.3Å; F294-F325 HydrophobicContact CG-CE2 4.47Å; I297-F325 HydrophobicContact CD1-CB 3.77Å; I297-F325 HydrophobicContact CD1-CD1 4.42Å; I297-F325 HydrophobicContact CD1-CG 4.13Å; W321-F325 WeakPolarHBondContact O-CB 3.37Å; W321-F325 PolarHBondContact O-N 3.41Å; F325-Y328 PolarHBondContact O-N 2.92Å; F325-L329 HydrophobicContact CE1-CD2 3.95Å; F325-L329 HydrophobicContact CZ-CD2 3.89Å; F325-L329 WeakPolarHBondContact O-CB 3.37Å; F325-L329 PolarHBondContact O-N 2.93Å
326	G	88.4	Confident	84.2	Confident	27 Å²	27	41.9 Å²	41.9	28%	0.278	24%	0.239	S	C	.	.	H	α-helix	trans	-58.1	-48.9	175.5	0	0	0	0	0	113	V322 L323 L324 Y328 L329 V330	V322-G326 PolarHBondContact O-N 2.9Å; L323-G326 WeakPolarHBondContact O-CA 3.22Å; L323-G326 PolarHBondContact O-N 2.93Å; L323-G326 VanDerWaalsContact O-N 3.12Å; L324-G326 VanDerWaalsContact C-N 3.33Å; G326-Y328 VanDerWaalsContact C-N 3.26Å; G326-Y328 PolarHBondContact O-N 2.92Å; G326-L329 PolarHBondContact O-N 2.91Å; G326-L329 VanDerWaalsContact O-N 3.08Å; G326-V330 WeakPolarHBondContact O-CG2 3.37Å; G326-V330 PolarHBondContact O-N 3.32Å
327	S	89.6	Confident	83.9	Confident	9 Å²	9	43 Å²	43	6%	0.063	25%	0.246	C	C	.	.	H	α-helix	trans	-65.7	-23.2	-179.6	54.3	0	0	0	0	114.3	L323 L324 P331 Q348	L323-S327 PolarHBondContact O-N 2.72Å; L323-S327 PolarHBondContact O-OG 2.96Å; L324-S327 WeakPolarHBondContact CA-OG 3.48Å; L324-S327 PolarHBondContact O-N 3.32Å; L324-S327 PolarHBondContact O-OG 3.33Å; S327-P331 WeakPolarHBondContact O-CD 3.2Å; S327-Q348 PolarHBondContact O-NE2 3.35Å
328	Y	87.3	Confident	83.6	Confident	9 Å²	9	49.9 Å²	49.9	4%	0.035	28%	0.278	C	S	.	.	H	α-helix	trans	-85.4	-28.4	170.3	-76.8	-60.4	0	0	0	113.5	T251 S255 N286 A289 T293 L324 F325 G326 Q348	T251-Y328 VanDerWaalsContact CB-OH 3.29Å; T251-Y328 WeakPolarHBondContact CB-OH 3.39Å; T251-Y328 HydrophobicContact CG2-CE2 3.55Å; T251-Y328 PolarHBondContact O-OH 3.35Å; S255-Y328 PolarHBondContact OG-OH 3.08Å; N286-Y328 WeakPolarHBondContact OD1-CE1 3.3Å; A289-Y328 HydrophobicContact CB-CD1 3.93Å; A289-Y328 HydrophobicContact CB-CD2 3.82Å; A289-Y328 HydrophobicContact CB-CE1 3.98Å; A289-Y328 HydrophobicContact CB-CE2 3.86Å; A289-Y328 HydrophobicContact CB-CG 3.87Å; T293-Y328 HydrophobicContact CG2-CD2 4.45Å; L324-Y328 HydrophobicContact CD1-CD2 4.24Å; L324-Y328 HydrophobicContact CD1-CE2 3.67Å; L324-Y328 HydrophobicContact CG-CD2 4.21Å; L324-Y328 HydrophobicContact CG-CE2 3.93Å; L324-Y328 WeakPolarHBondContact O-CD2 3.34Å; L324-Y328 PolarHBondContact O-N 2.92Å; F325-Y328 PolarHBondContact O-N 2.92Å; G326-Y328 VanDerWaalsContact C-N 3.26Å; G326-Y328 PolarHBondContact O-N 2.92Å; Y328-Q348 HydrophobicContact CD1-CG 4.24Å; Y328-Q348 HydrophobicContact CE1-CB 4.37Å; Y328-Q348 HydrophobicContact CE1-CG 3.94Å
329	L	85.5	Confident	83.3	Confident	47 Å²	47	55.8 Å²	55.8	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-78.9	-30.4	179.6	-168.4	68.5	0	0	0	112.5	F325 G326 Q332 L333	F325-L329 HydrophobicContact CE1-CD2 3.95Å; F325-L329 HydrophobicContact CZ-CD2 3.89Å; F325-L329 WeakPolarHBondContact O-CB 3.37Å; F325-L329 PolarHBondContact O-N 2.93Å; G326-L329 PolarHBondContact O-N 2.91Å; G326-L329 VanDerWaalsContact O-N 3.08Å; L329-Q332 PolarHBondContact O-N 3.45Å; L329-Q332 VanDerWaalsContact O-N 3.14Å; L329-L333 HydrophobicContact CD1-CD1 4.38Å; L329-L333 HydrophobicContact CD1-CG 4.34Å; L329-L333 HydrophobicContact CD2-CD1 3.89Å; L329-L333 HydrophobicContact CG-CD1 3.72Å; L329-L333 HydrophobicContact CG-CG 4.04Å; L329-L333 PolarHBondContact O-N 3.03Å; L329-L333 VanDerWaalsContact O-N 3.07Å
330	V	84	Confident	82.9	Confident	50 Å²	50	57 Å²	57	30%	0.303	31%	0.306	S	S	.	.	H	α-helix	trans	-57.8	-52.2	-177.7	161.2	0	0	0	0	113.2	G326 Q332 L333 L334 L336 M344	G326-V330 WeakPolarHBondContact O-CG2 3.37Å; G326-V330 PolarHBondContact O-N 3.32Å; V330-Q332 PolarHBondContact O-N 3.41Å; V330-L333 PolarHBondContact O-N 3.06Å; V330-L334 HydrophobicContact CG1-CD1 4.08Å; V330-L334 PolarHBondContact O-N 3.22Å; V330-L336 HydrophobicContact CG1-CD1 4.33Å; V330-M344 HydrophobicContact CB-CE 4.46Å; V330-M344 HydrophobicContact CG1-CE 3.78Å
331	P	76.9	Confident	82.4	Confident	33 Å²	33	60.9 Å²	60.9	21%	0.214	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-24.5	175.4	-25.1	35.9	0	0	0	114.5	S327 L336 M344	S327-P331 WeakPolarHBondContact O-CD 3.2Å; P331-L336 HydrophobicContact CB-CD1 4.27Å; P331-L336 HydrophobicContact CG-CD1 4.09Å; P331-M344 HydrophobicContact CG-CG 3.77Å
332	Q	75.3	Confident	82	Confident	84 Å²	84	65.6 Å²	65.6	39%	0.393	34%	0.339	S	S	.	.	H	α-helix	trans	-78.5	-31.8	178.3	-62.4	-171.8	-13.2	0	0	112.3	L329 V330	L329-Q332 PolarHBondContact O-N 3.45Å; L329-Q332 VanDerWaalsContact O-N 3.14Å; V330-Q332 PolarHBondContact O-N 3.41Å
333	L	72.8	Confident	81.8	Confident	60 Å²	60	66.7 Å²	66.7	31%	0.314	34%	0.339	S	S	.	.	H	α-helix	trans	-91.3	-31.5	-179	-66	-179.3	0	0	0	114	I11 K13 L329 V330	I11-L333 HydrophobicContact CB-CD2 4.49Å; I11-L333 HydrophobicContact CD1-CD2 4.36Å; I11-L333 HydrophobicContact CG2-CD2 3.77Å; K13-L333 WeakPolarHBondContact CB-O 3.21Å; K13-L333 WeakPolarHBondContact CG-O 3.19Å; L329-L333 HydrophobicContact CD1-CD1 4.38Å; L329-L333 HydrophobicContact CD1-CG 4.34Å; L329-L333 HydrophobicContact CD2-CD1 3.89Å; L329-L333 HydrophobicContact CG-CD1 3.72Å; L329-L333 HydrophobicContact CG-CG 4.04Å; L329-L333 PolarHBondContact O-N 3.03Å; L329-L333 VanDerWaalsContact O-N 3.07Å; V330-L333 PolarHBondContact O-N 3.06Å
334	L	73.2	Confident	81.6	Confident	30 Å²	30	64 Å²	64	16%	0.157	32%	0.324	C	S	.	.	S	Bend	trans	-104.8	162.3	-174.2	-54.5	-170.6	0	0	0	112.2	K13 Y21 V330 L336	K13-L334 PolarHBondContact NZ-O 2.92Å; Y21-L334 HydrophobicContact CE1-CD2 3.92Å; Y21-L334 HydrophobicContact CE2-CD1 4.3Å; Y21-L334 HydrophobicContact CE2-CD2 4.1Å; Y21-L334 VanDerWaalsContact CZ-CD2 3.5Å; Y21-L334 VanDerWaalsContact OH-CD2 3.23Å; Y21-L334 WeakPolarHBondContact OH-CD2 3.39Å; V330-L334 HydrophobicContact CG1-CD1 4.08Å; V330-L334 PolarHBondContact O-N 3.22Å; L334-L336 HydrophobicContact CB-CD2 4.22Å; L334-L336 HydrophobicContact CB-CG 4.42Å; L334-L336 HydrophobicContact CD1-CD2 4.41Å
335	T	75.6	Confident	81.3	Confident	112 Å²	112	65.5 Å²	65.5	69%	0.687	33%	0.332	S	S	*	.			trans	-94.2	118.4	157.2	44	0	0	0	0	107.6	K13	K13-T335 HydrophobicContact CD-CG2 3.93Å
336	L	76	Confident	81.2	Confident	32 Å²	32	65.5 Å²	65.5	17%	0.168	34%	0.336	C	S	.	.			trans	-107.9	153.6	177.8	-64.3	179.8	0	0	0	109.3	V330 P331 L334 Q340 E341	V330-L336 HydrophobicContact CG1-CD1 4.33Å; P331-L336 HydrophobicContact CB-CD1 4.27Å; P331-L336 HydrophobicContact CG-CD1 4.09Å; L334-L336 HydrophobicContact CB-CD2 4.22Å; L334-L336 HydrophobicContact CB-CG 4.42Å; L334-L336 HydrophobicContact CD1-CD2 4.41Å; L336-Q340 HydrophobicContact CB-CB 4.08Å; L336-Q340 HydrophobicContact CD2-CB 4.33Å; L336-E341 HydrophobicContact CB-CG 3.61Å; L336-E341 HydrophobicContact CD1-CG 4.14Å
337	N	81.5	Confident	81.3	Confident	111 Å²	111	71 Å²	71	59%	0.594	35%	0.349	S	S	*	.			trans	-75.9	154.5	165.8	-63.4	-11	0	0	0	109.5	E339 Q340 E341	N337-E339 PolarHBondContact O-N 2.97Å; N337-E339 VanDerWaalsContact O-N 3.14Å; N337-Q340 HydrophobicContact CB-CG 4.3Å; N337-Q340 CarbonylContact O-C 3.44Å; N337-Q340 WeakPolarHBondContact O-CA 3.46Å; N337-Q340 WeakPolarHBondContact O-CB 3.42Å; N337-Q340 PolarHBondContact O-N 3.18Å; N337-E341 PolarHBondContact O-N 3.19Å
338	E	77.2	Confident	81.4	Confident	143 Å²	143	70.9 Å²	70.9	67%	0.668	35%	0.347	S	S	*	.	H	α-helix	trans	-52.2	-39.9	-179.1	-59.9	178.2	-176.8	0	0	113.6	Q340 E341 R342	E338-Q340 VanDerWaalsContact C-N 3.33Å; E338-Q340 PolarHBondContact O-N 3.14Å; E338-E341 PolarHBondContact O-N 3.15Å; E338-R342 PolarHBondContact O-N 3Å; E338-R342 IonicContact OE2-NH2 3.52Å
339	E	78.9	Confident	81.5	Confident	145 Å²	145	72.5 Å²	72.5	68%	0.678	36%	0.356	S	S	*	.	H	α-helix	trans	-60.1	-40.2	174.2	-175	179.3	-156.6	0	0	112.4	N337 E343	N337-E339 PolarHBondContact O-N 2.97Å; N337-E339 VanDerWaalsContact O-N 3.14Å; E339-E343 WeakPolarHBondContact O-CG 3.44Å; E339-E343 PolarHBondContact O-N 3.34Å
340	Q	80.2	Confident	81.9	Confident	71 Å²	71	74.2 Å²	74.2	33%	0.332	37%	0.365	S	S	.	.	H	α-helix	trans	-73.5	-28.9	176.8	-60.7	177.8	-57.2	0	0	112.3	L336 N337 E338 M344	L336-Q340 HydrophobicContact CB-CB 4.08Å; L336-Q340 HydrophobicContact CD2-CB 4.33Å; N337-Q340 HydrophobicContact CB-CG 4.3Å; N337-Q340 CarbonylContact O-C 3.44Å; N337-Q340 WeakPolarHBondContact O-CA 3.46Å; N337-Q340 WeakPolarHBondContact O-CB 3.42Å; N337-Q340 PolarHBondContact O-N 3.18Å; E338-Q340 VanDerWaalsContact C-N 3.33Å; E338-Q340 PolarHBondContact O-N 3.14Å; Q340-M344 WeakPolarHBondContact O-CB 3.26Å; Q340-M344 PolarHBondContact O-N 3.38Å
341	E	78.5	Confident	82.3	Confident	92 Å²	92	73.7 Å²	73.7	43%	0.43	36%	0.36	S	S	.	.	H	α-helix	trans	-71	-43.6	173	-62.6	-160.9	146.9	0	0	111.2	L336 N337 E338 M344 L345	L336-E341 HydrophobicContact CB-CG 3.61Å; L336-E341 HydrophobicContact CD1-CG 4.14Å; N337-E341 PolarHBondContact O-N 3.19Å; E338-E341 PolarHBondContact O-N 3.15Å; E341-M344 PolarHBondContact O-N 3.08Å; E341-L345 WeakPolarHBondContact O-CG 3.34Å; E341-L345 PolarHBondContact O-N 3.42Å
342	R	79.8	Confident	83	Confident	101 Å²	101	72.1 Å²	72.1	38%	0.381	35%	0.35	S	S	.	.	H	α-helix	trans	-54.8	-52.5	169.5	-94.2	-177.4	-85.6	-85.3	1.2	112.1	D262 E338 M344 L345 V346	D262-R342 VanDerWaalsContact CG-NH1 3.27Å; D262-R342 IonicContact OD1-NH1 3.05Å; D262-R342 PolarHBondContact OD1-NH1 3.27Å; D262-R342 WeakPolarHBondContact OD2-CD 3.45Å; D262-R342 WeakPolarHBondContact OD2-CG 3.37Å; D262-R342 IonicContact OD2-CZ 3.46Å; D262-R342 IonicContact OD2-NE 3.13Å; D262-R342 IonicContact OD2-NH1 3.7Å; D262-R342 PolarHBondContact OD2-NH1 3.26Å; E338-R342 PolarHBondContact O-N 3Å; E338-R342 IonicContact OE2-NH2 3.52Å; R342-M344 VanDerWaalsContact C-N 3.29Å; R342-M344 PolarHBondContact O-N 3Å; R342-L345 WeakPolarHBondContact O-CB 3.26Å; R342-L345 PolarHBondContact O-N 2.86Å; R342-L345 VanDerWaalsContact O-N 3.15Å; R342-V346 PolarHBondContact O-N 2.97Å
343	E	85.8	Confident	83.8	Confident	103 Å²	103	70.9 Å²	70.9	48%	0.481	35%	0.348	S	S	.	.	H	α-helix	trans	-56.2	-43.6	175.3	-81.4	-66.2	123.3	0	0	111.6	E339 L345 V346 W347	E339-E343 WeakPolarHBondContact O-CG 3.44Å; E339-E343 PolarHBondContact O-N 3.34Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 3.34Å; E343-V346 WeakPolarHBondContact O-CB 3.44Å; E343-V346 PolarHBondContact O-N 2.89Å; E343-V346 VanDerWaalsContact O-N 3.14Å; E343-W347 PolarHBondContact O-N 3.1Å
344	M	85.7	Confident	84.8	Confident	36 Å²	36	72.1 Å²	72.1	18%	0.177	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-36	178.8	-165.9	61.2	54.3	0	0	112.8	V330 P331 Q340 E341 R342 W347 Q348	V330-M344 HydrophobicContact CB-CE 4.46Å; V330-M344 HydrophobicContact CG1-CE 3.78Å; P331-M344 HydrophobicContact CG-CG 3.77Å; Q340-M344 WeakPolarHBondContact O-CB 3.26Å; Q340-M344 PolarHBondContact O-N 3.38Å; E341-M344 PolarHBondContact O-N 3.08Å; R342-M344 VanDerWaalsContact C-N 3.29Å; R342-M344 PolarHBondContact O-N 3Å; M344-W347 PolarHBondContact O-N 3.46Å; M344-Q348 WeakPolarHBondContact O-CB 3.26Å; M344-Q348 WeakPolarHBondContact O-CG 3.46Å; M344-Q348 PolarHBondContact O-N 3.28Å
345	L	85.1	Confident	85.6	Confident	32 Å²	32	70.7 Å²	70.7	17%	0.168	35%	0.35	C	S	.	.	H	α-helix	trans	-63	-41.2	173.2	-69.5	172.9	0	0	0	111.7	M258 L259 E341 R342 E343 Q348 M349	M258-L345 HydrophobicContact CB-CD1 4.05Å; M258-L345 HydrophobicContact CB-CD2 3.91Å; M258-L345 HydrophobicContact CG-CD2 4.36Å; L259-L345 HydrophobicContact CD2-CB 3.76Å; L259-L345 HydrophobicContact CD2-CD1 4.39Å; L259-L345 HydrophobicContact CG-CB 4Å; E341-L345 WeakPolarHBondContact O-CG 3.34Å; E341-L345 PolarHBondContact O-N 3.42Å; R342-L345 WeakPolarHBondContact O-CB 3.26Å; R342-L345 PolarHBondContact O-N 2.86Å; R342-L345 VanDerWaalsContact O-N 3.15Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 3.34Å; L345-Q348 PolarHBondContact O-N 3.07Å; L345-M349 PolarHBondContact O-N 3.24Å
346	V	88.5	Confident	86.4	Confident	49 Å²	49	66.7 Å²	66.7	30%	0.297	33%	0.326	S	S	.	.	H	α-helix	trans	-63.1	-45.8	174.1	179.2	0	0	0	0	110.7	L259 R342 E343 Q348 M349 L350	L259-V346 HydrophobicContact CD1-CG2 4.38Å; L259-V346 HydrophobicContact CD2-CG2 3.93Å; R342-V346 PolarHBondContact O-N 2.97Å; E343-V346 WeakPolarHBondContact O-CB 3.44Å; E343-V346 PolarHBondContact O-N 2.89Å; E343-V346 VanDerWaalsContact O-N 3.14Å; V346-Q348 PolarHBondContact O-N 3.01Å; V346-M349 PolarHBondContact O-N 2.74Å; V346-L350 HydrophobicContact CG1-CD1 4.01Å; V346-L350 HydrophobicContact CG1-CG 4.43Å; V346-L350 WeakPolarHBondContact O-CG 3.15Å; V346-L350 PolarHBondContact O-N 3.33Å
347	W	89.6	Confident	87.1	Confident	141 Å²	141	69.1 Å²	69.1	53%	0.534	34%	0.343	S	S	.	.	H	α-helix	trans	-62.2	-40.3	175.8	-75.1	108.5	0	0	0	112.9	E343 M344 L350 L351	E343-W347 PolarHBondContact O-N 3.1Å; M344-W347 PolarHBondContact O-N 3.46Å; W347-L350 HydrophobicContact CE3-CD1 4.42Å; W347-L350 PolarHBondContact O-N 3.46Å; W347-L351 VanDerWaalsContact O-CB 3.27Å; W347-L351 WeakPolarHBondContact O-CB 3.39Å; W347-L351 VanDerWaalsContact O-CG 3.24Å; W347-L351 WeakPolarHBondContact O-CG 3.46Å; W347-L351 PolarHBondContact O-N 3.42Å
348	Q	91.3	Very high	87.5	Confident	8 Å²	8	65.1 Å²	65.1	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-61.5	-45.8	173.7	-73	166.2	10.2	0	0	111.6	S255 S327 Y328 M344 L345 V346 L351 S352	S255-Q348 WeakPolarHBondContact OG-CB 3.15Å; S255-Q348 PolarHBondContact OG-OE1 2.98Å; S327-Q348 PolarHBondContact O-NE2 3.35Å; Y328-Q348 HydrophobicContact CD1-CG 4.24Å; Y328-Q348 HydrophobicContact CE1-CB 4.37Å; Y328-Q348 HydrophobicContact CE1-CG 3.94Å; M344-Q348 WeakPolarHBondContact O-CB 3.26Å; M344-Q348 WeakPolarHBondContact O-CG 3.46Å; M344-Q348 PolarHBondContact O-N 3.28Å; L345-Q348 PolarHBondContact O-N 3.07Å; V346-Q348 PolarHBondContact O-N 3.01Å; Q348-L351 PolarHBondContact O-N 2.98Å; Q348-S352 VanDerWaalsContact O-CB 3.31Å; Q348-S352 WeakPolarHBondContact O-CB 3.25Å; Q348-S352 PolarHBondContact O-N 3.32Å
349	M	90.5	Very high	88	Confident	42 Å²	42	58.4 Å²	58.4	21%	0.207	29%	0.291	C	S	.	.	H	α-helix	trans	-62	-45.5	177.5	-175.9	177.5	60.7	0	0	111.7	L256 L259 L345 V346 S352 T353	L256-M349 HydrophobicContact CD1-SD 4.05Å; L259-M349 HydrophobicContact CD1-CB 4.27Å; L259-M349 HydrophobicContact CD1-CE 3.64Å; L259-M349 HydrophobicContact CD1-SD 3.81Å; L345-M349 PolarHBondContact O-N 3.24Å; V346-M349 PolarHBondContact O-N 2.74Å; M349-S352 PolarHBondContact O-N 3.28Å; M349-T353 WeakPolarHBondContact O-CB 3.35Å; M349-T353 PolarHBondContact O-N 3.11Å; M349-T353 PolarHBondContact O-OG1 2.96Å
350	L	92.8	Very high	88.4	Confident	84 Å²	84	56.7 Å²	56.7	44%	0.44	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-48.6	177.2	-71.6	172.2	0	0	0	111.9	V346 W347 S352 T353 V354	V346-L350 HydrophobicContact CG1-CD1 4.01Å; V346-L350 HydrophobicContact CG1-CG 4.43Å; V346-L350 WeakPolarHBondContact O-CG 3.15Å; V346-L350 PolarHBondContact O-N 3.33Å; W347-L350 HydrophobicContact CE3-CD1 4.42Å; W347-L350 PolarHBondContact O-N 3.46Å; L350-S352 VanDerWaalsContact C-N 3.28Å; L350-S352 PolarHBondContact O-N 2.88Å; L350-T353 WeakPolarHBondContact O-CB 3.4Å; L350-T353 PolarHBondContact O-N 2.92Å; L350-V354 WeakPolarHBondContact O-CG2 3.34Å; L350-V354 PolarHBondContact O-N 3.46Å
351	L	92.6	Very high	88.6	Confident	39 Å²	39	60 Å²	60	20%	0.204	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-38.3	175.9	-75.4	170.9	0	0	0	111.6	L323 L324 W347 Q348 N355	L323-L351 HydrophobicContact CB-CD1 4.33Å; L323-L351 HydrophobicContact CB-CD2 3.88Å; L323-L351 HydrophobicContact CD1-CD2 4.19Å; L324-L351 HydrophobicContact CD1-CB 4.05Å; W347-L351 VanDerWaalsContact O-CB 3.27Å; W347-L351 WeakPolarHBondContact O-CB 3.39Å; W347-L351 VanDerWaalsContact O-CG 3.24Å; W347-L351 WeakPolarHBondContact O-CG 3.46Å; W347-L351 PolarHBondContact O-N 3.42Å; Q348-L351 PolarHBondContact O-N 2.98Å; L351-N355 PolarHBondContact O-N 2.94Å; L351-N355 PolarHBondContact O-ND2 3.02Å
352	S	92	Very high	88.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-71.6	-37.7	177.7	-160.1	0	0	0	0	112.2	S248 T251 W252 Q348 M349 L350 V354 N355 C356	S248-S352 PolarHBondContact O-OG 3.37Å; T251-S352 PolarHBondContact OG1-OG 2.89Å; W252-S352 PolarHBondContact N-OG 3.42Å; Q348-S352 VanDerWaalsContact O-CB 3.31Å; Q348-S352 WeakPolarHBondContact O-CB 3.25Å; Q348-S352 PolarHBondContact O-N 3.32Å; M349-S352 PolarHBondContact O-N 3.28Å; L350-S352 VanDerWaalsContact C-N 3.28Å; L350-S352 PolarHBondContact O-N 2.88Å; S352-V354 PolarHBondContact O-N 2.67Å; S352-N355 CarbonylContact O-C 3.48Å; S352-N355 PolarHBondContact O-N 3.39Å; S352-N355 VanDerWaalsContact O-N 3.14Å; S352-C356 PolarHBondContact O-N 3.02Å
353	T	93.3	Very high	88.8	Confident	57 Å²	57	55.1 Å²	55.1	35%	0.35	28%	0.275	S	S	.	.	H	α-helix	trans	-58.8	-46.2	172.2	-55.3	0	0	0	0	111.3	W252 M349 L350 N355 C356 V357	W252-T353 PolarHBondContact NE1-OG1 3.41Å; W252-T353 VanDerWaalsContact NE1-OG1 3.17Å; M349-T353 WeakPolarHBondContact O-CB 3.35Å; M349-T353 PolarHBondContact O-N 3.11Å; M349-T353 PolarHBondContact O-OG1 2.96Å; L350-T353 WeakPolarHBondContact O-CB 3.4Å; L350-T353 PolarHBondContact O-N 2.92Å; T353-N355 VanDerWaalsContact C-N 3.33Å; T353-N355 PolarHBondContact O-N 3.36Å; T353-C356 WeakPolarHBondContact O-CB 3.23Å; T353-C356 PolarHBondContact O-N 2.86Å; T353-V357 WeakPolarHBondContact O-CG2 3.04Å; T353-V357 PolarHBondContact O-N 3.07Å
354	V	92.1	Very high	88.5	Confident	86 Å²	86	55.2 Å²	55.2	52%	0.521	28%	0.278	S	S	.	.	H	α-helix	trans	-63.8	-37.3	175.6	172.9	0	0	0	0	111.6	L350 S352 T358	L350-V354 WeakPolarHBondContact O-CG2 3.34Å; L350-V354 PolarHBondContact O-N 3.46Å; S352-V354 PolarHBondContact O-N 2.67Å; V354-T358 HydrophobicContact CG1-CG2 4.37Å; V354-T358 WeakPolarHBondContact O-CB 3.5Å; V354-T358 VanDerWaalsContact O-CG2 3.29Å; V354-T358 WeakPolarHBondContact O-CG2 3.34Å; V354-T358 PolarHBondContact O-N 2.69Å; V354-T358 PolarHBondContact O-OG1 3.29Å
355	N	91.2	Very high	87.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.6	-47.3	173.1	-81.9	-66.3	0	0	0	111.9	G320 W321 L351 S352 T353 V357 T358 V359	G320-N355 VanDerWaalsContact C-ND2 3.32Å; G320-N355 WeakPolarHBondContact CA-OD1 3.11Å; G320-N355 PolarHBondContact O-ND2 3Å; W321-N355 PolarHBondContact N-OD1 2.91Å; L351-N355 PolarHBondContact O-N 2.94Å; L351-N355 PolarHBondContact O-ND2 3.02Å; S352-N355 CarbonylContact O-C 3.48Å; S352-N355 PolarHBondContact O-N 3.39Å; S352-N355 VanDerWaalsContact O-N 3.14Å; T353-N355 VanDerWaalsContact C-N 3.33Å; T353-N355 PolarHBondContact O-N 3.36Å; N355-V357 PolarHBondContact O-N 3.09Å; N355-T358 PolarHBondContact O-N 3.37Å; N355-T358 PolarHBondContact O-OG1 3.48Å; N355-V359 WeakPolarHBondContact O-CB 3.39Å; N355-V359 WeakPolarHBondContact O-CG2 3.33Å; N355-V359 PolarHBondContact O-N 3.04Å
356	C	92.1	Very high	86.7	Confident	28 Å²	28	59.7 Å²	59.7	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-52.2	-53.2	174.1	-77.9	0	0	0	0	111.7	S248 S352 T353 V359 F360	S248-C356 VanDerWaalsContact C-SG 3.59Å; S248-C356 WeakPolarHBondContact CB-SG 3.43Å; S352-C356 PolarHBondContact O-N 3.02Å; T353-C356 WeakPolarHBondContact O-CB 3.23Å; T353-C356 PolarHBondContact O-N 2.86Å; C356-V359 PolarHBondContact O-N 3Å; C356-F360 VanDerWaalsContact O-CB 3.23Å; C356-F360 WeakPolarHBondContact O-CB 3.44Å; C356-F360 PolarHBondContact O-N 3.22Å
357	V	91.3	Very high	85.5	Confident	84 Å²	84	60.7 Å²	60.7	51%	0.509	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-48.4	-179.6	173.1	0	0	0	0	111.6	T353 N355 W361	T353-V357 WeakPolarHBondContact O-CG2 3.04Å; T353-V357 PolarHBondContact O-N 3.07Å; N355-V357 PolarHBondContact O-N 3.09Å; V357-W361 WeakPolarHBondContact O-CB 3.11Å; V357-W361 PolarHBondContact O-N 3.29Å
358	T	88.7	Confident	83.7	Confident	27 Å²	27	62.8 Å²	62.8	17%	0.166	32%	0.319	C	S	.	.	H	α-helix	trans	-67.6	-40.3	-178.6	58.3	0	0	0	0	112.1	I316 C317 V354 N355 W361 T362	I316-T358 HydrophobicContact CG2-CG2 4.21Å; C317-T358 VanDerWaalsContact SG-C 3.52Å; C317-T358 VanDerWaalsContact SG-CB 3.55Å; C317-T358 PolarHBondContact SG-OG1 3.11Å; C317-T358 VanDerWaalsContact SG-OG1 3.42Å; V354-T358 HydrophobicContact CG1-CG2 4.37Å; V354-T358 WeakPolarHBondContact O-CB 3.5Å; V354-T358 VanDerWaalsContact O-CG2 3.29Å; V354-T358 WeakPolarHBondContact O-CG2 3.34Å; V354-T358 PolarHBondContact O-N 2.69Å; V354-T358 PolarHBondContact O-OG1 3.29Å; N355-T358 PolarHBondContact O-N 3.37Å; N355-T358 PolarHBondContact O-OG1 3.48Å; T358-W361 PolarHBondContact O-N 2.93Å; T358-T362 WeakPolarHBondContact O-CG2 3.47Å; T358-T362 PolarHBondContact O-N 3.11Å
359	V	87.5	Confident	81.5	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.006	35%	0.353	C	S	.	.	H	α-helix	trans	-65.2	-45.2	177.6	173.2	0	0	0	0	110.7	I241 L245 C317 N355 C356 W361 T362 L363	I241-V359 HydrophobicContact CG2-CG1 3.85Å; I241-V359 WeakPolarHBondContact O-CG1 3.16Å; L245-V359 HydrophobicContact CB-CG1 3.73Å; L245-V359 HydrophobicContact CD1-CG1 4.34Å; L245-V359 HydrophobicContact CG-CG1 4.41Å; C317-V359 HydrophobicContact CB-CG2 4.43Å; N355-V359 WeakPolarHBondContact O-CB 3.39Å; N355-V359 WeakPolarHBondContact O-CG2 3.33Å; N355-V359 PolarHBondContact O-N 3.04Å; C356-V359 PolarHBondContact O-N 3Å; V359-W361 VanDerWaalsContact C-N 3.32Å; V359-W361 PolarHBondContact O-N 3.45Å; V359-T362 PolarHBondContact O-N 3.14Å; V359-T362 PolarHBondContact O-OG1 3.07Å; V359-L363 PolarHBondContact O-N 3.04Å
360	F	87.2	Confident	78.9	Confident	109 Å²	109	69.3 Å²	69.3	48%	0.478	38%	0.375	S	S	.	.	H	α-helix	trans	-56.2	-44.9	171.9	179.6	-109.8	0	0	0	111.7	C356 T362 L363 L364	C356-F360 VanDerWaalsContact O-CB 3.23Å; C356-F360 WeakPolarHBondContact O-CB 3.44Å; C356-F360 PolarHBondContact O-N 3.22Å; F360-T362 VanDerWaalsContact C-N 3.28Å; F360-T362 PolarHBondContact O-N 2.98Å; F360-L363 WeakPolarHBondContact O-CB 3.5Å; F360-L363 PolarHBondContact O-N 2.83Å; F360-L364 HydrophobicContact CD1-CD1 4.04Å; F360-L364 HydrophobicContact CE1-CD1 3.44Å; F360-L364 VanDerWaalsContact CE1-CD1 3.44Å; F360-L364 HydrophobicContact CE1-CG 4.18Å; F360-L364 HydrophobicContact CZ-CD1 3.72Å; F360-L364 HydrophobicContact CZ-CD2 4.42Å; F360-L364 HydrophobicContact CZ-CG 4.19Å; F360-L364 PolarHBondContact O-N 2.75Å; F360-L364 VanDerWaalsContact O-N 3.1Å
361	W	85.9	Confident	76.1	Confident	142 Å²	142	70.8 Å²	70.8	54%	0.538	39%	0.393	S	S	.	.	H	α-helix	trans	-64.7	-28.8	176.1	-151.1	-86.7	0	0	0	113	I313 V357 T358 V359 L363 L365	I313-W361 HydrophobicContact CD1-CB 4Å; I313-W361 HydrophobicContact CD1-CG 4.17Å; V357-W361 WeakPolarHBondContact O-CB 3.11Å; V357-W361 PolarHBondContact O-N 3.29Å; T358-W361 PolarHBondContact O-N 2.93Å; V359-W361 VanDerWaalsContact C-N 3.32Å; V359-W361 PolarHBondContact O-N 3.45Å; W361-L363 VanDerWaalsContact C-N 3.29Å; W361-L363 PolarHBondContact O-N 2.99Å; W361-L365 WeakPolarHBondContact O-CB 3.42Å; W361-L365 WeakPolarHBondContact O-CG 3.38Å; W361-L365 PolarHBondContact O-N 2.95Å
362	T	82	Confident	73.4	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.012	42%	0.42	C	S	.	.	H	α-helix	trans	-71.9	-16.7	171.8	67.9	0	0	0	0	115.3	I241 I313 C317 T358 V359 F360 R367	I241-T362 WeakPolarHBondContact CG2-OG1 3.41Å; I313-T362 HydrophobicContact CB-CG2 4.32Å; I313-T362 HydrophobicContact CD1-CG2 3.78Å; I313-T362 HydrophobicContact CG1-CG2 3.63Å; I313-T362 HydrophobicContact CG2-CG2 4.02Å; C317-T362 WeakPolarHBondContact SG-CG2 3.44Å; T358-T362 WeakPolarHBondContact O-CG2 3.47Å; T358-T362 PolarHBondContact O-N 3.11Å; V359-T362 PolarHBondContact O-N 3.14Å; V359-T362 PolarHBondContact O-OG1 3.07Å; F360-T362 VanDerWaalsContact C-N 3.28Å; F360-T362 PolarHBondContact O-N 2.98Å; T362-R367 PolarHBondContact O-NE 3.22Å; T362-R367 PolarHBondContact O-NH2 3.22Å; T362-R367 VanDerWaalsContact O-NH2 3.14Å
363	L	79.3	Confident	70.6	Confident	87 Å²	87	85.7 Å²	85.7	46%	0.455	46%	0.462	S	S	.	.	H	α-helix	trans	-83.6	-47.6	170.3	-66.4	169.5	0	0	0	110.8	I241 L245 V359 F360 W361	I241-L363 HydrophobicContact CB-CD2 4.23Å; I241-L363 HydrophobicContact CG2-CD1 4.3Å; I241-L363 HydrophobicContact CG2-CD2 3.45Å; I241-L363 VanDerWaalsContact CG2-CD2 3.45Å; I241-L363 HydrophobicContact CG2-CG 3.62Å; L245-L363 HydrophobicContact CD1-CD1 3.81Å; V359-L363 PolarHBondContact O-N 3.04Å; F360-L363 WeakPolarHBondContact O-CB 3.5Å; F360-L363 PolarHBondContact O-N 2.83Å; W361-L363 VanDerWaalsContact C-N 3.29Å; W361-L363 PolarHBondContact O-N 2.99Å
364	L	80.2	Confident	67.8	Low	106 Å²	106	94.3 Å²	94.3	56%	0.555	49%	0.488	S	S	*	.	H	α-helix	trans	-68.5	-36.4	-177.5	-67	-172.5	0	0	0	113.9	F360 P366	F360-L364 HydrophobicContact CD1-CD1 4.04Å; F360-L364 HydrophobicContact CE1-CD1 3.44Å; F360-L364 VanDerWaalsContact CE1-CD1 3.44Å; F360-L364 HydrophobicContact CE1-CG 4.18Å; F360-L364 HydrophobicContact CZ-CD1 3.72Å; F360-L364 HydrophobicContact CZ-CD2 4.42Å; F360-L364 HydrophobicContact CZ-CG 4.19Å; F360-L364 PolarHBondContact O-N 2.75Å; F360-L364 VanDerWaalsContact O-N 3.1Å; L364-P366 WeakPolarHBondContact O-CD 3.44Å; L364-P366 VanDerWaalsContact O-N 3.15Å
365	L	70.4	Confident	65	Low	60 Å²	60	102.2 Å²	102.2	31%	0.314	51%	0.509	S	S	.	.	S	Bend	trans	-61.3	118.4	-174	-85.1	178.6	0	0	0	112	M311 I313 W361 R367	M311-L365 HydrophobicContact CE-CB 4.42Å; M311-L365 HydrophobicContact CE-CD1 4.4Å; I313-L365 HydrophobicContact CD1-CD1 3.74Å; I313-L365 HydrophobicContact CG2-CD1 4.03Å; W361-L365 WeakPolarHBondContact O-CB 3.42Å; W361-L365 WeakPolarHBondContact O-CG 3.38Å; W361-L365 PolarHBondContact O-N 2.95Å; L365-R367 VanDerWaalsContact O-CG 3.3Å; L365-R367 WeakPolarHBondContact O-CG 3.32Å; L365-R367 PolarHBondContact O-N 3.26Å
366	P	63.2	Low	62.4	Low	101 Å²	101	114.3 Å²	114.3	66%	0.656	56%	0.555	S	S	*	*			trans	-69.7	100.8	-174.8	27.3	-34.5	0	0	0	110.2	L364 K368	L364-P366 WeakPolarHBondContact O-CD 3.44Å; L364-P366 VanDerWaalsContact O-N 3.15Å; P366-K368 PolarHBondContact O-N 3.14Å
367	R	62.9	Low	59.8	Low	70 Å²	70	117.8 Å²	117.8	26%	0.264	58%	0.579	S	S	.	*			trans	-73.2	46.3	-178.2	-53.4	-167.4	-177.6	-136.2	12.6	113.4	M311 D314 T362 L365 A369	M311-R367 HydrophobicContact CE-CG 3.95Å; M311-R367 HydrophobicContact SD-CG 4.16Å; D314-R367 IonicContact OD1-CZ 3.04Å; D314-R367 IonicContact OD1-NH1 3.8Å; D314-R367 PolarHBondContact OD1-NH1 2.98Å; D314-R367 IonicContact OD1-NH2 2.75Å; D314-R367 PolarHBondContact OD1-NH2 2.94Å; D314-R367 IonicContact OD2-CZ 2.74Å; D314-R367 IonicContact OD2-NH1 3.67Å; D314-R367 PolarHBondContact OD2-NH1 3.46Å; T362-R367 PolarHBondContact O-NE 3.22Å; T362-R367 PolarHBondContact O-NH2 3.22Å; T362-R367 VanDerWaalsContact O-NH2 3.14Å; L365-R367 VanDerWaalsContact O-CG 3.3Å; L365-R367 WeakPolarHBondContact O-CG 3.32Å; L365-R367 PolarHBondContact O-N 3.26Å; R367-A369 PolarHBondContact O-N 3.46Å
368	K	51.6	Low	57.3	Low	185 Å²	185	125.4 Å²	125.4	80%	0.804	60%	0.598	S	S	*	*			trans	-62.8	104.5	168.2	-73.2	177	177.8	172.2	0	107.8	P366 S370	P366-K368 PolarHBondContact O-N 3.14Å; K368-S370 PolarHBondContact O-N 3.18Å
369	A	44.5	Very low	54.8	Low	91 Å²	91	136 Å²	136	75%	0.752	64%	0.636	S	S	*	*			trans	-61.1	104.4	168.8	0	0	0	0	0	108.2	R367 S371	R367-A369 PolarHBondContact O-N 3.46Å; A369-S371 PolarHBondContact O-N 3.21Å
370	S	36	Very low	52.4	Low	96 Å²	96	140.8 Å²	140.8	67%	0.671	67%	0.669	S	S	*	*			trans	-68.5	100.2	-175.1	45.6	0	0	0	0	110	K368 L372	K368-S370 PolarHBondContact O-N 3.18Å; S370-L372 PolarHBondContact O-N 3.05Å
371	S	33.3	Very low	50.3	Low	115 Å²	115	143.8 Å²	143.8	80%	0.804	69%	0.686	S	S	*	*			trans	-72.8	42.4	172.8	50	0	0	0	0	112.2	A369 K373	A369-S371 PolarHBondContact O-N 3.21Å; S371-K373 PolarHBondContact O-N 3.19Å
372	L	36.9	Very low	48.1	Very low	146 Å²	146	144.9 Å²	144.9	76%	0.764	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	122.2	172.9	-82.2	163	0	0	0	109.1	S370	S370-L372 PolarHBondContact O-N 3.05Å
373	K	33.7	Very low	46	Very low	206 Å²	206	149.2 Å²	149.2	90%	0.896	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.4	64.7	175.3	-58.9	-177.8	176.6	178.6	0	117.1	S371	S371-K373 PolarHBondContact O-N 3.19Å
374	R	33.2	Very low	44.1	Very low	238 Å²	238	150.7 Å²	150.7	90%	0.898	75%	0.751	S	S	*	*			trans	-137.9	32.1	131.5	-135.9	179.4	-166.2	-154.5	1.9	115.7
375	R	34.5	Very low	42	Very low	253 Å²	253	150.5 Å²	150.5	96%	0.955	77%	0.765	S	S	*	*			trans	-97.1	24.7	177.5	-145.9	-177.8	-169	-155.6	3.1	114.5
376	R	36.6	Very low	40.5	Very low	254 Å²	254	152.4 Å²	152.4	96%	0.958	78%	0.783	S	S	*	*	S	Bend	trans	-123.6	41.4	-177.9	-151.7	-178.6	-161.7	-179	6.5	112.9
377	S	37.4	Very low	39.3	Very low	100 Å²	100	159 Å²	159	70%	0.699	80%	0.795	S	S	*	*	S	Bend	trans	-148.9	31.1	-178.9	-169.4	0	0	0	0	113.1
378	R	37.6	Very low	37.9	Very low	244 Å²	244	161.5 Å²	161.5	92%	0.921	82%	0.823	S	S	*	*	S	Bend	trans	-141.8	37.7	173.5	-73.7	-166.4	176.6	-174.9	-2.1	111.8
379	R	37.1	Very low	37.3	Very low	251 Å²	251	158.8 Å²	158.8	95%	0.947	82%	0.822	S	S	*	*	S	Bend	trans	-137.9	72.8	170.7	-83.6	-169.8	173	178.2	-3.4	108.6
380	S	37	Very low	37.1	Very low	101 Å²	101	160.6 Å²	160.6	71%	0.706	82%	0.823	S	S	*	*	S	Bend	trans	-167	-21.5	169.5	57.7	0	0	0	0	111.6
381	M	44	Very low	37.3	Very low	171 Å²	171	162.1 Å²	162.1	84%	0.842	83%	0.831	S	S	*	*	S	Bend	trans	-99.2	84	164.9	-62.3	-175.1	77.8	0	0	109.8
382	N	38.6	Very low	37.5	Very low	166 Å²	166	161.9 Å²	161.9	89%	0.888	83%	0.829	S	S	*	*	S	Bend	trans	-169.4	47.9	157.7	-108.9	16.6	0	0	0	110.1
383	S	37.7	Very low	37.6	Very low	92 Å²	92	162.9 Å²	162.9	64%	0.643	83%	0.834	S	S	*	*	S	Bend	trans	-140.9	144.1	170.7	48.9	0	0	0	0	106.1
384	S	39.2	Very low	37.9	Very low	119 Å²	119	157.7 Å²	157.7	83%	0.832	82%	0.824	S	S	*	*			trans	67.1	51.6	-168.5	-47.6	0	0	0	0	114.7
385	A	35.9	Very low	38	Very low	102 Å²	102	151.9 Å²	151.9	84%	0.843	82%	0.82	S	S	*	*			trans	-104.3	75.1	161	0	0	0	0	0	109.3
386	S	39.7	Very low	38.1	Very low	99 Å²	99	144 Å²	144	69%	0.692	81%	0.809	S	S	*	*			trans	-139.6	103.4	-173.7	54.2	0	0	0	0	112.1
387	R	37.8	Very low	38	Very low	240 Å²	240	137.7 Å²	137.7	91%	0.906	80%	0.799	S	S	*	*			trans	51.2	91.8	165.3	-67.1	-177.9	175.3	167	-1.5	117.2
388	S	33.4	Very low	37.8	Very low	123 Å²	123	138.5 Å²	138.5	86%	0.86	80%	0.8	S	S	*	*			trans	-64.9	129.3	144.5	51.1	0	0	0	0	110.5
389	V	39.8	Very low	37.6	Very low	128 Å²	128	131.5 Å²	131.5	78%	0.776	79%	0.788	S	S	*	*			trans	-133.5	125	157.8	-179	0	0	0	0	107.4
390	T	40	Very low	37.6	Very low	128 Å²	128	128.7 Å²	128.7	79%	0.785	78%	0.779	S	S	*	*			trans	-81	148.7	175.8	20.3	0	0	0	0	111.5
391	P	39.8	Very low	37.7	Very low	128 Å²	128	130 Å²	130	83%	0.831	78%	0.783	S	S	*	*			trans	-119.7	118.3	148.7	33.2	-22.5	0	0	0	110.5
392	S	38.1	Very low	37.5	Very low	110 Å²	110	127.3 Å²	127.3	77%	0.769	78%	0.776	S	S	*	*			trans	-124.7	88.1	172.8	58.7	0	0	0	0	110.8
393	L	38.5	Very low	37.5	Very low	167 Å²	167	125.5 Å²	125.5	87%	0.874	77%	0.766	S	S	*	*			trans	55.6	161.9	153.8	-128.2	71.9	0	0	0	120.3
394	S	38.9	Very low	37.6	Very low	97 Å²	97	129.2 Å²	129.2	68%	0.678	77%	0.773	S	S	*	*			trans	80.4	97	161.3	-48.1	0	0	0	0	118.7
395	S	36	Very low	37.4	Very low	116 Å²	116	131.1 Å²	131.1	81%	0.811	77%	0.773	S	S	*	*				73.1	124.3	120.3	-53.5	0	0	0	0	122.1
396	A	36.2	Very low	37.3	Very low	88 Å²	88	129.7 Å²	129.7	73%	0.727	77%	0.769	S	S	*	*				78.7	96.3	127.4	0	0	0	0	0	120.9
397	T	34.2	Very low	37	Very low	122 Å²	122	128.1 Å²	128.1	75%	0.748	77%	0.768	S	S	*	*				97.9	136.3	114.6	-54.5	0	0	0	0	119.7
398	T	34.5	Very low	36.8	Very low	116 Å²	116	125.2 Å²	125.2	71%	0.712	77%	0.769	S	S	*	*			trans	65.2	110.2	163.5	39.8	0	0	0	0	121.2
399	S	32.7	Very low	36.8	Very low	98 Å²	98	123 Å²	123	69%	0.685	76%	0.758	S	S	*	*			trans	64.6	161.2	135	61.3	0	0	0	0	118.3
400	Y	36.9	Very low	36.4	Very low	192 Å²	192	121.8 Å²	121.8	75%	0.753	76%	0.756	S	S	*	*			cis	-153.5	146.4	20.3	22	-97.7	0	0	0	111.1
401	T	38.9	Very low	36.1	Very low	128 Å²	128	120.6 Å²	120.6	79%	0.785	75%	0.753	S	S	*	*			trans	48	141.1	142.7	63	0	0	0	0	120.8
402	V	40.4	Very low	35.9	Very low	114 Å²	114	122 Å²	122	69%	0.691	75%	0.752	S	S	*	*			cis	-166.1	156.4	7.2	100.8	0	0	0	0	110.2
403	D	38.5	Very low	35.5	Very low	129 Å²	129	124.6 Å²	124.6	69%	0.69	76%	0.757	S	S	*	*			trans	45.7	147.3	158.3	-50.4	-21.3	0	0	0	121
404	H	39.4	Very low	35.3	Very low	169 Å²	169	120.5 Å²	120.5	78%	0.782	76%	0.755	S	S	*	*			cis	-150.1	169.8	39.8	-125.2	-90.5	0	0	0	114.4
405	L	35.9	Very low	34.9	Very low	159 Å²	159	121.3 Å²	121.3	83%	0.832	76%	0.761	S	S	*	*			trans	-54.2	164.3	-177	-66.2	83.5	0	0	0	116.1
406	G	34.5	Very low	34.9	Very low	73 Å²	73	123.9 Å²	123.9	75%	0.753	77%	0.765	S	S	*	*			cis	154.9	171.2	-2.3	0	0	0	0	0	113.3
407	G	32.7	Very low	34.8	Very low	66 Å²	66	126.8 Å²	126.8	68%	0.68	77%	0.767	S	S	*	*			trans	94.8	128.5	179.4	0	0	0	0	0	113.9
408	L	33.4	Very low	35	Very low	178 Å²	178	126.8 Å²	126.8	93%	0.932	77%	0.769	S	S	*	*				71.7	134.8	50.4	-62.1	170.2	0	0	0	113.9
409	A	33.8	Very low	34.8	Very low	76 Å²	76	127 Å²	127	63%	0.628	77%	0.77	S	S	*	*			cis	-165.4	157.4	-18.1	0	0	0	0	0	111.9
410	S	31.6	Very low	34.9	Very low	104 Å²	104	127.6 Å²	127.6	73%	0.727	78%	0.775	S	S	*	*			trans	44.4	117	142.7	62.4	0	0	0	0	123.2
411	S	32.4	Very low	34.6	Very low	102 Å²	102	123.2 Å²	123.2	71%	0.713	77%	0.772	S	S	*	*				103.8	163.8	114.7	79.8	0	0	0	0	123.3
412	I	35.7	Very low	34.4	Very low	158 Å²	158	122.1 Å²	122.1	81%	0.81	77%	0.77	S	S	*	*			trans	89.5	136.4	159	-67.7	166.2	0	0	0	119
413	N	31.4	Very low	34.1	Very low	164 Å²	164	124.5 Å²	124.5	88%	0.877	78%	0.779	S	S	*	*			trans	-75	157.4	-174.2	-56.7	-42.9	0	0	0	113.3
414	G	34.3	Very low	34	Very low	82 Å²	82	122.3 Å²	122.3	85%	0.845	79%	0.787	S	S	*	*			trans	-151.3	103.1	163.1	0	0	0	0	0	111
415	S	30.4	Very low	33.6	Very low	113 Å²	113	120.2 Å²	120.2	79%	0.79	79%	0.791	S	S	*	*			trans	-90.5	149.2	172.7	48.8	0	0	0	0	110.8
416	L	34.9	Very low	33.5	Very low	171 Å²	171	117.4 Å²	117.4	90%	0.895	79%	0.79	S	S	*	*			trans	-176.8	146	143.5	-102.4	156.4	0	0	0	111.9
417	L	33.6	Very low	33.5	Very low	148 Å²	148	121.9 Å²	121.9	78%	0.775	80%	0.796	S	S	*	*			trans	-123.1	153.6	163.3	-138.8	100.5	0	0	0	107
418	P	38.3	Very low	33.8	Very low	122 Å²	122	124.2 Å²	124.2	79%	0.792	80%	0.8	S	S	*	*			trans	-137.8	174.1	139.7	25.3	-5.7	0	0	0	115
419	T	31.4	Very low	33.7	Very low	120 Å²	120	120.8 Å²	120.8	74%	0.736	80%	0.797	S	S	*	*			trans	-103	178.1	-162.4	45.8	0	0	0	0	114.9
420	S	34.2	Very low	33.6	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	80%	0.804	S	S	*	*			trans	78.4	154.9	150.2	75.3	0	0	0	0	118.9
421	S	29.9	Very low	33.5	Very low	101 Å²	101	123.5 Å²	123.5	71%	0.706	81%	0.811	S	S	*	*			cis	-169.8	176.8	-28.4	60.1	0	0	0	0	110.1
422	S	36	Very low	33.3	Very low	104 Å²	104	122.2 Å²	122.2	73%	0.727	81%	0.807	S	S	*	*			trans	70.2	163.9	167.3	84.8	0	0	0	0	117
423	N	34.7	Very low	33	Very low	165 Å²	165	120.6 Å²	120.6	88%	0.882	80%	0.804	S	S	*	*			cis	-160.8	142.4	-40.1	-100.8	-11.7	0	0	0	107.4
424	G	34.8	Very low	32.9	Very low	83 Å²	83	118.8 Å²	118.8	86%	0.856	79%	0.794	S	S	*	*			trans	175.3	131.4	175	0	0	0	0	0	113.5
425	S	31.4	Very low	32.5	Very low	124 Å²	124	121.4 Å²	121.4	87%	0.867	80%	0.799	S	S	*	*			trans	-124.6	129.3	-164.5	55.6	0	0	0	0	114.4
426	A	34.8	Very low	32.4	Very low	100 Å²	100	121.7 Å²	121.7	83%	0.826	79%	0.79	S	S	*	*			trans	-163.1	142	149.7	0	0	0	0	0	111.5
427	L	34	Very low	32.5	Very low	168 Å²	168	117.8 Å²	117.8	88%	0.88	78%	0.777	S	S	*	*			trans	-128.3	171.5	170.8	-100.4	85.7	0	0	0	107.8
428	P	38.2	Very low	32.5	Very low	115 Å²	115	117.2 Å²	117.2	75%	0.747	78%	0.775	S	S	*	*			cis	-136.4	166.3	-39.5	37.6	-22.4	0	0	0	112.4
429	A	32.9	Very low	32.3	Very low	106 Å²	106	114.9 Å²	114.9	88%	0.876	76%	0.762	S	S	*	*			trans	-151.1	150.4	160.7	0	0	0	0	0	111.6
430	A	30.3	Very low	32.5	Very low	95 Å²	95	114.2 Å²	114.2	79%	0.785	75%	0.754	S	S	*	*			trans	-80	148.2	-174.9	0	0	0	0	0	113.3
431	T	30.8	Very low	32.5	Very low	142 Å²	142	116.1 Å²	116.1	87%	0.871	75%	0.752	S	S	*	*				-176.1	144.9	112.6	-69.5	0	0	0	0	108.7
432	A	27.3	Very low	32.7	Very low	75 Å²	75	118 Å²	118	62%	0.62	75%	0.745	S	S	*	*			trans	-116.2	166.3	-175.6	0	0	0	0	0	112.8
433	T	29.5	Very low	32.8	Very low	123 Å²	123	116.8 Å²	116.8	76%	0.755	73%	0.73	S	S	*	*			trans	71.8	149.8	165.9	74.9	0	0	0	0	117.9
434	N	29.6	Very low	32.7	Very low	126 Å²	126	114.1 Å²	114.1	67%	0.674	71%	0.712	S	S	*	*			cis	-160.2	147	-26.1	-105.1	-15.1	0	0	0	109.5	L436	N434-L436 HydrophobicContact CB-CD1 4.15Å; N434-L436 HydrophobicContact CB-CG 4.39Å; N434-L436 PolarHBondContact O-N 3.32Å; N434-L436 VanDerWaalsContact O-N 3.15Å
435	C	25.5	Very low	32.8	Very low	138 Å²	138	112.3 Å²	112.3	93%	0.932	69%	0.686	S	S	*	*			trans	-81.3	88.5	171	-64.1	0	0	0	0	111
436	L	28.8	Very low	33	Very low	118 Å²	118	109.7 Å²	109.7	62%	0.618	66%	0.66	S	S	*	*			trans	-137.4	80.9	-179.9	-77.6	170.2	0	0	0	112.1	N434	N434-L436 HydrophobicContact CB-CD1 4.15Å; N434-L436 HydrophobicContact CB-CG 4.39Å; N434-L436 PolarHBondContact O-N 3.32Å; N434-L436 VanDerWaalsContact O-N 3.15Å
437	S	35.6	Very low	33	Very low	89 Å²	89	109.2 Å²	109.2	62%	0.622	64%	0.643	S	S	*	*	S	Bend	trans	-115.4	-46.2	175.6	55.9	0	0	0	0	113.9
438	D	33.5	Very low	33	Very low	137 Å²	137	107 Å²	107	73%	0.733	62%	0.624	S	S	*	*	S	Bend	trans	-91.9	-21.8	-158.7	-65.8	8.5	0	0	0	114.2
439	S	35.8	Very low	32.7	Very low	73 Å²	73	103.8 Å²	103.8	51%	0.51	60%	0.604	S	S	.	*	S	Bend	trans	-70.2	-34.2	-178.6	46	0	0	0	0	113.6	M441 Y442	S439-M441 VanDerWaalsContact C-N 3.34Å; S439-M441 PolarHBondContact O-N 3.24Å; S439-Y442 PolarHBondContact O-N 3.19Å
440	N	34.5	Very low	32.6	Very low	106 Å²	106	104.5 Å²	104.5	57%	0.567	59%	0.592	S	S	*	*	H	α-helix	trans	-64.9	-34.2	-177.1	-80.5	-37.8	0	0	0	113.4	Y442 L443 E444	N440-Y442 VanDerWaalsContact C-N 3.26Å; N440-Y442 PolarHBondContact O-N 2.95Å; N440-L443 PolarHBondContact O-N 3.36Å; N440-E444 PolarHBondContact O-N 3.32Å
441	M	34.8	Very low	32.7	Very low	151 Å²	151	104.1 Å²	104.1	74%	0.744	58%	0.583	S	S	*	*	H	α-helix	trans	-72.3	-20.4	-175	-149.6	-177.6	75	0	0	113.1	S439	S439-M441 VanDerWaalsContact C-N 3.34Å; S439-M441 PolarHBondContact O-N 3.24Å
442	Y	34.6	Very low	32.7	Very low	141 Å²	141	101.9 Å²	101.9	55%	0.553	57%	0.566	S	S	*	*	H	α-helix	trans	-77.8	-41.7	173.4	-168.3	-110.5	0	0	0	111.5	S439 N440 E444 S445 Q446	S439-Y442 PolarHBondContact O-N 3.19Å; N440-Y442 VanDerWaalsContact C-N 3.26Å; N440-Y442 PolarHBondContact O-N 2.95Å; Y442-E444 PolarHBondContact O-N 3.2Å; Y442-S445 WeakPolarHBondContact O-CB 3.47Å; Y442-S445 PolarHBondContact O-N 3.33Å; Y442-S445 VanDerWaalsContact O-N 3.1Å; Y442-S445 PolarHBondContact O-OG 3.36Å; Y442-Q446 PolarHBondContact O-N 3.47Å
443	L	36.7	Very low	32.7	Very low	78 Å²	78	101.2 Å²	101.2	41%	0.408	57%	0.566	S	S	.	*	H	α-helix	trans	-65.4	-38.9	-179.7	-158.8	75.2	0	0	0	112.3	N440 S445 Q446 L447	N440-L443 PolarHBondContact O-N 3.36Å; L443-S445 PolarHBondContact O-N 2.81Å; L443-S445 VanDerWaalsContact O-N 3.16Å; L443-Q446 PolarHBondContact O-N 3.27Å; L443-L447 HydrophobicContact CG-CD1 4.44Å; L443-L447 PolarHBondContact O-N 2.83Å; L443-L447 VanDerWaalsContact O-N 3.14Å
444	E	33.6	Very low	32.7	Very low	108 Å²	108	102.9 Å²	102.9	51%	0.505	57%	0.57	S	S	.	*	H	α-helix	trans	-58.1	-25.8	173	-112.8	-134.8	105.8	0	0	113.6	N440 Y442 R448	N440-E444 PolarHBondContact O-N 3.32Å; Y442-E444 PolarHBondContact O-N 3.2Å; E444-R448 WeakPolarHBondContact O-CD 3.41Å; E444-R448 WeakPolarHBondContact O-CG 3.49Å; E444-R448 IonicContact OE1-CZ 3.97Å; E444-R448 IonicContact OE1-NE 3.22Å; E444-R448 IonicContact OE1-NH2 2.88Å; E444-R448 PolarHBondContact OE1-NH2 3.32Å; E444-R448 IonicContact OE2-NH2 2.73Å
445	S	37.5	Very low	32.8	Very low	46 Å²	46	104.5 Å²	104.5	32%	0.322	58%	0.579	S	S	.	*	H	α-helix	trans	-80.4	-39.9	177.2	78.5	0	0	0	0	112.6	Y442 L443 R448 S449	Y442-S445 WeakPolarHBondContact O-CB 3.47Å; Y442-S445 PolarHBondContact O-N 3.33Å; Y442-S445 VanDerWaalsContact O-N 3.1Å; Y442-S445 PolarHBondContact O-OG 3.36Å; L443-S445 PolarHBondContact O-N 2.81Å; L443-S445 VanDerWaalsContact O-N 3.16Å; S445-R448 PolarHBondContact O-N 3.43Å; S445-S449 PolarHBondContact O-OG 2.9Å
446	Q	35.4	Very low	32.9	Very low	69 Å²	69	103.8 Å²	103.8	32%	0.322	57%	0.574	S	S	.	*	H	α-helix	trans	-59.5	-49.3	175.2	-68.5	-83.2	1.1	0	0	111.1	W98 Y442 L443 R448 S449	W98-Q446 HydrophobicContact CH2-CG 4.43Å; Y442-Q446 PolarHBondContact O-N 3.47Å; L443-Q446 PolarHBondContact O-N 3.27Å; Q446-R448 PolarHBondContact O-N 2.96Å; Q446-S449 WeakPolarHBondContact O-CB 3.46Å; Q446-S449 PolarHBondContact O-N 3.44Å; Q446-S449 PolarHBondContact O-OG 3.34Å
447	L	34.8	Very low	33	Very low	89 Å²	89	102.9 Å²	102.9	47%	0.466	57%	0.57	S	S	.	*	H	α-helix	trans	-59.9	-28.1	-178	-73.1	165.6	0	0	0	113.8	L183 L443 S449	L183-L447 HydrophobicContact CD2-CD2 3.86Å; L443-L447 HydrophobicContact CG-CD1 4.44Å; L443-L447 PolarHBondContact O-N 2.83Å; L443-L447 VanDerWaalsContact O-N 3.14Å; L447-S449 VanDerWaalsContact C-N 3.26Å; L447-S449 PolarHBondContact O-N 2.79Å
448	R	33	Very low	32.8	Very low	123 Å²	123	102.8 Å²	102.8	46%	0.464	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.6	-11.6	178.5	-68.8	173.8	-171.8	-159.2	5.4	113.7	E444 S445 Q446	E444-R448 WeakPolarHBondContact O-CD 3.41Å; E444-R448 WeakPolarHBondContact O-CG 3.49Å; E444-R448 IonicContact OE1-CZ 3.97Å; E444-R448 IonicContact OE1-NE 3.22Å; E444-R448 IonicContact OE1-NH2 2.88Å; E444-R448 PolarHBondContact OE1-NH2 3.32Å; E444-R448 IonicContact OE2-NH2 2.73Å; S445-R448 PolarHBondContact O-N 3.43Å; Q446-R448 PolarHBondContact O-N 2.96Å
449	S	32.5	Very low	32.7	Very low	47 Å²	47	102.1 Å²	102.1	33%	0.329	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.5	-35.3	176.2	-22.5	0	0	0	0	112.3	W98 S445 Q446 L447 S451 L452	W98-S449 WeakPolarHBondContact CZ2-OG 3.48Å; S445-S449 PolarHBondContact O-OG 2.9Å; Q446-S449 WeakPolarHBondContact O-CB 3.46Å; Q446-S449 PolarHBondContact O-N 3.44Å; Q446-S449 PolarHBondContact O-OG 3.34Å; L447-S449 VanDerWaalsContact C-N 3.26Å; L447-S449 PolarHBondContact O-N 2.79Å; S449-S451 VanDerWaalsContact C-N 3.25Å; S449-S451 PolarHBondContact O-N 2.85Å; S449-L452 PolarHBondContact O-N 3.22Å
450	L	31.2	Very low	32.4	Very low	121 Å²	121	104.6 Å²	104.6	63%	0.634	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-7.3	-170.8	-68.2	168	0	0	0	114.2	L183 L452	L183-L450 HydrophobicContact CD2-CD1 4.12Å; L450-L452 PolarHBondContact O-N 3.23Å
451	S	31.8	Very low	32.2	Very low	86 Å²	86	103 Å²	103	60%	0.601	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	8	174.5	-174.4	0	0	0	0	114	S449	S449-S451 VanDerWaalsContact C-N 3.25Å; S449-S451 PolarHBondContact O-N 2.85Å
452	L	30.3	Very low	32.1	Very low	96 Å²	96	103 Å²	103	50%	0.503	57%	0.566	S	S	.	*	S	Bend	trans	-125.5	61.8	-172.7	-79.1	157.5	0	0	0	111.2	F49 S449 L450	F49-L452 HydrophobicContact CE1-CD2 4.29Å; S449-L452 PolarHBondContact O-N 3.22Å; L450-L452 PolarHBondContact O-N 3.23Å
453	G	27.3	Very low	32.1	Very low	61 Å²	61	99.9 Å²	99.9	63%	0.629	58%	0.577	S	S	*	*	S	Bend	trans	178.9	42.8	-176.7	0	0	0	0	0	116.4
454	N	29.8	Very low	31.8	Very low	157 Å²	157	105.9 Å²	105.9	84%	0.84	59%	0.594	S	S	*	*			trans	-176.8	110.4	160.7	-94	-28.3	0	0	0	109
455	N	32.4	Very low	31.9	Very low	160 Å²	160	104.3 Å²	104.3	86%	0.856	59%	0.591	S	S	*	*			trans	173	62.1	157.5	-92.8	-11.1	0	0	0	110	L457	N455-L457 VanDerWaalsContact C-N 3.31Å; N455-L457 PolarHBondContact O-N 2.83Å
456	C	27.2	Very low	31.7	Very low	124 Å²	124	107.2 Å²	107.2	84%	0.838	60%	0.603	S	S	*	*			trans	-89.8	66.4	165.7	-70.3	0	0	0	0	109.9
457	L	31.6	Very low	31.7	Very low	99 Å²	99	107 Å²	107	52%	0.518	61%	0.609	S	S	.	*	S	Bend	trans	-161.3	138.4	159.7	-132.5	80.3	0	0	0	112.4	E148 N455	E148-L457 HydrophobicContact CG-CD1 4.11Å; N455-L457 VanDerWaalsContact C-N 3.31Å; N455-L457 PolarHBondContact O-N 2.83Å
458	S	30.9	Very low	31.6	Very low	86 Å²	86	107.3 Å²	107.3	60%	0.601	61%	0.611	S	S	*	*			trans	12.7	127.1	159.2	60.3	0	0	0	0	122.6
459	E	30.7	Very low	31.6	Very low	124 Å²	124	105.4 Å²	105.4	58%	0.579	62%	0.622	S	S	*	*				-166.2	107.3	120.3	-102.9	-125.9	111.7	0	0	112.4	T461	E459-T461 PolarHBondContact O-N 3.37Å; E459-T461 WeakPolarHBondContact OE1-CB 3.38Å; E459-T461 PolarHBondContact OE1-OG1 3.13Å
460	P	29.7	Very low	31.6	Very low	125 Å²	125	107.6 Å²	107.6	81%	0.812	64%	0.643	S	S	*	*			trans	-81.3	35.7	175.3	35.1	-35.8	0	0	0	113.3
461	T	31.5	Very low	31.8	Very low	72 Å²	72	109.5 Å²	109.5	44%	0.442	65%	0.648	S	S	.	*			trans	-118.4	-3	-152.7	-29.3	0	0	0	0	115.8	E459	E459-T461 PolarHBondContact O-N 3.37Å; E459-T461 WeakPolarHBondContact OE1-CB 3.38Å; E459-T461 PolarHBondContact OE1-OG1 3.13Å
462	F	31.5	Very low	31.7	Very low	150 Å²	150	115.6 Å²	115.6	66%	0.658	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-93.3	7.5	-178.3	-129.9	-100.7	0	0	0	116.6	R464 V465	F462-R464 VanDerWaalsContact C-N 3.28Å; F462-R464 PolarHBondContact O-N 3.35Å; F462-V465 HydrophobicContact CD1-CB 4.1Å; F462-V465 HydrophobicContact CD1-CG2 4.39Å; F462-V465 HydrophobicContact CD2-CG2 3.97Å; F462-V465 HydrophobicContact CE1-CB 3.67Å; F462-V465 HydrophobicContact CE1-CG1 3.91Å; F462-V465 HydrophobicContact CE1-CG2 4.13Å; F462-V465 HydrophobicContact CE2-CB 4.14Å; F462-V465 HydrophobicContact CE2-CG1 4.39Å; F462-V465 HydrophobicContact CE2-CG2 3.68Å; F462-V465 HydrophobicContact CG-CG2 4.33Å; F462-V465 HydrophobicContact CZ-CB 3.69Å; F462-V465 HydrophobicContact CZ-CG1 3.67Å; F462-V465 HydrophobicContact CZ-CG2 3.77Å
463	G	34.3	Very low	31.9	Very low	76 Å²	76	120.6 Å²	120.6	78%	0.784	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-68.2	-19.8	174.3	0	0	0	0	0	115.1
464	R	32	Very low	32	Very low	205 Å²	205	122.6 Å²	122.6	77%	0.774	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-103.4	-8.7	-174.3	-79.1	-177.8	171	174.7	-2.2	115.7	F462 S467	F462-R464 VanDerWaalsContact C-N 3.28Å; F462-R464 PolarHBondContact O-N 3.35Å; R464-S467 PolarHBondContact O-OG 2.89Å
465	V	34.6	Very low	32	Very low	74 Å²	74	122 Å²	122	45%	0.448	69%	0.685	S	S	.	*	H	α-helix	trans	-82.1	-28.2	-176.8	-175.5	0	0	0	0	112	F462	F462-V465 HydrophobicContact CD1-CB 4.1Å; F462-V465 HydrophobicContact CD1-CG2 4.39Å; F462-V465 HydrophobicContact CD2-CG2 3.97Å; F462-V465 HydrophobicContact CE1-CB 3.67Å; F462-V465 HydrophobicContact CE1-CG1 3.91Å; F462-V465 HydrophobicContact CE1-CG2 4.13Å; F462-V465 HydrophobicContact CE2-CB 4.14Å; F462-V465 HydrophobicContact CE2-CG1 4.39Å; F462-V465 HydrophobicContact CE2-CG2 3.68Å; F462-V465 HydrophobicContact CG-CG2 4.33Å; F462-V465 HydrophobicContact CZ-CB 3.69Å; F462-V465 HydrophobicContact CZ-CG1 3.67Å; F462-V465 HydrophobicContact CZ-CG2 3.77Å
466	L	34.3	Very low	31.8	Very low	108 Å²	108	119.2 Å²	119.2	57%	0.565	68%	0.684	S	S	*	*	H	α-helix	trans	-77.9	-14.3	176.7	-96.1	164.2	0	0	0	114.8
467	S	34.2	Very low	31.9	Very low	63 Å²	63	121.3 Å²	121.3	44%	0.441	69%	0.686	S	S	.	*	H	α-helix	trans	-78.1	-42.2	169.4	50	0	0	0	0	111.6	R464 A469 A470	R464-S467 PolarHBondContact O-OG 2.89Å; S467-A469 VanDerWaalsContact C-N 3.26Å; S467-A469 PolarHBondContact O-N 3.08Å; S467-A470 PolarHBondContact O-N 3.36Å
468	N	33.5	Very low	31.7	Very low	97 Å²	97	122.2 Å²	122.2	52%	0.519	70%	0.7	S	S	.	*	H	α-helix	trans	-76.1	-15.5	-172	-63.8	6.6	0	0	0	113.1	A470 Q471	N468-A470 PolarHBondContact O-N 2.74Å; N468-Q471 PolarHBondContact O-N 3.18Å
469	A	32.3	Very low	31.7	Very low	83 Å²	83	127 Å²	127	69%	0.686	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-11.4	172	0	0	0	0	0	114.2	S467	S467-A469 VanDerWaalsContact C-N 3.26Å; S467-A469 PolarHBondContact O-N 3.08Å
470	A	33.5	Very low	31.8	Very low	93 Å²	93	132.4 Å²	132.4	77%	0.769	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-2.4	176.7	0	0	0	0	0	113.7	S467 N468	S467-A470 PolarHBondContact O-N 3.36Å; N468-A470 PolarHBondContact O-N 2.74Å
471	Q	34.8	Very low	32.1	Very low	160 Å²	160	133.2 Å²	133.2	75%	0.748	73%	0.733	S	S	*	*	S	Bend	trans	-126	33.6	-167.5	-157.6	163.4	-8.1	0	0	112.7	N468	N468-Q471 PolarHBondContact O-N 3.18Å
472	R	30.1	Very low	32.2	Very low	214 Å²	214	134.5 Å²	134.5	81%	0.808	75%	0.745	S	S	*	*			trans	-138.6	58.3	176.1	-69.2	-169.7	175.1	-170.3	-1.6	112.1
473	H	33.2	Very low	32.3	Very low	202 Å²	202	137.9 Å²	137.9	94%	0.935	75%	0.753	S	S	*	*	S	Bend	trans	-142	36	168.1	-101.9	-73	0	0	0	112.3
474	S	29.4	Very low	32.4	Very low	102 Å²	102	142.7 Å²	142.7	71%	0.713	76%	0.755	S	S	*	*	S	Bend	trans	-150.8	161.5	165.2	53.3	0	0	0	0	108.2
475	V	29.7	Very low	32.4	Very low	146 Å²	146	138.5 Å²	138.5	89%	0.885	76%	0.755	S	S	*	*			trans	63	74.7	-172.8	-164.8	0	0	0	0	113.6
476	A	28.8	Very low	32.4	Very low	101 Å²	101	143.1 Å²	143.1	84%	0.835	78%	0.776	S	S	*	*			trans	-144.1	55.1	166.8	0	0	0	0	0	110.8
477	L	29.7	Very low	32.2	Very low	168 Å²	168	142.2 Å²	142.2	88%	0.88	78%	0.779	S	S	*	*			trans	-136.7	155.7	173.6	-88.6	170.9	0	0	0	109.8
478	S	28.1	Very low	32.2	Very low	118 Å²	118	145.1 Å²	145.1	83%	0.825	79%	0.794	S	S	*	*			trans	71	91	-177.3	-158.5	0	0	0	0	116.9
479	M	30.5	Very low	32.1	Very low	185 Å²	185	145.4 Å²	145.4	91%	0.911	80%	0.803	S	S	*	*			trans	-152.4	101.5	145.6	-94	-153.1	175.9	0	0	110.5
480	R	32.7	Very low	32.2	Very low	238 Å²	238	145.9 Å²	145.9	90%	0.898	80%	0.802	S	S	*	*			trans	154	100.7	136.4	-87.9	176.3	167	-176.1	-4.1	113.9
481	T	35.5	Very low	32.2	Very low	143 Å²	143	147 Å²	147	88%	0.877	80%	0.804	S	S	*	*			trans	-177.6	110	143	31	0	0	0	0	105.7
482	S	33	Very low	32.3	Very low	98 Å²	98	147.3 Å²	147.3	69%	0.685	81%	0.807	S	S	*	*			cis	90.4	100.9	49.8	-175.4	0	0	0	0	113
483	R	35.2	Very low	32.6	Very low	222 Å²	222	140.8 Å²	140.8	84%	0.838	79%	0.794	S	S	*	*			trans	69.5	148.2	171.8	-53.4	172.7	-172.7	-173.8	-0.3	114.5
484	Q	35.3	Very low	32.6	Very low	176 Å²	176	137.2 Å²	137.2	82%	0.822	79%	0.787	S	S	*	*			cis	-153.6	162	-9	-123	169.2	-47.5	0	0	109
485	P	32.8	Very low	32.8	Very low	118 Å²	118	137.7 Å²	137.7	77%	0.766	79%	0.789	S	S	*	*			trans	-108.6	151.5	-173.1	39	-31.3	0	0	0	115.4
486	L	33.8	Very low	33.1	Very low	170 Å²	170	136.5 Å²	136.5	89%	0.89	78%	0.782	S	S	*	*			trans	-173.5	159.2	160.3	-89.7	173.2	0	0	0	105.1
487	S	30.2	Very low	33.3	Very low	89 Å²	89	135.4 Å²	135.4	62%	0.622	77%	0.773	S	S	*	*			cis	-176.2	172	-25.9	50.3	0	0	0	0	108.3
488	V	33.8	Very low	33.5	Very low	124 Å²	124	133.2 Å²	133.2	75%	0.752	77%	0.767	S	S	*	*			trans	67.4	97.5	166.8	-174.9	0	0	0	0	113.8
489	S	32.3	Very low	33.7	Very low	104 Å²	104	135.5 Å²	135.5	73%	0.727	77%	0.769	S	S	*	*				71.3	157	81.8	94.3	0	0	0	0	114.2
490	S	34.9	Very low	34.2	Very low	93 Å²	93	131.9 Å²	131.9	65%	0.65	76%	0.76	S	S	*	*			cis	-167.1	151.5	8.5	13	0	0	0	0	111.8
491	S	33	Very low	34.3	Very low	116 Å²	116	126.1 Å²	126.1	81%	0.811	76%	0.755	S	S	*	*			trans	64.3	161.7	160.7	76.4	0	0	0	0	116.8
492	M	36.2	Very low	34	Very low	167 Å²	167	123.2 Å²	123.2	82%	0.823	75%	0.746	S	S	*	*			cis	-141.5	176.2	2.8	-70	-179.2	72.8	0	0	108.2
493	S	36.2	Very low	33.9	Very low	76 Å²	76	125.9 Å²	125.9	53%	0.531	75%	0.752	S	S	.	*			cis	-171.1	160.4	-41.4	62	0	0	0	0	108.6
494	T	34.3	Very low	33.8	Very low	128 Å²	128	122.8 Å²	122.8	79%	0.785	75%	0.747	S	S	*	*			trans	58.6	142	159.7	51.5	0	0	0	0	119
495	C	33.2	Very low	33.6	Very low	111 Å²	111	120.9 Å²	120.9	75%	0.75	75%	0.747	S	S	*	*			cis	-165.5	176.7	-5.5	-108	0	0	0	0	107.1
496	T	35.3	Very low	33.6	Very low	121 Å²	121	118.6 Å²	118.6	74%	0.742	75%	0.745	S	S	*	*			cis	-151.3	153.6	3.5	1.2	0	0	0	0	106.9
497	A	32.7	Very low	33.4	Very low	79 Å²	79	119.9 Å²	119.9	65%	0.653	74%	0.744	S	S	*	*				51.6	136	84.8	0	0	0	0	0	115.9
498	T	34.4	Very low	33.5	Very low	121 Å²	121	120.2 Å²	120.2	74%	0.742	75%	0.746	S	S	*	*			cis	-163.7	130.6	-1.2	9.8	0	0	0	0	108.4
499	L	32	Very low	33.4	Very low	166 Å²	166	122 Å²	122	87%	0.869	75%	0.746	S	S	*	*				68.5	156.5	100.3	-90.1	83.8	0	0	0	118.7
500	P	41	Very low	33.6	Very low	110 Å²	110	122 Å²	122	71%	0.714	74%	0.738	S	S	*	*			trans	-129.4	-151.7	-153.5	46	-29.4	0	0	0	114.5
501	S	34.6	Very low	33.4	Very low	116 Å²	116	127.4 Å²	127.4	81%	0.811	74%	0.744	S	S	*	*			trans	110.7	159.3	173.1	-52.6	0	0	0	0	113.5
502	A	30.8	Very low	33.4	Very low	83 Å²	83	125.5 Å²	125.5	69%	0.686	73%	0.731	S	S	*	*			cis	-173.8	177	-29.5	0	0	0	0	0	108.7
503	L	30.9	Very low	33.3	Very low	153 Å²	153	124.9 Å²	124.9	80%	0.801	73%	0.731	S	S	*	*			trans	69.5	161.5	168.9	-55.4	161.3	0	0	0	115
504	Q	33.1	Very low	33.1	Very low	158 Å²	158	126.9 Å²	126.9	74%	0.738	75%	0.745	S	S	*	*			cis	-151.9	135.1	-9	-121	160.9	-35.7	0	0	108
505	V	30.9	Very low	33.1	Very low	135 Å²	135	124.4 Å²	124.4	82%	0.818	75%	0.745	S	S	*	*				59	126.3	97	-173.4	0	0	0	0	117.2
506	G	32.2	Very low	33	Very low	71 Å²	71	127 Å²	127	73%	0.732	75%	0.751	S	S	*	*			trans	147.6	87.3	172.7	0	0	0	0	0	112.2
507	F	29	Very low	32.7	Very low	197 Å²	197	125.3 Å²	125.3	86%	0.864	75%	0.75	S	S	*	*				83.4	137.5	60.4	-116.2	-75.8	0	0	0	116.4
508	S	32.4	Very low	32.5	Very low	95 Å²	95	131.9 Å²	131.9	66%	0.664	76%	0.758	S	S	*	*			trans	73	152.2	165	-67	0	0	0	0	119.7
509	Q	32.3	Very low	32.4	Very low	161 Å²	161	133.4 Å²	133.4	75%	0.752	76%	0.761	S	S	*	*			cis	-169.7	177.2	-22.9	-178.2	160.8	-24.8	0	0	109.2
510	D	35.5	Very low	32.4	Very low	106 Å²	106	132.4 Å²	132.4	57%	0.567	76%	0.757	S	S	*	*			trans	73.4	153.1	162.7	-94	16.5	0	0	0	114.7
511	R	30.7	Very low	31.8	Very low	206 Å²	206	130.4 Å²	130.4	78%	0.777	76%	0.757	S	S	*	*			cis	172.5	165.9	-9.4	-133.4	-178	-175.8	129	-14.2	102.8
512	S	34.1	Very low	31.6	Very low	76 Å²	76	131 Å²	131	53%	0.531	76%	0.757	S	S	.	*			cis	-154.3	167.6	2.2	-37.6	0	0	0	0	107.4
513	D	34.8	Very low	31.6	Very low	154 Å²	154	135.2 Å²	135.2	82%	0.824	77%	0.768	S	S	*	*			trans	57.9	162.8	143.5	-53.2	-27.4	0	0	0	120.1
514	S	32	Very low	31.5	Very low	118 Å²	118	134.1 Å²	134.1	83%	0.825	76%	0.762	S	S	*	*			cis	-160.9	167	-35.4	58.5	0	0	0	0	107.3
515	G	33.4	Very low	31.4	Very low	76 Å²	76	131.9 Å²	131.9	78%	0.784	76%	0.764	S	S	*	*			trans	145.9	114.5	167.3	0	0	0	0	0	115.7
516	N	30.9	Very low	31.3	Very low	165 Å²	165	135.6 Å²	135.6	88%	0.882	76%	0.764	S	S	*	*			trans	-82.7	149.5	171.1	-55.1	-61.8	0	0	0	110.8
517	A	30.1	Very low	31.1	Very low	86 Å²	86	143 Å²	143	71%	0.711	77%	0.77	S	S	*	*				172.8	131.2	111	0	0	0	0	0	115
518	W	27.7	Very low	31.1	Very low	217 Å²	217	139.4 Å²	139.4	82%	0.822	77%	0.766	S	S	*	*			trans	22.5	117.6	136.5	-57.8	77	0	0	0	119.8
519	N	33.1	Very low	31	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	77%	0.769	S	S	*	*				-167.3	162.4	99.8	-107	-56.7	0	0	0	115.1
520	N	30.1	Very low	31	Very low	145 Å²	145	137.5 Å²	137.5	78%	0.775	76%	0.758	S	S	*	*			trans	-92.7	150.3	-172.9	-62.2	-71	0	0	0	113.1
521	G	29.7	Very low	30.9	Very low	69 Å²	69	140.7 Å²	140.7	71%	0.711	77%	0.769	S	S	*	*			trans	177.3	108.5	170.7	0	0	0	0	0	114.6
522	P	29.5	Very low	31.1	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	76%	0.76	S	S	*	*			trans	-88.9	116.8	-176	32.6	-32.7	0	0	0	113.2	N524	P522-N524 PolarHBondContact O-N 3.33Å
523	L	31.8	Very low	31	Very low	173 Å²	173	140 Å²	140	91%	0.906	77%	0.765	S	S	*	*			trans	-105.2	66.2	176.5	-88.1	169.4	0	0	0	114.3	S525	L523-S525 PolarHBondContact O-N 2.95Å
524	N	28.7	Very low	30.9	Very low	129 Å²	129	137.1 Å²	137.1	69%	0.69	75%	0.747	S	S	*	*			trans	-19.9	102.7	152	-165.4	12.4	0	0	0	115.9	P522 R526	P522-N524 PolarHBondContact O-N 3.33Å; N524-R526 WeakPolarHBondContact OD1-CB 3.24Å
525	S	30.1	Very low	30.8	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	73%	0.727	S	S	*	*			trans	-105.7	57.2	169.9	47.6	0	0	0	0	111.5	L523 W527	L523-S525 PolarHBondContact O-N 2.95Å; S525-W527 PolarHBondContact O-N 3.1Å
526	R	29.1	Very low	30.9	Very low	214 Å²	214	136 Å²	136	81%	0.808	71%	0.71	S	S	*	*			trans	-65.8	110.4	-173.9	-146.5	178.8	-159.7	-167.4	6.1	112.6	N524	N524-R526 WeakPolarHBondContact OD1-CB 3.24Å
527	W	28.9	Very low	31	Very low	226 Å²	226	132.1 Å²	132.1	86%	0.856	69%	0.691	S	S	*	*			trans	-67.6	129.6	160.9	-72.5	94.8	0	0	0	109.4	S525 I529	S525-W527 PolarHBondContact O-N 3.1Å; W527-I529 VanDerWaalsContact C-N 3.34Å; W527-I529 PolarHBondContact O-N 3.18Å
528	P	28.7	Very low	31.3	Very low	121 Å²	121	130.7 Å²	130.7	79%	0.786	67%	0.674	S	S	*	*			trans	-79.1	83.4	176.4	32.1	-33.8	0	0	0	110	S530	P528-S530 PolarHBondContact O-N 2.99Å; P528-S530 VanDerWaalsContact O-N 3.09Å
529	I	30.3	Very low	31.7	Very low	142 Å²	142	124.6 Å²	124.6	73%	0.728	66%	0.658	S	S	*	*			trans	-65.8	107.6	165.2	-58.9	178	0	0	0	106.8	W527	W527-I529 VanDerWaalsContact C-N 3.34Å; W527-I529 PolarHBondContact O-N 3.18Å
530	S	32.9	Very low	31.6	Very low	74 Å²	74	124.3 Å²	124.3	52%	0.517	65%	0.653	S	S	.	*			trans	-70.6	133.9	174.2	56.1	0	0	0	0	110.5	P528 F532 Q533	P528-S530 PolarHBondContact O-N 2.99Å; P528-S530 VanDerWaalsContact O-N 3.09Å; S530-F532 PolarHBondContact O-N 2.7Å; S530-Q533 PolarHBondContact O-N 3Å
531	E	33.3	Very low	31.8	Very low	173 Å²	173	121 Å²	121	81%	0.808	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-53.7	-18.4	179.4	-65.4	157.4	115.6	0	0	113.8	Q533 Q534	E531-Q533 VanDerWaalsContact C-N 3.28Å; E531-Q533 PolarHBondContact O-N 3.34Å; E531-Q534 PolarHBondContact O-N 2.93Å
532	F	33.4	Very low	32.2	Very low	132 Å²	132	120.5 Å²	120.5	58%	0.579	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-62.6	-17.4	-179.4	-119.1	-98.1	0	0	0	116.6	E91 S530 S535	E91-F532 WeakPolarHBondContact OE2-CD1 3.36Å; E91-F532 WeakPolarHBondContact OE2-CE1 3.26Å; S530-F532 PolarHBondContact O-N 2.7Å; F532-S535 PolarHBondContact O-OG 3.3Å
533	Q	33	Very low	32.3	Very low	135 Å²	135	118.5 Å²	118.5	63%	0.631	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-85.9	-19.7	177	-73.6	-154.4	-38.9	0	0	114.2	S530 E531	S530-Q533 PolarHBondContact O-N 3Å; E531-Q533 VanDerWaalsContact C-N 3.28Å; E531-Q533 PolarHBondContact O-N 3.34Å
534	Q	31.6	Very low	32.3	Very low	95 Å²	95	116.8 Å²	116.8	44%	0.444	59%	0.593	S	S	.	*	H	α-helix	trans	-73.1	-32	-179.2	-72.3	-179.4	-89.3	0	0	112.5	S134 E531 R536	S134-Q534 PolarHBondContact OG-NE2 2.93Å; E531-Q534 PolarHBondContact O-N 2.93Å; Q534-R536 PolarHBondContact O-N 3.48Å
535	S	31.6	Very low	32.5	Very low	59 Å²	59	116 Å²	116	41%	0.413	60%	0.598	S	S	.	*	H	α-helix	trans	-74.4	-2	178.4	56.8	0	0	0	0	115.3	F532 T538 D539	F532-S535 PolarHBondContact O-OG 3.3Å; S535-T538 PolarHBondContact O-OG1 3.26Å; S535-D539 VanDerWaalsContact O-CG 3.26Å
536	R	34.8	Very low	32.6	Very low	112 Å²	112	121.4 Å²	121.4	42%	0.423	61%	0.608	S	S	.	*	H	α-helix	trans	-106.2	-21	-173.1	-69.4	-163.7	159.7	-164.7	0.6	115.3	E91 Q534 M540	E91-R536 WeakPolarHBondContact OE1-CD 3.36Å; E91-R536 IonicContact OE1-CZ 3.66Å; E91-R536 IonicContact OE1-NE 2.69Å; E91-R536 PolarHBondContact OE1-NE 2.62Å; E91-R536 VanDerWaalsContact OE1-NE 3.13Å; E91-R536 IonicContact OE1-NH1 3.07Å; E91-R536 PolarHBondContact OE1-NH1 3.07Å; E91-R536 IonicContact OE1-NH2 2.67Å; E91-R536 IonicContact OE2-CZ 2.78Å; E91-R536 IonicContact OE2-NE 2.98Å; E91-R536 IonicContact OE2-NH1 3.53Å; E91-R536 PolarHBondContact OE2-NH1 3.18Å; E91-R536 IonicContact OE2-NH2 3.5Å; E91-R536 PolarHBondContact OE2-NH2 3.21Å; Q534-R536 PolarHBondContact O-N 3.48Å; R536-M540 VanDerWaalsContact O-CE 3.24Å; R536-M540 WeakPolarHBondContact O-CE 3.22Å; R536-M540 WeakPolarHBondContact O-CG 3.23Å
537	V	32.8	Very low	32.6	Very low	82 Å²	82	115 Å²	115	50%	0.497	61%	0.609	S	S	.	*	H	α-helix	trans	-81.3	-25.4	178.5	-172.1	0	0	0	0	111.1	I133	I133-V537 HydrophobicContact CD1-CG1 4.32Å; I133-V537 HydrophobicContact CG2-CB 4.17Å; I133-V537 HydrophobicContact CG2-CG1 3.82Å
538	T	36.2	Very low	32.8	Very low	56 Å²	56	109.8 Å²	109.8	34%	0.344	61%	0.607	S	S	.	*	H	α-helix	trans	-73.6	-46.1	173.6	46.9	0	0	0	0	112.8	S535 M540	S535-T538 PolarHBondContact O-OG1 3.26Å; T538-M540 PolarHBondContact O-N 3.31Å
539	D	36	Very low	32.8	Very low	90 Å²	90	115.8 Å²	115.8	48%	0.481	61%	0.614	S	S	.	*	H	α-helix	trans	-82.2	-20.3	-162	-69.9	24.3	0	0	0	113.8	S535 V541	S535-D539 VanDerWaalsContact O-CG 3.26Å; D539-V541 VanDerWaalsContact C-N 3.34Å; D539-V541 PolarHBondContact O-N 3.34Å
540	M	31.8	Very low	32.8	Very low	145 Å²	145	115.3 Å²	115.3	71%	0.714	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-2.8	-173.1	-72.6	-164.5	-70.8	0	0	115.5	R536 T538	R536-M540 VanDerWaalsContact O-CE 3.24Å; R536-M540 WeakPolarHBondContact O-CE 3.22Å; R536-M540 WeakPolarHBondContact O-CG 3.23Å; T538-M540 PolarHBondContact O-N 3.31Å
541	V	34.4	Very low	32.7	Very low	75 Å²	75	117.1 Å²	117.1	46%	0.455	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.1	-17.8	-175.6	-173.5	0	0	0	0	113	D539	D539-V541 VanDerWaalsContact C-N 3.34Å; D539-V541 PolarHBondContact O-N 3.34Å
542	F	38.1	Very low	32.6	Very low	60 Å²	60	124.5 Å²	124.5	26%	0.263	66%	0.655	S	S	.	*			trans	-140	71	-161.8	-57.8	-71.8	0	0	0	116.1	N119	N119-F542 HydrophobicContact CB-CB 4.03Å; N119-F542 HydrophobicContact CB-CD1 3.36Å; N119-F542 HydrophobicContact CB-CD2 3.38Å; N119-F542 HydrophobicContact CB-CE1 3.5Å; N119-F542 VanDerWaalsContact CB-CE1 3.5Å; N119-F542 HydrophobicContact CB-CE2 3.51Å; N119-F542 HydrophobicContact CB-CG 3.3Å; N119-F542 HydrophobicContact CB-CZ 3.57Å
543	T	32.1	Very low	32.6	Very low	84 Å²	84	124.1 Å²	124.1	52%	0.515	66%	0.658	S	S	.	*			trans	-146.5	106.8	157.5	37	0	0	0	0	112.8	V100	V100-T543 HydrophobicContact CG1-CG2 3.86Å; V100-T543 WeakPolarHBondContact CG1-OG1 3.29Å
544	N	31.4	Very low	32.5	Very low	137 Å²	137	123.5 Å²	123.5	73%	0.733	66%	0.66	S	S	*	*			trans	172.1	109.1	146.4	-97.2	-24.4	0	0	0	110.5
545	S	33.2	Very low	32.6	Very low	114 Å²	114	125.1 Å²	125.1	80%	0.797	67%	0.672	S	S	*	*			trans	-163.6	107.7	163.1	-92.7	0	0	0	0	110.5
546	F	30.7	Very low	32.7	Very low	223 Å²	223	129 Å²	129	98%	0.978	69%	0.687	S	S	*	*			trans	172.4	124.4	145.2	-103.4	-66.2	0	0	0	108
547	G	29.8	Very low	32.5	Very low	80 Å²	80	130.1 Å²	130.1	83%	0.825	70%	0.704	S	S	*	*			trans	-179	3	-173.6	0	0	0	0	0	120.5
548	S	33	Very low	32.5	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	72%	0.717	S	S	*	*			trans	-151.6	105.6	175.1	53	0	0	0	0	112.9
549	R	28.4	Very low	32.2	Very low	248 Å²	248	138.8 Å²	138.8	94%	0.936	74%	0.744	S	S	*	*			trans	-69.1	135.2	152.8	-73.2	178.5	174	172.3	-3.4	107.5
550	C	31.1	Very low	32	Very low	132 Å²	132	142.5 Å²	142.5	89%	0.892	76%	0.764	S	S	*	*			trans	-118.5	129.2	160.1	-149.9	0	0	0	0	107.5
551	S	29.8	Very low	32	Very low	112 Å²	112	142.3 Å²	142.3	78%	0.783	77%	0.768	S	S	*	*			trans	-100.4	115.5	-176.3	-55.9	0	0	0	0	110.3
552	R	31.8	Very low	31.7	Very low	327 Å²	327	148.5 Å²	148.5	100%	1.234	80%	0.797	S	S	*	*			trans	-162.9	0	148.9	-110.7	173.2	-166.6	-160.2	2.1	110

Retrieved 552 of 552 residues in 818.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).